Browse entries in the PDBbind-CN Database
HEADER 1BTN_COMPLEX COMPND 1BTN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 106 MET GLU GLY PHE LEU ASN ARG LYS HIS GLU TRP GLU ALA SEQRES 2 A 106 HIS ASN LYS LYS ALA SER SER ARG SER TRP HIS ASN VAL SEQRES 3 A 106 TYR CYS VAL ILE ASN ASN GLN GLU MET GLY PHE TYR LYS SEQRES 4 A 106 ASP ALA LYS SER ALA ALA SER GLY ILE PRO TYR HIS SER SEQRES 5 A 106 GLU VAL PRO VAL SER LEU LYS GLU ALA ILE CYS GLU VAL SEQRES 6 A 106 ALA LEU ASP TYR LYS LYS LYS LYS HIS VAL PHE LYS LEU SEQRES 7 A 106 ARG LEU SER ASP GLY ASN GLU TYR LEU PHE GLN ALA LYS SEQRES 8 A 106 ASP ASP GLU GLU MET ASN THR TRP ILE GLN ALA ILE SER SEQRES 9 A 106 SER ALA SEQRES 1 B 106 MET GLU GLY PHE LEU ASN ARG LYS HIS GLU TRP GLU ALA SEQRES 2 B 106 HIS ASN LYS LYS ALA SER SER ARG SER TRP HIS ASN VAL SEQRES 3 B 106 TYR CYS VAL ILE ASN ASN GLN GLU MET GLY PHE TYR LYS SEQRES 4 B 106 ASP ALA LYS SER ALA ALA SER GLY ILE PRO TYR HIS SER SEQRES 5 B 106 GLU VAL PRO VAL SER LEU LYS GLU ALA ILE CYS GLU VAL SEQRES 6 B 106 ALA LEU ASP TYR LYS LYS LYS LYS HIS VAL PHE LYS LEU SEQRES 7 B 106 ARG LEU SER ASP GLY ASN GLU TYR LEU PHE GLN ALA LYS SEQRES 8 B 106 ASP ASP GLU GLU MET ASN THR TRP ILE GLN ALA ILE SER SEQRES 9 B 106 SER ALA HET I A 3P 33 ATOM 1 N MET A 1 4.606 58.490 -0.389 1.00 17.43 N ATOM 2 CA MET A 1 3.655 59.182 0.534 1.00 14.49 C ATOM 3 C MET A 1 4.418 59.540 1.808 1.00 12.75 C ATOM 4 O MET A 1 5.191 58.739 2.306 1.00 13.92 O ATOM 5 CB MET A 1 2.493 58.238 0.833 1.00 18.54 C ATOM 6 CG MET A 1 1.702 58.558 2.066 1.00 24.48 C ATOM 7 SD MET A 1 0.517 59.877 1.890 1.00 30.80 S ATOM 8 CE MET A 1 -0.903 58.996 2.266 1.00 29.06 C ATOM 9 HA MET A 1 3.252 60.093 0.090 1.00 0.00 H ATOM 10 HB2 MET A 1 1.813 58.262 -0.018 1.00 0.00 H ATOM 11 HB3 MET A 1 2.897 57.232 0.945 1.00 0.00 H ATOM 12 HG2 MET A 1 2.403 58.837 2.853 1.00 0.00 H ATOM 13 HG3 MET A 1 1.163 57.658 2.364 1.00 0.00 H ATOM 14 HE1 MET A 1 -1.022 58.180 1.553 1.00 0.00 H ATOM 15 HE2 MET A 1 -0.821 58.590 3.274 1.00 0.00 H ATOM 16 HE3 MET A 1 -1.766 59.659 2.209 1.00 0.00 H ATOM 17 HN3 MET A 1 4.968 57.629 0.069 1.00 0.00 H ATOM 18 HN2 MET A 1 5.399 59.126 -0.609 1.00 0.00 H ATOM 19 HN1 MET A 1 4.111 58.234 -1.267 1.00 0.00 H ATOM 20 N GLU A 2 4.285 60.762 2.294 1.00 12.54 N ATOM 21 CA GLU A 2 4.988 61.153 3.512 1.00 15.08 C ATOM 22 C GLU A 2 4.299 62.307 4.201 1.00 13.04 C ATOM 23 O GLU A 2 3.521 63.047 3.586 1.00 16.26 O ATOM 24 CB GLU A 2 6.425 61.554 3.199 1.00 14.96 C ATOM 25 CG GLU A 2 6.485 62.780 2.329 1.00 18.36 C ATOM 26 CD GLU A 2 7.818 62.955 1.621 1.00 21.43 C ATOM 27 OE1 GLU A 2 8.219 61.959 0.986 1.00 23.68 O ATOM 28 OE2 GLU A 2 8.396 64.033 1.686 1.00 19.98 O ATOM 29 HA GLU A 2 4.982 60.289 4.176 1.00 0.00 H ATOM 30 HB2 GLU A 2 6.946 61.758 4.134 1.00 0.00 H ATOM 31 HB3 GLU A 2 6.917 60.730 2.683 1.00 0.00 H ATOM 32 HG2 GLU A 2 5.701 62.708 1.576 1.00 0.00 H ATOM 33 HG3 GLU A 2 6.308 63.656 2.953 1.00 0.00 H ATOM 34 H GLU A 2 3.676 61.449 1.806 1.00 0.00 H ATOM 35 N GLY A 3 4.608 62.471 5.477 1.00 12.69 N ATOM 36 CA GLY A 3 4.018 63.532 6.260 1.00 12.30 C ATOM 37 C GLY A 3 4.226 63.273 7.737 1.00 13.84 C ATOM 38 O GLY A 3 4.716 62.216 8.133 1.00 13.25 O ATOM 39 HA3 GLY A 3 2.950 63.583 6.050 1.00 0.00 H ATOM 40 HA2 GLY A 3 4.485 64.480 5.992 1.00 0.00 H ATOM 41 H GLY A 3 5.288 61.824 5.925 1.00 0.00 H ATOM 42 N PHE A 4 3.900 64.271 8.547 1.00 12.97 N ATOM 43 CA PHE A 4 4.016 64.158 9.991 1.00 14.40 C ATOM 44 C PHE A 4 2.830 63.363 10.520 1.00 14.47 C ATOM 45 O PHE A 4 1.716 63.467 10.013 1.00 15.67 O ATOM 46 CB PHE A 4 4.012 65.547 10.644 1.00 15.31 C ATOM 47 CG PHE A 4 5.305 66.319 10.483 1.00 15.98 C ATOM 48 CD1 PHE A 4 6.387 66.077 11.328 1.00 15.88 C ATOM 49 CD2 PHE A 4 5.408 67.344 9.543 1.00 15.58 C ATOM 50 CE1 PHE A 4 7.538 66.848 11.246 1.00 16.00 C ATOM 51 CE2 PHE A 4 6.549 68.118 9.454 1.00 14.37 C ATOM 52 CZ PHE A 4 7.619 67.869 10.310 1.00 15.96 C ATOM 53 HA PHE A 4 4.954 63.657 10.231 1.00 0.00 H ATOM 54 HB2 PHE A 4 3.208 66.132 10.197 1.00 0.00 H ATOM 55 HB3 PHE A 4 3.820 65.422 11.710 1.00 0.00 H ATOM 56 HD2 PHE A 4 4.575 67.538 8.868 1.00 0.00 H ATOM 57 HE2 PHE A 4 6.611 68.919 8.718 1.00 0.00 H ATOM 58 HZ PHE A 4 8.521 68.477 10.245 1.00 0.00 H ATOM 59 HE1 PHE A 4 8.376 66.652 11.915 1.00 0.00 H ATOM 60 HD1 PHE A 4 6.328 65.273 12.062 1.00 0.00 H ATOM 61 H PHE A 4 3.551 65.161 8.137 1.00 0.00 H ATOM 62 N LEU A 5 3.061 62.628 11.597 1.00 15.90 N ATOM 63 CA LEU A 5 2.025 61.817 12.226 1.00 14.95 C ATOM 64 C LEU A 5 2.463 61.641 13.681 1.00 15.58 C ATOM 65 O LEU A 5 3.663 61.568 13.931 1.00 14.65 O ATOM 66 CB LEU A 5 2.022 60.438 11.554 1.00 14.44 C ATOM 67 CG LEU A 5 0.822 59.759 10.879 1.00 15.81 C ATOM 68 CD1 LEU A 5 -0.027 60.733 10.085 1.00 14.82 C ATOM 69 CD2 LEU A 5 1.375 58.631 9.983 1.00 14.90 C ATOM 70 HA LEU A 5 1.038 62.271 12.145 1.00 0.00 H ATOM 71 HB2 LEU A 5 2.788 60.497 10.781 1.00 0.00 H ATOM 72 HB3 LEU A 5 2.343 59.743 12.330 1.00 0.00 H ATOM 73 HG LEU A 5 0.157 59.354 11.641 1.00 0.00 H ATOM 74 HD21 LEU A 5 2.044 59.057 9.235 1.00 0.00 H ATOM 75 HD22 LEU A 5 1.923 57.917 10.597 1.00 0.00 H ATOM 76 HD23 LEU A 5 0.547 58.125 9.486 1.00 0.00 H ATOM 77 HD11 LEU A 5 -0.410 61.506 10.751 1.00 0.00 H ATOM 78 HD12 LEU A 5 0.581 61.192 9.306 1.00 0.00 H ATOM 79 HD13 LEU A 5 -0.861 60.199 9.630 1.00 0.00 H ATOM 80 H LEU A 5 4.016 62.629 12.009 1.00 0.00 H ATOM 81 N ASN A 6 1.528 61.693 14.637 1.00 15.41 N ATOM 82 CA ASN A 6 1.872 61.424 16.048 1.00 17.86 C ATOM 83 C ASN A 6 1.940 59.905 16.136 1.00 15.12 C ATOM 84 O ASN A 6 1.037 59.233 15.672 1.00 16.99 O ATOM 85 CB ASN A 6 0.795 61.907 17.003 1.00 20.07 C ATOM 86 CG ASN A 6 0.807 63.388 17.165 1.00 24.58 C ATOM 87 OD1 ASN A 6 1.859 64.016 17.067 1.00 27.76 O ATOM 88 ND2 ASN A 6 -0.355 63.971 17.421 1.00 26.75 N ATOM 89 HA ASN A 6 2.794 61.935 16.324 1.00 0.00 H ATOM 90 HB2 ASN A 6 -0.178 61.604 16.617 1.00 0.00 H ATOM 91 HB3 ASN A 6 0.957 61.446 17.977 1.00 0.00 H ATOM 92 HD22 ASN A 6 -1.219 63.397 17.495 1.00 0.00 H ATOM 93 HD21 ASN A 6 -0.403 65.002 17.548 1.00 0.00 H ATOM 94 H ASN A 6 0.547 61.926 14.383 1.00 0.00 H ATOM 95 N ARG A 7 3.006 59.358 16.701 1.00 16.18 N ATOM 96 CA ARG A 7 3.150 57.903 16.776 1.00 16.19 C ATOM 97 C ARG A 7 3.346 57.357 18.192 1.00 13.63 C ATOM 98 O ARG A 7 4.061 57.936 18.997 1.00 15.40 O ATOM 99 CB ARG A 7 4.333 57.457 15.905 1.00 16.01 C ATOM 100 CG ARG A 7 4.561 55.947 15.874 1.00 17.82 C ATOM 101 CD ARG A 7 5.961 55.617 15.354 1.00 17.21 C ATOM 102 NE ARG A 7 6.969 55.769 16.399 1.00 17.73 N ATOM 103 CZ ARG A 7 8.282 55.754 16.197 1.00 18.12 C ATOM 104 NH1 ARG A 7 8.767 55.603 14.978 1.00 20.67 N ATOM 105 NH2 ARG A 7 9.110 55.833 17.228 1.00 17.39 N ATOM 106 HA ARG A 7 2.206 57.494 16.414 1.00 0.00 H ATOM 107 HB2 ARG A 7 4.152 57.796 14.885 1.00 0.00 H ATOM 108 HB3 ARG A 7 5.237 57.931 16.289 1.00 0.00 H ATOM 109 HG2 ARG A 7 4.451 55.548 16.883 1.00 0.00 H ATOM 110 HG3 ARG A 7 3.820 55.487 15.220 1.00 0.00 H ATOM 111 HD2 ARG A 7 6.201 56.289 14.530 1.00 0.00 H ATOM 112 HD3 ARG A 7 5.973 54.587 14.997 1.00 0.00 H ATOM 113 HE ARG A 7 6.634 55.899 17.375 1.00 0.00 H ATOM 114 HH12 ARG A 7 9.796 55.592 14.825 1.00 0.00 H ATOM 115 HH11 ARG A 7 8.120 55.495 14.171 1.00 0.00 H ATOM 116 HH22 ARG A 7 10.138 55.821 17.071 1.00 0.00 H ATOM 117 HH21 ARG A 7 8.732 55.907 18.194 1.00 0.00 H ATOM 118 H ARG A 7 3.749 59.969 17.096 1.00 0.00 H ATOM 119 N LYS A 8 2.721 56.224 18.471 1.00 13.89 N ATOM 120 CA LYS A 8 2.848 55.584 19.770 1.00 13.88 C ATOM 121 C LYS A 8 3.159 54.123 19.545 1.00 14.53 C ATOM 122 O LYS A 8 2.495 53.445 18.763 1.00 13.85 O ATOM 123 CB LYS A 8 1.556 55.686 20.581 1.00 13.06 C ATOM 124 CG LYS A 8 1.652 55.004 21.938 1.00 13.78 C ATOM 125 CD LYS A 8 0.305 54.854 22.610 1.00 12.91 C ATOM 126 CE LYS A 8 0.452 54.231 23.969 1.00 12.26 C ATOM 127 NZ LYS A 8 -0.850 54.143 24.651 1.00 12.67 N ATOM 128 HA LYS A 8 3.639 56.085 20.328 1.00 0.00 H ATOM 129 HB2 LYS A 8 1.325 56.740 20.737 1.00 0.00 H ATOM 130 HB3 LYS A 8 0.751 55.219 20.013 1.00 0.00 H ATOM 131 HG2 LYS A 8 2.087 54.014 21.801 1.00 0.00 H ATOM 132 HG3 LYS A 8 2.300 55.598 22.583 1.00 0.00 H ATOM 133 HD2 LYS A 8 -0.153 55.837 22.715 1.00 0.00 H ATOM 134 HD3 LYS A 8 -0.333 54.221 21.994 1.00 0.00 H ATOM 135 HE2 LYS A 8 1.129 54.839 24.569 1.00 0.00 H ATOM 136 HE3 LYS A 8 0.866 53.229 23.859 1.00 0.00 H ATOM 137 HZ1 LYS A 8 -1.247 55.098 24.762 1.00 0.00 H ATOM 138 HZ2 LYS A 8 -1.498 53.560 24.084 1.00 0.00 H ATOM 139 HZ3 LYS A 8 -0.721 53.709 25.587 1.00 0.00 H ATOM 140 H LYS A 8 2.125 55.781 17.743 1.00 0.00 H ATOM 141 N HIS A 9 4.188 53.639 20.218 1.00 15.62 N ATOM 142 CA HIS A 9 4.568 52.244 20.127 1.00 16.70 C ATOM 143 C HIS A 9 3.740 51.544 21.218 1.00 18.83 C ATOM 144 O HIS A 9 3.892 51.835 22.408 1.00 21.40 O ATOM 145 CB HIS A 9 6.064 52.128 20.403 1.00 18.43 C ATOM 146 CG HIS A 9 6.664 50.832 19.983 1.00 18.25 C ATOM 147 ND1 HIS A 9 5.909 49.729 19.647 1.00 21.26 N ATOM 148 CD2 HIS A 9 7.956 50.454 19.833 1.00 19.27 C ATOM 149 CE1 HIS A 9 6.706 48.733 19.305 1.00 18.30 C ATOM 150 NE2 HIS A 9 7.954 49.154 19.410 1.00 21.71 N ATOM 151 HA HIS A 9 4.383 51.801 19.149 1.00 0.00 H ATOM 152 HB2 HIS A 9 6.574 52.930 19.869 1.00 0.00 H ATOM 153 HB3 HIS A 9 6.224 52.248 21.474 1.00 0.00 H ATOM 154 HD2 HIS A 9 8.835 51.072 20.016 1.00 0.00 H ATOM 155 HE1 HIS A 9 6.390 47.738 18.991 1.00 0.00 H ATOM 156 H HIS A 9 4.739 54.276 20.828 1.00 0.00 H ATOM 157 N GLU A 10 2.837 50.668 20.799 1.00 16.96 N ATOM 158 CA GLU A 10 1.945 49.937 21.694 1.00 18.64 C ATOM 159 C GLU A 10 2.411 48.541 22.069 1.00 18.43 C ATOM 160 O GLU A 10 2.490 48.178 23.244 1.00 17.76 O ATOM 161 CB GLU A 10 0.584 49.792 21.022 1.00 22.03 C ATOM 162 CG GLU A 10 -0.387 50.871 21.365 1.00 27.85 C ATOM 163 CD GLU A 10 -1.041 50.651 22.710 1.00 29.36 C ATOM 164 OE1 GLU A 10 -0.874 49.560 23.297 1.00 31.67 O ATOM 165 OE2 GLU A 10 -1.742 51.571 23.171 1.00 30.45 O ATOM 166 HA GLU A 10 1.916 50.522 22.613 1.00 0.00 H ATOM 167 HB2 GLU A 10 0.734 49.797 19.942 1.00 0.00 H ATOM 168 HB3 GLU A 10 0.154 48.837 21.323 1.00 0.00 H ATOM 169 HG2 GLU A 10 0.141 51.824 21.384 1.00 0.00 H ATOM 170 HG3 GLU A 10 -1.162 50.901 20.599 1.00 0.00 H ATOM 171 H GLU A 10 2.760 50.492 19.777 1.00 0.00 H ATOM 172 N TRP A 11 2.622 47.729 21.045 1.00 18.53 N ATOM 173 CA TRP A 11 3.018 46.356 21.231 1.00 17.30 C ATOM 174 C TRP A 11 4.356 46.023 20.632 1.00 20.83 C ATOM 175 O TRP A 11 4.811 46.641 19.661 1.00 19.36 O ATOM 176 CB TRP A 11 1.982 45.444 20.591 1.00 16.79 C ATOM 177 CG TRP A 11 0.717 45.439 21.298 1.00 15.43 C ATOM 178 CD1 TRP A 11 -0.357 46.236 21.067 1.00 16.15 C ATOM 179 CD2 TRP A 11 0.378 44.599 22.397 1.00 15.95 C ATOM 180 NE1 TRP A 11 -1.355 45.945 21.965 1.00 14.15 N ATOM 181 CE2 TRP A 11 -0.930 44.944 22.792 1.00 15.71 C ATOM 182 CE3 TRP A 11 1.045 43.579 23.081 1.00 15.63 C ATOM 183 CZ2 TRP A 11 -1.576 44.304 23.854 1.00 16.96 C ATOM 184 CZ3 TRP A 11 0.410 42.948 24.119 1.00 16.77 C ATOM 185 CH2 TRP A 11 -0.890 43.306 24.499 1.00 18.14 C ATOM 186 HA TRP A 11 3.093 46.206 22.308 1.00 0.00 H ATOM 187 HB2 TRP A 11 1.807 45.780 19.569 1.00 0.00 H ATOM 188 HB3 TRP A 11 2.376 44.428 20.576 1.00 0.00 H ATOM 189 HE1 TRP A 11 -2.284 46.411 22.008 1.00 0.00 H ATOM 190 HD1 TRP A 11 -0.418 46.994 20.286 1.00 0.00 H ATOM 191 HZ2 TRP A 11 -2.584 44.587 24.157 1.00 0.00 H ATOM 192 HH2 TRP A 11 -1.367 42.780 25.326 1.00 0.00 H ATOM 193 HZ3 TRP A 11 0.926 42.154 24.658 1.00 0.00 H ATOM 194 HE3 TRP A 11 2.056 43.289 22.793 1.00 0.00 H ATOM 195 H TRP A 11 2.498 48.092 20.078 1.00 0.00 H ATOM 196 N GLU A 12 4.987 45.034 21.235 1.00 21.11 N ATOM 197 CA GLU A 12 6.241 44.529 20.746 1.00 22.04 C ATOM 198 C GLU A 12 5.906 43.096 20.424 1.00 21.34 C ATOM 199 O GLU A 12 4.745 42.684 20.546 1.00 20.00 O ATOM 200 CB GLU A 12 7.321 44.635 21.808 1.00 23.52 C ATOM 201 CG GLU A 12 7.700 46.071 22.062 1.00 28.01 C ATOM 202 CD GLU A 12 8.932 46.202 22.914 1.00 31.32 C ATOM 203 OE1 GLU A 12 9.657 45.192 23.040 1.00 34.37 O ATOM 204 OE2 GLU A 12 9.177 47.310 23.453 1.00 32.30 O ATOM 205 HA GLU A 12 6.638 45.077 19.892 1.00 0.00 H ATOM 206 HB2 GLU A 12 6.952 44.195 22.735 1.00 0.00 H ATOM 207 HB3 GLU A 12 8.203 44.088 21.474 1.00 0.00 H ATOM 208 HG2 GLU A 12 7.884 46.558 21.105 1.00 0.00 H ATOM 209 HG3 GLU A 12 6.871 46.567 22.567 1.00 0.00 H ATOM 210 H GLU A 12 4.567 44.609 22.086 1.00 0.00 H ATOM 211 N ALA A 13 6.890 42.335 19.974 1.00 21.46 N ATOM 212 CA ALA A 13 6.631 40.950 19.643 1.00 21.09 C ATOM 213 C ALA A 13 6.356 40.097 20.894 1.00 21.55 C ATOM 214 O ALA A 13 6.698 40.479 22.019 1.00 20.29 O ATOM 215 CB ALA A 13 7.789 40.372 18.823 1.00 21.92 C ATOM 216 HA ALA A 13 5.726 40.920 19.037 1.00 0.00 H ATOM 217 HB1 ALA A 13 7.901 40.943 17.901 1.00 0.00 H ATOM 218 HB2 ALA A 13 8.710 40.433 19.403 1.00 0.00 H ATOM 219 HB3 ALA A 13 7.578 39.330 18.583 1.00 0.00 H ATOM 220 H ALA A 13 7.845 42.730 19.859 1.00 0.00 H ATOM 221 N HIS A 14 5.658 38.985 20.682 1.00 22.41 N ATOM 222 CA HIS A 14 5.330 38.034 21.735 1.00 23.43 C ATOM 223 C HIS A 14 4.427 38.565 22.833 1.00 26.65 C ATOM 224 O HIS A 14 4.607 38.284 24.027 1.00 25.72 O ATOM 225 CB HIS A 14 6.615 37.427 22.280 1.00 20.70 C ATOM 226 CG HIS A 14 7.302 36.559 21.284 1.00 19.89 C ATOM 227 ND1 HIS A 14 8.343 36.987 20.508 1.00 20.25 N ATOM 228 CD2 HIS A 14 7.030 35.285 20.882 1.00 20.19 C ATOM 229 CE1 HIS A 14 8.696 36.033 19.662 1.00 20.13 C ATOM 230 NE2 HIS A 14 7.908 34.988 19.880 1.00 18.43 N ATOM 231 HA HIS A 14 4.720 37.257 21.274 1.00 0.00 H ATOM 232 HB2 HIS A 14 7.290 38.234 22.565 1.00 0.00 H ATOM 233 HB3 HIS A 14 6.374 36.829 23.159 1.00 0.00 H ATOM 234 HD2 HIS A 14 6.258 34.629 21.284 1.00 0.00 H ATOM 235 HE1 HIS A 14 9.491 36.094 18.919 1.00 0.00 H ATOM 236 H HIS A 14 5.330 38.784 19.716 1.00 0.00 H ATOM 237 N ASN A 15 3.393 39.265 22.380 1.00 28.96 N ATOM 238 CA ASN A 15 2.399 39.876 23.248 1.00 30.52 C ATOM 239 C ASN A 15 2.977 40.624 24.425 1.00 28.86 C ATOM 240 O ASN A 15 2.425 40.598 25.520 1.00 28.49 O ATOM 241 CB ASN A 15 1.360 38.858 23.681 1.00 33.46 C ATOM 242 CG ASN A 15 0.428 38.509 22.566 1.00 36.47 C ATOM 243 OD1 ASN A 15 -0.545 39.213 22.337 1.00 39.03 O ATOM 244 ND2 ASN A 15 0.754 37.464 21.808 1.00 38.03 N ATOM 245 HA ASN A 15 1.908 40.641 22.646 1.00 0.00 H ATOM 246 HB2 ASN A 15 1.869 37.953 24.013 1.00 0.00 H ATOM 247 HB3 ASN A 15 0.783 39.272 24.508 1.00 0.00 H ATOM 248 HD22 ASN A 15 1.591 36.893 22.042 1.00 0.00 H ATOM 249 HD21 ASN A 15 0.171 37.218 20.982 1.00 0.00 H ATOM 250 H ASN A 15 3.289 39.382 21.352 1.00 0.00 H ATOM 251 N LYS A 16 4.131 41.237 24.191 1.00 28.08 N ATOM 252 CA LYS A 16 4.776 42.051 25.201 1.00 29.95 C ATOM 253 C LYS A 16 4.312 43.476 24.941 1.00 28.45 C ATOM 254 O LYS A 16 4.189 43.901 23.793 1.00 25.74 O ATOM 255 CB LYS A 16 6.302 42.000 25.083 1.00 32.55 C ATOM 256 CG LYS A 16 7.020 43.021 25.991 1.00 36.30 C ATOM 257 CD LYS A 16 8.554 42.915 25.900 1.00 40.04 C ATOM 258 CE LYS A 16 9.293 43.829 26.912 1.00 40.76 C ATOM 259 NZ LYS A 16 9.198 45.302 26.613 1.00 41.55 N ATOM 260 HA LYS A 16 4.517 41.691 26.197 1.00 0.00 H ATOM 261 HB2 LYS A 16 6.637 40.999 25.355 1.00 0.00 H ATOM 262 HB3 LYS A 16 6.576 42.204 24.048 1.00 0.00 H ATOM 263 HG2 LYS A 16 6.720 44.026 25.693 1.00 0.00 H ATOM 264 HG3 LYS A 16 6.718 42.844 27.023 1.00 0.00 H ATOM 265 HD2 LYS A 16 8.842 41.881 26.093 1.00 0.00 H ATOM 266 HD3 LYS A 16 8.861 43.195 24.892 1.00 0.00 H ATOM 267 HE2 LYS A 16 10.347 43.550 26.916 1.00 0.00 H ATOM 268 HE3 LYS A 16 8.869 43.655 27.901 1.00 0.00 H ATOM 269 HZ1 LYS A 16 9.611 45.492 25.677 1.00 0.00 H ATOM 270 HZ2 LYS A 16 8.199 45.592 26.618 1.00 0.00 H ATOM 271 HZ3 LYS A 16 9.719 45.836 27.338 1.00 0.00 H ATOM 272 H LYS A 16 4.583 41.130 23.260 1.00 0.00 H ATOM 273 N LYS A 17 4.031 44.192 26.017 1.00 27.33 N ATOM 274 CA LYS A 17 3.624 45.574 25.933 1.00 26.96 C ATOM 275 C LYS A 17 4.944 46.324 25.747 1.00 28.15 C ATOM 276 O LYS A 17 5.948 45.987 26.375 1.00 27.87 O ATOM 277 CB LYS A 17 2.975 45.988 27.249 1.00 27.62 C ATOM 278 CG LYS A 17 1.778 46.869 27.094 1.00 29.05 C ATOM 279 CD LYS A 17 0.655 46.113 26.416 1.00 32.51 C ATOM 280 CE LYS A 17 -0.562 47.005 26.218 1.00 35.66 C ATOM 281 NZ LYS A 17 -1.113 47.480 27.535 1.00 38.04 N ATOM 282 HA LYS A 17 2.907 45.769 25.136 1.00 0.00 H ATOM 283 HB2 LYS A 17 2.669 45.085 27.778 1.00 0.00 H ATOM 284 HB3 LYS A 17 3.717 46.521 27.843 1.00 0.00 H ATOM 285 HG2 LYS A 17 1.446 47.202 28.077 1.00 0.00 H ATOM 286 HG3 LYS A 17 2.045 47.736 26.490 1.00 0.00 H ATOM 287 HD2 LYS A 17 0.999 45.759 25.444 1.00 0.00 H ATOM 288 HD3 LYS A 17 0.375 45.260 27.034 1.00 0.00 H ATOM 289 HE2 LYS A 17 -1.333 46.442 25.693 1.00 0.00 H ATOM 290 HE3 LYS A 17 -0.275 47.870 25.620 1.00 0.00 H ATOM 291 HZ1 LYS A 17 -1.394 46.659 28.108 1.00 0.00 H ATOM 292 HZ2 LYS A 17 -0.383 48.023 28.039 1.00 0.00 H ATOM 293 HZ3 LYS A 17 -1.941 48.085 27.365 1.00 0.00 H ATOM 294 H LYS A 17 4.106 43.745 26.953 1.00 0.00 H ATOM 295 N ALA A 18 4.978 47.268 24.818 1.00 26.95 N ATOM 296 CA ALA A 18 6.184 48.042 24.590 1.00 24.83 C ATOM 297 C ALA A 18 6.508 48.847 25.857 1.00 26.34 C ATOM 298 O ALA A 18 5.610 49.358 26.532 1.00 25.61 O ATOM 299 CB ALA A 18 5.981 48.971 23.407 1.00 25.25 C ATOM 300 HA ALA A 18 7.017 47.376 24.366 1.00 0.00 H ATOM 301 HB1 ALA A 18 5.756 48.382 22.518 1.00 0.00 H ATOM 302 HB2 ALA A 18 5.152 49.647 23.616 1.00 0.00 H ATOM 303 HB3 ALA A 18 6.890 49.549 23.241 1.00 0.00 H ATOM 304 H ALA A 18 4.130 47.456 24.246 1.00 0.00 H ATOM 305 N SER A 19 7.796 48.952 26.173 1.00 29.37 N ATOM 306 CA SER A 19 8.278 49.684 27.355 1.00 31.72 C ATOM 307 C SER A 19 8.313 51.190 27.152 1.00 32.25 C ATOM 308 O SER A 19 8.228 51.957 28.108 1.00 33.66 O ATOM 309 CB SER A 19 9.679 49.202 27.734 1.00 32.21 C ATOM 310 OG SER A 19 10.522 49.148 26.593 1.00 34.59 O ATOM 311 HA SER A 19 7.568 49.477 28.155 1.00 0.00 H ATOM 312 HB2 SER A 19 9.608 48.207 28.173 1.00 0.00 H ATOM 313 HB3 SER A 19 10.108 49.889 28.463 1.00 0.00 H ATOM 314 HG SER A 19 11.421 48.834 26.863 1.00 0.00 H ATOM 315 H SER A 19 8.496 48.495 25.555 1.00 0.00 H ATOM 316 N SER A 20 8.498 51.590 25.899 1.00 33.22 N ATOM 317 CA SER A 20 8.554 52.988 25.477 1.00 32.63 C ATOM 318 C SER A 20 7.193 53.375 24.874 1.00 29.50 C ATOM 319 O SER A 20 6.968 53.232 23.664 1.00 28.25 O ATOM 320 CB SER A 20 9.667 53.127 24.428 1.00 34.97 C ATOM 321 OG SER A 20 9.680 51.993 23.552 1.00 36.36 O ATOM 322 HA SER A 20 8.767 53.646 26.319 1.00 0.00 H ATOM 323 HB2 SER A 20 10.630 53.200 24.934 1.00 0.00 H ATOM 324 HB3 SER A 20 9.497 54.030 23.842 1.00 0.00 H ATOM 325 HG SER A 20 8.808 51.926 23.088 1.00 0.00 H ATOM 326 H SER A 20 8.611 50.858 25.168 1.00 0.00 H ATOM 327 N ARG A 21 6.298 53.913 25.690 1.00 26.57 N ATOM 328 CA ARG A 21 4.992 54.239 25.163 1.00 24.41 C ATOM 329 C ARG A 21 4.460 55.646 25.113 1.00 20.69 C ATOM 330 O ARG A 21 3.252 55.840 25.180 1.00 19.62 O ATOM 331 CB ARG A 21 3.955 53.329 25.790 1.00 28.80 C ATOM 332 CG ARG A 21 4.123 51.906 25.356 1.00 32.60 C ATOM 333 CD ARG A 21 2.974 51.101 25.819 1.00 36.05 C ATOM 334 NE ARG A 21 3.055 50.861 27.247 1.00 38.77 N ATOM 335 CZ ARG A 21 2.000 50.631 28.008 1.00 40.18 C ATOM 336 NH1 ARG A 21 0.784 50.631 27.473 1.00 42.41 N ATOM 337 NH2 ARG A 21 2.169 50.339 29.287 1.00 41.27 N ATOM 338 HA ARG A 21 5.183 54.084 24.101 1.00 0.00 H ATOM 339 HB2 ARG A 21 4.051 53.380 26.875 1.00 0.00 H ATOM 340 HB3 ARG A 21 2.962 53.672 25.498 1.00 0.00 H ATOM 341 HG2 ARG A 21 4.180 51.864 24.268 1.00 0.00 H ATOM 342 HG3 ARG A 21 5.042 51.504 25.782 1.00 0.00 H ATOM 343 HD2 ARG A 21 2.973 50.145 25.295 1.00 0.00 H ATOM 344 HD3 ARG A 21 2.050 51.636 25.598 1.00 0.00 H ATOM 345 HE ARG A 21 3.993 50.870 27.696 1.00 0.00 H ATOM 346 HH12 ARG A 21 -0.047 50.450 28.071 1.00 0.00 H ATOM 347 HH11 ARG A 21 0.663 50.812 26.456 1.00 0.00 H ATOM 348 HH22 ARG A 21 1.343 50.157 29.892 1.00 0.00 H ATOM 349 HH21 ARG A 21 3.128 50.292 29.687 1.00 0.00 H ATOM 350 H ARG A 21 6.530 54.097 26.687 1.00 0.00 H ATOM 351 N SER A 22 5.321 56.641 24.986 1.00 17.56 N ATOM 352 CA SER A 22 4.785 57.982 24.884 1.00 20.47 C ATOM 353 C SER A 22 4.616 58.335 23.398 1.00 17.10 C ATOM 354 O SER A 22 5.207 57.703 22.524 1.00 20.23 O ATOM 355 CB SER A 22 5.657 59.001 25.635 1.00 21.16 C ATOM 356 OG SER A 22 6.911 58.450 26.011 1.00 28.08 O ATOM 357 HA SER A 22 3.808 58.022 25.366 1.00 0.00 H ATOM 358 HB2 SER A 22 5.130 59.322 26.533 1.00 0.00 H ATOM 359 HB3 SER A 22 5.829 59.862 24.989 1.00 0.00 H ATOM 360 HG SER A 22 7.400 58.161 25.200 1.00 0.00 H ATOM 361 H SER A 22 6.346 56.467 24.960 1.00 0.00 H ATOM 362 N TRP A 23 3.757 59.299 23.114 1.00 16.99 N ATOM 363 CA TRP A 23 3.517 59.719 21.737 1.00 17.47 C ATOM 364 C TRP A 23 4.665 60.596 21.305 1.00 17.91 C ATOM 365 O TRP A 23 5.280 61.274 22.131 1.00 16.76 O ATOM 366 CB TRP A 23 2.212 60.503 21.628 1.00 17.14 C ATOM 367 CG TRP A 23 0.988 59.656 21.769 1.00 18.46 C ATOM 368 CD1 TRP A 23 0.370 59.280 22.943 1.00 17.04 C ATOM 369 CD2 TRP A 23 0.222 59.078 20.702 1.00 16.69 C ATOM 370 NE1 TRP A 23 -0.738 58.515 22.658 1.00 16.21 N ATOM 371 CE2 TRP A 23 -0.854 58.370 21.295 1.00 18.04 C ATOM 372 CE3 TRP A 23 0.337 59.085 19.307 1.00 15.15 C ATOM 373 CZ2 TRP A 23 -1.805 57.675 20.532 1.00 18.08 C ATOM 374 CZ3 TRP A 23 -0.607 58.400 18.549 1.00 14.80 C ATOM 375 CH2 TRP A 23 -1.664 57.705 19.161 1.00 16.88 C ATOM 376 HA TRP A 23 3.440 58.839 21.099 1.00 0.00 H ATOM 377 HB2 TRP A 23 2.199 61.260 22.412 1.00 0.00 H ATOM 378 HB3 TRP A 23 2.183 60.990 20.653 1.00 0.00 H ATOM 379 HE1 TRP A 23 -1.386 58.110 23.363 1.00 0.00 H ATOM 380 HD1 TRP A 23 0.708 59.548 23.944 1.00 0.00 H ATOM 381 HZ2 TRP A 23 -2.623 57.132 21.005 1.00 0.00 H ATOM 382 HH2 TRP A 23 -2.388 57.179 18.539 1.00 0.00 H ATOM 383 HZ3 TRP A 23 -0.525 58.402 17.462 1.00 0.00 H ATOM 384 HE3 TRP A 23 1.154 59.619 18.822 1.00 0.00 H ATOM 385 H TRP A 23 3.242 59.767 23.887 1.00 0.00 H ATOM 386 N HIS A 24 5.015 60.525 20.031 1.00 18.00 N ATOM 387 CA HIS A 24 6.100 61.351 19.499 1.00 17.66 C ATOM 388 C HIS A 24 5.714 61.757 18.098 1.00 17.67 C ATOM 389 O HIS A 24 5.094 60.977 17.377 1.00 14.22 O ATOM 390 CB HIS A 24 7.427 60.583 19.489 1.00 18.65 C ATOM 391 CG HIS A 24 7.968 60.282 20.858 1.00 22.33 C ATOM 392 ND1 HIS A 24 8.058 59.005 21.362 1.00 22.09 N ATOM 393 CD2 HIS A 24 8.440 61.103 21.827 1.00 21.09 C ATOM 394 CE1 HIS A 24 8.563 59.047 22.585 1.00 20.28 C ATOM 395 NE2 HIS A 24 8.803 60.313 22.888 1.00 20.78 N ATOM 396 HA HIS A 24 6.245 62.229 20.129 1.00 0.00 H ATOM 397 HB2 HIS A 24 7.274 59.639 18.965 1.00 0.00 H ATOM 398 HB3 HIS A 24 8.165 61.179 18.952 1.00 0.00 H ATOM 399 HD2 HIS A 24 8.517 62.189 21.773 1.00 0.00 H ATOM 400 HE1 HIS A 24 8.749 58.188 23.230 1.00 0.00 H ATOM 401 H HIS A 24 4.511 59.872 19.398 1.00 0.00 H ATOM 402 N ASN A 25 5.996 63.010 17.761 1.00 17.55 N ATOM 403 CA ASN A 25 5.690 63.551 16.447 1.00 19.15 C ATOM 404 C ASN A 25 6.836 63.158 15.517 1.00 19.81 C ATOM 405 O ASN A 25 7.977 63.563 15.727 1.00 20.87 O ATOM 406 CB ASN A 25 5.560 65.073 16.528 1.00 22.24 C ATOM 407 CG ASN A 25 5.213 65.717 15.185 1.00 25.75 C ATOM 408 OD1 ASN A 25 5.833 66.707 14.796 1.00 28.50 O ATOM 409 ND2 ASN A 25 4.202 65.186 14.496 1.00 25.16 N ATOM 410 HA ASN A 25 4.746 63.157 16.072 1.00 0.00 H ATOM 411 HB2 ASN A 25 4.775 65.317 17.243 1.00 0.00 H ATOM 412 HB3 ASN A 25 6.507 65.485 16.876 1.00 0.00 H ATOM 413 HD22 ASN A 25 3.706 64.349 14.863 1.00 0.00 H ATOM 414 HD21 ASN A 25 3.910 65.609 13.592 1.00 0.00 H ATOM 415 H ASN A 25 6.453 63.627 18.463 1.00 0.00 H ATOM 416 N VAL A 26 6.540 62.289 14.556 1.00 15.96 N ATOM 417 CA VAL A 26 7.534 61.835 13.601 1.00 15.20 C ATOM 418 C VAL A 26 7.108 62.068 12.138 1.00 13.93 C ATOM 419 O VAL A 26 5.918 62.100 11.799 1.00 13.63 O ATOM 420 CB VAL A 26 7.878 60.345 13.823 1.00 15.73 C ATOM 421 CG1 VAL A 26 8.500 60.155 15.192 1.00 18.56 C ATOM 422 CG2 VAL A 26 6.629 59.488 13.715 1.00 18.23 C ATOM 423 HA VAL A 26 8.424 62.438 13.779 1.00 0.00 H ATOM 424 HB VAL A 26 8.587 60.038 13.054 1.00 0.00 H ATOM 425 HG11 VAL A 26 9.412 60.748 15.261 1.00 0.00 H ATOM 426 HG12 VAL A 26 7.795 60.479 15.958 1.00 0.00 H ATOM 427 HG13 VAL A 26 8.739 59.102 15.338 1.00 0.00 H ATOM 428 HG21 VAL A 26 5.908 59.802 14.470 1.00 0.00 H ATOM 429 HG22 VAL A 26 6.193 59.607 12.723 1.00 0.00 H ATOM 430 HG23 VAL A 26 6.892 58.442 13.874 1.00 0.00 H ATOM 431 H VAL A 26 5.569 61.924 14.486 1.00 0.00 H ATOM 432 N TYR A 27 8.105 62.273 11.288 1.00 15.11 N ATOM 433 CA TYR A 27 7.904 62.496 9.865 1.00 14.53 C ATOM 434 C TYR A 27 8.054 61.130 9.195 1.00 11.70 C ATOM 435 O TYR A 27 9.150 60.576 9.137 1.00 11.47 O ATOM 436 CB TYR A 27 8.949 63.482 9.339 1.00 13.59 C ATOM 437 CG TYR A 27 8.704 63.893 7.915 1.00 15.13 C ATOM 438 CD1 TYR A 27 7.848 64.952 7.615 1.00 15.83 C ATOM 439 CD2 TYR A 27 9.299 63.208 6.857 1.00 15.99 C ATOM 440 CE1 TYR A 27 7.591 65.320 6.308 1.00 15.94 C ATOM 441 CE2 TYR A 27 9.040 63.574 5.534 1.00 16.47 C ATOM 442 CZ TYR A 27 8.188 64.626 5.277 1.00 16.93 C ATOM 443 OH TYR A 27 7.915 64.989 3.988 1.00 18.84 O ATOM 444 HA TYR A 27 6.924 62.925 9.656 1.00 0.00 H ATOM 445 HB3 TYR A 27 9.931 63.014 9.402 1.00 0.00 H ATOM 446 HB2 TYR A 27 8.932 64.374 9.966 1.00 0.00 H ATOM 447 HD2 TYR A 27 9.974 62.378 7.064 1.00 0.00 H ATOM 448 HE2 TYR A 27 9.508 63.032 4.712 1.00 0.00 H ATOM 449 HE1 TYR A 27 6.921 66.153 6.094 1.00 0.00 H ATOM 450 HD1 TYR A 27 7.372 65.501 8.428 1.00 0.00 H ATOM 451 HH TYR A 27 7.502 64.226 3.512 1.00 0.00 H ATOM 452 H TYR A 27 9.077 62.274 11.657 1.00 0.00 H ATOM 453 N CYS A 28 6.940 60.599 8.704 1.00 14.77 N ATOM 454 CA CYS A 28 6.891 59.276 8.072 1.00 16.76 C ATOM 455 C CYS A 28 6.963 59.230 6.547 1.00 14.57 C ATOM 456 O CYS A 28 6.350 60.047 5.871 1.00 14.13 O ATOM 457 CB CYS A 28 5.627 58.547 8.527 1.00 18.26 C ATOM 458 SG CYS A 28 5.468 58.479 10.330 1.00 18.07 S ATOM 459 HA CYS A 28 7.809 58.791 8.404 1.00 0.00 H ATOM 460 HB2 CYS A 28 5.654 57.528 8.141 1.00 0.00 H ATOM 461 HB3 CYS A 28 4.759 59.066 8.120 1.00 0.00 H ATOM 462 HG CYS A 28 5.421 59.763 10.835 1.00 0.00 H ATOM 463 H CYS A 28 6.059 61.148 8.771 1.00 0.00 H ATOM 464 N VAL A 29 7.673 58.241 6.012 1.00 14.65 N ATOM 465 CA VAL A 29 7.794 58.106 4.562 1.00 14.68 C ATOM 466 C VAL A 29 7.518 56.696 4.115 1.00 13.25 C ATOM 467 O VAL A 29 8.113 55.759 4.628 1.00 14.32 O ATOM 468 CB VAL A 29 9.206 58.502 4.054 1.00 14.48 C ATOM 469 CG1 VAL A 29 9.300 58.322 2.526 1.00 15.59 C ATOM 470 CG2 VAL A 29 9.520 59.943 4.424 1.00 11.45 C ATOM 471 HA VAL A 29 7.053 58.784 4.139 1.00 0.00 H ATOM 472 HB VAL A 29 9.936 57.848 4.532 1.00 0.00 H ATOM 473 HG11 VAL A 29 9.111 57.279 2.272 1.00 0.00 H ATOM 474 HG12 VAL A 29 8.558 58.956 2.040 1.00 0.00 H ATOM 475 HG13 VAL A 29 10.297 58.605 2.189 1.00 0.00 H ATOM 476 HG21 VAL A 29 8.781 60.603 3.969 1.00 0.00 H ATOM 477 HG22 VAL A 29 9.489 60.053 5.508 1.00 0.00 H ATOM 478 HG23 VAL A 29 10.514 60.202 4.059 1.00 0.00 H ATOM 479 H VAL A 29 8.148 57.555 6.633 1.00 0.00 H ATOM 480 N ILE A 30 6.548 56.543 3.223 1.00 14.58 N ATOM 481 CA ILE A 30 6.228 55.224 2.652 1.00 18.10 C ATOM 482 C ILE A 30 6.903 55.171 1.279 1.00 18.47 C ATOM 483 O ILE A 30 6.541 55.946 0.375 1.00 17.66 O ATOM 484 CB ILE A 30 4.704 55.026 2.419 1.00 19.55 C ATOM 485 CG1 ILE A 30 3.969 54.930 3.750 1.00 22.28 C ATOM 486 CG2 ILE A 30 4.446 53.779 1.604 1.00 19.43 C ATOM 487 CD1 ILE A 30 4.606 53.994 4.707 1.00 25.40 C ATOM 488 HA ILE A 30 6.567 54.453 3.344 1.00 0.00 H ATOM 489 HB ILE A 30 4.332 55.890 1.868 1.00 0.00 H ATOM 490 HG12 ILE A 30 3.941 55.921 4.202 1.00 0.00 H ATOM 491 HG13 ILE A 30 2.951 54.590 3.559 1.00 0.00 H ATOM 492 HD11 ILE A 30 4.632 52.994 4.273 1.00 0.00 H ATOM 493 HD12 ILE A 30 5.623 54.327 4.917 1.00 0.00 H ATOM 494 HD13 ILE A 30 4.031 53.975 5.633 1.00 0.00 H ATOM 495 HG21 ILE A 30 4.942 53.869 0.638 1.00 0.00 H ATOM 496 HG22 ILE A 30 4.838 52.912 2.136 1.00 0.00 H ATOM 497 HG23 ILE A 30 3.373 53.661 1.453 1.00 0.00 H ATOM 498 H ILE A 30 6.001 57.374 2.920 1.00 0.00 H ATOM 499 N ASN A 31 7.880 54.286 1.125 1.00 17.68 N ATOM 500 CA ASN A 31 8.600 54.134 -0.139 1.00 18.69 C ATOM 501 C ASN A 31 9.177 52.721 -0.215 1.00 18.06 C ATOM 502 O ASN A 31 9.703 52.216 0.775 1.00 18.45 O ATOM 503 CB ASN A 31 9.727 55.176 -0.248 1.00 16.59 C ATOM 504 CG ASN A 31 10.447 55.130 -1.593 1.00 18.15 C ATOM 505 OD1 ASN A 31 11.585 54.698 -1.677 1.00 19.51 O ATOM 506 ND2 ASN A 31 9.770 55.551 -2.649 1.00 17.78 N ATOM 507 HA ASN A 31 7.911 54.294 -0.968 1.00 0.00 H ATOM 508 HB2 ASN A 31 9.297 56.169 -0.116 1.00 0.00 H ATOM 509 HB3 ASN A 31 10.453 54.988 0.543 1.00 0.00 H ATOM 510 HD22 ASN A 31 8.801 55.912 -2.536 1.00 0.00 H ATOM 511 HD21 ASN A 31 10.206 55.520 -3.593 1.00 0.00 H ATOM 512 H ASN A 31 8.142 53.681 1.929 1.00 0.00 H ATOM 513 N ASN A 32 9.063 52.094 -1.388 1.00 18.40 N ATOM 514 CA ASN A 32 9.555 50.733 -1.626 1.00 17.68 C ATOM 515 C ASN A 32 9.087 49.709 -0.607 1.00 14.45 C ATOM 516 O ASN A 32 9.877 48.944 -0.097 1.00 16.24 O ATOM 517 CB ASN A 32 11.082 50.701 -1.716 1.00 22.56 C ATOM 518 CG ASN A 32 11.615 49.430 -2.412 1.00 28.30 C ATOM 519 OD1 ASN A 32 12.803 49.344 -2.725 1.00 32.16 O ATOM 520 ND2 ASN A 32 10.735 48.459 -2.676 1.00 30.28 N ATOM 521 HA ASN A 32 9.117 50.446 -2.582 1.00 0.00 H ATOM 522 HB2 ASN A 32 11.416 51.573 -2.279 1.00 0.00 H ATOM 523 HB3 ASN A 32 11.491 50.743 -0.707 1.00 0.00 H ATOM 524 HD22 ASN A 32 9.740 48.569 -2.396 1.00 0.00 H ATOM 525 HD21 ASN A 32 11.046 47.594 -3.162 1.00 0.00 H ATOM 526 H ASN A 32 8.602 52.596 -2.173 1.00 0.00 H ATOM 527 N GLN A 33 7.784 49.669 -0.370 1.00 17.51 N ATOM 528 CA GLN A 33 7.149 48.750 0.584 1.00 18.63 C ATOM 529 C GLN A 33 7.667 48.807 2.010 1.00 17.69 C ATOM 530 O GLN A 33 7.607 47.797 2.722 1.00 15.07 O ATOM 531 CB GLN A 33 7.233 47.311 0.105 1.00 24.47 C ATOM 532 CG GLN A 33 6.403 46.994 -1.124 1.00 28.75 C ATOM 533 CD GLN A 33 6.453 45.511 -1.444 1.00 30.69 C ATOM 534 OE1 GLN A 33 5.511 44.769 -1.152 1.00 31.04 O ATOM 535 NE2 GLN A 33 7.585 45.058 -1.986 1.00 31.70 N ATOM 536 HA GLN A 33 6.118 49.103 0.616 1.00 0.00 H ATOM 537 HB2 GLN A 33 8.276 47.091 -0.125 1.00 0.00 H ATOM 538 HB3 GLN A 33 6.897 46.664 0.916 1.00 0.00 H ATOM 539 HG2 GLN A 33 5.369 47.285 -0.941 1.00 0.00 H ATOM 540 HG3 GLN A 33 6.793 47.556 -1.973 1.00 0.00 H ATOM 541 HE22 GLN A 33 8.353 45.721 -2.216 1.00 0.00 H ATOM 542 HE21 GLN A 33 7.699 44.042 -2.179 1.00 0.00 H ATOM 543 H GLN A 33 7.173 50.329 -0.892 1.00 0.00 H ATOM 544 N GLU A 34 8.204 49.962 2.408 1.00 17.93 N ATOM 545 CA GLU A 34 8.709 50.162 3.760 1.00 18.99 C ATOM 546 C GLU A 34 8.319 51.524 4.294 1.00 17.91 C ATOM 547 O GLU A 34 7.864 52.403 3.554 1.00 14.12 O ATOM 548 CB GLU A 34 10.228 49.998 3.830 1.00 22.53 C ATOM 549 CG GLU A 34 10.675 48.556 3.690 1.00 29.83 C ATOM 550 CD GLU A 34 12.032 48.287 4.302 1.00 33.87 C ATOM 551 OE1 GLU A 34 13.043 48.611 3.641 1.00 34.98 O ATOM 552 OE2 GLU A 34 12.088 47.735 5.438 1.00 36.29 O ATOM 553 HA GLU A 34 8.252 49.392 4.382 1.00 0.00 H ATOM 554 HB2 GLU A 34 10.678 50.581 3.027 1.00 0.00 H ATOM 555 HB3 GLU A 34 10.575 50.378 4.791 1.00 0.00 H ATOM 556 HG2 GLU A 34 9.941 47.917 4.181 1.00 0.00 H ATOM 557 HG3 GLU A 34 10.719 48.309 2.629 1.00 0.00 H ATOM 558 H GLU A 34 8.264 50.747 1.729 1.00 0.00 H ATOM 559 N MET A 35 8.462 51.691 5.600 1.00 18.75 N ATOM 560 CA MET A 35 8.131 52.958 6.232 1.00 18.73 C ATOM 561 C MET A 35 9.322 53.442 7.042 1.00 15.64 C ATOM 562 O MET A 35 9.867 52.713 7.871 1.00 13.80 O ATOM 563 CB MET A 35 6.880 52.813 7.111 1.00 20.61 C ATOM 564 CG MET A 35 6.384 54.099 7.759 1.00 21.49 C ATOM 565 SD MET A 35 4.859 53.825 8.668 1.00 23.80 S ATOM 566 CE MET A 35 3.821 54.914 7.938 1.00 23.74 C ATOM 567 HA MET A 35 7.906 53.699 5.465 1.00 0.00 H ATOM 568 HB2 MET A 35 6.076 52.417 6.490 1.00 0.00 H ATOM 569 HB3 MET A 35 7.107 52.102 7.905 1.00 0.00 H ATOM 570 HG2 MET A 35 6.206 54.843 6.982 1.00 0.00 H ATOM 571 HG3 MET A 35 7.146 54.468 8.446 1.00 0.00 H ATOM 572 HE1 MET A 35 4.214 55.924 8.056 1.00 0.00 H ATOM 573 HE2 MET A 35 3.736 54.678 6.877 1.00 0.00 H ATOM 574 HE3 MET A 35 2.839 54.848 8.407 1.00 0.00 H ATOM 575 H MET A 35 8.816 50.905 6.182 1.00 0.00 H ATOM 576 N GLY A 36 9.804 54.622 6.690 1.00 13.19 N ATOM 577 CA GLY A 36 10.923 55.201 7.396 1.00 15.14 C ATOM 578 C GLY A 36 10.423 56.302 8.305 1.00 14.42 C ATOM 579 O GLY A 36 9.402 56.932 8.007 1.00 12.60 O ATOM 580 HA3 GLY A 36 11.632 55.614 6.679 1.00 0.00 H ATOM 581 HA2 GLY A 36 11.416 54.432 7.991 1.00 0.00 H ATOM 582 H GLY A 36 9.373 55.138 5.897 1.00 0.00 H ATOM 583 N PHE A 37 11.150 56.536 9.402 1.00 16.60 N ATOM 584 CA PHE A 37 10.813 57.573 10.397 1.00 15.71 C ATOM 585 C PHE A 37 11.938 58.603 10.488 1.00 15.47 C ATOM 586 O PHE A 37 13.113 58.241 10.611 1.00 18.11 O ATOM 587 CB PHE A 37 10.565 56.930 11.772 1.00 16.36 C ATOM 588 CG PHE A 37 9.499 55.851 11.752 1.00 16.05 C ATOM 589 CD1 PHE A 37 8.161 56.178 11.513 1.00 14.84 C ATOM 590 CD2 PHE A 37 9.840 54.514 11.904 1.00 14.25 C ATOM 591 CE1 PHE A 37 7.184 55.182 11.429 1.00 13.47 C ATOM 592 CE2 PHE A 37 8.870 53.515 11.824 1.00 15.39 C ATOM 593 CZ PHE A 37 7.539 53.854 11.581 1.00 14.05 C ATOM 594 HA PHE A 37 9.901 58.080 10.080 1.00 0.00 H ATOM 595 HB2 PHE A 37 11.498 56.487 12.119 1.00 0.00 H ATOM 596 HB3 PHE A 37 10.254 57.710 12.467 1.00 0.00 H ATOM 597 HD2 PHE A 37 10.879 54.241 12.088 1.00 0.00 H ATOM 598 HE2 PHE A 37 9.152 52.470 11.951 1.00 0.00 H ATOM 599 HZ PHE A 37 6.781 53.074 11.511 1.00 0.00 H ATOM 600 HE1 PHE A 37 6.144 55.451 11.244 1.00 0.00 H ATOM 601 HD1 PHE A 37 7.876 57.223 11.391 1.00 0.00 H ATOM 602 H PHE A 37 11.998 55.956 9.563 1.00 0.00 H ATOM 603 N TYR A 38 11.576 59.875 10.392 1.00 15.65 N ATOM 604 CA TYR A 38 12.529 60.976 10.433 1.00 17.08 C ATOM 605 C TYR A 38 11.983 62.034 11.362 1.00 16.50 C ATOM 606 O TYR A 38 10.805 62.031 11.672 1.00 15.66 O ATOM 607 CB TYR A 38 12.730 61.564 9.022 1.00 15.79 C ATOM 608 CG TYR A 38 13.149 60.525 8.001 1.00 16.25 C ATOM 609 CD1 TYR A 38 14.498 60.175 7.830 1.00 15.13 C ATOM 610 CD2 TYR A 38 12.189 59.830 7.255 1.00 14.76 C ATOM 611 CE1 TYR A 38 14.881 59.152 6.933 1.00 16.06 C ATOM 612 CE2 TYR A 38 12.559 58.805 6.358 1.00 16.42 C ATOM 613 CZ TYR A 38 13.896 58.464 6.211 1.00 17.30 C ATOM 614 OH TYR A 38 14.232 57.425 5.371 1.00 17.33 O ATOM 615 HA TYR A 38 13.495 60.620 10.791 1.00 0.00 H ATOM 616 HB3 TYR A 38 13.501 62.333 9.072 1.00 0.00 H ATOM 617 HB2 TYR A 38 11.792 62.013 8.696 1.00 0.00 H ATOM 618 HD2 TYR A 38 11.136 60.086 7.369 1.00 0.00 H ATOM 619 HE2 TYR A 38 11.796 58.282 5.782 1.00 0.00 H ATOM 620 HE1 TYR A 38 15.934 58.900 6.804 1.00 0.00 H ATOM 621 HD1 TYR A 38 15.264 60.702 8.399 1.00 0.00 H ATOM 622 HH TYR A 38 15.215 57.305 5.373 1.00 0.00 H ATOM 623 H TYR A 38 10.566 60.097 10.282 1.00 0.00 H ATOM 624 N LYS A 39 12.844 62.921 11.845 1.00 20.63 N ATOM 625 CA LYS A 39 12.392 63.977 12.751 1.00 23.18 C ATOM 626 C LYS A 39 11.626 65.041 11.957 1.00 22.20 C ATOM 627 O LYS A 39 10.655 65.615 12.447 1.00 21.23 O ATOM 628 CB LYS A 39 13.585 64.590 13.520 1.00 26.66 C ATOM 629 CG LYS A 39 13.199 65.468 14.727 1.00 33.34 C ATOM 630 CD LYS A 39 12.188 64.761 15.676 1.00 36.12 C ATOM 631 CE LYS A 39 11.772 65.651 16.856 1.00 36.19 C ATOM 632 NZ LYS A 39 10.489 65.187 17.472 1.00 37.75 N ATOM 633 HA LYS A 39 11.718 63.549 13.493 1.00 0.00 H ATOM 634 HB2 LYS A 39 14.210 63.774 13.881 1.00 0.00 H ATOM 635 HB3 LYS A 39 14.157 65.204 12.824 1.00 0.00 H ATOM 636 HG2 LYS A 39 14.101 65.705 15.290 1.00 0.00 H ATOM 637 HG3 LYS A 39 12.749 66.390 14.360 1.00 0.00 H ATOM 638 HD2 LYS A 39 11.298 64.497 15.105 1.00 0.00 H ATOM 639 HD3 LYS A 39 12.650 63.854 16.067 1.00 0.00 H ATOM 640 HE2 LYS A 39 11.644 66.673 16.500 1.00 0.00 H ATOM 641 HE3 LYS A 39 12.557 65.626 17.612 1.00 0.00 H ATOM 642 HZ1 LYS A 39 9.733 65.214 16.758 1.00 0.00 H ATOM 643 HZ2 LYS A 39 10.605 64.214 17.820 1.00 0.00 H ATOM 644 HZ3 LYS A 39 10.241 65.812 18.265 1.00 0.00 H ATOM 645 H LYS A 39 13.847 62.865 11.577 1.00 0.00 H ATOM 646 N ASP A 40 12.039 65.269 10.712 1.00 21.36 N ATOM 647 CA ASP A 40 11.378 66.254 9.857 1.00 20.13 C ATOM 648 C ASP A 40 11.638 65.959 8.394 1.00 16.54 C ATOM 649 O ASP A 40 12.355 65.020 8.050 1.00 15.14 O ATOM 650 CB ASP A 40 11.848 67.677 10.195 1.00 21.32 C ATOM 651 CG ASP A 40 13.362 67.781 10.363 1.00 22.70 C ATOM 652 OD1 ASP A 40 14.130 67.069 9.671 1.00 23.79 O ATOM 653 OD2 ASP A 40 13.789 68.578 11.217 1.00 24.16 O ATOM 654 HA ASP A 40 10.306 66.187 10.043 1.00 0.00 H ATOM 655 HB2 ASP A 40 11.541 68.345 9.390 1.00 0.00 H ATOM 656 HB3 ASP A 40 11.373 67.988 11.125 1.00 0.00 H ATOM 657 H ASP A 40 12.850 64.735 10.339 1.00 0.00 H ATOM 658 N ALA A 41 11.071 66.790 7.539 1.00 14.54 N ATOM 659 CA ALA A 41 11.230 66.635 6.115 1.00 16.78 C ATOM 660 C ALA A 41 12.698 66.734 5.688 1.00 19.08 C ATOM 661 O ALA A 41 13.162 65.969 4.823 1.00 20.33 O ATOM 662 CB ALA A 41 10.395 67.660 5.401 1.00 15.61 C ATOM 663 HA ALA A 41 10.889 65.637 5.841 1.00 0.00 H ATOM 664 HB1 ALA A 41 9.347 67.522 5.667 1.00 0.00 H ATOM 665 HB2 ALA A 41 10.717 68.659 5.696 1.00 0.00 H ATOM 666 HB3 ALA A 41 10.517 67.540 4.324 1.00 0.00 H ATOM 667 H ALA A 41 10.495 67.576 7.902 1.00 0.00 H ATOM 668 N LYS A 42 13.443 67.659 6.288 1.00 18.12 N ATOM 669 CA LYS A 42 14.834 67.801 5.928 1.00 18.10 C ATOM 670 C LYS A 42 15.680 66.585 6.275 1.00 18.56 C ATOM 671 O LYS A 42 16.534 66.181 5.487 1.00 20.23 O ATOM 672 CB LYS A 42 15.407 69.093 6.481 1.00 21.88 C ATOM 673 CG LYS A 42 15.729 70.079 5.364 1.00 27.22 C ATOM 674 CD LYS A 42 17.071 69.751 4.626 1.00 33.40 C ATOM 675 CE LYS A 42 16.989 68.732 3.451 1.00 35.50 C ATOM 676 NZ LYS A 42 18.084 67.705 3.602 1.00 34.21 N ATOM 677 HA LYS A 42 14.873 67.861 4.840 1.00 0.00 H ATOM 678 HB2 LYS A 42 14.679 69.545 7.155 1.00 0.00 H ATOM 679 HB3 LYS A 42 16.321 68.869 7.032 1.00 0.00 H ATOM 680 HG2 LYS A 42 14.918 70.057 4.636 1.00 0.00 H ATOM 681 HG3 LYS A 42 15.803 71.078 5.793 1.00 0.00 H ATOM 682 HD2 LYS A 42 17.466 70.685 4.227 1.00 0.00 H ATOM 683 HD3 LYS A 42 17.765 69.350 5.364 1.00 0.00 H ATOM 684 HE2 LYS A 42 17.111 69.258 2.504 1.00 0.00 H ATOM 685 HE3 LYS A 42 16.019 68.235 3.467 1.00 0.00 H ATOM 686 HZ1 LYS A 42 19.009 68.181 3.586 1.00 0.00 H ATOM 687 HZ2 LYS A 42 17.966 67.204 4.506 1.00 0.00 H ATOM 688 HZ3 LYS A 42 18.030 67.024 2.818 1.00 0.00 H ATOM 689 H LYS A 42 13.025 68.277 7.013 1.00 0.00 H ATOM 690 N SER A 43 15.390 65.939 7.397 1.00 16.34 N ATOM 691 CA SER A 43 16.138 64.760 7.776 1.00 16.97 C ATOM 692 C SER A 43 15.787 63.635 6.838 1.00 14.59 C ATOM 693 O SER A 43 16.608 62.776 6.557 1.00 17.30 O ATOM 694 CB SER A 43 15.817 64.358 9.206 1.00 19.66 C ATOM 695 OG SER A 43 16.179 65.404 10.085 1.00 26.94 O ATOM 696 HA SER A 43 17.204 64.978 7.714 1.00 0.00 H ATOM 697 HB2 SER A 43 16.375 63.458 9.464 1.00 0.00 H ATOM 698 HB3 SER A 43 14.749 64.161 9.297 1.00 0.00 H ATOM 699 HG SER A 43 15.672 66.221 9.850 1.00 0.00 H ATOM 700 H SER A 43 14.621 66.282 8.007 1.00 0.00 H ATOM 701 N ALA A 44 14.574 63.663 6.314 1.00 14.94 N ATOM 702 CA ALA A 44 14.121 62.630 5.394 1.00 15.23 C ATOM 703 C ALA A 44 14.911 62.663 4.076 1.00 14.67 C ATOM 704 O ALA A 44 15.341 61.620 3.570 1.00 16.26 O ATOM 705 CB ALA A 44 12.619 62.797 5.131 1.00 15.63 C ATOM 706 HA ALA A 44 14.299 61.658 5.853 1.00 0.00 H ATOM 707 HB1 ALA A 44 12.075 62.709 6.071 1.00 0.00 H ATOM 708 HB2 ALA A 44 12.435 63.778 4.694 1.00 0.00 H ATOM 709 HB3 ALA A 44 12.284 62.022 4.442 1.00 0.00 H ATOM 710 H ALA A 44 13.929 64.440 6.564 1.00 0.00 H ATOM 711 N ALA A 45 15.117 63.864 3.541 1.00 15.77 N ATOM 712 CA ALA A 45 15.846 64.048 2.290 1.00 16.70 C ATOM 713 C ALA A 45 17.318 63.712 2.486 1.00 17.57 C ATOM 714 O ALA A 45 17.975 63.209 1.581 1.00 16.94 O ATOM 715 CB ALA A 45 15.683 65.489 1.796 1.00 16.32 C ATOM 716 HA ALA A 45 15.436 63.374 1.537 1.00 0.00 H ATOM 717 HB1 ALA A 45 14.626 65.697 1.630 1.00 0.00 H ATOM 718 HB2 ALA A 45 16.077 66.175 2.546 1.00 0.00 H ATOM 719 HB3 ALA A 45 16.231 65.616 0.862 1.00 0.00 H ATOM 720 H ALA A 45 14.745 64.702 4.032 1.00 0.00 H ATOM 721 N SER A 46 17.815 63.927 3.695 1.00 19.08 N ATOM 722 CA SER A 46 19.211 63.664 4.008 1.00 20.56 C ATOM 723 C SER A 46 19.488 62.232 4.422 1.00 20.15 C ATOM 724 O SER A 46 20.626 61.784 4.383 1.00 23.16 O ATOM 725 CB SER A 46 19.691 64.603 5.108 1.00 19.77 C ATOM 726 OG SER A 46 19.515 65.953 4.730 1.00 21.33 O ATOM 727 HA SER A 46 19.759 63.839 3.082 1.00 0.00 H ATOM 728 HB2 SER A 46 20.749 64.420 5.298 1.00 0.00 H ATOM 729 HB3 SER A 46 19.121 64.409 6.017 1.00 0.00 H ATOM 730 HG SER A 46 20.034 66.134 3.907 1.00 0.00 H ATOM 731 H SER A 46 17.190 64.294 4.441 1.00 0.00 H ATOM 732 N GLY A 47 18.459 61.514 4.843 1.00 21.38 N ATOM 733 CA GLY A 47 18.639 60.129 5.253 1.00 22.12 C ATOM 734 C GLY A 47 19.038 59.909 6.709 1.00 24.13 C ATOM 735 O GLY A 47 19.601 58.868 7.040 1.00 26.48 O ATOM 736 HA3 GLY A 47 19.416 59.693 4.625 1.00 0.00 H ATOM 737 HA2 GLY A 47 17.698 59.605 5.082 1.00 0.00 H ATOM 738 H GLY A 47 17.513 61.944 4.881 1.00 0.00 H ATOM 739 N ILE A 48 18.776 60.893 7.566 1.00 22.63 N ATOM 740 CA ILE A 48 19.099 60.812 8.996 1.00 25.22 C ATOM 741 C ILE A 48 17.863 60.279 9.734 1.00 23.75 C ATOM 742 O ILE A 48 16.862 60.992 9.878 1.00 23.64 O ATOM 743 CB ILE A 48 19.481 62.214 9.545 1.00 26.22 C ATOM 744 CG1 ILE A 48 20.606 62.809 8.689 1.00 26.12 C ATOM 745 CG2 ILE A 48 19.926 62.104 11.004 1.00 25.53 C ATOM 746 CD1 ILE A 48 20.851 64.292 8.907 1.00 27.86 C ATOM 747 HA ILE A 48 19.949 60.146 9.148 1.00 0.00 H ATOM 748 HB ILE A 48 18.611 62.869 9.498 1.00 0.00 H ATOM 749 HG12 ILE A 48 21.528 62.275 8.919 1.00 0.00 H ATOM 750 HG13 ILE A 48 20.352 62.657 7.640 1.00 0.00 H ATOM 751 HD11 ILE A 48 19.944 64.848 8.668 1.00 0.00 H ATOM 752 HD12 ILE A 48 21.121 64.465 9.949 1.00 0.00 H ATOM 753 HD13 ILE A 48 21.663 64.624 8.260 1.00 0.00 H ATOM 754 HG21 ILE A 48 19.111 61.695 11.601 1.00 0.00 H ATOM 755 HG22 ILE A 48 20.792 61.445 11.070 1.00 0.00 H ATOM 756 HG23 ILE A 48 20.191 63.093 11.377 1.00 0.00 H ATOM 757 H ILE A 48 18.323 61.757 7.207 1.00 0.00 H ATOM 758 N PRO A 49 17.952 59.042 10.264 1.00 23.06 N ATOM 759 CA PRO A 49 16.894 58.324 10.996 1.00 23.13 C ATOM 760 C PRO A 49 16.393 58.985 12.280 1.00 23.17 C ATOM 761 O PRO A 49 17.155 59.654 12.984 1.00 21.87 O ATOM 762 CB PRO A 49 17.545 56.972 11.260 1.00 23.81 C ATOM 763 CG PRO A 49 18.950 57.344 11.507 1.00 24.68 C ATOM 764 CD PRO A 49 19.228 58.320 10.378 1.00 24.29 C ATOM 765 HA PRO A 49 15.973 58.288 10.414 1.00 0.00 H ATOM 766 HD3 PRO A 49 20.043 58.997 10.633 1.00 0.00 H ATOM 767 HD2 PRO A 49 19.469 57.796 9.453 1.00 0.00 H ATOM 768 HG3 PRO A 49 19.605 56.475 11.449 1.00 0.00 H ATOM 769 HG2 PRO A 49 19.067 57.821 12.480 1.00 0.00 H ATOM 770 HB2 PRO A 49 17.106 56.485 12.131 1.00 0.00 H ATOM 771 HB3 PRO A 49 17.456 56.315 10.395 1.00 0.00 H ATOM 772 N TYR A 50 15.114 58.758 12.591 1.00 22.96 N ATOM 773 CA TYR A 50 14.486 59.330 13.768 1.00 25.35 C ATOM 774 C TYR A 50 15.290 59.115 15.040 1.00 29.13 C ATOM 775 O TYR A 50 15.677 60.087 15.684 1.00 34.08 O ATOM 776 CB TYR A 50 13.051 58.833 13.955 1.00 25.48 C ATOM 777 CG TYR A 50 12.377 59.380 15.207 1.00 22.92 C ATOM 778 CD1 TYR A 50 12.313 60.749 15.444 1.00 21.55 C ATOM 779 CD2 TYR A 50 11.843 58.523 16.165 1.00 22.68 C ATOM 780 CE1 TYR A 50 11.748 61.247 16.596 1.00 22.32 C ATOM 781 CE2 TYR A 50 11.266 59.014 17.327 1.00 23.05 C ATOM 782 CZ TYR A 50 11.224 60.375 17.539 1.00 23.04 C ATOM 783 OH TYR A 50 10.671 60.854 18.706 1.00 25.33 O ATOM 784 HA TYR A 50 14.456 60.404 13.583 1.00 0.00 H ATOM 785 HB3 TYR A 50 13.068 57.745 14.019 1.00 0.00 H ATOM 786 HB2 TYR A 50 12.465 59.135 13.087 1.00 0.00 H ATOM 787 HD2 TYR A 50 11.879 57.446 15.999 1.00 0.00 H ATOM 788 HE2 TYR A 50 10.850 58.329 18.066 1.00 0.00 H ATOM 789 HE1 TYR A 50 11.712 62.323 16.767 1.00 0.00 H ATOM 790 HD1 TYR A 50 12.718 61.440 14.704 1.00 0.00 H ATOM 791 HH TYR A 50 11.176 60.498 19.480 1.00 0.00 H ATOM 792 H TYR A 50 14.547 58.149 11.967 1.00 0.00 H ATOM 793 N HIS A 51 15.485 57.879 15.471 1.00 28.80 N ATOM 794 CA HIS A 51 16.299 57.676 16.680 1.00 29.41 C ATOM 795 C HIS A 51 17.111 56.438 16.427 1.00 28.44 C ATOM 796 O HIS A 51 17.105 55.490 17.205 1.00 27.12 O ATOM 797 CB HIS A 51 15.428 57.548 17.942 1.00 32.08 C ATOM 798 CG HIS A 51 15.070 58.861 18.569 1.00 33.72 C ATOM 799 ND1 HIS A 51 14.010 59.018 19.437 1.00 36.39 N ATOM 800 CD2 HIS A 51 15.627 60.093 18.447 1.00 35.91 C ATOM 801 CE1 HIS A 51 13.925 60.282 19.818 1.00 36.36 C ATOM 802 NE2 HIS A 51 14.895 60.956 19.232 1.00 34.98 N ATOM 803 HA HIS A 51 16.944 58.534 16.869 1.00 0.00 H ATOM 804 HB2 HIS A 51 14.506 57.034 17.672 1.00 0.00 H ATOM 805 HB3 HIS A 51 15.972 56.954 18.676 1.00 0.00 H ATOM 806 HD2 HIS A 51 16.494 60.352 17.839 1.00 0.00 H ATOM 807 HE1 HIS A 51 13.181 60.695 20.499 1.00 0.00 H ATOM 808 H HIS A 51 15.072 57.069 14.966 1.00 0.00 H ATOM 809 N SER A 52 17.784 56.458 15.283 1.00 27.96 N ATOM 810 CA SER A 52 18.587 55.336 14.823 1.00 30.52 C ATOM 811 C SER A 52 17.643 54.171 14.536 1.00 29.08 C ATOM 812 O SER A 52 18.019 52.995 14.576 1.00 29.75 O ATOM 813 CB SER A 52 19.683 54.976 15.837 1.00 32.92 C ATOM 814 OG SER A 52 20.600 56.064 15.987 1.00 36.03 O ATOM 815 HA SER A 52 19.117 55.598 13.908 1.00 0.00 H ATOM 816 HB2 SER A 52 20.223 54.097 15.486 1.00 0.00 H ATOM 817 HB3 SER A 52 19.223 54.758 16.801 1.00 0.00 H ATOM 818 HG SER A 52 21.299 55.817 16.643 1.00 0.00 H ATOM 819 H SER A 52 17.735 57.312 14.691 1.00 0.00 H ATOM 820 N GLU A 53 16.404 54.529 14.210 1.00 28.13 N ATOM 821 CA GLU A 53 15.387 53.549 13.878 1.00 29.01 C ATOM 822 C GLU A 53 15.674 53.076 12.464 1.00 27.67 C ATOM 823 O GLU A 53 16.200 53.842 11.658 1.00 29.41 O ATOM 824 CB GLU A 53 13.998 54.189 13.922 1.00 29.49 C ATOM 825 CG GLU A 53 13.722 54.938 15.204 1.00 34.26 C ATOM 826 CD GLU A 53 12.272 54.853 15.667 1.00 35.62 C ATOM 827 OE1 GLU A 53 11.417 54.305 14.933 1.00 35.05 O ATOM 828 OE2 GLU A 53 11.994 55.338 16.791 1.00 37.64 O ATOM 829 HA GLU A 53 15.406 52.723 14.589 1.00 0.00 H ATOM 830 HB2 GLU A 53 13.912 54.887 13.089 1.00 0.00 H ATOM 831 HB3 GLU A 53 13.251 53.402 13.814 1.00 0.00 H ATOM 832 HG2 GLU A 53 14.358 54.525 15.987 1.00 0.00 H ATOM 833 HG3 GLU A 53 13.973 55.988 15.050 1.00 0.00 H ATOM 834 H GLU A 53 16.158 55.539 14.193 1.00 0.00 H ATOM 835 N VAL A 54 15.362 51.819 12.172 1.00 26.06 N ATOM 836 CA VAL A 54 15.563 51.268 10.834 1.00 25.17 C ATOM 837 C VAL A 54 14.186 51.260 10.175 1.00 24.79 C ATOM 838 O VAL A 54 13.177 51.121 10.861 1.00 25.45 O ATOM 839 CB VAL A 54 16.077 49.815 10.912 1.00 26.01 C ATOM 840 CG1 VAL A 54 14.996 48.900 11.473 1.00 26.67 C ATOM 841 CG2 VAL A 54 16.519 49.324 9.547 1.00 28.35 C ATOM 842 HA VAL A 54 16.294 51.857 10.281 1.00 0.00 H ATOM 843 HB VAL A 54 16.938 49.795 11.580 1.00 0.00 H ATOM 844 HG11 VAL A 54 14.722 49.235 12.473 1.00 0.00 H ATOM 845 HG12 VAL A 54 14.121 48.934 10.824 1.00 0.00 H ATOM 846 HG13 VAL A 54 15.375 47.879 11.521 1.00 0.00 H ATOM 847 HG21 VAL A 54 15.675 49.362 8.858 1.00 0.00 H ATOM 848 HG22 VAL A 54 17.322 49.961 9.176 1.00 0.00 H ATOM 849 HG23 VAL A 54 16.877 48.298 9.630 1.00 0.00 H ATOM 850 H VAL A 54 14.964 51.210 12.916 1.00 0.00 H ATOM 851 N PRO A 55 14.106 51.497 8.862 1.00 24.84 N ATOM 852 CA PRO A 55 12.793 51.481 8.211 1.00 22.98 C ATOM 853 C PRO A 55 12.170 50.102 8.386 1.00 21.20 C ATOM 854 O PRO A 55 12.874 49.093 8.400 1.00 22.11 O ATOM 855 CB PRO A 55 13.140 51.720 6.748 1.00 23.17 C ATOM 856 CG PRO A 55 14.324 52.590 6.838 1.00 24.46 C ATOM 857 CD PRO A 55 15.148 51.924 7.911 1.00 24.48 C ATOM 858 HA PRO A 55 12.086 52.210 8.608 1.00 0.00 H ATOM 859 HD3 PRO A 55 15.701 51.071 7.517 1.00 0.00 H ATOM 860 HD2 PRO A 55 15.844 52.625 8.371 1.00 0.00 H ATOM 861 HG3 PRO A 55 14.046 53.603 7.128 1.00 0.00 H ATOM 862 HG2 PRO A 55 14.863 52.620 5.891 1.00 0.00 H ATOM 863 HB2 PRO A 55 13.376 50.784 6.241 1.00 0.00 H ATOM 864 HB3 PRO A 55 12.323 52.219 6.226 1.00 0.00 H ATOM 865 N VAL A 56 10.857 50.047 8.515 1.00 19.54 N ATOM 866 CA VAL A 56 10.211 48.771 8.701 1.00 18.42 C ATOM 867 C VAL A 56 9.450 48.358 7.453 1.00 18.28 C ATOM 868 O VAL A 56 8.932 49.209 6.731 1.00 16.44 O ATOM 869 CB VAL A 56 9.295 48.782 9.940 1.00 19.27 C ATOM 870 CG1 VAL A 56 8.120 49.728 9.751 1.00 17.47 C ATOM 871 CG2 VAL A 56 8.837 47.367 10.239 1.00 23.80 C ATOM 872 HA VAL A 56 10.988 48.027 8.877 1.00 0.00 H ATOM 873 HB VAL A 56 9.857 49.154 10.796 1.00 0.00 H ATOM 874 HG11 VAL A 56 8.492 50.739 9.586 1.00 0.00 H ATOM 875 HG12 VAL A 56 7.534 49.410 8.889 1.00 0.00 H ATOM 876 HG13 VAL A 56 7.494 49.711 10.643 1.00 0.00 H ATOM 877 HG21 VAL A 56 8.288 46.976 9.383 1.00 0.00 H ATOM 878 HG22 VAL A 56 9.706 46.739 10.433 1.00 0.00 H ATOM 879 HG23 VAL A 56 8.189 47.374 11.115 1.00 0.00 H ATOM 880 H VAL A 56 10.292 50.919 8.483 1.00 0.00 H ATOM 881 N SER A 57 9.428 47.052 7.186 1.00 18.25 N ATOM 882 CA SER A 57 8.740 46.502 6.023 1.00 16.65 C ATOM 883 C SER A 57 7.233 46.493 6.244 1.00 17.60 C ATOM 884 O SER A 57 6.762 46.191 7.335 1.00 19.78 O ATOM 885 CB SER A 57 9.250 45.091 5.744 1.00 16.33 C ATOM 886 OG SER A 57 8.454 44.421 4.785 1.00 17.05 O ATOM 887 HA SER A 57 8.949 47.132 5.158 1.00 0.00 H ATOM 888 HB2 SER A 57 9.237 44.521 6.673 1.00 0.00 H ATOM 889 HB3 SER A 57 10.273 45.153 5.372 1.00 0.00 H ATOM 890 HG SER A 57 8.817 43.513 4.633 1.00 0.00 H ATOM 891 H SER A 57 9.920 46.401 7.831 1.00 0.00 H ATOM 892 N LEU A 58 6.483 46.831 5.205 1.00 16.27 N ATOM 893 CA LEU A 58 5.033 46.865 5.271 1.00 15.95 C ATOM 894 C LEU A 58 4.426 45.603 4.656 1.00 16.64 C ATOM 895 O LEU A 58 3.211 45.493 4.506 1.00 13.84 O ATOM 896 CB LEU A 58 4.516 48.121 4.577 1.00 15.46 C ATOM 897 CG LEU A 58 4.997 49.459 5.156 1.00 14.17 C ATOM 898 CD1 LEU A 58 4.483 50.564 4.253 1.00 14.15 C ATOM 899 CD2 LEU A 58 4.513 49.672 6.588 1.00 12.42 C ATOM 900 HA LEU A 58 4.728 46.894 6.317 1.00 0.00 H ATOM 901 HB2 LEU A 58 4.828 48.078 3.534 1.00 0.00 H ATOM 902 HB3 LEU A 58 3.427 48.107 4.630 1.00 0.00 H ATOM 903 HG LEU A 58 6.086 49.463 5.195 1.00 0.00 H ATOM 904 HD21 LEU A 58 3.423 49.665 6.607 1.00 0.00 H ATOM 905 HD22 LEU A 58 4.893 48.871 7.222 1.00 0.00 H ATOM 906 HD23 LEU A 58 4.878 50.631 6.955 1.00 0.00 H ATOM 907 HD11 LEU A 58 4.877 50.422 3.247 1.00 0.00 H ATOM 908 HD12 LEU A 58 3.394 50.532 4.226 1.00 0.00 H ATOM 909 HD13 LEU A 58 4.810 51.529 4.640 1.00 0.00 H ATOM 910 H LEU A 58 6.950 47.081 4.310 1.00 0.00 H ATOM 911 N LYS A 59 5.297 44.645 4.339 1.00 20.39 N ATOM 912 CA LYS A 59 4.920 43.341 3.781 1.00 21.12 C ATOM 913 C LYS A 59 4.010 42.610 4.756 1.00 21.34 C ATOM 914 O LYS A 59 4.410 42.342 5.884 1.00 20.65 O ATOM 915 CB LYS A 59 6.171 42.489 3.547 1.00 25.50 C ATOM 916 CG LYS A 59 6.531 42.272 2.090 1.00 31.56 C ATOM 917 CD LYS A 59 6.440 40.785 1.709 1.00 36.04 C ATOM 918 CE LYS A 59 5.012 40.247 1.891 1.00 38.73 C ATOM 919 NZ LYS A 59 4.824 38.806 1.524 1.00 41.32 N ATOM 920 HA LYS A 59 4.402 43.503 2.835 1.00 0.00 H ATOM 921 HB2 LYS A 59 7.013 42.981 4.035 1.00 0.00 H ATOM 922 HB3 LYS A 59 6.007 41.513 4.005 1.00 0.00 H ATOM 923 HG2 LYS A 59 5.843 42.842 1.465 1.00 0.00 H ATOM 924 HG3 LYS A 59 7.549 42.621 1.919 1.00 0.00 H ATOM 925 HD2 LYS A 59 6.734 40.667 0.666 1.00 0.00 H ATOM 926 HD3 LYS A 59 7.118 40.214 2.343 1.00 0.00 H ATOM 927 HE2 LYS A 59 4.344 40.844 1.270 1.00 0.00 H ATOM 928 HE3 LYS A 59 4.736 40.368 2.939 1.00 0.00 H ATOM 929 HZ1 LYS A 59 5.068 38.670 0.522 1.00 0.00 H ATOM 930 HZ2 LYS A 59 5.442 38.215 2.116 1.00 0.00 H ATOM 931 HZ3 LYS A 59 3.832 38.536 1.680 1.00 0.00 H ATOM 932 H LYS A 59 6.307 44.834 4.497 1.00 0.00 H ATOM 933 N GLU A 60 2.783 42.325 4.329 1.00 22.04 N ATOM 934 CA GLU A 60 1.807 41.615 5.152 1.00 25.74 C ATOM 935 C GLU A 60 1.461 42.356 6.441 1.00 24.68 C ATOM 936 O GLU A 60 1.225 41.732 7.482 1.00 25.77 O ATOM 937 CB GLU A 60 2.292 40.202 5.513 1.00 30.20 C ATOM 938 CG GLU A 60 2.198 39.166 4.414 1.00 35.53 C ATOM 939 CD GLU A 60 2.432 37.750 4.943 1.00 40.25 C ATOM 940 OE1 GLU A 60 3.601 37.388 5.227 1.00 41.32 O ATOM 941 OE2 GLU A 60 1.435 36.993 5.086 1.00 43.60 O ATOM 942 HA GLU A 60 0.908 41.553 4.539 1.00 0.00 H ATOM 943 HB2 GLU A 60 3.337 40.275 5.814 1.00 0.00 H ATOM 944 HB3 GLU A 60 1.696 39.850 6.355 1.00 0.00 H ATOM 945 HG2 GLU A 60 1.205 39.216 3.966 1.00 0.00 H ATOM 946 HG3 GLU A 60 2.949 39.388 3.655 1.00 0.00 H ATOM 947 H GLU A 60 2.507 42.620 3.370 1.00 0.00 H ATOM 948 N ALA A 61 1.403 43.680 6.370 1.00 22.56 N ATOM 949 CA ALA A 61 1.079 44.495 7.534 1.00 18.68 C ATOM 950 C ALA A 61 -0.427 44.628 7.644 1.00 19.21 C ATOM 951 O ALA A 61 -1.136 44.542 6.650 1.00 20.03 O ATOM 952 CB ALA A 61 1.703 45.866 7.389 1.00 16.84 C ATOM 953 HA ALA A 61 1.471 44.020 8.433 1.00 0.00 H ATOM 954 HB1 ALA A 61 2.785 45.765 7.309 1.00 0.00 H ATOM 955 HB2 ALA A 61 1.315 46.347 6.492 1.00 0.00 H ATOM 956 HB3 ALA A 61 1.457 46.470 8.262 1.00 0.00 H ATOM 957 H ALA A 61 1.594 44.148 5.461 1.00 0.00 H ATOM 958 N ILE A 62 -0.920 44.797 8.861 1.00 18.06 N ATOM 959 CA ILE A 62 -2.344 44.993 9.088 1.00 17.86 C ATOM 960 C ILE A 62 -2.472 46.457 9.482 1.00 17.24 C ATOM 961 O ILE A 62 -1.779 46.920 10.377 1.00 16.24 O ATOM 962 CB ILE A 62 -2.857 44.055 10.214 1.00 20.09 C ATOM 963 CG1 ILE A 62 -2.848 42.600 9.700 1.00 21.20 C ATOM 964 CG2 ILE A 62 -4.245 44.499 10.724 1.00 22.24 C ATOM 965 CD1 ILE A 62 -2.770 41.551 10.773 1.00 21.87 C ATOM 966 HA ILE A 62 -2.943 44.756 8.209 1.00 0.00 H ATOM 967 HB ILE A 62 -2.191 44.116 11.075 1.00 0.00 H ATOM 968 HG12 ILE A 62 -3.763 42.436 9.131 1.00 0.00 H ATOM 969 HG13 ILE A 62 -1.987 42.478 9.043 1.00 0.00 H ATOM 970 HD11 ILE A 62 -1.853 41.687 11.346 1.00 0.00 H ATOM 971 HD12 ILE A 62 -3.631 41.645 11.435 1.00 0.00 H ATOM 972 HD13 ILE A 62 -2.769 40.563 10.314 1.00 0.00 H ATOM 973 HG21 ILE A 62 -4.178 45.513 11.119 1.00 0.00 H ATOM 974 HG22 ILE A 62 -4.958 44.475 9.900 1.00 0.00 H ATOM 975 HG23 ILE A 62 -4.575 43.821 11.511 1.00 0.00 H ATOM 976 H ILE A 62 -0.273 44.790 9.675 1.00 0.00 H ATOM 977 N CYS A 63 -3.302 47.195 8.759 1.00 17.28 N ATOM 978 CA CYS A 63 -3.514 48.615 9.022 1.00 18.72 C ATOM 979 C CYS A 63 -5.017 48.904 9.033 1.00 18.16 C ATOM 980 O CYS A 63 -5.731 48.530 8.101 1.00 18.74 O ATOM 981 CB CYS A 63 -2.831 49.441 7.932 1.00 21.64 C ATOM 982 SG CYS A 63 -2.843 51.208 8.219 1.00 24.53 S ATOM 983 HA CYS A 63 -3.088 48.881 9.989 1.00 0.00 H ATOM 984 HB2 CYS A 63 -3.340 49.246 6.988 1.00 0.00 H ATOM 985 HB3 CYS A 63 -1.793 49.115 7.858 1.00 0.00 H ATOM 986 HG CYS A 63 -2.203 51.846 7.176 1.00 0.00 H ATOM 987 H CYS A 63 -3.820 46.747 7.977 1.00 0.00 H ATOM 988 N GLU A 64 -5.510 49.559 10.079 1.00 18.03 N ATOM 989 CA GLU A 64 -6.943 49.838 10.168 1.00 17.98 C ATOM 990 C GLU A 64 -7.248 50.948 11.158 1.00 20.43 C ATOM 991 O GLU A 64 -6.366 51.358 11.910 1.00 21.20 O ATOM 992 CB GLU A 64 -7.680 48.575 10.606 1.00 20.21 C ATOM 993 CG GLU A 64 -7.182 48.006 11.921 1.00 23.44 C ATOM 994 CD GLU A 64 -7.790 46.645 12.252 1.00 28.17 C ATOM 995 OE1 GLU A 64 -8.162 45.892 11.316 1.00 30.32 O ATOM 996 OE2 GLU A 64 -7.881 46.316 13.457 1.00 27.85 O ATOM 997 HA GLU A 64 -7.276 50.161 9.181 1.00 0.00 H ATOM 998 HB2 GLU A 64 -8.738 48.813 10.712 1.00 0.00 H ATOM 999 HB3 GLU A 64 -7.555 47.817 9.833 1.00 0.00 H ATOM 1000 HG2 GLU A 64 -6.099 47.898 11.865 1.00 0.00 H ATOM 1001 HG3 GLU A 64 -7.436 48.703 12.720 1.00 0.00 H ATOM 1002 H GLU A 64 -4.873 49.875 10.838 1.00 0.00 H ATOM 1003 N VAL A 65 -8.488 51.447 11.149 1.00 19.27 N ATOM 1004 CA VAL A 65 -8.904 52.493 12.090 1.00 19.89 C ATOM 1005 C VAL A 65 -8.904 51.907 13.509 1.00 18.94 C ATOM 1006 O VAL A 65 -9.366 50.787 13.739 1.00 17.30 O ATOM 1007 CB VAL A 65 -10.309 53.086 11.733 1.00 20.55 C ATOM 1008 CG1 VAL A 65 -11.388 52.031 11.816 1.00 21.04 C ATOM 1009 CG2 VAL A 65 -10.653 54.221 12.660 1.00 19.30 C ATOM 1010 HA VAL A 65 -8.196 53.319 12.027 1.00 0.00 H ATOM 1011 HB VAL A 65 -10.257 53.454 10.708 1.00 0.00 H ATOM 1012 HG11 VAL A 65 -11.163 51.227 11.116 1.00 0.00 H ATOM 1013 HG12 VAL A 65 -11.427 51.632 12.830 1.00 0.00 H ATOM 1014 HG13 VAL A 65 -12.350 52.476 11.562 1.00 0.00 H ATOM 1015 HG21 VAL A 65 -10.672 53.856 13.687 1.00 0.00 H ATOM 1016 HG22 VAL A 65 -9.902 55.006 12.566 1.00 0.00 H ATOM 1017 HG23 VAL A 65 -11.633 54.620 12.396 1.00 0.00 H ATOM 1018 H VAL A 65 -9.175 51.085 10.458 1.00 0.00 H ATOM 1019 N ALA A 66 -8.333 52.643 14.448 1.00 19.03 N ATOM 1020 CA ALA A 66 -8.263 52.186 15.822 1.00 19.91 C ATOM 1021 C ALA A 66 -9.532 52.587 16.574 1.00 22.57 C ATOM 1022 O ALA A 66 -9.539 53.595 17.269 1.00 24.39 O ATOM 1023 CB ALA A 66 -7.034 52.781 16.492 1.00 17.73 C ATOM 1024 HA ALA A 66 -8.184 51.099 15.839 1.00 0.00 H ATOM 1025 HB1 ALA A 66 -6.140 52.462 15.956 1.00 0.00 H ATOM 1026 HB2 ALA A 66 -7.102 53.869 16.473 1.00 0.00 H ATOM 1027 HB3 ALA A 66 -6.982 52.437 17.525 1.00 0.00 H ATOM 1028 H ALA A 66 -7.927 53.567 14.196 1.00 0.00 H ATOM 1029 N LEU A 67 -10.608 51.817 16.399 1.00 27.18 N ATOM 1030 CA LEU A 67 -11.902 52.074 17.064 1.00 30.15 C ATOM 1031 C LEU A 67 -11.757 51.904 18.565 1.00 30.21 C ATOM 1032 O LEU A 67 -12.340 52.646 19.359 1.00 31.74 O ATOM 1033 CB LEU A 67 -12.963 51.064 16.604 1.00 32.67 C ATOM 1034 CG LEU A 67 -13.644 51.128 15.238 1.00 33.66 C ATOM 1035 CD1 LEU A 67 -13.462 49.806 14.541 1.00 34.94 C ATOM 1036 CD2 LEU A 67 -15.127 51.419 15.416 1.00 34.74 C ATOM 1037 HA LEU A 67 -12.204 53.089 16.806 1.00 0.00 H ATOM 1038 HB2 LEU A 67 -12.486 50.085 16.655 1.00 0.00 H ATOM 1039 HB3 LEU A 67 -13.765 51.116 17.341 1.00 0.00 H ATOM 1040 HG LEU A 67 -13.199 51.923 14.640 1.00 0.00 H ATOM 1041 HD21 LEU A 67 -15.583 50.627 16.010 1.00 0.00 H ATOM 1042 HD22 LEU A 67 -15.250 52.374 15.926 1.00 0.00 H ATOM 1043 HD23 LEU A 67 -15.607 51.463 14.438 1.00 0.00 H ATOM 1044 HD11 LEU A 67 -12.398 49.607 14.414 1.00 0.00 H ATOM 1045 HD12 LEU A 67 -13.912 49.015 15.141 1.00 0.00 H ATOM 1046 HD13 LEU A 67 -13.945 49.842 13.565 1.00 0.00 H ATOM 1047 H LEU A 67 -10.532 50.997 15.764 1.00 0.00 H ATOM 1048 N ASP A 68 -11.028 50.857 18.927 1.00 29.13 N ATOM 1049 CA ASP A 68 -10.758 50.514 20.308 1.00 29.04 C ATOM 1050 C ASP A 68 -9.983 51.591 21.064 1.00 27.97 C ATOM 1051 O ASP A 68 -10.079 51.675 22.283 1.00 30.53 O ATOM 1052 CB ASP A 68 -10.030 49.162 20.369 1.00 31.62 C ATOM 1053 CG ASP A 68 -8.724 49.128 19.539 1.00 31.93 C ATOM 1054 OD1 ASP A 68 -8.398 50.091 18.821 1.00 34.02 O ATOM 1055 OD2 ASP A 68 -8.002 48.116 19.622 1.00 33.00 O ATOM 1056 HA ASP A 68 -11.720 50.439 20.815 1.00 0.00 H ATOM 1057 HB2 ASP A 68 -9.784 48.948 21.409 1.00 0.00 H ATOM 1058 HB3 ASP A 68 -10.701 48.391 19.990 1.00 0.00 H ATOM 1059 H ASP A 68 -10.630 50.251 18.181 1.00 0.00 H ATOM 1060 N TYR A 69 -9.186 52.390 20.362 1.00 23.97 N ATOM 1061 CA TYR A 69 -8.452 53.445 21.042 1.00 24.92 C ATOM 1062 C TYR A 69 -9.372 54.655 21.106 1.00 26.43 C ATOM 1063 O TYR A 69 -9.774 55.208 20.086 1.00 28.36 O ATOM 1064 CB TYR A 69 -7.153 53.790 20.327 1.00 21.51 C ATOM 1065 CG TYR A 69 -6.336 54.825 21.073 1.00 20.27 C ATOM 1066 CD1 TYR A 69 -5.493 54.458 22.121 1.00 19.42 C ATOM 1067 CD2 TYR A 69 -6.396 56.168 20.723 1.00 17.78 C ATOM 1068 CE1 TYR A 69 -4.723 55.425 22.795 1.00 19.52 C ATOM 1069 CE2 TYR A 69 -5.645 57.121 21.384 1.00 17.84 C ATOM 1070 CZ TYR A 69 -4.813 56.750 22.417 1.00 18.06 C ATOM 1071 OH TYR A 69 -4.106 57.712 23.092 1.00 19.50 O ATOM 1072 HA TYR A 69 -8.166 53.114 22.041 1.00 0.00 H ATOM 1073 HB3 TYR A 69 -7.391 54.180 19.337 1.00 0.00 H ATOM 1074 HB2 TYR A 69 -6.558 52.882 20.225 1.00 0.00 H ATOM 1075 HD2 TYR A 69 -7.051 56.477 19.908 1.00 0.00 H ATOM 1076 HE2 TYR A 69 -5.711 58.168 21.088 1.00 0.00 H ATOM 1077 HE1 TYR A 69 -4.061 55.130 23.609 1.00 0.00 H ATOM 1078 HD1 TYR A 69 -5.429 53.412 22.422 1.00 0.00 H ATOM 1079 HH TYR A 69 -3.560 57.284 23.799 1.00 0.00 H ATOM 1080 H TYR A 69 -9.088 52.262 19.335 1.00 0.00 H ATOM 1081 N LYS A 70 -9.649 55.103 22.317 1.00 28.52 N ATOM 1082 CA LYS A 70 -10.573 56.203 22.500 1.00 30.62 C ATOM 1083 C LYS A 70 -9.991 57.473 23.094 1.00 28.94 C ATOM 1084 O LYS A 70 -10.687 58.476 23.217 1.00 31.55 O ATOM 1085 CB LYS A 70 -11.746 55.725 23.357 1.00 34.43 C ATOM 1086 CG LYS A 70 -12.304 54.377 22.909 1.00 37.28 C ATOM 1087 CD LYS A 70 -13.616 54.040 23.592 1.00 40.55 C ATOM 1088 CE LYS A 70 -14.163 52.717 23.092 1.00 42.82 C ATOM 1089 NZ LYS A 70 -15.531 52.478 23.629 1.00 46.53 N ATOM 1090 HA LYS A 70 -10.883 56.490 21.495 1.00 0.00 H ATOM 1091 HB2 LYS A 70 -11.408 55.635 24.389 1.00 0.00 H ATOM 1092 HB3 LYS A 70 -12.543 56.467 23.300 1.00 0.00 H ATOM 1093 HG2 LYS A 70 -12.467 54.405 21.832 1.00 0.00 H ATOM 1094 HG3 LYS A 70 -11.576 53.600 23.145 1.00 0.00 H ATOM 1095 HD2 LYS A 70 -13.452 53.975 24.668 1.00 0.00 H ATOM 1096 HD3 LYS A 70 -14.340 54.828 23.383 1.00 0.00 H ATOM 1097 HE2 LYS A 70 -13.505 51.911 23.417 1.00 0.00 H ATOM 1098 HE3 LYS A 70 -14.204 52.735 22.003 1.00 0.00 H ATOM 1099 HZ1 LYS A 70 -15.495 52.457 24.668 1.00 0.00 H ATOM 1100 HZ2 LYS A 70 -16.163 53.243 23.318 1.00 0.00 H ATOM 1101 HZ3 LYS A 70 -15.887 51.567 23.275 1.00 0.00 H ATOM 1102 H LYS A 70 -9.200 54.663 23.145 1.00 0.00 H ATOM 1103 N LYS A 71 -8.720 57.452 23.448 1.00 27.22 N ATOM 1104 CA LYS A 71 -8.139 58.631 24.038 1.00 27.43 C ATOM 1105 C LYS A 71 -7.993 59.772 23.048 1.00 27.35 C ATOM 1106 O LYS A 71 -7.732 60.902 23.433 1.00 30.43 O ATOM 1107 CB LYS A 71 -6.814 58.295 24.717 1.00 28.44 C ATOM 1108 CG LYS A 71 -6.952 57.241 25.823 1.00 30.61 C ATOM 1109 CD LYS A 71 -5.666 57.140 26.644 1.00 33.20 C ATOM 1110 CE LYS A 71 -5.621 55.899 27.539 1.00 33.64 C ATOM 1111 NZ LYS A 71 -6.684 55.841 28.597 1.00 35.15 N ATOM 1112 HA LYS A 71 -8.833 58.985 24.801 1.00 0.00 H ATOM 1113 HB2 LYS A 71 -6.124 57.918 23.963 1.00 0.00 H ATOM 1114 HB3 LYS A 71 -6.408 59.207 25.155 1.00 0.00 H ATOM 1115 HG2 LYS A 71 -7.775 57.520 26.481 1.00 0.00 H ATOM 1116 HG3 LYS A 71 -7.163 56.273 25.369 1.00 0.00 H ATOM 1117 HD2 LYS A 71 -4.819 57.105 25.959 1.00 0.00 H ATOM 1118 HD3 LYS A 71 -5.586 58.026 27.274 1.00 0.00 H ATOM 1119 HE2 LYS A 71 -4.650 55.873 28.033 1.00 0.00 H ATOM 1120 HE3 LYS A 71 -5.727 55.020 26.904 1.00 0.00 H ATOM 1121 HZ1 LYS A 71 -6.592 56.665 29.225 1.00 0.00 H ATOM 1122 HZ2 LYS A 71 -7.621 55.850 28.146 1.00 0.00 H ATOM 1123 HZ3 LYS A 71 -6.573 54.968 29.151 1.00 0.00 H ATOM 1124 H LYS A 71 -8.146 56.597 23.303 1.00 0.00 H ATOM 1125 N LYS A 72 -8.135 59.488 21.764 1.00 27.26 N ATOM 1126 CA LYS A 72 -8.038 60.550 20.771 1.00 24.04 C ATOM 1127 C LYS A 72 -8.575 60.154 19.421 1.00 21.95 C ATOM 1128 O LYS A 72 -8.820 58.985 19.177 1.00 21.57 O ATOM 1129 CB LYS A 72 -6.626 61.127 20.680 1.00 24.38 C ATOM 1130 CG LYS A 72 -5.561 60.219 20.198 1.00 24.88 C ATOM 1131 CD LYS A 72 -4.203 60.833 20.479 1.00 25.32 C ATOM 1132 CE LYS A 72 -3.989 60.956 21.975 1.00 26.51 C ATOM 1133 NZ LYS A 72 -2.620 61.400 22.337 1.00 27.15 N ATOM 1134 HA LYS A 72 -8.689 61.348 21.128 1.00 0.00 H ATOM 1135 HB2 LYS A 72 -6.662 61.981 20.004 1.00 0.00 H ATOM 1136 HB3 LYS A 72 -6.344 61.466 21.677 1.00 0.00 H ATOM 1137 HG2 LYS A 72 -5.640 59.261 20.713 1.00 0.00 H ATOM 1138 HG3 LYS A 72 -5.674 60.064 19.125 1.00 0.00 H ATOM 1139 HD2 LYS A 72 -3.425 60.199 20.054 1.00 0.00 H ATOM 1140 HD3 LYS A 72 -4.153 61.822 20.024 1.00 0.00 H ATOM 1141 HE2 LYS A 72 -4.170 59.983 22.432 1.00 0.00 H ATOM 1142 HE3 LYS A 72 -4.703 61.679 22.369 1.00 0.00 H ATOM 1143 HZ1 LYS A 72 -1.927 60.713 21.976 1.00 0.00 H ATOM 1144 HZ2 LYS A 72 -2.437 62.333 21.916 1.00 0.00 H ATOM 1145 HZ3 LYS A 72 -2.540 61.464 23.372 1.00 0.00 H ATOM 1146 H LYS A 72 -8.316 58.509 21.464 1.00 0.00 H ATOM 1147 N LYS A 73 -8.810 61.155 18.582 1.00 21.34 N ATOM 1148 CA LYS A 73 -9.380 60.973 17.252 1.00 21.97 C ATOM 1149 C LYS A 73 -8.399 60.837 16.103 1.00 19.12 C ATOM 1150 O LYS A 73 -7.235 61.215 16.213 1.00 19.82 O ATOM 1151 CB LYS A 73 -10.323 62.139 16.956 1.00 22.73 C ATOM 1152 CG LYS A 73 -11.626 62.061 17.713 1.00 27.02 C ATOM 1153 CD LYS A 73 -12.347 63.390 17.717 1.00 31.18 C ATOM 1154 CE LYS A 73 -13.739 63.273 18.348 1.00 35.20 C ATOM 1155 NZ LYS A 73 -14.741 62.572 17.478 1.00 38.14 N ATOM 1156 HA LYS A 73 -9.888 60.010 17.299 1.00 0.00 H ATOM 1157 HB2 LYS A 73 -9.821 63.068 17.227 1.00 0.00 H ATOM 1158 HB3 LYS A 73 -10.543 62.144 15.888 1.00 0.00 H ATOM 1159 HG2 LYS A 73 -12.265 61.313 17.243 1.00 0.00 H ATOM 1160 HG3 LYS A 73 -11.421 61.766 18.742 1.00 0.00 H ATOM 1161 HD2 LYS A 73 -11.759 64.110 18.286 1.00 0.00 H ATOM 1162 HD3 LYS A 73 -12.452 63.739 16.690 1.00 0.00 H ATOM 1163 HE2 LYS A 73 -14.108 64.277 18.557 1.00 0.00 H ATOM 1164 HE3 LYS A 73 -13.648 62.719 19.282 1.00 0.00 H ATOM 1165 HZ1 LYS A 73 -14.849 63.094 16.585 1.00 0.00 H ATOM 1166 HZ2 LYS A 73 -14.410 61.607 17.278 1.00 0.00 H ATOM 1167 HZ3 LYS A 73 -15.656 62.531 17.970 1.00 0.00 H ATOM 1168 H LYS A 73 -8.575 62.120 18.889 1.00 0.00 H ATOM 1169 N HIS A 74 -8.920 60.342 14.984 1.00 18.70 N ATOM 1170 CA HIS A 74 -8.171 60.160 13.741 1.00 18.30 C ATOM 1171 C HIS A 74 -6.934 59.282 13.952 1.00 16.52 C ATOM 1172 O HIS A 74 -5.873 59.538 13.372 1.00 12.44 O ATOM 1173 CB HIS A 74 -7.748 61.524 13.166 1.00 18.63 C ATOM 1174 CG HIS A 74 -8.691 62.651 13.480 1.00 21.14 C ATOM 1175 ND1 HIS A 74 -10.050 62.587 13.226 1.00 23.56 N ATOM 1176 CD2 HIS A 74 -8.463 63.873 13.999 1.00 20.86 C ATOM 1177 CE1 HIS A 74 -10.609 63.734 13.570 1.00 22.05 C ATOM 1178 NE2 HIS A 74 -9.676 64.533 14.040 1.00 19.94 N ATOM 1179 HA HIS A 74 -8.829 59.656 13.033 1.00 0.00 H ATOM 1180 HB2 HIS A 74 -6.768 61.776 13.572 1.00 0.00 H ATOM 1181 HB3 HIS A 74 -7.678 61.430 12.082 1.00 0.00 H ATOM 1182 HD2 HIS A 74 -7.501 64.268 14.326 1.00 0.00 H ATOM 1183 HE1 HIS A 74 -11.668 63.977 13.479 1.00 0.00 H ATOM 1184 H HIS A 74 -9.923 60.067 14.993 1.00 0.00 H ATOM 1185 N VAL A 75 -7.082 58.253 14.786 1.00 15.43 N ATOM 1186 CA VAL A 75 -5.988 57.329 15.098 1.00 16.47 C ATOM 1187 C VAL A 75 -6.113 55.997 14.356 1.00 16.51 C ATOM 1188 O VAL A 75 -7.172 55.364 14.382 1.00 15.73 O ATOM 1189 CB VAL A 75 -5.926 57.014 16.622 1.00 15.31 C ATOM 1190 CG1 VAL A 75 -4.787 56.027 16.918 1.00 16.60 C ATOM 1191 CG2 VAL A 75 -5.760 58.285 17.424 1.00 10.91 C ATOM 1192 HA VAL A 75 -5.080 57.839 14.775 1.00 0.00 H ATOM 1193 HB VAL A 75 -6.867 56.550 16.918 1.00 0.00 H ATOM 1194 HG11 VAL A 75 -4.959 55.101 16.370 1.00 0.00 H ATOM 1195 HG12 VAL A 75 -3.839 56.464 16.606 1.00 0.00 H ATOM 1196 HG13 VAL A 75 -4.758 55.818 17.987 1.00 0.00 H ATOM 1197 HG21 VAL A 75 -4.836 58.782 17.128 1.00 0.00 H ATOM 1198 HG22 VAL A 75 -6.606 58.946 17.234 1.00 0.00 H ATOM 1199 HG23 VAL A 75 -5.719 58.041 18.485 1.00 0.00 H ATOM 1200 H VAL A 75 -8.009 58.100 15.232 1.00 0.00 H ATOM 1201 N PHE A 76 -5.051 55.591 13.666 1.00 16.44 N ATOM 1202 CA PHE A 76 -5.065 54.307 12.995 1.00 15.67 C ATOM 1203 C PHE A 76 -4.023 53.377 13.598 1.00 13.71 C ATOM 1204 O PHE A 76 -3.070 53.821 14.231 1.00 13.35 O ATOM 1205 CB PHE A 76 -4.996 54.419 11.452 1.00 15.35 C ATOM 1206 CG PHE A 76 -3.670 54.871 10.893 1.00 13.48 C ATOM 1207 CD1 PHE A 76 -2.682 53.954 10.599 1.00 14.05 C ATOM 1208 CD2 PHE A 76 -3.453 56.214 10.592 1.00 15.17 C ATOM 1209 CE1 PHE A 76 -1.483 54.345 10.014 1.00 16.28 C ATOM 1210 CE2 PHE A 76 -2.249 56.626 10.000 1.00 16.76 C ATOM 1211 CZ PHE A 76 -1.266 55.688 9.710 1.00 17.26 C ATOM 1212 HA PHE A 76 -6.038 53.850 13.175 1.00 0.00 H ATOM 1213 HB2 PHE A 76 -5.221 53.438 11.033 1.00 0.00 H ATOM 1214 HB3 PHE A 76 -5.756 55.132 11.132 1.00 0.00 H ATOM 1215 HD2 PHE A 76 -4.224 56.950 10.818 1.00 0.00 H ATOM 1216 HE2 PHE A 76 -2.086 57.679 9.768 1.00 0.00 H ATOM 1217 HZ PHE A 76 -0.330 56.001 9.247 1.00 0.00 H ATOM 1218 HE1 PHE A 76 -0.715 53.604 9.794 1.00 0.00 H ATOM 1219 HD1 PHE A 76 -2.845 52.901 10.830 1.00 0.00 H ATOM 1220 H PHE A 76 -4.208 56.197 13.608 1.00 0.00 H ATOM 1221 N LYS A 77 -4.265 52.088 13.461 1.00 11.79 N ATOM 1222 CA LYS A 77 -3.395 51.059 14.003 1.00 14.97 C ATOM 1223 C LYS A 77 -2.619 50.345 12.895 1.00 14.66 C ATOM 1224 O LYS A 77 -3.179 50.030 11.836 1.00 12.66 O ATOM 1225 CB LYS A 77 -4.267 50.047 14.735 1.00 15.92 C ATOM 1226 CG LYS A 77 -3.528 48.987 15.478 1.00 20.13 C ATOM 1227 CD LYS A 77 -4.478 47.854 15.802 1.00 24.66 C ATOM 1228 CE LYS A 77 -5.781 48.368 16.389 1.00 25.92 C ATOM 1229 NZ LYS A 77 -6.778 47.272 16.525 1.00 29.80 N ATOM 1230 HA LYS A 77 -2.671 51.520 14.675 1.00 0.00 H ATOM 1231 HB2 LYS A 77 -4.886 50.590 15.449 1.00 0.00 H ATOM 1232 HB3 LYS A 77 -4.907 49.559 13.999 1.00 0.00 H ATOM 1233 HG2 LYS A 77 -2.710 48.613 14.863 1.00 0.00 H ATOM 1234 HG3 LYS A 77 -3.126 49.402 16.402 1.00 0.00 H ATOM 1235 HD2 LYS A 77 -4.695 47.301 14.888 1.00 0.00 H ATOM 1236 HD3 LYS A 77 -4.003 47.189 16.523 1.00 0.00 H ATOM 1237 HE2 LYS A 77 -6.187 49.139 15.734 1.00 0.00 H ATOM 1238 HE3 LYS A 77 -5.585 48.795 17.373 1.00 0.00 H ATOM 1239 HZ1 LYS A 77 -6.973 46.864 15.588 1.00 0.00 H ATOM 1240 HZ2 LYS A 77 -6.398 46.535 17.153 1.00 0.00 H ATOM 1241 HZ3 LYS A 77 -7.658 47.653 16.928 1.00 0.00 H ATOM 1242 H LYS A 77 -5.117 51.795 12.942 1.00 0.00 H ATOM 1243 N LEU A 78 -1.341 50.071 13.156 1.00 14.83 N ATOM 1244 CA LEU A 78 -0.483 49.383 12.205 1.00 13.48 C ATOM 1245 C LEU A 78 0.233 48.238 12.913 1.00 14.49 C ATOM 1246 O LEU A 78 1.019 48.470 13.835 1.00 14.29 O ATOM 1247 CB LEU A 78 0.554 50.343 11.613 1.00 12.68 C ATOM 1248 CG LEU A 78 1.665 49.728 10.746 1.00 12.27 C ATOM 1249 CD1 LEU A 78 1.097 49.176 9.450 1.00 14.18 C ATOM 1250 CD2 LEU A 78 2.708 50.771 10.421 1.00 13.97 C ATOM 1251 HA LEU A 78 -1.100 48.996 11.394 1.00 0.00 H ATOM 1252 HB2 LEU A 78 0.019 51.065 10.997 1.00 0.00 H ATOM 1253 HB3 LEU A 78 1.034 50.861 12.443 1.00 0.00 H ATOM 1254 HG LEU A 78 2.119 48.914 11.311 1.00 0.00 H ATOM 1255 HD21 LEU A 78 2.242 51.592 9.876 1.00 0.00 H ATOM 1256 HD22 LEU A 78 3.143 51.148 11.346 1.00 0.00 H ATOM 1257 HD23 LEU A 78 3.489 50.323 9.807 1.00 0.00 H ATOM 1258 HD11 LEU A 78 0.361 48.405 9.677 1.00 0.00 H ATOM 1259 HD12 LEU A 78 0.621 49.982 8.891 1.00 0.00 H ATOM 1260 HD13 LEU A 78 1.903 48.747 8.855 1.00 0.00 H ATOM 1261 H LEU A 78 -0.943 50.360 14.073 1.00 0.00 H ATOM 1262 N ARG A 79 -0.061 47.007 12.507 1.00 12.62 N ATOM 1263 CA ARG A 79 0.597 45.845 13.078 1.00 13.89 C ATOM 1264 C ARG A 79 1.507 45.304 11.992 1.00 13.25 C ATOM 1265 O ARG A 79 1.038 44.962 10.916 1.00 12.28 O ATOM 1266 CB ARG A 79 -0.413 44.759 13.486 1.00 17.76 C ATOM 1267 CG ARG A 79 0.231 43.582 14.272 1.00 24.67 C ATOM 1268 CD ARG A 79 -0.778 42.563 14.825 1.00 25.44 C ATOM 1269 NE ARG A 79 -1.931 43.220 15.431 1.00 28.35 N ATOM 1270 CZ ARG A 79 -3.144 42.686 15.499 1.00 29.87 C ATOM 1271 NH1 ARG A 79 -3.363 41.469 15.032 1.00 31.39 N ATOM 1272 NH2 ARG A 79 -4.169 43.433 15.888 1.00 30.92 N ATOM 1273 HA ARG A 79 1.141 46.126 13.980 1.00 0.00 H ATOM 1274 HB2 ARG A 79 -1.178 45.216 14.113 1.00 0.00 H ATOM 1275 HB3 ARG A 79 -0.876 44.360 12.583 1.00 0.00 H ATOM 1276 HG2 ARG A 79 0.914 43.058 13.603 1.00 0.00 H ATOM 1277 HG3 ARG A 79 0.791 43.997 15.110 1.00 0.00 H ATOM 1278 HD2 ARG A 79 -0.284 41.950 15.579 1.00 0.00 H ATOM 1279 HD3 ARG A 79 -1.122 41.927 14.009 1.00 0.00 H ATOM 1280 HE ARG A 79 -1.793 44.168 15.836 1.00 0.00 H ATOM 1281 HH12 ARG A 79 -4.315 41.054 15.087 1.00 0.00 H ATOM 1282 HH11 ARG A 79 -2.583 40.926 14.609 1.00 0.00 H ATOM 1283 HH22 ARG A 79 -5.122 43.020 15.943 1.00 0.00 H ATOM 1284 HH21 ARG A 79 -4.020 44.431 16.138 1.00 0.00 H ATOM 1285 H ARG A 79 -0.777 46.873 11.765 1.00 0.00 H ATOM 1286 N LEU A 80 2.810 45.315 12.250 1.00 12.62 N ATOM 1287 CA LEU A 80 3.790 44.798 11.309 1.00 14.31 C ATOM 1288 C LEU A 80 3.828 43.269 11.456 1.00 16.33 C ATOM 1289 O LEU A 80 3.434 42.727 12.498 1.00 13.98 O ATOM 1290 CB LEU A 80 5.164 45.392 11.620 1.00 15.19 C ATOM 1291 CG LEU A 80 5.200 46.914 11.767 1.00 17.17 C ATOM 1292 CD1 LEU A 80 6.440 47.301 12.543 1.00 19.02 C ATOM 1293 CD2 LEU A 80 5.153 47.590 10.400 1.00 15.76 C ATOM 1294 HA LEU A 80 3.521 45.069 10.288 1.00 0.00 H ATOM 1295 HB2 LEU A 80 5.517 44.955 12.554 1.00 0.00 H ATOM 1296 HB3 LEU A 80 5.842 45.115 10.812 1.00 0.00 H ATOM 1297 HG LEU A 80 4.322 47.254 12.317 1.00 0.00 H ATOM 1298 HD21 LEU A 80 6.012 47.272 9.809 1.00 0.00 H ATOM 1299 HD22 LEU A 80 4.234 47.307 9.888 1.00 0.00 H ATOM 1300 HD23 LEU A 80 5.180 48.672 10.530 1.00 0.00 H ATOM 1301 HD11 LEU A 80 6.411 46.835 13.528 1.00 0.00 H ATOM 1302 HD12 LEU A 80 7.325 46.961 12.005 1.00 0.00 H ATOM 1303 HD13 LEU A 80 6.475 48.385 12.653 1.00 0.00 H ATOM 1304 H LEU A 80 3.140 45.706 13.155 1.00 0.00 H ATOM 1305 N SER A 81 4.348 42.581 10.444 1.00 16.04 N ATOM 1306 CA SER A 81 4.423 41.124 10.461 1.00 18.11 C ATOM 1307 C SER A 81 5.231 40.536 11.637 1.00 19.70 C ATOM 1308 O SER A 81 4.935 39.442 12.127 1.00 20.75 O ATOM 1309 CB SER A 81 5.014 40.645 9.145 1.00 19.59 C ATOM 1310 OG SER A 81 6.266 41.286 8.956 1.00 25.20 O ATOM 1311 HA SER A 81 3.403 40.766 10.598 1.00 0.00 H ATOM 1312 HB2 SER A 81 4.342 40.900 8.325 1.00 0.00 H ATOM 1313 HB3 SER A 81 5.154 39.565 9.176 1.00 0.00 H ATOM 1314 HG SER A 81 6.133 42.267 8.931 1.00 0.00 H ATOM 1315 H SER A 81 4.712 43.096 9.617 1.00 0.00 H ATOM 1316 N ASP A 82 6.229 41.274 12.108 1.00 20.82 N ATOM 1317 CA ASP A 82 7.066 40.798 13.207 1.00 23.69 C ATOM 1318 C ASP A 82 6.448 40.956 14.599 1.00 23.86 C ATOM 1319 O ASP A 82 7.094 40.653 15.608 1.00 24.91 O ATOM 1320 CB ASP A 82 8.429 41.488 13.165 1.00 24.85 C ATOM 1321 CG ASP A 82 8.360 42.945 13.568 1.00 27.57 C ATOM 1322 OD1 ASP A 82 7.276 43.555 13.468 1.00 28.60 O ATOM 1323 OD2 ASP A 82 9.398 43.487 14.003 1.00 29.22 O ATOM 1324 HA ASP A 82 7.169 39.724 13.049 1.00 0.00 H ATOM 1325 HB2 ASP A 82 9.104 40.969 13.846 1.00 0.00 H ATOM 1326 HB3 ASP A 82 8.821 41.425 12.150 1.00 0.00 H ATOM 1327 H ASP A 82 6.418 42.206 11.688 1.00 0.00 H ATOM 1328 N GLY A 83 5.221 41.470 14.657 1.00 21.24 N ATOM 1329 CA GLY A 83 4.572 41.644 15.939 1.00 18.00 C ATOM 1330 C GLY A 83 4.507 43.054 16.503 1.00 15.72 C ATOM 1331 O GLY A 83 3.735 43.315 17.420 1.00 17.12 O ATOM 1332 HA3 GLY A 83 5.104 41.026 16.662 1.00 0.00 H ATOM 1333 HA2 GLY A 83 3.548 41.284 15.839 1.00 0.00 H ATOM 1334 H GLY A 83 4.730 41.746 13.783 1.00 0.00 H ATOM 1335 N ASN A 84 5.330 43.965 16.016 1.00 14.62 N ATOM 1336 CA ASN A 84 5.272 45.322 16.534 1.00 16.29 C ATOM 1337 C ASN A 84 4.009 46.008 16.107 1.00 16.20 C ATOM 1338 O ASN A 84 3.562 45.867 14.960 1.00 17.94 O ATOM 1339 CB ASN A 84 6.466 46.145 16.098 1.00 17.51 C ATOM 1340 CG ASN A 84 7.709 45.787 16.865 1.00 22.10 C ATOM 1341 OD1 ASN A 84 8.596 45.114 16.343 1.00 26.21 O ATOM 1342 ND2 ASN A 84 7.769 46.198 18.125 1.00 20.25 N ATOM 1343 HA ASN A 84 5.288 45.243 17.621 1.00 0.00 H ATOM 1344 HB2 ASN A 84 6.645 45.971 15.037 1.00 0.00 H ATOM 1345 HB3 ASN A 84 6.244 47.200 16.260 1.00 0.00 H ATOM 1346 HD22 ASN A 84 6.994 46.766 18.524 1.00 0.00 H ATOM 1347 HD21 ASN A 84 8.591 45.952 18.714 1.00 0.00 H ATOM 1348 H ASN A 84 6.011 43.715 15.271 1.00 0.00 H ATOM 1349 N GLU A 85 3.437 46.752 17.040 1.00 14.83 N ATOM 1350 CA GLU A 85 2.204 47.474 16.774 1.00 15.89 C ATOM 1351 C GLU A 85 2.290 48.947 17.184 1.00 15.26 C ATOM 1352 O GLU A 85 2.700 49.294 18.307 1.00 13.52 O ATOM 1353 CB GLU A 85 1.033 46.791 17.472 1.00 16.80 C ATOM 1354 CG GLU A 85 -0.279 47.438 17.157 1.00 21.16 C ATOM 1355 CD GLU A 85 -1.416 46.735 17.814 1.00 23.74 C ATOM 1356 OE1 GLU A 85 -1.624 45.550 17.487 1.00 22.54 O ATOM 1357 OE2 GLU A 85 -2.077 47.370 18.664 1.00 26.34 O ATOM 1358 HA GLU A 85 2.042 47.454 15.696 1.00 0.00 H ATOM 1359 HB2 GLU A 85 0.995 45.749 17.153 1.00 0.00 H ATOM 1360 HB3 GLU A 85 1.195 46.834 18.549 1.00 0.00 H ATOM 1361 HG2 GLU A 85 -0.255 48.471 17.504 1.00 0.00 H ATOM 1362 HG3 GLU A 85 -0.430 47.422 16.078 1.00 0.00 H ATOM 1363 H GLU A 85 3.877 46.821 17.980 1.00 0.00 H ATOM 1364 N TYR A 86 1.934 49.810 16.247 1.00 13.85 N ATOM 1365 CA TYR A 86 1.974 51.243 16.464 1.00 12.47 C ATOM 1366 C TYR A 86 0.597 51.836 16.220 1.00 12.81 C ATOM 1367 O TYR A 86 -0.248 51.238 15.539 1.00 11.68 O ATOM 1368 CB TYR A 86 2.976 51.911 15.493 1.00 14.41 C ATOM 1369 CG TYR A 86 4.437 51.487 15.616 1.00 16.29 C ATOM 1370 CD1 TYR A 86 5.309 52.156 16.482 1.00 16.42 C ATOM 1371 CD2 TYR A 86 4.952 50.445 14.840 1.00 18.49 C ATOM 1372 CE1 TYR A 86 6.654 51.803 16.578 1.00 16.75 C ATOM 1373 CE2 TYR A 86 6.307 50.080 14.929 1.00 18.94 C ATOM 1374 CZ TYR A 86 7.146 50.765 15.800 1.00 19.18 C ATOM 1375 OH TYR A 86 8.464 50.395 15.926 1.00 19.88 O ATOM 1376 HA TYR A 86 2.288 51.425 17.492 1.00 0.00 H ATOM 1377 HB3 TYR A 86 2.929 52.987 15.659 1.00 0.00 H ATOM 1378 HB2 TYR A 86 2.651 51.687 14.477 1.00 0.00 H ATOM 1379 HD2 TYR A 86 4.294 49.908 14.156 1.00 0.00 H ATOM 1380 HE2 TYR A 86 6.697 49.265 14.319 1.00 0.00 H ATOM 1381 HE1 TYR A 86 7.315 52.339 17.260 1.00 0.00 H ATOM 1382 HD1 TYR A 86 4.928 52.972 17.096 1.00 0.00 H ATOM 1383 HH TYR A 86 8.514 49.456 16.237 1.00 0.00 H ATOM 1384 H TYR A 86 1.615 49.449 15.325 1.00 0.00 H ATOM 1385 N LEU A 87 0.362 52.981 16.850 1.00 13.11 N ATOM 1386 CA LEU A 87 -0.862 53.754 16.701 1.00 13.14 C ATOM 1387 C LEU A 87 -0.372 55.066 16.104 1.00 11.91 C ATOM 1388 O LEU A 87 0.617 55.626 16.578 1.00 12.47 O ATOM 1389 CB LEU A 87 -1.519 54.018 18.066 1.00 15.13 C ATOM 1390 CG LEU A 87 -2.583 53.032 18.555 1.00 16.43 C ATOM 1391 CD1 LEU A 87 -2.055 51.608 18.531 1.00 19.62 C ATOM 1392 CD2 LEU A 87 -3.012 53.425 19.953 1.00 17.90 C ATOM 1393 HA LEU A 87 -1.609 53.244 16.094 1.00 0.00 H ATOM 1394 HB2 LEU A 87 -0.724 54.033 18.811 1.00 0.00 H ATOM 1395 HB3 LEU A 87 -1.987 55.001 18.016 1.00 0.00 H ATOM 1396 HG LEU A 87 -3.444 53.070 17.888 1.00 0.00 H ATOM 1397 HD21 LEU A 87 -2.149 53.396 20.618 1.00 0.00 H ATOM 1398 HD22 LEU A 87 -3.425 54.434 19.935 1.00 0.00 H ATOM 1399 HD23 LEU A 87 -3.770 52.727 20.309 1.00 0.00 H ATOM 1400 HD11 LEU A 87 -1.773 51.343 17.512 1.00 0.00 H ATOM 1401 HD12 LEU A 87 -1.183 51.534 19.181 1.00 0.00 H ATOM 1402 HD13 LEU A 87 -2.831 50.928 18.883 1.00 0.00 H ATOM 1403 H LEU A 87 1.097 53.347 17.488 1.00 0.00 H ATOM 1404 N PHE A 88 -1.023 55.529 15.042 1.00 12.93 N ATOM 1405 CA PHE A 88 -0.641 56.780 14.399 1.00 13.91 C ATOM 1406 C PHE A 88 -1.823 57.721 14.391 1.00 14.67 C ATOM 1407 O PHE A 88 -2.929 57.304 14.089 1.00 16.26 O ATOM 1408 CB PHE A 88 -0.204 56.547 12.952 1.00 14.83 C ATOM 1409 CG PHE A 88 1.082 55.796 12.811 1.00 15.66 C ATOM 1410 CD1 PHE A 88 2.300 56.474 12.771 1.00 14.83 C ATOM 1411 CD2 PHE A 88 1.078 54.408 12.686 1.00 15.07 C ATOM 1412 CE1 PHE A 88 3.496 55.777 12.581 1.00 15.85 C ATOM 1413 CE2 PHE A 88 2.268 53.709 12.499 1.00 15.69 C ATOM 1414 CZ PHE A 88 3.473 54.389 12.451 1.00 14.48 C ATOM 1415 HA PHE A 88 0.192 57.206 14.959 1.00 0.00 H ATOM 1416 HB2 PHE A 88 -0.987 55.982 12.445 1.00 0.00 H ATOM 1417 HB3 PHE A 88 -0.088 57.518 12.470 1.00 0.00 H ATOM 1418 HD2 PHE A 88 0.135 53.864 12.735 1.00 0.00 H ATOM 1419 HE2 PHE A 88 2.251 52.625 12.390 1.00 0.00 H ATOM 1420 HZ PHE A 88 4.404 53.839 12.312 1.00 0.00 H ATOM 1421 HE1 PHE A 88 4.442 56.316 12.535 1.00 0.00 H ATOM 1422 HD1 PHE A 88 2.319 57.557 12.889 1.00 0.00 H ATOM 1423 H PHE A 88 -1.824 54.986 14.661 1.00 0.00 H ATOM 1424 N GLN A 89 -1.585 58.997 14.693 1.00 14.73 N ATOM 1425 CA GLN A 89 -2.654 59.981 14.705 1.00 15.18 C ATOM 1426 C GLN A 89 -2.456 61.012 13.610 1.00 15.70 C ATOM 1427 O GLN A 89 -1.407 61.645 13.519 1.00 14.21 O ATOM 1428 CB GLN A 89 -2.745 60.703 16.049 1.00 15.76 C ATOM 1429 CG GLN A 89 -4.051 61.476 16.171 1.00 17.55 C ATOM 1430 CD GLN A 89 -4.042 62.599 17.192 1.00 19.30 C ATOM 1431 OE1 GLN A 89 -3.000 62.990 17.731 1.00 19.45 O ATOM 1432 NE2 GLN A 89 -5.224 63.140 17.450 1.00 20.30 N ATOM 1433 HA GLN A 89 -3.582 59.435 14.533 1.00 0.00 H ATOM 1434 HB2 GLN A 89 -2.690 59.968 16.852 1.00 0.00 H ATOM 1435 HB3 GLN A 89 -1.910 61.398 16.137 1.00 0.00 H ATOM 1436 HG2 GLN A 89 -4.281 61.907 15.197 1.00 0.00 H ATOM 1437 HG3 GLN A 89 -4.835 60.772 16.450 1.00 0.00 H ATOM 1438 HE22 GLN A 89 -6.076 62.780 16.974 1.00 0.00 H ATOM 1439 HE21 GLN A 89 -5.300 63.924 18.129 1.00 0.00 H ATOM 1440 H GLN A 89 -0.616 59.294 14.925 1.00 0.00 H ATOM 1441 N ALA A 90 -3.485 61.173 12.790 1.00 19.53 N ATOM 1442 CA ALA A 90 -3.478 62.133 11.695 1.00 20.37 C ATOM 1443 C ALA A 90 -4.240 63.385 12.126 1.00 21.84 C ATOM 1444 O ALA A 90 -4.962 63.365 13.124 1.00 17.60 O ATOM 1445 CB ALA A 90 -4.143 61.509 10.470 1.00 20.17 C ATOM 1446 HA ALA A 90 -2.453 62.404 11.442 1.00 0.00 H ATOM 1447 HB1 ALA A 90 -3.593 60.615 10.175 1.00 0.00 H ATOM 1448 HB2 ALA A 90 -5.171 61.241 10.713 1.00 0.00 H ATOM 1449 HB3 ALA A 90 -4.138 62.227 9.650 1.00 0.00 H ATOM 1450 H ALA A 90 -4.333 60.589 12.935 1.00 0.00 H ATOM 1451 N LYS A 91 -4.120 64.448 11.329 1.00 24.94 N ATOM 1452 CA LYS A 91 -4.786 65.733 11.593 1.00 26.08 C ATOM 1453 C LYS A 91 -6.303 65.664 11.478 1.00 25.41 C ATOM 1454 O LYS A 91 -7.014 66.431 12.127 1.00 26.52 O ATOM 1455 CB LYS A 91 -4.232 66.838 10.678 1.00 28.66 C ATOM 1456 CG LYS A 91 -4.333 66.544 9.181 1.00 33.02 C ATOM 1457 CD LYS A 91 -3.995 67.752 8.299 1.00 37.27 C ATOM 1458 CE LYS A 91 -2.716 68.475 8.730 1.00 37.79 C ATOM 1459 NZ LYS A 91 -1.488 67.650 8.573 1.00 39.95 N ATOM 1460 HA LYS A 91 -4.562 65.978 12.631 1.00 0.00 H ATOM 1461 HB2 LYS A 91 -4.785 67.755 10.881 1.00 0.00 H ATOM 1462 HB3 LYS A 91 -3.181 66.987 10.924 1.00 0.00 H ATOM 1463 HG2 LYS A 91 -3.642 65.736 8.940 1.00 0.00 H ATOM 1464 HG3 LYS A 91 -5.352 66.228 8.959 1.00 0.00 H ATOM 1465 HD2 LYS A 91 -3.869 67.407 7.273 1.00 0.00 H ATOM 1466 HD3 LYS A 91 -4.824 68.458 8.345 1.00 0.00 H ATOM 1467 HE2 LYS A 91 -2.813 68.754 9.779 1.00 0.00 H ATOM 1468 HE3 LYS A 91 -2.607 69.375 8.125 1.00 0.00 H ATOM 1469 HZ1 LYS A 91 -1.572 66.791 9.153 1.00 0.00 H ATOM 1470 HZ2 LYS A 91 -1.375 67.385 7.574 1.00 0.00 H ATOM 1471 HZ3 LYS A 91 -0.661 68.199 8.882 1.00 0.00 H ATOM 1472 H LYS A 91 -3.526 64.364 10.479 1.00 0.00 H ATOM 1473 N ASP A 92 -6.802 64.787 10.614 1.00 23.85 N ATOM 1474 CA ASP A 92 -8.236 64.600 10.446 1.00 22.19 C ATOM 1475 C ASP A 92 -8.494 63.218 9.872 1.00 21.99 C ATOM 1476 O ASP A 92 -7.560 62.483 9.587 1.00 20.60 O ATOM 1477 CB ASP A 92 -8.883 65.708 9.589 1.00 25.78 C ATOM 1478 CG ASP A 92 -8.316 65.798 8.191 1.00 28.13 C ATOM 1479 OD1 ASP A 92 -7.826 64.789 7.660 1.00 31.25 O ATOM 1480 OD2 ASP A 92 -8.355 66.890 7.590 1.00 30.34 O ATOM 1481 HA ASP A 92 -8.710 64.676 11.425 1.00 0.00 H ATOM 1482 HB2 ASP A 92 -9.952 65.508 9.516 1.00 0.00 H ATOM 1483 HB3 ASP A 92 -8.727 66.665 10.087 1.00 0.00 H ATOM 1484 H ASP A 92 -6.148 64.217 10.040 1.00 0.00 H ATOM 1485 N ASP A 93 -9.757 62.874 9.681 1.00 21.61 N ATOM 1486 CA ASP A 93 -10.121 61.561 9.173 1.00 22.66 C ATOM 1487 C ASP A 93 -9.774 61.274 7.731 1.00 22.50 C ATOM 1488 O ASP A 93 -9.436 60.136 7.410 1.00 21.64 O ATOM 1489 CB ASP A 93 -11.612 61.293 9.406 1.00 24.62 C ATOM 1490 CG ASP A 93 -11.942 61.000 10.864 1.00 24.52 C ATOM 1491 OD1 ASP A 93 -11.026 60.689 11.658 1.00 25.98 O ATOM 1492 OD2 ASP A 93 -13.139 61.038 11.197 1.00 25.75 O ATOM 1493 HA ASP A 93 -9.496 60.878 9.748 1.00 0.00 H ATOM 1494 HB2 ASP A 93 -12.177 62.171 9.091 1.00 0.00 H ATOM 1495 HB3 ASP A 93 -11.910 60.435 8.803 1.00 0.00 H ATOM 1496 H ASP A 93 -10.508 63.559 9.900 1.00 0.00 H ATOM 1497 N GLU A 94 -9.858 62.288 6.867 1.00 24.20 N ATOM 1498 CA GLU A 94 -9.549 62.134 5.440 1.00 27.18 C ATOM 1499 C GLU A 94 -8.110 61.700 5.264 1.00 26.55 C ATOM 1500 O GLU A 94 -7.829 60.740 4.536 1.00 28.37 O ATOM 1501 CB GLU A 94 -9.778 63.443 4.685 1.00 32.42 C ATOM 1502 CG GLU A 94 -10.181 63.253 3.211 1.00 39.70 C ATOM 1503 CD GLU A 94 -9.044 63.479 2.196 1.00 42.16 C ATOM 1504 OE1 GLU A 94 -8.718 64.659 1.929 1.00 43.38 O ATOM 1505 OE2 GLU A 94 -8.520 62.485 1.624 1.00 43.28 O ATOM 1506 HA GLU A 94 -10.215 61.373 5.032 1.00 0.00 H ATOM 1507 HB2 GLU A 94 -10.571 63.996 5.189 1.00 0.00 H ATOM 1508 HB3 GLU A 94 -8.856 64.023 4.717 1.00 0.00 H ATOM 1509 HG2 GLU A 94 -10.548 62.234 3.088 1.00 0.00 H ATOM 1510 HG3 GLU A 94 -10.983 63.956 2.985 1.00 0.00 H ATOM 1511 H GLU A 94 -10.153 63.222 7.218 1.00 0.00 H ATOM 1512 N GLU A 95 -7.203 62.404 5.943 1.00 25.45 N ATOM 1513 CA GLU A 95 -5.769 62.100 5.922 1.00 23.76 C ATOM 1514 C GLU A 95 -5.535 60.710 6.530 1.00 20.75 C ATOM 1515 O GLU A 95 -4.754 59.910 6.013 1.00 19.35 O ATOM 1516 CB GLU A 95 -4.987 63.156 6.706 1.00 25.66 C ATOM 1517 CG GLU A 95 -3.515 62.839 6.795 1.00 30.00 C ATOM 1518 CD GLU A 95 -2.686 63.966 7.372 1.00 32.69 C ATOM 1519 OE1 GLU A 95 -2.726 64.192 8.605 1.00 30.42 O ATOM 1520 OE2 GLU A 95 -1.955 64.606 6.587 1.00 34.16 O ATOM 1521 HA GLU A 95 -5.417 62.109 4.890 1.00 0.00 H ATOM 1522 HB2 GLU A 95 -5.108 64.120 6.211 1.00 0.00 H ATOM 1523 HB3 GLU A 95 -5.394 63.214 7.716 1.00 0.00 H ATOM 1524 HG2 GLU A 95 -3.389 61.960 7.427 1.00 0.00 H ATOM 1525 HG3 GLU A 95 -3.148 62.620 5.792 1.00 0.00 H ATOM 1526 H GLU A 95 -7.529 63.208 6.516 1.00 0.00 H ATOM 1527 N MET A 96 -6.248 60.418 7.611 1.00 19.54 N ATOM 1528 CA MET A 96 -6.134 59.120 8.239 1.00 19.10 C ATOM 1529 C MET A 96 -6.393 58.042 7.183 1.00 19.84 C ATOM 1530 O MET A 96 -5.569 57.133 6.992 1.00 18.51 O ATOM 1531 CB MET A 96 -7.137 58.962 9.385 1.00 19.08 C ATOM 1532 CG MET A 96 -7.074 57.571 9.989 1.00 17.27 C ATOM 1533 SD MET A 96 -8.249 57.299 11.244 1.00 19.40 S ATOM 1534 CE MET A 96 -9.710 56.988 10.316 1.00 19.19 C ATOM 1535 HA MET A 96 -5.132 59.020 8.656 1.00 0.00 H ATOM 1536 HB2 MET A 96 -6.910 59.695 10.159 1.00 0.00 H ATOM 1537 HB3 MET A 96 -8.143 59.138 9.003 1.00 0.00 H ATOM 1538 HG2 MET A 96 -6.080 57.423 10.410 1.00 0.00 H ATOM 1539 HG3 MET A 96 -7.243 56.843 9.195 1.00 0.00 H ATOM 1540 HE1 MET A 96 -9.938 57.856 9.698 1.00 0.00 H ATOM 1541 HE2 MET A 96 -9.556 56.117 9.679 1.00 0.00 H ATOM 1542 HE3 MET A 96 -10.539 56.798 10.998 1.00 0.00 H ATOM 1543 H MET A 96 -6.894 61.129 8.010 1.00 0.00 H ATOM 1544 N ASN A 97 -7.498 58.179 6.453 1.00 19.85 N ATOM 1545 CA ASN A 97 -7.852 57.200 5.424 1.00 20.41 C ATOM 1546 C ASN A 97 -6.875 57.197 4.260 1.00 19.68 C ATOM 1547 O ASN A 97 -6.591 56.144 3.674 1.00 20.08 O ATOM 1548 CB ASN A 97 -9.297 57.370 4.965 1.00 20.90 C ATOM 1549 CG ASN A 97 -10.292 56.941 6.037 1.00 25.96 C ATOM 1550 OD1 ASN A 97 -11.182 57.707 6.417 1.00 31.98 O ATOM 1551 ND2 ASN A 97 -10.136 55.718 6.549 1.00 26.96 N ATOM 1552 HA ASN A 97 -7.773 56.215 5.884 1.00 0.00 H ATOM 1553 HB2 ASN A 97 -9.469 58.419 4.725 1.00 0.00 H ATOM 1554 HB3 ASN A 97 -9.457 56.764 4.073 1.00 0.00 H ATOM 1555 HD22 ASN A 97 -9.373 55.102 6.202 1.00 0.00 H ATOM 1556 HD21 ASN A 97 -10.777 55.381 7.295 1.00 0.00 H ATOM 1557 H ASN A 97 -8.121 58.996 6.617 1.00 0.00 H ATOM 1558 N THR A 98 -6.324 58.367 3.967 1.00 19.73 N ATOM 1559 CA THR A 98 -5.334 58.508 2.919 1.00 18.74 C ATOM 1560 C THR A 98 -4.145 57.617 3.308 1.00 20.07 C ATOM 1561 O THR A 98 -3.632 56.851 2.473 1.00 18.79 O ATOM 1562 CB THR A 98 -4.867 59.967 2.809 1.00 18.79 C ATOM 1563 OG1 THR A 98 -5.989 60.806 2.539 1.00 24.14 O ATOM 1564 CG2 THR A 98 -3.860 60.138 1.692 1.00 20.97 C ATOM 1565 HA THR A 98 -5.754 58.218 1.956 1.00 0.00 H ATOM 1566 HB THR A 98 -4.398 60.242 3.754 1.00 0.00 H ATOM 1567 HG1 THR A 98 -6.646 60.724 3.275 1.00 0.00 H ATOM 1568 HG23 THR A 98 -2.995 59.503 1.884 1.00 0.00 H ATOM 1569 HG21 THR A 98 -4.318 59.854 0.745 1.00 0.00 H ATOM 1570 HG22 THR A 98 -3.544 61.180 1.646 1.00 0.00 H ATOM 1571 H THR A 98 -6.611 59.209 4.506 1.00 0.00 H ATOM 1572 N TRP A 99 -3.718 57.707 4.575 1.00 18.24 N ATOM 1573 CA TRP A 99 -2.604 56.902 5.078 1.00 17.49 C ATOM 1574 C TRP A 99 -2.938 55.403 5.111 1.00 16.95 C ATOM 1575 O TRP A 99 -2.112 54.565 4.747 1.00 16.17 O ATOM 1576 CB TRP A 99 -2.197 57.360 6.470 1.00 16.62 C ATOM 1577 CG TRP A 99 -1.317 58.545 6.481 1.00 16.73 C ATOM 1578 CD1 TRP A 99 -1.665 59.836 6.794 1.00 16.91 C ATOM 1579 CD2 TRP A 99 0.085 58.556 6.226 1.00 16.09 C ATOM 1580 NE1 TRP A 99 -0.553 60.643 6.760 1.00 17.44 N ATOM 1581 CE2 TRP A 99 0.537 59.885 6.417 1.00 17.04 C ATOM 1582 CE3 TRP A 99 1.016 57.574 5.872 1.00 15.63 C ATOM 1583 CZ2 TRP A 99 1.876 60.247 6.253 1.00 15.11 C ATOM 1584 CZ3 TRP A 99 2.344 57.937 5.709 1.00 14.85 C ATOM 1585 CH2 TRP A 99 2.760 59.263 5.902 1.00 15.82 C ATOM 1586 HA TRP A 99 -1.774 57.047 4.386 1.00 0.00 H ATOM 1587 HB2 TRP A 99 -3.101 57.599 7.030 1.00 0.00 H ATOM 1588 HB3 TRP A 99 -1.673 56.540 6.961 1.00 0.00 H ATOM 1589 HE1 TRP A 99 -0.540 61.663 6.962 1.00 0.00 H ATOM 1590 HD1 TRP A 99 -2.674 60.171 7.034 1.00 0.00 H ATOM 1591 HZ2 TRP A 99 2.205 61.276 6.399 1.00 0.00 H ATOM 1592 HH2 TRP A 99 3.812 59.515 5.769 1.00 0.00 H ATOM 1593 HZ3 TRP A 99 3.076 57.181 5.427 1.00 0.00 H ATOM 1594 HE3 TRP A 99 0.703 56.540 5.727 1.00 0.00 H ATOM 1595 H TRP A 99 -4.193 58.369 5.221 1.00 0.00 H ATOM 1596 N ILE A 100 -4.149 55.068 5.537 1.00 17.89 N ATOM 1597 CA ILE A 100 -4.564 53.673 5.597 1.00 20.15 C ATOM 1598 C ILE A 100 -4.551 53.025 4.205 1.00 20.83 C ATOM 1599 O ILE A 100 -4.141 51.881 4.065 1.00 22.07 O ATOM 1600 CB ILE A 100 -5.953 53.535 6.266 1.00 18.90 C ATOM 1601 CG1 ILE A 100 -5.855 53.902 7.747 1.00 17.28 C ATOM 1602 CG2 ILE A 100 -6.483 52.115 6.121 1.00 20.35 C ATOM 1603 CD1 ILE A 100 -7.198 53.893 8.470 1.00 15.50 C ATOM 1604 HA ILE A 100 -3.841 53.139 6.214 1.00 0.00 H ATOM 1605 HB ILE A 100 -6.644 54.215 5.769 1.00 0.00 H ATOM 1606 HG12 ILE A 100 -5.195 53.186 8.237 1.00 0.00 H ATOM 1607 HG13 ILE A 100 -5.427 54.901 7.827 1.00 0.00 H ATOM 1608 HD11 ILE A 100 -7.867 54.613 8.000 1.00 0.00 H ATOM 1609 HD12 ILE A 100 -7.635 52.896 8.410 1.00 0.00 H ATOM 1610 HD13 ILE A 100 -7.048 54.163 9.515 1.00 0.00 H ATOM 1611 HG21 ILE A 100 -6.575 51.869 5.063 1.00 0.00 H ATOM 1612 HG22 ILE A 100 -5.792 51.420 6.598 1.00 0.00 H ATOM 1613 HG23 ILE A 100 -7.460 52.043 6.599 1.00 0.00 H ATOM 1614 H ILE A 100 -4.812 55.813 5.833 1.00 0.00 H ATOM 1615 N GLN A 101 -4.981 53.763 3.183 1.00 22.89 N ATOM 1616 CA GLN A 101 -4.990 53.259 1.798 1.00 23.20 C ATOM 1617 C GLN A 101 -3.565 53.133 1.266 1.00 20.44 C ATOM 1618 O GLN A 101 -3.216 52.134 0.631 1.00 21.18 O ATOM 1619 CB GLN A 101 -5.783 54.203 0.883 1.00 29.27 C ATOM 1620 CG GLN A 101 -7.300 54.236 1.119 1.00 34.97 C ATOM 1621 CD GLN A 101 -8.010 52.939 0.719 1.00 38.55 C ATOM 1622 OE1 GLN A 101 -7.380 51.887 0.529 1.00 38.92 O ATOM 1623 NE2 GLN A 101 -9.336 53.012 0.599 1.00 38.89 N ATOM 1624 HA GLN A 101 -5.465 52.278 1.803 1.00 0.00 H ATOM 1625 HB2 GLN A 101 -5.399 55.213 1.028 1.00 0.00 H ATOM 1626 HB3 GLN A 101 -5.610 53.895 -0.148 1.00 0.00 H ATOM 1627 HG2 GLN A 101 -7.481 54.416 2.179 1.00 0.00 H ATOM 1628 HG3 GLN A 101 -7.722 55.055 0.536 1.00 0.00 H ATOM 1629 HE22 GLN A 101 -9.824 53.915 0.767 1.00 0.00 H ATOM 1630 HE21 GLN A 101 -9.882 52.166 0.337 1.00 0.00 H ATOM 1631 H GLN A 101 -5.322 54.728 3.369 1.00 0.00 H ATOM 1632 N ALA A 102 -2.755 54.161 1.505 1.00 16.13 N ATOM 1633 CA ALA A 102 -1.362 54.149 1.088 1.00 16.24 C ATOM 1634 C ALA A 102 -0.646 52.913 1.614 1.00 16.18 C ATOM 1635 O ALA A 102 -0.041 52.175 0.856 1.00 18.24 O ATOM 1636 CB ALA A 102 -0.663 55.385 1.584 1.00 17.73 C ATOM 1637 HA ALA A 102 -1.336 54.129 -0.002 1.00 0.00 H ATOM 1638 HB1 ALA A 102 -1.153 56.268 1.172 1.00 0.00 H ATOM 1639 HB2 ALA A 102 -0.711 55.416 2.673 1.00 0.00 H ATOM 1640 HB3 ALA A 102 0.379 55.364 1.265 1.00 0.00 H ATOM 1641 H ALA A 102 -3.128 54.995 2.003 1.00 0.00 H ATOM 1642 N ILE A 103 -0.710 52.692 2.921 1.00 18.21 N ATOM 1643 CA ILE A 103 -0.075 51.524 3.555 1.00 19.38 C ATOM 1644 C ILE A 103 -0.668 50.198 3.088 1.00 22.15 C ATOM 1645 O ILE A 103 0.049 49.246 2.783 1.00 21.29 O ATOM 1646 CB ILE A 103 -0.200 51.584 5.110 1.00 19.54 C ATOM 1647 CG1 ILE A 103 0.528 52.818 5.650 1.00 18.45 C ATOM 1648 CG2 ILE A 103 0.245 50.265 5.748 1.00 16.19 C ATOM 1649 CD1 ILE A 103 0.395 53.026 7.118 1.00 18.15 C ATOM 1650 HA ILE A 103 0.971 51.568 3.253 1.00 0.00 H ATOM 1651 HB ILE A 103 -1.247 51.700 5.391 1.00 0.00 H ATOM 1652 HG12 ILE A 103 1.588 52.717 5.416 1.00 0.00 H ATOM 1653 HG13 ILE A 103 0.128 53.697 5.145 1.00 0.00 H ATOM 1654 HD11 ILE A 103 -0.658 53.144 7.373 1.00 0.00 H ATOM 1655 HD12 ILE A 103 0.803 52.163 7.644 1.00 0.00 H ATOM 1656 HD13 ILE A 103 0.943 53.923 7.408 1.00 0.00 H ATOM 1657 HG21 ILE A 103 -0.382 49.454 5.377 1.00 0.00 H ATOM 1658 HG22 ILE A 103 1.285 50.070 5.488 1.00 0.00 H ATOM 1659 HG23 ILE A 103 0.147 50.336 6.831 1.00 0.00 H ATOM 1660 H ILE A 103 -1.227 53.368 3.519 1.00 0.00 H ATOM 1661 N SER A 104 -1.987 50.126 3.015 1.00 25.76 N ATOM 1662 CA SER A 104 -2.635 48.898 2.605 1.00 29.50 C ATOM 1663 C SER A 104 -2.425 48.547 1.148 1.00 31.59 C ATOM 1664 O SER A 104 -2.761 47.438 0.721 1.00 32.75 O ATOM 1665 CB SER A 104 -4.135 48.963 2.935 1.00 30.37 C ATOM 1666 OG SER A 104 -4.351 49.048 4.349 1.00 31.89 O ATOM 1667 HA SER A 104 -2.161 48.096 3.171 1.00 0.00 H ATOM 1668 HB2 SER A 104 -4.622 48.066 2.554 1.00 0.00 H ATOM 1669 HB3 SER A 104 -4.567 49.841 2.456 1.00 0.00 H ATOM 1670 HG SER A 104 -3.914 49.864 4.700 1.00 0.00 H ATOM 1671 H SER A 104 -2.563 50.958 3.254 1.00 0.00 H ATOM 1672 N SER A 105 -1.808 49.429 0.378 1.00 32.61 N ATOM 1673 CA SER A 105 -1.620 49.158 -1.033 1.00 32.03 C ATOM 1674 C SER A 105 -0.149 49.058 -1.399 1.00 32.49 C ATOM 1675 O SER A 105 0.150 48.616 -2.480 1.00 36.02 O ATOM 1676 CB SER A 105 -2.317 50.272 -1.813 1.00 33.18 C ATOM 1677 OG SER A 105 -3.622 50.413 -1.318 1.00 34.43 O ATOM 1678 HA SER A 105 -2.055 48.191 -1.286 1.00 0.00 H ATOM 1679 HB2 SER A 105 -2.351 50.014 -2.872 1.00 0.00 H ATOM 1680 HB3 SER A 105 -1.772 51.207 -1.685 1.00 0.00 H ATOM 1681 HG SER A 105 -3.586 50.645 -0.356 1.00 0.00 H ATOM 1682 H SER A 105 -1.457 50.319 0.787 1.00 0.00 H ATOM 1683 N ALA A 106 0.707 49.274 -0.402 1.00 32.46 N ATOM 1684 CA ALA A 106 2.145 49.214 -0.596 1.00 31.86 C ATOM 1685 C ALA A 106 2.500 47.821 -1.037 1.00 34.81 C ATOM 1686 O ALA A 106 2.077 46.847 -0.358 1.00 34.40 O ATOM 1687 CB ALA A 106 2.860 49.569 0.684 1.00 32.17 C ATOM 1688 HA ALA A 106 2.454 49.931 -1.356 1.00 0.00 H ATOM 1689 OXT ALA A 106 3.151 47.709 -2.118 1.00 37.18 O ATOM 1690 HB1 ALA A 106 2.582 50.579 0.986 1.00 0.00 H ATOM 1691 HB2 ALA A 106 2.576 48.864 1.465 1.00 0.00 H ATOM 1692 HB3 ALA A 106 3.937 49.520 0.523 1.00 0.00 H ATOM 1693 H ALA A 106 0.334 49.492 0.544 1.00 0.00 H TER 1694 ALA A 106 ATOM 1695 N MET B 1 10.510 64.394 0.389 1.00 17.43 N ATOM 1696 CA MET B 1 9.818 65.345 -0.534 1.00 14.49 C ATOM 1697 C MET B 1 9.460 64.582 -1.808 1.00 12.75 C ATOM 1698 O MET B 1 10.261 63.809 -2.306 1.00 13.92 O ATOM 1699 CB MET B 1 10.762 66.507 -0.833 1.00 18.54 C ATOM 1700 CG MET B 1 10.442 67.298 -2.066 1.00 24.48 C ATOM 1701 SD MET B 1 9.123 68.483 -1.890 1.00 30.80 S ATOM 1702 CE MET B 1 10.004 69.903 -2.266 1.00 29.06 C ATOM 1703 HA MET B 1 8.907 65.748 -0.090 1.00 0.00 H ATOM 1704 HB2 MET B 1 10.738 67.187 0.018 1.00 0.00 H ATOM 1705 HB3 MET B 1 11.768 66.103 -0.945 1.00 0.00 H ATOM 1706 HG2 MET B 1 10.163 66.597 -2.853 1.00 0.00 H ATOM 1707 HG3 MET B 1 11.342 67.837 -2.364 1.00 0.00 H ATOM 1708 HE1 MET B 1 10.820 70.022 -1.553 1.00 0.00 H ATOM 1709 HE2 MET B 1 10.410 69.821 -3.274 1.00 0.00 H ATOM 1710 HE3 MET B 1 9.341 70.766 -2.209 1.00 0.00 H ATOM 1711 HN3 MET B 1 11.371 64.032 -0.069 1.00 0.00 H ATOM 1712 HN2 MET B 1 9.874 63.601 0.609 1.00 0.00 H ATOM 1713 HN1 MET B 1 10.766 64.889 1.267 1.00 0.00 H ATOM 1714 N GLU B 2 8.238 64.715 -2.294 1.00 12.54 N ATOM 1715 CA GLU B 2 7.847 64.012 -3.512 1.00 15.08 C ATOM 1716 C GLU B 2 6.693 64.701 -4.201 1.00 13.04 C ATOM 1717 O GLU B 2 5.953 65.479 -3.586 1.00 16.26 O ATOM 1718 CB GLU B 2 7.446 62.575 -3.199 1.00 14.96 C ATOM 1719 CG GLU B 2 6.220 62.515 -2.329 1.00 18.36 C ATOM 1720 CD GLU B 2 6.045 61.182 -1.621 1.00 21.43 C ATOM 1721 OE1 GLU B 2 7.041 60.781 -0.986 1.00 23.68 O ATOM 1722 OE2 GLU B 2 4.967 60.604 -1.686 1.00 19.98 O ATOM 1723 HA GLU B 2 8.711 64.018 -4.176 1.00 0.00 H ATOM 1724 HB2 GLU B 2 7.242 62.054 -4.134 1.00 0.00 H ATOM 1725 HB3 GLU B 2 8.270 62.083 -2.683 1.00 0.00 H ATOM 1726 HG2 GLU B 2 6.292 63.299 -1.576 1.00 0.00 H ATOM 1727 HG3 GLU B 2 5.344 62.692 -2.953 1.00 0.00 H ATOM 1728 H GLU B 2 7.551 65.324 -1.806 1.00 0.00 H ATOM 1729 N GLY B 3 6.529 64.392 -5.477 1.00 12.69 N ATOM 1730 CA GLY B 3 5.468 64.982 -6.260 1.00 12.30 C ATOM 1731 C GLY B 3 5.727 64.774 -7.737 1.00 13.84 C ATOM 1732 O GLY B 3 6.784 64.284 -8.133 1.00 13.25 O ATOM 1733 HA3 GLY B 3 5.417 66.050 -6.050 1.00 0.00 H ATOM 1734 HA2 GLY B 3 4.520 64.515 -5.992 1.00 0.00 H ATOM 1735 H GLY B 3 7.176 63.712 -5.925 1.00 0.00 H ATOM 1736 N PHE B 4 4.729 65.100 -8.547 1.00 12.97 N ATOM 1737 CA PHE B 4 4.842 64.984 -9.991 1.00 14.40 C ATOM 1738 C PHE B 4 5.637 66.170 -10.520 1.00 14.47 C ATOM 1739 O PHE B 4 5.533 67.284 -10.013 1.00 15.67 O ATOM 1740 CB PHE B 4 3.453 64.988 -10.644 1.00 15.31 C ATOM 1741 CG PHE B 4 2.681 63.695 -10.483 1.00 15.98 C ATOM 1742 CD1 PHE B 4 2.923 62.613 -11.328 1.00 15.88 C ATOM 1743 CD2 PHE B 4 1.656 63.592 -9.543 1.00 15.58 C ATOM 1744 CE1 PHE B 4 2.152 61.462 -11.246 1.00 16.00 C ATOM 1745 CE2 PHE B 4 0.882 62.451 -9.454 1.00 14.37 C ATOM 1746 CZ PHE B 4 1.131 61.381 -10.310 1.00 15.96 C ATOM 1747 HA PHE B 4 5.343 64.046 -10.231 1.00 0.00 H ATOM 1748 HB2 PHE B 4 2.868 65.792 -10.197 1.00 0.00 H ATOM 1749 HB3 PHE B 4 3.578 65.180 -11.710 1.00 0.00 H ATOM 1750 HD2 PHE B 4 1.462 64.425 -8.868 1.00 0.00 H ATOM 1751 HE2 PHE B 4 0.081 62.389 -8.718 1.00 0.00 H ATOM 1752 HZ PHE B 4 0.523 60.479 -10.245 1.00 0.00 H ATOM 1753 HE1 PHE B 4 2.348 60.624 -11.915 1.00 0.00 H ATOM 1754 HD1 PHE B 4 3.727 62.672 -12.062 1.00 0.00 H ATOM 1755 H PHE B 4 3.839 65.449 -8.137 1.00 0.00 H ATOM 1756 N LEU B 5 6.372 65.939 -11.597 1.00 15.90 N ATOM 1757 CA LEU B 5 7.183 66.975 -12.226 1.00 14.95 C ATOM 1758 C LEU B 5 7.359 66.537 -13.681 1.00 15.58 C ATOM 1759 O LEU B 5 7.432 65.337 -13.931 1.00 14.65 O ATOM 1760 CB LEU B 5 8.562 66.978 -11.554 1.00 14.44 C ATOM 1761 CG LEU B 5 9.241 68.178 -10.879 1.00 15.81 C ATOM 1762 CD1 LEU B 5 8.267 69.027 -10.085 1.00 14.82 C ATOM 1763 CD2 LEU B 5 10.369 67.625 -9.983 1.00 14.90 C ATOM 1764 HA LEU B 5 6.729 67.962 -12.145 1.00 0.00 H ATOM 1765 HB2 LEU B 5 8.503 66.212 -10.781 1.00 0.00 H ATOM 1766 HB3 LEU B 5 9.257 66.657 -12.330 1.00 0.00 H ATOM 1767 HG LEU B 5 9.646 68.843 -11.641 1.00 0.00 H ATOM 1768 HD21 LEU B 5 9.943 66.956 -9.235 1.00 0.00 H ATOM 1769 HD22 LEU B 5 11.083 67.077 -10.597 1.00 0.00 H ATOM 1770 HD23 LEU B 5 10.875 68.453 -9.486 1.00 0.00 H ATOM 1771 HD11 LEU B 5 7.494 69.410 -10.751 1.00 0.00 H ATOM 1772 HD12 LEU B 5 7.808 68.419 -9.306 1.00 0.00 H ATOM 1773 HD13 LEU B 5 8.801 69.861 -9.630 1.00 0.00 H ATOM 1774 H LEU B 5 6.371 64.984 -12.009 1.00 0.00 H ATOM 1775 N ASN B 6 7.307 67.472 -14.637 1.00 15.41 N ATOM 1776 CA ASN B 6 7.576 67.128 -16.048 1.00 17.86 C ATOM 1777 C ASN B 6 9.095 67.060 -16.136 1.00 15.12 C ATOM 1778 O ASN B 6 9.767 67.963 -15.672 1.00 16.99 O ATOM 1779 CB ASN B 6 7.093 68.205 -17.003 1.00 20.07 C ATOM 1780 CG ASN B 6 5.612 68.193 -17.165 1.00 24.58 C ATOM 1781 OD1 ASN B 6 4.984 67.141 -17.067 1.00 27.76 O ATOM 1782 ND2 ASN B 6 5.029 69.355 -17.421 1.00 26.75 N ATOM 1783 HA ASN B 6 7.065 66.206 -16.324 1.00 0.00 H ATOM 1784 HB2 ASN B 6 7.396 69.178 -16.617 1.00 0.00 H ATOM 1785 HB3 ASN B 6 7.554 68.043 -17.977 1.00 0.00 H ATOM 1786 HD22 ASN B 6 5.603 70.219 -17.495 1.00 0.00 H ATOM 1787 HD21 ASN B 6 3.998 69.403 -17.548 1.00 0.00 H ATOM 1788 H ASN B 6 7.074 68.453 -14.383 1.00 0.00 H ATOM 1789 N ARG B 7 9.642 65.994 -16.701 1.00 16.18 N ATOM 1790 CA ARG B 7 11.097 65.850 -16.776 1.00 16.19 C ATOM 1791 C ARG B 7 11.643 65.654 -18.192 1.00 13.63 C ATOM 1792 O ARG B 7 11.064 64.939 -18.997 1.00 15.40 O ATOM 1793 CB ARG B 7 11.543 64.667 -15.905 1.00 16.01 C ATOM 1794 CG ARG B 7 13.053 64.439 -15.874 1.00 17.82 C ATOM 1795 CD ARG B 7 13.383 63.039 -15.354 1.00 17.21 C ATOM 1796 NE ARG B 7 13.231 62.031 -16.399 1.00 17.73 N ATOM 1797 CZ ARG B 7 13.246 60.718 -16.197 1.00 18.12 C ATOM 1798 NH1 ARG B 7 13.397 60.233 -14.978 1.00 20.67 N ATOM 1799 NH2 ARG B 7 13.167 59.890 -17.228 1.00 17.39 N ATOM 1800 HA ARG B 7 11.506 66.794 -16.414 1.00 0.00 H ATOM 1801 HB2 ARG B 7 11.204 64.848 -14.885 1.00 0.00 H ATOM 1802 HB3 ARG B 7 11.069 63.763 -16.289 1.00 0.00 H ATOM 1803 HG2 ARG B 7 13.452 64.549 -16.883 1.00 0.00 H ATOM 1804 HG3 ARG B 7 13.513 65.180 -15.220 1.00 0.00 H ATOM 1805 HD2 ARG B 7 12.711 62.799 -14.530 1.00 0.00 H ATOM 1806 HD3 ARG B 7 14.413 63.027 -14.997 1.00 0.00 H ATOM 1807 HE ARG B 7 13.101 62.366 -17.375 1.00 0.00 H ATOM 1808 HH12 ARG B 7 13.408 59.204 -14.825 1.00 0.00 H ATOM 1809 HH11 ARG B 7 13.505 60.880 -14.171 1.00 0.00 H ATOM 1810 HH22 ARG B 7 13.179 58.862 -17.071 1.00 0.00 H ATOM 1811 HH21 ARG B 7 13.093 60.268 -18.194 1.00 0.00 H ATOM 1812 H ARG B 7 9.031 65.251 -17.096 1.00 0.00 H ATOM 1813 N LYS B 8 12.776 66.279 -18.471 1.00 13.89 N ATOM 1814 CA LYS B 8 13.416 66.152 -19.770 1.00 13.88 C ATOM 1815 C LYS B 8 14.877 65.841 -19.545 1.00 14.53 C ATOM 1816 O LYS B 8 15.555 66.505 -18.763 1.00 13.85 O ATOM 1817 CB LYS B 8 13.314 67.444 -20.581 1.00 13.06 C ATOM 1818 CG LYS B 8 13.996 67.348 -21.938 1.00 13.78 C ATOM 1819 CD LYS B 8 14.146 68.695 -22.610 1.00 12.91 C ATOM 1820 CE LYS B 8 14.769 68.548 -23.969 1.00 12.26 C ATOM 1821 NZ LYS B 8 14.857 69.850 -24.651 1.00 12.67 N ATOM 1822 HA LYS B 8 12.915 65.361 -20.328 1.00 0.00 H ATOM 1823 HB2 LYS B 8 12.260 67.675 -20.737 1.00 0.00 H ATOM 1824 HB3 LYS B 8 13.781 68.249 -20.013 1.00 0.00 H ATOM 1825 HG2 LYS B 8 14.986 66.913 -21.801 1.00 0.00 H ATOM 1826 HG3 LYS B 8 13.402 66.700 -22.583 1.00 0.00 H ATOM 1827 HD2 LYS B 8 13.163 69.153 -22.715 1.00 0.00 H ATOM 1828 HD3 LYS B 8 14.779 69.333 -21.994 1.00 0.00 H ATOM 1829 HE2 LYS B 8 14.161 67.871 -24.569 1.00 0.00 H ATOM 1830 HE3 LYS B 8 15.771 68.134 -23.859 1.00 0.00 H ATOM 1831 HZ1 LYS B 8 13.902 70.247 -24.762 1.00 0.00 H ATOM 1832 HZ2 LYS B 8 15.440 70.498 -24.084 1.00 0.00 H ATOM 1833 HZ3 LYS B 8 15.291 69.721 -25.587 1.00 0.00 H ATOM 1834 H LYS B 8 13.219 66.875 -17.743 1.00 0.00 H ATOM 1835 N HIS B 9 15.361 64.812 -20.218 1.00 15.62 N ATOM 1836 CA HIS B 9 16.756 64.432 -20.127 1.00 16.70 C ATOM 1837 C HIS B 9 17.456 65.260 -21.218 1.00 18.83 C ATOM 1838 O HIS B 9 17.165 65.108 -22.408 1.00 21.40 O ATOM 1839 CB HIS B 9 16.872 62.936 -20.403 1.00 18.43 C ATOM 1840 CG HIS B 9 18.168 62.336 -19.983 1.00 18.25 C ATOM 1841 ND1 HIS B 9 19.271 63.091 -19.647 1.00 21.26 N ATOM 1842 CD2 HIS B 9 18.546 61.044 -19.833 1.00 19.27 C ATOM 1843 CE1 HIS B 9 20.267 62.294 -19.305 1.00 18.30 C ATOM 1844 NE2 HIS B 9 19.846 61.046 -19.410 1.00 21.71 N ATOM 1845 HA HIS B 9 17.199 64.617 -19.149 1.00 0.00 H ATOM 1846 HB2 HIS B 9 16.070 62.426 -19.869 1.00 0.00 H ATOM 1847 HB3 HIS B 9 16.752 62.776 -21.474 1.00 0.00 H ATOM 1848 HD2 HIS B 9 17.928 60.165 -20.016 1.00 0.00 H ATOM 1849 HE1 HIS B 9 21.262 62.610 -18.991 1.00 0.00 H ATOM 1850 H HIS B 9 14.724 64.261 -20.828 1.00 0.00 H ATOM 1851 N GLU B 10 18.332 66.163 -20.799 1.00 16.96 N ATOM 1852 CA GLU B 10 19.063 67.055 -21.694 1.00 18.64 C ATOM 1853 C GLU B 10 20.459 66.589 -22.069 1.00 18.43 C ATOM 1854 O GLU B 10 20.822 66.510 -23.244 1.00 17.76 O ATOM 1855 CB GLU B 10 19.208 68.416 -21.022 1.00 22.03 C ATOM 1856 CG GLU B 10 18.129 69.387 -21.365 1.00 27.85 C ATOM 1857 CD GLU B 10 18.349 70.041 -22.710 1.00 29.36 C ATOM 1858 OE1 GLU B 10 19.440 69.874 -23.297 1.00 31.67 O ATOM 1859 OE2 GLU B 10 17.429 70.742 -23.171 1.00 30.45 O ATOM 1860 HA GLU B 10 18.478 67.084 -22.613 1.00 0.00 H ATOM 1861 HB2 GLU B 10 19.203 68.266 -19.942 1.00 0.00 H ATOM 1862 HB3 GLU B 10 20.163 68.846 -21.323 1.00 0.00 H ATOM 1863 HG2 GLU B 10 17.176 68.859 -21.384 1.00 0.00 H ATOM 1864 HG3 GLU B 10 18.099 70.162 -20.599 1.00 0.00 H ATOM 1865 H GLU B 10 18.508 66.240 -19.777 1.00 0.00 H ATOM 1866 N TRP B 11 21.271 66.378 -21.045 1.00 18.53 N ATOM 1867 CA TRP B 11 22.644 65.982 -21.231 1.00 17.30 C ATOM 1868 C TRP B 11 22.977 64.644 -20.632 1.00 20.83 C ATOM 1869 O TRP B 11 22.359 64.189 -19.661 1.00 19.36 O ATOM 1870 CB TRP B 11 23.556 67.018 -20.591 1.00 16.79 C ATOM 1871 CG TRP B 11 23.561 68.283 -21.298 1.00 15.43 C ATOM 1872 CD1 TRP B 11 22.764 69.357 -21.067 1.00 16.15 C ATOM 1873 CD2 TRP B 11 24.401 68.622 -22.397 1.00 15.95 C ATOM 1874 NE1 TRP B 11 23.055 70.355 -21.965 1.00 14.15 N ATOM 1875 CE2 TRP B 11 24.056 69.930 -22.792 1.00 15.71 C ATOM 1876 CE3 TRP B 11 25.421 67.955 -23.081 1.00 15.63 C ATOM 1877 CZ2 TRP B 11 24.696 70.576 -23.854 1.00 16.96 C ATOM 1878 CZ3 TRP B 11 26.052 68.590 -24.119 1.00 16.77 C ATOM 1879 CH2 TRP B 11 25.694 69.890 -24.499 1.00 18.14 C ATOM 1880 HA TRP B 11 22.794 65.907 -22.308 1.00 0.00 H ATOM 1881 HB2 TRP B 11 23.220 67.193 -19.569 1.00 0.00 H ATOM 1882 HB3 TRP B 11 24.572 66.624 -20.576 1.00 0.00 H ATOM 1883 HE1 TRP B 11 22.589 71.284 -22.008 1.00 0.00 H ATOM 1884 HD1 TRP B 11 22.006 69.418 -20.286 1.00 0.00 H ATOM 1885 HZ2 TRP B 11 24.413 71.584 -24.157 1.00 0.00 H ATOM 1886 HH2 TRP B 11 26.220 70.367 -25.326 1.00 0.00 H ATOM 1887 HZ3 TRP B 11 26.846 68.074 -24.658 1.00 0.00 H ATOM 1888 HE3 TRP B 11 25.711 66.944 -22.793 1.00 0.00 H ATOM 1889 H TRP B 11 20.908 66.502 -20.078 1.00 0.00 H ATOM 1890 N GLU B 12 23.966 64.013 -21.235 1.00 21.11 N ATOM 1891 CA GLU B 12 24.471 62.759 -20.746 1.00 22.04 C ATOM 1892 C GLU B 12 25.904 63.094 -20.424 1.00 21.34 C ATOM 1893 O GLU B 12 26.316 64.255 -20.546 1.00 20.00 O ATOM 1894 CB GLU B 12 24.365 61.679 -21.808 1.00 23.52 C ATOM 1895 CG GLU B 12 22.929 61.300 -22.062 1.00 28.01 C ATOM 1896 CD GLU B 12 22.798 60.068 -22.914 1.00 31.32 C ATOM 1897 OE1 GLU B 12 23.808 59.343 -23.040 1.00 34.37 O ATOM 1898 OE2 GLU B 12 21.690 59.823 -23.453 1.00 32.30 O ATOM 1899 HA GLU B 12 23.923 62.362 -19.892 1.00 0.00 H ATOM 1900 HB2 GLU B 12 24.805 62.048 -22.735 1.00 0.00 H ATOM 1901 HB3 GLU B 12 24.912 60.797 -21.474 1.00 0.00 H ATOM 1902 HG2 GLU B 12 22.442 61.116 -21.105 1.00 0.00 H ATOM 1903 HG3 GLU B 12 22.433 62.129 -22.567 1.00 0.00 H ATOM 1904 H GLU B 12 24.391 64.433 -22.086 1.00 0.00 H ATOM 1905 N ALA B 13 26.665 62.110 -19.974 1.00 21.46 N ATOM 1906 CA ALA B 13 28.050 62.369 -19.643 1.00 21.09 C ATOM 1907 C ALA B 13 28.903 62.644 -20.894 1.00 21.55 C ATOM 1908 O ALA B 13 28.521 62.302 -22.019 1.00 20.29 O ATOM 1909 CB ALA B 13 28.628 61.211 -18.823 1.00 21.92 C ATOM 1910 HA ALA B 13 28.080 63.274 -19.037 1.00 0.00 H ATOM 1911 HB1 ALA B 13 28.057 61.099 -17.901 1.00 0.00 H ATOM 1912 HB2 ALA B 13 28.567 60.290 -19.403 1.00 0.00 H ATOM 1913 HB3 ALA B 13 29.670 61.422 -18.583 1.00 0.00 H ATOM 1914 H ALA B 13 26.270 61.155 -19.859 1.00 0.00 H ATOM 1915 N HIS B 14 30.015 63.342 -20.682 1.00 22.41 N ATOM 1916 CA HIS B 14 30.966 63.670 -21.735 1.00 23.43 C ATOM 1917 C HIS B 14 30.435 64.573 -22.833 1.00 26.65 C ATOM 1918 O HIS B 14 30.716 64.393 -24.027 1.00 25.72 O ATOM 1919 CB HIS B 14 31.573 62.385 -22.280 1.00 20.70 C ATOM 1920 CG HIS B 14 32.441 61.698 -21.284 1.00 19.89 C ATOM 1921 ND1 HIS B 14 32.013 60.657 -20.508 1.00 20.25 N ATOM 1922 CD2 HIS B 14 33.715 61.970 -20.882 1.00 20.19 C ATOM 1923 CE1 HIS B 14 32.967 60.304 -19.662 1.00 20.13 C ATOM 1924 NE2 HIS B 14 34.012 61.092 -19.880 1.00 18.43 N ATOM 1925 HA HIS B 14 31.743 64.280 -21.274 1.00 0.00 H ATOM 1926 HB2 HIS B 14 30.766 61.710 -22.565 1.00 0.00 H ATOM 1927 HB3 HIS B 14 32.171 62.626 -23.159 1.00 0.00 H ATOM 1928 HD2 HIS B 14 34.371 62.742 -21.284 1.00 0.00 H ATOM 1929 HE1 HIS B 14 32.906 59.509 -18.919 1.00 0.00 H ATOM 1930 H HIS B 14 30.216 63.670 -19.716 1.00 0.00 H ATOM 1931 N ASN B 15 29.735 65.607 -22.380 1.00 28.96 N ATOM 1932 CA ASN B 15 29.124 66.601 -23.248 1.00 30.52 C ATOM 1933 C ASN B 15 28.376 66.023 -24.425 1.00 28.86 C ATOM 1934 O ASN B 15 28.402 66.575 -25.520 1.00 28.49 O ATOM 1935 CB ASN B 15 30.142 67.640 -23.681 1.00 33.46 C ATOM 1936 CG ASN B 15 30.491 68.572 -22.566 1.00 36.47 C ATOM 1937 OD1 ASN B 15 29.787 69.545 -22.337 1.00 39.03 O ATOM 1938 ND2 ASN B 15 31.536 68.246 -21.808 1.00 38.03 N ATOM 1939 HA ASN B 15 28.359 67.092 -22.646 1.00 0.00 H ATOM 1940 HB2 ASN B 15 31.047 67.131 -24.013 1.00 0.00 H ATOM 1941 HB3 ASN B 15 29.728 68.217 -24.508 1.00 0.00 H ATOM 1942 HD22 ASN B 15 32.107 67.409 -22.042 1.00 0.00 H ATOM 1943 HD21 ASN B 15 31.782 68.829 -20.982 1.00 0.00 H ATOM 1944 H ASN B 15 29.618 65.711 -21.352 1.00 0.00 H ATOM 1945 N LYS B 16 27.763 64.869 -24.191 1.00 28.08 N ATOM 1946 CA LYS B 16 26.949 64.224 -25.201 1.00 29.95 C ATOM 1947 C LYS B 16 25.524 64.688 -24.941 1.00 28.45 C ATOM 1948 O LYS B 16 25.099 64.811 -23.793 1.00 25.74 O ATOM 1949 CB LYS B 16 27.000 62.698 -25.083 1.00 32.55 C ATOM 1950 CG LYS B 16 25.979 61.980 -25.991 1.00 36.30 C ATOM 1951 CD LYS B 16 26.085 60.446 -25.900 1.00 40.04 C ATOM 1952 CE LYS B 16 25.171 59.707 -26.912 1.00 40.76 C ATOM 1953 NZ LYS B 16 23.698 59.802 -26.613 1.00 41.55 N ATOM 1954 HA LYS B 16 27.309 64.483 -26.197 1.00 0.00 H ATOM 1955 HB2 LYS B 16 28.001 62.363 -25.355 1.00 0.00 H ATOM 1956 HB3 LYS B 16 26.796 62.424 -24.048 1.00 0.00 H ATOM 1957 HG2 LYS B 16 24.974 62.280 -25.693 1.00 0.00 H ATOM 1958 HG3 LYS B 16 26.156 62.282 -27.023 1.00 0.00 H ATOM 1959 HD2 LYS B 16 27.119 60.158 -26.093 1.00 0.00 H ATOM 1960 HD3 LYS B 16 25.805 60.139 -24.892 1.00 0.00 H ATOM 1961 HE2 LYS B 16 25.450 58.653 -26.916 1.00 0.00 H ATOM 1962 HE3 LYS B 16 25.345 60.131 -27.901 1.00 0.00 H ATOM 1963 HZ1 LYS B 16 23.508 59.389 -25.677 1.00 0.00 H ATOM 1964 HZ2 LYS B 16 23.408 60.801 -26.618 1.00 0.00 H ATOM 1965 HZ3 LYS B 16 23.164 59.281 -27.338 1.00 0.00 H ATOM 1966 H LYS B 16 27.870 64.417 -23.260 1.00 0.00 H ATOM 1967 N LYS B 17 24.808 64.969 -26.017 1.00 27.33 N ATOM 1968 CA LYS B 17 23.426 65.376 -25.933 1.00 26.96 C ATOM 1969 C LYS B 17 22.676 64.056 -25.747 1.00 28.15 C ATOM 1970 O LYS B 17 23.013 63.052 -26.375 1.00 27.87 O ATOM 1971 CB LYS B 17 23.012 66.025 -27.249 1.00 27.62 C ATOM 1972 CG LYS B 17 22.131 67.222 -27.094 1.00 29.05 C ATOM 1973 CD LYS B 17 22.887 68.345 -26.416 1.00 32.51 C ATOM 1974 CE LYS B 17 21.995 69.562 -26.218 1.00 35.66 C ATOM 1975 NZ LYS B 17 21.520 70.113 -27.535 1.00 38.04 N ATOM 1976 HA LYS B 17 23.231 66.093 -25.136 1.00 0.00 H ATOM 1977 HB2 LYS B 17 23.915 66.331 -27.778 1.00 0.00 H ATOM 1978 HB3 LYS B 17 22.479 65.283 -27.843 1.00 0.00 H ATOM 1979 HG2 LYS B 17 21.798 67.554 -28.077 1.00 0.00 H ATOM 1980 HG3 LYS B 17 21.264 66.955 -26.490 1.00 0.00 H ATOM 1981 HD2 LYS B 17 23.241 68.001 -25.444 1.00 0.00 H ATOM 1982 HD3 LYS B 17 23.740 68.625 -27.034 1.00 0.00 H ATOM 1983 HE2 LYS B 17 22.558 70.333 -25.693 1.00 0.00 H ATOM 1984 HE3 LYS B 17 21.130 69.275 -25.620 1.00 0.00 H ATOM 1985 HZ1 LYS B 17 22.341 70.394 -28.108 1.00 0.00 H ATOM 1986 HZ2 LYS B 17 20.977 69.383 -28.039 1.00 0.00 H ATOM 1987 HZ3 LYS B 17 20.915 70.941 -27.365 1.00 0.00 H ATOM 1988 H LYS B 17 25.255 64.894 -26.953 1.00 0.00 H ATOM 1989 N ALA B 18 21.732 64.022 -24.818 1.00 26.95 N ATOM 1990 CA ALA B 18 20.958 62.816 -24.590 1.00 24.83 C ATOM 1991 C ALA B 18 20.153 62.492 -25.857 1.00 26.34 C ATOM 1992 O ALA B 18 19.642 63.390 -26.532 1.00 25.61 O ATOM 1993 CB ALA B 18 20.029 63.019 -23.407 1.00 25.25 C ATOM 1994 HA ALA B 18 21.624 61.983 -24.366 1.00 0.00 H ATOM 1995 HB1 ALA B 18 20.618 63.244 -22.518 1.00 0.00 H ATOM 1996 HB2 ALA B 18 19.353 63.848 -23.616 1.00 0.00 H ATOM 1997 HB3 ALA B 18 19.451 62.110 -23.241 1.00 0.00 H ATOM 1998 H ALA B 18 21.544 64.870 -24.246 1.00 0.00 H ATOM 1999 N SER B 19 20.048 61.204 -26.173 1.00 29.37 N ATOM 2000 CA SER B 19 19.316 60.722 -27.355 1.00 31.72 C ATOM 2001 C SER B 19 17.810 60.687 -27.152 1.00 32.25 C ATOM 2002 O SER B 19 17.043 60.772 -28.108 1.00 33.66 O ATOM 2003 CB SER B 19 19.798 59.321 -27.734 1.00 32.21 C ATOM 2004 OG SER B 19 19.852 58.478 -26.593 1.00 34.59 O ATOM 2005 HA SER B 19 19.523 61.432 -28.155 1.00 0.00 H ATOM 2006 HB2 SER B 19 20.793 59.392 -28.173 1.00 0.00 H ATOM 2007 HB3 SER B 19 19.111 58.892 -28.463 1.00 0.00 H ATOM 2008 HG SER B 19 20.166 57.579 -26.863 1.00 0.00 H ATOM 2009 H SER B 19 20.505 60.504 -25.555 1.00 0.00 H ATOM 2010 N SER B 20 17.410 60.502 -25.899 1.00 33.22 N ATOM 2011 CA SER B 20 16.012 60.446 -25.477 1.00 32.63 C ATOM 2012 C SER B 20 15.625 61.807 -24.874 1.00 29.50 C ATOM 2013 O SER B 20 15.768 62.032 -23.664 1.00 28.25 O ATOM 2014 CB SER B 20 15.873 59.333 -24.428 1.00 34.97 C ATOM 2015 OG SER B 20 17.007 59.320 -23.552 1.00 36.36 O ATOM 2016 HA SER B 20 15.354 60.233 -26.319 1.00 0.00 H ATOM 2017 HB2 SER B 20 15.800 58.370 -24.934 1.00 0.00 H ATOM 2018 HB3 SER B 20 14.970 59.503 -23.842 1.00 0.00 H ATOM 2019 HG SER B 20 17.074 60.192 -23.088 1.00 0.00 H ATOM 2020 H SER B 20 18.142 60.389 -25.168 1.00 0.00 H ATOM 2021 N ARG B 21 15.087 62.702 -25.690 1.00 26.57 N ATOM 2022 CA ARG B 21 14.761 64.008 -25.163 1.00 24.41 C ATOM 2023 C ARG B 21 13.354 64.540 -25.113 1.00 20.69 C ATOM 2024 O ARG B 21 13.160 65.748 -25.180 1.00 19.62 O ATOM 2025 CB ARG B 21 15.671 65.045 -25.790 1.00 28.80 C ATOM 2026 CG ARG B 21 17.094 64.877 -25.356 1.00 32.60 C ATOM 2027 CD ARG B 21 17.899 66.026 -25.819 1.00 36.05 C ATOM 2028 NE ARG B 21 18.139 65.945 -27.247 1.00 38.77 N ATOM 2029 CZ ARG B 21 18.369 67.000 -28.008 1.00 40.18 C ATOM 2030 NH1 ARG B 21 18.369 68.216 -27.473 1.00 42.41 N ATOM 2031 NH2 ARG B 21 18.661 66.831 -29.287 1.00 41.27 N ATOM 2032 HA ARG B 21 14.916 63.817 -24.101 1.00 0.00 H ATOM 2033 HB2 ARG B 21 15.620 64.949 -26.875 1.00 0.00 H ATOM 2034 HB3 ARG B 21 15.328 66.038 -25.498 1.00 0.00 H ATOM 2035 HG2 ARG B 21 17.136 64.820 -24.268 1.00 0.00 H ATOM 2036 HG3 ARG B 21 17.496 63.958 -25.782 1.00 0.00 H ATOM 2037 HD2 ARG B 21 18.855 66.027 -25.295 1.00 0.00 H ATOM 2038 HD3 ARG B 21 17.364 66.950 -25.598 1.00 0.00 H ATOM 2039 HE ARG B 21 18.130 65.007 -27.696 1.00 0.00 H ATOM 2040 HH12 ARG B 21 18.550 69.047 -28.071 1.00 0.00 H ATOM 2041 HH11 ARG B 21 18.188 68.337 -26.456 1.00 0.00 H ATOM 2042 HH22 ARG B 21 18.843 67.657 -29.892 1.00 0.00 H ATOM 2043 HH21 ARG B 21 18.708 65.872 -29.687 1.00 0.00 H ATOM 2044 H ARG B 21 14.903 62.470 -26.687 1.00 0.00 H ATOM 2045 N SER B 22 12.359 63.679 -24.986 1.00 17.56 N ATOM 2046 CA SER B 22 11.018 64.215 -24.884 1.00 20.47 C ATOM 2047 C SER B 22 10.665 64.384 -23.398 1.00 17.10 C ATOM 2048 O SER B 22 11.297 63.793 -22.524 1.00 20.23 O ATOM 2049 CB SER B 22 9.999 63.343 -25.635 1.00 21.16 C ATOM 2050 OG SER B 22 10.550 62.089 -26.011 1.00 28.08 O ATOM 2051 HA SER B 22 10.978 65.192 -25.366 1.00 0.00 H ATOM 2052 HB2 SER B 22 9.678 63.870 -26.533 1.00 0.00 H ATOM 2053 HB3 SER B 22 9.138 63.171 -24.989 1.00 0.00 H ATOM 2054 HG SER B 22 10.839 61.600 -25.200 1.00 0.00 H ATOM 2055 H SER B 22 12.533 62.654 -24.960 1.00 0.00 H ATOM 2056 N TRP B 23 9.701 65.243 -23.114 1.00 16.99 N ATOM 2057 CA TRP B 23 9.281 65.483 -21.737 1.00 17.47 C ATOM 2058 C TRP B 23 8.404 64.335 -21.305 1.00 17.91 C ATOM 2059 O TRP B 23 7.726 63.720 -22.131 1.00 16.76 O ATOM 2060 CB TRP B 23 8.497 66.788 -21.628 1.00 17.14 C ATOM 2061 CG TRP B 23 9.344 68.012 -21.769 1.00 18.46 C ATOM 2062 CD1 TRP B 23 9.720 68.630 -22.943 1.00 17.04 C ATOM 2063 CD2 TRP B 23 9.922 68.778 -20.702 1.00 16.69 C ATOM 2064 NE1 TRP B 23 10.485 69.738 -22.658 1.00 16.21 N ATOM 2065 CE2 TRP B 23 10.630 69.854 -21.295 1.00 18.04 C ATOM 2066 CE3 TRP B 23 9.915 68.663 -19.307 1.00 15.15 C ATOM 2067 CZ2 TRP B 23 11.325 70.805 -20.532 1.00 18.08 C ATOM 2068 CZ3 TRP B 23 10.600 69.607 -18.549 1.00 14.80 C ATOM 2069 CH2 TRP B 23 11.295 70.664 -19.161 1.00 16.88 C ATOM 2070 HA TRP B 23 10.161 65.560 -21.099 1.00 0.00 H ATOM 2071 HB2 TRP B 23 7.740 66.801 -22.412 1.00 0.00 H ATOM 2072 HB3 TRP B 23 8.010 66.817 -20.653 1.00 0.00 H ATOM 2073 HE1 TRP B 23 10.890 70.386 -23.363 1.00 0.00 H ATOM 2074 HD1 TRP B 23 9.452 68.292 -23.944 1.00 0.00 H ATOM 2075 HZ2 TRP B 23 11.868 71.623 -21.005 1.00 0.00 H ATOM 2076 HH2 TRP B 23 11.821 71.388 -18.539 1.00 0.00 H ATOM 2077 HZ3 TRP B 23 10.598 69.525 -17.462 1.00 0.00 H ATOM 2078 HE3 TRP B 23 9.381 67.846 -18.822 1.00 0.00 H ATOM 2079 H TRP B 23 9.233 65.758 -23.887 1.00 0.00 H ATOM 2080 N HIS B 24 8.475 63.985 -20.031 1.00 18.00 N ATOM 2081 CA HIS B 24 7.649 62.900 -19.499 1.00 17.66 C ATOM 2082 C HIS B 24 7.243 63.286 -18.098 1.00 17.67 C ATOM 2083 O HIS B 24 8.023 63.906 -17.377 1.00 14.22 O ATOM 2084 CB HIS B 24 8.417 61.573 -19.489 1.00 18.65 C ATOM 2085 CG HIS B 24 8.718 61.032 -20.858 1.00 22.33 C ATOM 2086 ND1 HIS B 24 9.995 60.942 -21.362 1.00 22.09 N ATOM 2087 CD2 HIS B 24 7.897 60.560 -21.827 1.00 21.09 C ATOM 2088 CE1 HIS B 24 9.953 60.437 -22.585 1.00 20.28 C ATOM 2089 NE2 HIS B 24 8.687 60.197 -22.888 1.00 20.78 N ATOM 2090 HA HIS B 24 6.771 62.755 -20.129 1.00 0.00 H ATOM 2091 HB2 HIS B 24 9.361 61.726 -18.965 1.00 0.00 H ATOM 2092 HB3 HIS B 24 7.821 60.835 -18.952 1.00 0.00 H ATOM 2093 HD2 HIS B 24 6.811 60.483 -21.773 1.00 0.00 H ATOM 2094 HE1 HIS B 24 10.812 60.251 -23.230 1.00 0.00 H ATOM 2095 H HIS B 24 9.128 64.489 -19.398 1.00 0.00 H ATOM 2096 N ASN B 25 5.990 63.004 -17.761 1.00 17.55 N ATOM 2097 CA ASN B 25 5.449 63.310 -16.447 1.00 19.15 C ATOM 2098 C ASN B 25 5.842 62.164 -15.517 1.00 19.81 C ATOM 2099 O ASN B 25 5.437 61.023 -15.727 1.00 20.87 O ATOM 2100 CB ASN B 25 3.927 63.440 -16.528 1.00 22.24 C ATOM 2101 CG ASN B 25 3.283 63.787 -15.185 1.00 25.75 C ATOM 2102 OD1 ASN B 25 2.293 63.167 -14.796 1.00 28.50 O ATOM 2103 ND2 ASN B 25 3.814 64.798 -14.496 1.00 25.16 N ATOM 2104 HA ASN B 25 5.843 64.254 -16.072 1.00 0.00 H ATOM 2105 HB2 ASN B 25 3.683 64.225 -17.243 1.00 0.00 H ATOM 2106 HB3 ASN B 25 3.515 62.493 -16.876 1.00 0.00 H ATOM 2107 HD22 ASN B 25 4.651 65.294 -14.863 1.00 0.00 H ATOM 2108 HD21 ASN B 25 3.391 65.090 -13.592 1.00 0.00 H ATOM 2109 H ASN B 25 5.373 62.547 -18.463 1.00 0.00 H ATOM 2110 N VAL B 26 6.711 62.460 -14.556 1.00 15.96 N ATOM 2111 CA VAL B 26 7.165 61.466 -13.601 1.00 15.20 C ATOM 2112 C VAL B 26 6.932 61.892 -12.138 1.00 13.93 C ATOM 2113 O VAL B 26 6.900 63.082 -11.799 1.00 13.63 O ATOM 2114 CB VAL B 26 8.655 61.122 -13.823 1.00 15.73 C ATOM 2115 CG1 VAL B 26 8.845 60.500 -15.192 1.00 18.56 C ATOM 2116 CG2 VAL B 26 9.512 62.371 -13.715 1.00 18.23 C ATOM 2117 HA VAL B 26 6.562 60.576 -13.779 1.00 0.00 H ATOM 2118 HB VAL B 26 8.962 60.413 -13.054 1.00 0.00 H ATOM 2119 HG11 VAL B 26 8.252 59.588 -15.261 1.00 0.00 H ATOM 2120 HG12 VAL B 26 8.521 61.205 -15.958 1.00 0.00 H ATOM 2121 HG13 VAL B 26 9.898 60.261 -15.338 1.00 0.00 H ATOM 2122 HG21 VAL B 26 9.198 63.092 -14.470 1.00 0.00 H ATOM 2123 HG22 VAL B 26 9.393 62.807 -12.723 1.00 0.00 H ATOM 2124 HG23 VAL B 26 10.558 62.108 -13.874 1.00 0.00 H ATOM 2125 H VAL B 26 7.076 63.431 -14.486 1.00 0.00 H ATOM 2126 N TYR B 27 6.727 60.895 -11.288 1.00 15.11 N ATOM 2127 CA TYR B 27 6.504 61.096 -9.865 1.00 14.53 C ATOM 2128 C TYR B 27 7.870 60.946 -9.195 1.00 11.70 C ATOM 2129 O TYR B 27 8.424 59.850 -9.137 1.00 11.47 O ATOM 2130 CB TYR B 27 5.518 60.051 -9.339 1.00 13.59 C ATOM 2131 CG TYR B 27 5.107 60.296 -7.915 1.00 15.13 C ATOM 2132 CD1 TYR B 27 4.048 61.152 -7.615 1.00 15.83 C ATOM 2133 CD2 TYR B 27 5.792 59.701 -6.857 1.00 15.99 C ATOM 2134 CE1 TYR B 27 3.680 61.409 -6.308 1.00 15.94 C ATOM 2135 CE2 TYR B 27 5.426 59.960 -5.534 1.00 16.47 C ATOM 2136 CZ TYR B 27 4.374 60.812 -5.277 1.00 16.93 C ATOM 2137 OH TYR B 27 4.011 61.085 -3.988 1.00 18.84 O ATOM 2138 HA TYR B 27 6.075 62.076 -9.656 1.00 0.00 H ATOM 2139 HB3 TYR B 27 5.986 59.069 -9.402 1.00 0.00 H ATOM 2140 HB2 TYR B 27 4.626 60.068 -9.966 1.00 0.00 H ATOM 2141 HD2 TYR B 27 6.622 59.026 -7.064 1.00 0.00 H ATOM 2142 HE2 TYR B 27 5.968 59.492 -4.712 1.00 0.00 H ATOM 2143 HE1 TYR B 27 2.847 62.079 -6.094 1.00 0.00 H ATOM 2144 HD1 TYR B 27 3.499 61.628 -8.428 1.00 0.00 H ATOM 2145 HH TYR B 27 4.774 61.498 -3.512 1.00 0.00 H ATOM 2146 H TYR B 27 6.726 59.923 -11.657 1.00 0.00 H ATOM 2147 N CYS B 28 8.401 62.060 -8.704 1.00 14.77 N ATOM 2148 CA CYS B 28 9.724 62.109 -8.072 1.00 16.76 C ATOM 2149 C CYS B 28 9.770 62.037 -6.547 1.00 14.57 C ATOM 2150 O CYS B 28 8.953 62.650 -5.871 1.00 14.13 O ATOM 2151 CB CYS B 28 10.453 63.373 -8.527 1.00 18.26 C ATOM 2152 SG CYS B 28 10.521 63.532 -10.330 1.00 18.07 S ATOM 2153 HA CYS B 28 10.209 61.191 -8.404 1.00 0.00 H ATOM 2154 HB2 CYS B 28 11.472 63.346 -8.141 1.00 0.00 H ATOM 2155 HB3 CYS B 28 9.934 64.241 -8.120 1.00 0.00 H ATOM 2156 HG CYS B 28 9.237 63.579 -10.835 1.00 0.00 H ATOM 2157 H CYS B 28 7.852 62.941 -8.771 1.00 0.00 H ATOM 2158 N VAL B 29 10.759 61.327 -6.012 1.00 14.65 N ATOM 2159 CA VAL B 29 10.894 61.206 -4.562 1.00 14.68 C ATOM 2160 C VAL B 29 12.304 61.482 -4.115 1.00 13.25 C ATOM 2161 O VAL B 29 13.241 60.887 -4.628 1.00 14.32 O ATOM 2162 CB VAL B 29 10.498 59.794 -4.054 1.00 14.48 C ATOM 2163 CG1 VAL B 29 10.678 59.700 -2.526 1.00 15.59 C ATOM 2164 CG2 VAL B 29 9.057 59.480 -4.424 1.00 11.45 C ATOM 2165 HA VAL B 29 10.216 61.947 -4.139 1.00 0.00 H ATOM 2166 HB VAL B 29 11.152 59.064 -4.532 1.00 0.00 H ATOM 2167 HG11 VAL B 29 11.721 59.889 -2.272 1.00 0.00 H ATOM 2168 HG12 VAL B 29 10.044 60.442 -2.040 1.00 0.00 H ATOM 2169 HG13 VAL B 29 10.395 58.703 -2.189 1.00 0.00 H ATOM 2170 HG21 VAL B 29 8.397 60.219 -3.969 1.00 0.00 H ATOM 2171 HG22 VAL B 29 8.947 59.511 -5.508 1.00 0.00 H ATOM 2172 HG23 VAL B 29 8.798 58.486 -4.059 1.00 0.00 H ATOM 2173 H VAL B 29 11.445 60.852 -6.633 1.00 0.00 H ATOM 2174 N ILE B 30 12.457 62.452 -3.223 1.00 14.58 N ATOM 2175 CA ILE B 30 13.776 62.772 -2.652 1.00 18.10 C ATOM 2176 C ILE B 30 13.829 62.097 -1.279 1.00 18.47 C ATOM 2177 O ILE B 30 13.054 62.459 -0.375 1.00 17.66 O ATOM 2178 CB ILE B 30 13.974 64.296 -2.419 1.00 19.55 C ATOM 2179 CG1 ILE B 30 14.070 65.031 -3.750 1.00 22.28 C ATOM 2180 CG2 ILE B 30 15.221 64.554 -1.604 1.00 19.43 C ATOM 2181 CD1 ILE B 30 15.006 64.394 -4.707 1.00 25.40 C ATOM 2182 HA ILE B 30 14.547 62.433 -3.344 1.00 0.00 H ATOM 2183 HB ILE B 30 13.110 64.668 -1.868 1.00 0.00 H ATOM 2184 HG12 ILE B 30 13.079 65.059 -4.202 1.00 0.00 H ATOM 2185 HG13 ILE B 30 14.410 66.049 -3.559 1.00 0.00 H ATOM 2186 HD11 ILE B 30 16.006 64.368 -4.273 1.00 0.00 H ATOM 2187 HD12 ILE B 30 14.673 63.377 -4.917 1.00 0.00 H ATOM 2188 HD13 ILE B 30 15.025 64.969 -5.633 1.00 0.00 H ATOM 2189 HG21 ILE B 30 15.131 64.058 -0.638 1.00 0.00 H ATOM 2190 HG22 ILE B 30 16.088 64.162 -2.136 1.00 0.00 H ATOM 2191 HG23 ILE B 30 15.339 65.627 -1.453 1.00 0.00 H ATOM 2192 H ILE B 30 11.626 62.999 -2.920 1.00 0.00 H ATOM 2193 N ASN B 31 14.714 61.120 -1.125 1.00 17.68 N ATOM 2194 CA ASN B 31 14.866 60.400 0.139 1.00 18.69 C ATOM 2195 C ASN B 31 16.279 59.823 0.215 1.00 18.06 C ATOM 2196 O ASN B 31 16.784 59.297 -0.775 1.00 18.45 O ATOM 2197 CB ASN B 31 13.824 59.273 0.248 1.00 16.59 C ATOM 2198 CG ASN B 31 13.870 58.553 1.593 1.00 18.15 C ATOM 2199 OD1 ASN B 31 14.302 57.415 1.677 1.00 19.51 O ATOM 2200 ND2 ASN B 31 13.449 59.230 2.649 1.00 17.78 N ATOM 2201 HA ASN B 31 14.706 61.089 0.968 1.00 0.00 H ATOM 2202 HB2 ASN B 31 12.831 59.703 0.116 1.00 0.00 H ATOM 2203 HB3 ASN B 31 14.012 58.547 -0.543 1.00 0.00 H ATOM 2204 HD22 ASN B 31 13.088 60.199 2.536 1.00 0.00 H ATOM 2205 HD21 ASN B 31 13.480 58.794 3.593 1.00 0.00 H ATOM 2206 H ASN B 31 15.319 60.858 -1.929 1.00 0.00 H ATOM 2207 N ASN B 32 16.906 59.937 1.388 1.00 18.40 N ATOM 2208 CA ASN B 32 18.267 59.445 1.626 1.00 17.68 C ATOM 2209 C ASN B 32 19.291 59.913 0.607 1.00 14.45 C ATOM 2210 O ASN B 32 20.056 59.123 0.097 1.00 16.24 O ATOM 2211 CB ASN B 32 18.299 57.918 1.716 1.00 22.56 C ATOM 2212 CG ASN B 32 19.570 57.385 2.412 1.00 28.30 C ATOM 2213 OD1 ASN B 32 19.656 56.197 2.725 1.00 32.16 O ATOM 2214 ND2 ASN B 32 20.541 58.265 2.676 1.00 30.28 N ATOM 2215 HA ASN B 32 18.554 59.883 2.582 1.00 0.00 H ATOM 2216 HB2 ASN B 32 17.427 57.584 2.279 1.00 0.00 H ATOM 2217 HB3 ASN B 32 18.257 57.509 0.707 1.00 0.00 H ATOM 2218 HD22 ASN B 32 20.431 59.260 2.396 1.00 0.00 H ATOM 2219 HD21 ASN B 32 21.406 57.954 3.162 1.00 0.00 H ATOM 2220 H ASN B 32 16.404 60.398 2.173 1.00 0.00 H ATOM 2221 N GLN B 33 19.331 61.216 0.370 1.00 17.51 N ATOM 2222 CA GLN B 33 20.250 61.851 -0.584 1.00 18.63 C ATOM 2223 C GLN B 33 20.193 61.333 -2.010 1.00 17.69 C ATOM 2224 O GLN B 33 21.203 61.393 -2.722 1.00 15.07 O ATOM 2225 CB GLN B 33 21.689 61.767 -0.105 1.00 24.47 C ATOM 2226 CG GLN B 33 22.006 62.597 1.124 1.00 28.75 C ATOM 2227 CD GLN B 33 23.489 62.547 1.444 1.00 30.69 C ATOM 2228 OE1 GLN B 33 24.231 63.489 1.152 1.00 31.04 O ATOM 2229 NE2 GLN B 33 23.942 61.415 1.986 1.00 31.70 N ATOM 2230 HA GLN B 33 19.897 62.882 -0.616 1.00 0.00 H ATOM 2231 HB2 GLN B 33 21.909 60.724 0.125 1.00 0.00 H ATOM 2232 HB3 GLN B 33 22.336 62.103 -0.916 1.00 0.00 H ATOM 2233 HG2 GLN B 33 21.715 63.631 0.941 1.00 0.00 H ATOM 2234 HG3 GLN B 33 21.444 62.207 1.973 1.00 0.00 H ATOM 2235 HE22 GLN B 33 23.279 60.647 2.216 1.00 0.00 H ATOM 2236 HE21 GLN B 33 24.958 61.301 2.179 1.00 0.00 H ATOM 2237 H GLN B 33 18.671 61.827 0.892 1.00 0.00 H ATOM 2238 N GLU B 34 19.038 60.796 -2.408 1.00 17.93 N ATOM 2239 CA GLU B 34 18.838 60.291 -3.760 1.00 18.99 C ATOM 2240 C GLU B 34 17.476 60.681 -4.294 1.00 17.91 C ATOM 2241 O GLU B 34 16.597 61.136 -3.554 1.00 14.12 O ATOM 2242 CB GLU B 34 19.002 58.772 -3.830 1.00 22.53 C ATOM 2243 CG GLU B 34 20.444 58.325 -3.690 1.00 29.83 C ATOM 2244 CD GLU B 34 20.713 56.968 -4.302 1.00 33.87 C ATOM 2245 OE1 GLU B 34 20.389 55.957 -3.641 1.00 34.98 O ATOM 2246 OE2 GLU B 34 21.265 56.912 -5.438 1.00 36.29 O ATOM 2247 HA GLU B 34 19.608 60.748 -4.382 1.00 0.00 H ATOM 2248 HB2 GLU B 34 18.419 58.322 -3.027 1.00 0.00 H ATOM 2249 HB3 GLU B 34 18.622 58.425 -4.791 1.00 0.00 H ATOM 2250 HG2 GLU B 34 21.083 59.059 -4.181 1.00 0.00 H ATOM 2251 HG3 GLU B 34 20.691 58.281 -2.629 1.00 0.00 H ATOM 2252 H GLU B 34 18.253 60.736 -1.729 1.00 0.00 H ATOM 2253 N MET B 35 17.309 60.538 -5.600 1.00 18.75 N ATOM 2254 CA MET B 35 16.042 60.869 -6.232 1.00 18.73 C ATOM 2255 C MET B 35 15.558 59.678 -7.042 1.00 15.64 C ATOM 2256 O MET B 35 16.287 59.133 -7.871 1.00 13.80 O ATOM 2257 CB MET B 35 16.187 62.120 -7.111 1.00 20.61 C ATOM 2258 CG MET B 35 14.901 62.616 -7.759 1.00 21.49 C ATOM 2259 SD MET B 35 15.175 64.141 -8.668 1.00 23.80 S ATOM 2260 CE MET B 35 14.086 65.179 -7.938 1.00 23.74 C ATOM 2261 HA MET B 35 15.301 61.094 -5.465 1.00 0.00 H ATOM 2262 HB2 MET B 35 16.583 62.924 -6.490 1.00 0.00 H ATOM 2263 HB3 MET B 35 16.898 61.893 -7.905 1.00 0.00 H ATOM 2264 HG2 MET B 35 14.157 62.794 -6.982 1.00 0.00 H ATOM 2265 HG3 MET B 35 14.532 61.854 -8.446 1.00 0.00 H ATOM 2266 HE1 MET B 35 13.076 64.786 -8.056 1.00 0.00 H ATOM 2267 HE2 MET B 35 14.322 65.264 -6.877 1.00 0.00 H ATOM 2268 HE3 MET B 35 14.152 66.161 -8.407 1.00 0.00 H ATOM 2269 H MET B 35 18.095 60.184 -6.182 1.00 0.00 H ATOM 2270 N GLY B 36 14.378 59.196 -6.690 1.00 13.19 N ATOM 2271 CA GLY B 36 13.799 58.077 -7.396 1.00 15.14 C ATOM 2272 C GLY B 36 12.698 58.577 -8.305 1.00 14.42 C ATOM 2273 O GLY B 36 12.068 59.598 -8.007 1.00 12.60 O ATOM 2274 HA3 GLY B 36 13.386 57.368 -6.679 1.00 0.00 H ATOM 2275 HA2 GLY B 36 14.568 57.584 -7.991 1.00 0.00 H ATOM 2276 H GLY B 36 13.862 59.627 -5.897 1.00 0.00 H ATOM 2277 N PHE B 37 12.464 57.850 -9.402 1.00 16.60 N ATOM 2278 CA PHE B 37 11.427 58.187 -10.397 1.00 15.71 C ATOM 2279 C PHE B 37 10.397 57.062 -10.488 1.00 15.47 C ATOM 2280 O PHE B 37 10.759 55.887 -10.611 1.00 18.11 O ATOM 2281 CB PHE B 37 12.070 58.435 -11.772 1.00 16.36 C ATOM 2282 CG PHE B 37 13.149 59.501 -11.752 1.00 16.05 C ATOM 2283 CD1 PHE B 37 12.822 60.839 -11.513 1.00 14.84 C ATOM 2284 CD2 PHE B 37 14.486 59.160 -11.904 1.00 14.25 C ATOM 2285 CE1 PHE B 37 13.818 61.816 -11.429 1.00 13.47 C ATOM 2286 CE2 PHE B 37 15.485 60.130 -11.824 1.00 15.39 C ATOM 2287 CZ PHE B 37 15.146 61.461 -11.581 1.00 14.05 C ATOM 2288 HA PHE B 37 10.920 59.099 -10.080 1.00 0.00 H ATOM 2289 HB2 PHE B 37 12.513 57.502 -12.119 1.00 0.00 H ATOM 2290 HB3 PHE B 37 11.290 58.746 -12.467 1.00 0.00 H ATOM 2291 HD2 PHE B 37 14.759 58.121 -12.088 1.00 0.00 H ATOM 2292 HE2 PHE B 37 16.530 59.848 -11.951 1.00 0.00 H ATOM 2293 HZ PHE B 37 15.926 62.219 -11.511 1.00 0.00 H ATOM 2294 HE1 PHE B 37 13.549 62.856 -11.244 1.00 0.00 H ATOM 2295 HD1 PHE B 37 11.777 61.124 -11.391 1.00 0.00 H ATOM 2296 H PHE B 37 13.044 57.002 -9.563 1.00 0.00 H ATOM 2297 N TYR B 38 9.125 57.424 -10.392 1.00 15.65 N ATOM 2298 CA TYR B 38 8.024 56.471 -10.433 1.00 17.08 C ATOM 2299 C TYR B 38 6.966 57.017 -11.362 1.00 16.50 C ATOM 2300 O TYR B 38 6.969 58.195 -11.672 1.00 15.66 O ATOM 2301 CB TYR B 38 7.436 56.270 -9.022 1.00 15.79 C ATOM 2302 CG TYR B 38 8.475 55.851 -8.001 1.00 16.25 C ATOM 2303 CD1 TYR B 38 8.825 54.502 -7.830 1.00 15.13 C ATOM 2304 CD2 TYR B 38 9.170 56.811 -7.255 1.00 14.76 C ATOM 2305 CE1 TYR B 38 9.848 54.119 -6.933 1.00 16.06 C ATOM 2306 CE2 TYR B 38 10.195 56.441 -6.358 1.00 16.42 C ATOM 2307 CZ TYR B 38 10.536 55.104 -6.211 1.00 17.30 C ATOM 2308 OH TYR B 38 11.575 54.768 -5.371 1.00 17.33 O ATOM 2309 HA TYR B 38 8.380 55.505 -10.791 1.00 0.00 H ATOM 2310 HB3 TYR B 38 6.667 55.499 -9.072 1.00 0.00 H ATOM 2311 HB2 TYR B 38 6.987 57.208 -8.696 1.00 0.00 H ATOM 2312 HD2 TYR B 38 8.914 57.864 -7.369 1.00 0.00 H ATOM 2313 HE2 TYR B 38 10.718 57.204 -5.782 1.00 0.00 H ATOM 2314 HE1 TYR B 38 10.100 53.066 -6.804 1.00 0.00 H ATOM 2315 HD1 TYR B 38 8.298 53.736 -8.399 1.00 0.00 H ATOM 2316 HH TYR B 38 11.695 53.785 -5.373 1.00 0.00 H ATOM 2317 H TYR B 38 8.903 58.434 -10.282 1.00 0.00 H ATOM 2318 N LYS B 39 6.079 56.156 -11.845 1.00 20.63 N ATOM 2319 CA LYS B 39 5.023 56.608 -12.751 1.00 23.18 C ATOM 2320 C LYS B 39 3.959 57.374 -11.957 1.00 22.20 C ATOM 2321 O LYS B 39 3.385 58.345 -12.447 1.00 21.23 O ATOM 2322 CB LYS B 39 4.410 55.415 -13.520 1.00 26.66 C ATOM 2323 CG LYS B 39 3.532 55.801 -14.727 1.00 33.34 C ATOM 2324 CD LYS B 39 4.239 56.812 -15.676 1.00 36.12 C ATOM 2325 CE LYS B 39 3.349 57.228 -16.856 1.00 36.19 C ATOM 2326 NZ LYS B 39 3.813 58.511 -17.472 1.00 37.75 N ATOM 2327 HA LYS B 39 5.451 57.282 -13.493 1.00 0.00 H ATOM 2328 HB2 LYS B 39 5.226 54.790 -13.881 1.00 0.00 H ATOM 2329 HB3 LYS B 39 3.796 54.843 -12.824 1.00 0.00 H ATOM 2330 HG2 LYS B 39 3.295 54.899 -15.290 1.00 0.00 H ATOM 2331 HG3 LYS B 39 2.610 56.251 -14.360 1.00 0.00 H ATOM 2332 HD2 LYS B 39 4.503 57.702 -15.105 1.00 0.00 H ATOM 2333 HD3 LYS B 39 5.146 56.350 -16.067 1.00 0.00 H ATOM 2334 HE2 LYS B 39 2.327 57.356 -16.500 1.00 0.00 H ATOM 2335 HE3 LYS B 39 3.374 56.443 -17.612 1.00 0.00 H ATOM 2336 HZ1 LYS B 39 3.786 59.267 -16.758 1.00 0.00 H ATOM 2337 HZ2 LYS B 39 4.786 58.395 -17.820 1.00 0.00 H ATOM 2338 HZ3 LYS B 39 3.188 58.759 -18.265 1.00 0.00 H ATOM 2339 H LYS B 39 6.135 55.153 -11.577 1.00 0.00 H ATOM 2340 N ASP B 40 3.731 56.961 -10.712 1.00 21.36 N ATOM 2341 CA ASP B 40 2.746 57.622 -9.857 1.00 20.13 C ATOM 2342 C ASP B 40 3.041 57.362 -8.394 1.00 16.54 C ATOM 2343 O ASP B 40 3.980 56.645 -8.050 1.00 15.14 O ATOM 2344 CB ASP B 40 1.323 57.152 -10.195 1.00 21.32 C ATOM 2345 CG ASP B 40 1.219 55.638 -10.363 1.00 22.70 C ATOM 2346 OD1 ASP B 40 1.931 54.870 -9.671 1.00 23.79 O ATOM 2347 OD2 ASP B 40 0.422 55.211 -11.217 1.00 24.16 O ATOM 2348 HA ASP B 40 2.813 58.694 -10.043 1.00 0.00 H ATOM 2349 HB2 ASP B 40 0.655 57.459 -9.390 1.00 0.00 H ATOM 2350 HB3 ASP B 40 1.012 57.627 -11.125 1.00 0.00 H ATOM 2351 H ASP B 40 4.265 56.150 -10.339 1.00 0.00 H ATOM 2352 N ALA B 41 2.210 57.929 -7.539 1.00 14.54 N ATOM 2353 CA ALA B 41 2.365 57.770 -6.115 1.00 16.78 C ATOM 2354 C ALA B 41 2.266 56.302 -5.688 1.00 19.08 C ATOM 2355 O ALA B 41 3.031 55.838 -4.823 1.00 20.33 O ATOM 2356 CB ALA B 41 1.340 58.605 -5.401 1.00 15.61 C ATOM 2357 HA ALA B 41 3.363 58.111 -5.841 1.00 0.00 H ATOM 2358 HB1 ALA B 41 1.478 59.653 -5.667 1.00 0.00 H ATOM 2359 HB2 ALA B 41 0.341 58.283 -5.696 1.00 0.00 H ATOM 2360 HB3 ALA B 41 1.460 58.483 -4.324 1.00 0.00 H ATOM 2361 H ALA B 41 1.424 58.505 -7.902 1.00 0.00 H ATOM 2362 N LYS B 42 1.341 55.557 -6.288 1.00 18.12 N ATOM 2363 CA LYS B 42 1.199 54.166 -5.928 1.00 18.10 C ATOM 2364 C LYS B 42 2.415 53.320 -6.275 1.00 18.56 C ATOM 2365 O LYS B 42 2.819 52.466 -5.487 1.00 20.23 O ATOM 2366 CB LYS B 42 -0.093 53.593 -6.481 1.00 21.88 C ATOM 2367 CG LYS B 42 -1.079 53.271 -5.364 1.00 27.22 C ATOM 2368 CD LYS B 42 -0.751 51.929 -4.626 1.00 33.40 C ATOM 2369 CE LYS B 42 0.268 52.011 -3.451 1.00 35.50 C ATOM 2370 NZ LYS B 42 1.295 50.916 -3.602 1.00 34.21 N ATOM 2371 HA LYS B 42 1.139 54.127 -4.840 1.00 0.00 H ATOM 2372 HB2 LYS B 42 -0.545 54.321 -7.155 1.00 0.00 H ATOM 2373 HB3 LYS B 42 0.131 52.679 -7.032 1.00 0.00 H ATOM 2374 HG2 LYS B 42 -1.057 54.082 -4.636 1.00 0.00 H ATOM 2375 HG3 LYS B 42 -2.078 53.197 -5.793 1.00 0.00 H ATOM 2376 HD2 LYS B 42 -1.685 51.534 -4.227 1.00 0.00 H ATOM 2377 HD3 LYS B 42 -0.350 51.235 -5.364 1.00 0.00 H ATOM 2378 HE2 LYS B 42 -0.258 51.889 -2.504 1.00 0.00 H ATOM 2379 HE3 LYS B 42 0.765 52.981 -3.467 1.00 0.00 H ATOM 2380 HZ1 LYS B 42 0.819 49.991 -3.586 1.00 0.00 H ATOM 2381 HZ2 LYS B 42 1.796 51.034 -4.506 1.00 0.00 H ATOM 2382 HZ3 LYS B 42 1.976 50.970 -2.818 1.00 0.00 H ATOM 2383 H LYS B 42 0.723 55.975 -7.013 1.00 0.00 H ATOM 2384 N SER B 43 3.061 53.610 -7.397 1.00 16.34 N ATOM 2385 CA SER B 43 4.240 52.862 -7.776 1.00 16.97 C ATOM 2386 C SER B 43 5.365 53.213 -6.838 1.00 14.59 C ATOM 2387 O SER B 43 6.224 52.392 -6.557 1.00 17.30 O ATOM 2388 CB SER B 43 4.642 53.183 -9.206 1.00 19.66 C ATOM 2389 OG SER B 43 3.596 52.821 -10.085 1.00 26.94 O ATOM 2390 HA SER B 43 4.022 51.796 -7.714 1.00 0.00 H ATOM 2391 HB2 SER B 43 5.542 52.625 -9.464 1.00 0.00 H ATOM 2392 HB3 SER B 43 4.839 54.251 -9.297 1.00 0.00 H ATOM 2393 HG SER B 43 2.779 53.328 -9.850 1.00 0.00 H ATOM 2394 H SER B 43 2.718 54.379 -8.007 1.00 0.00 H ATOM 2395 N ALA B 44 5.337 54.426 -6.314 1.00 14.94 N ATOM 2396 CA ALA B 44 6.370 54.879 -5.394 1.00 15.23 C ATOM 2397 C ALA B 44 6.337 54.089 -4.076 1.00 14.67 C ATOM 2398 O ALA B 44 7.380 53.659 -3.570 1.00 16.26 O ATOM 2399 CB ALA B 44 6.203 56.381 -5.131 1.00 15.63 C ATOM 2400 HA ALA B 44 7.342 54.701 -5.853 1.00 0.00 H ATOM 2401 HB1 ALA B 44 6.291 56.925 -6.071 1.00 0.00 H ATOM 2402 HB2 ALA B 44 5.222 56.565 -4.694 1.00 0.00 H ATOM 2403 HB3 ALA B 44 6.978 56.716 -4.442 1.00 0.00 H ATOM 2404 H ALA B 44 4.560 55.071 -6.564 1.00 0.00 H ATOM 2405 N ALA B 45 5.136 53.883 -3.541 1.00 15.77 N ATOM 2406 CA ALA B 45 4.952 53.154 -2.290 1.00 16.70 C ATOM 2407 C ALA B 45 5.288 51.682 -2.486 1.00 17.57 C ATOM 2408 O ALA B 45 5.791 51.025 -1.581 1.00 16.94 O ATOM 2409 CB ALA B 45 3.511 53.317 -1.796 1.00 16.32 C ATOM 2410 HA ALA B 45 5.626 53.564 -1.537 1.00 0.00 H ATOM 2411 HB1 ALA B 45 3.303 54.374 -1.630 1.00 0.00 H ATOM 2412 HB2 ALA B 45 2.825 52.923 -2.546 1.00 0.00 H ATOM 2413 HB3 ALA B 45 3.384 52.769 -0.862 1.00 0.00 H ATOM 2414 H ALA B 45 4.298 54.255 -4.032 1.00 0.00 H ATOM 2415 N SER B 46 5.073 51.185 -3.695 1.00 19.08 N ATOM 2416 CA SER B 46 5.336 49.789 -4.008 1.00 20.56 C ATOM 2417 C SER B 46 6.768 49.512 -4.422 1.00 20.15 C ATOM 2418 O SER B 46 7.216 48.374 -4.383 1.00 23.16 O ATOM 2419 CB SER B 46 4.397 49.309 -5.108 1.00 19.77 C ATOM 2420 OG SER B 46 3.047 49.485 -4.730 1.00 21.33 O ATOM 2421 HA SER B 46 5.161 49.241 -3.082 1.00 0.00 H ATOM 2422 HB2 SER B 46 4.580 48.251 -5.298 1.00 0.00 H ATOM 2423 HB3 SER B 46 4.591 49.879 -6.017 1.00 0.00 H ATOM 2424 HG SER B 46 2.866 48.966 -3.907 1.00 0.00 H ATOM 2425 H SER B 46 4.706 51.810 -4.441 1.00 0.00 H ATOM 2426 N GLY B 47 7.486 50.541 -4.843 1.00 21.38 N ATOM 2427 CA GLY B 47 8.871 50.361 -5.253 1.00 22.12 C ATOM 2428 C GLY B 47 9.091 49.962 -6.709 1.00 24.13 C ATOM 2429 O GLY B 47 10.132 49.399 -7.040 1.00 26.48 O ATOM 2430 HA3 GLY B 47 9.307 49.584 -4.625 1.00 0.00 H ATOM 2431 HA2 GLY B 47 9.395 51.302 -5.082 1.00 0.00 H ATOM 2432 H GLY B 47 7.056 51.487 -4.881 1.00 0.00 H ATOM 2433 N ILE B 48 8.107 50.224 -7.566 1.00 22.63 N ATOM 2434 CA ILE B 48 8.188 49.901 -8.996 1.00 25.22 C ATOM 2435 C ILE B 48 8.721 51.137 -9.734 1.00 23.75 C ATOM 2436 O ILE B 48 8.008 52.138 -9.878 1.00 23.64 O ATOM 2437 CB ILE B 48 6.786 49.519 -9.545 1.00 26.22 C ATOM 2438 CG1 ILE B 48 6.191 48.394 -8.689 1.00 26.12 C ATOM 2439 CG2 ILE B 48 6.896 49.074 -11.004 1.00 25.53 C ATOM 2440 CD1 ILE B 48 4.708 48.149 -8.907 1.00 27.86 C ATOM 2441 HA ILE B 48 8.854 49.051 -9.148 1.00 0.00 H ATOM 2442 HB ILE B 48 6.131 50.389 -9.498 1.00 0.00 H ATOM 2443 HG12 ILE B 48 6.725 47.472 -8.919 1.00 0.00 H ATOM 2444 HG13 ILE B 48 6.343 48.648 -7.640 1.00 0.00 H ATOM 2445 HD11 ILE B 48 4.152 49.056 -8.668 1.00 0.00 H ATOM 2446 HD12 ILE B 48 4.535 47.879 -9.949 1.00 0.00 H ATOM 2447 HD13 ILE B 48 4.376 47.337 -8.260 1.00 0.00 H ATOM 2448 HG21 ILE B 48 7.305 49.889 -11.601 1.00 0.00 H ATOM 2449 HG22 ILE B 48 7.555 48.208 -11.070 1.00 0.00 H ATOM 2450 HG23 ILE B 48 5.907 48.809 -11.377 1.00 0.00 H ATOM 2451 H ILE B 48 7.243 50.677 -7.207 1.00 0.00 H ATOM 2452 N PRO B 49 9.958 51.048 -10.264 1.00 23.06 N ATOM 2453 CA PRO B 49 10.676 52.106 -10.996 1.00 23.13 C ATOM 2454 C PRO B 49 10.015 52.607 -12.280 1.00 23.17 C ATOM 2455 O PRO B 49 9.346 51.845 -12.984 1.00 21.87 O ATOM 2456 CB PRO B 49 12.028 51.455 -11.260 1.00 23.81 C ATOM 2457 CG PRO B 49 11.656 50.050 -11.507 1.00 24.68 C ATOM 2458 CD PRO B 49 10.680 49.772 -10.378 1.00 24.29 C ATOM 2459 HA PRO B 49 10.712 53.027 -10.414 1.00 0.00 H ATOM 2460 HD3 PRO B 49 10.003 48.957 -10.633 1.00 0.00 H ATOM 2461 HD2 PRO B 49 11.204 49.531 -9.453 1.00 0.00 H ATOM 2462 HG3 PRO B 49 12.525 49.395 -11.449 1.00 0.00 H ATOM 2463 HG2 PRO B 49 11.179 49.933 -12.480 1.00 0.00 H ATOM 2464 HB2 PRO B 49 12.515 51.894 -12.131 1.00 0.00 H ATOM 2465 HB3 PRO B 49 12.685 51.544 -10.395 1.00 0.00 H ATOM 2466 N TYR B 50 10.242 53.886 -12.591 1.00 22.96 N ATOM 2467 CA TYR B 50 9.670 54.514 -13.768 1.00 25.35 C ATOM 2468 C TYR B 50 9.885 53.710 -15.040 1.00 29.13 C ATOM 2469 O TYR B 50 8.913 53.323 -15.684 1.00 34.08 O ATOM 2470 CB TYR B 50 10.167 55.949 -13.955 1.00 25.48 C ATOM 2471 CG TYR B 50 9.620 56.623 -15.207 1.00 22.92 C ATOM 2472 CD1 TYR B 50 8.251 56.687 -15.444 1.00 21.55 C ATOM 2473 CD2 TYR B 50 10.477 57.157 -16.165 1.00 22.68 C ATOM 2474 CE1 TYR B 50 7.753 57.252 -16.596 1.00 22.32 C ATOM 2475 CE2 TYR B 50 9.986 57.734 -17.327 1.00 23.05 C ATOM 2476 CZ TYR B 50 8.625 57.776 -17.539 1.00 23.04 C ATOM 2477 OH TYR B 50 8.146 58.329 -18.706 1.00 25.33 O ATOM 2478 HA TYR B 50 8.596 54.544 -13.583 1.00 0.00 H ATOM 2479 HB3 TYR B 50 11.255 55.932 -14.019 1.00 0.00 H ATOM 2480 HB2 TYR B 50 9.865 56.535 -13.087 1.00 0.00 H ATOM 2481 HD2 TYR B 50 11.554 57.121 -15.999 1.00 0.00 H ATOM 2482 HE2 TYR B 50 10.671 58.150 -18.066 1.00 0.00 H ATOM 2483 HE1 TYR B 50 6.677 57.288 -16.767 1.00 0.00 H ATOM 2484 HD1 TYR B 50 7.560 56.282 -14.704 1.00 0.00 H ATOM 2485 HH TYR B 50 8.502 57.824 -19.480 1.00 0.00 H ATOM 2486 H TYR B 50 10.851 54.453 -11.967 1.00 0.00 H ATOM 2487 N HIS B 51 11.121 53.515 -15.471 1.00 28.80 N ATOM 2488 CA HIS B 51 11.324 52.701 -16.680 1.00 29.41 C ATOM 2489 C HIS B 51 12.562 51.889 -16.427 1.00 28.44 C ATOM 2490 O HIS B 51 13.510 51.895 -17.205 1.00 27.12 O ATOM 2491 CB HIS B 51 11.452 53.572 -17.942 1.00 32.08 C ATOM 2492 CG HIS B 51 10.139 53.930 -18.569 1.00 33.72 C ATOM 2493 ND1 HIS B 51 9.982 54.990 -19.437 1.00 36.39 N ATOM 2494 CD2 HIS B 51 8.907 53.373 -18.447 1.00 35.91 C ATOM 2495 CE1 HIS B 51 8.718 55.075 -19.818 1.00 36.36 C ATOM 2496 NE2 HIS B 51 8.044 54.105 -19.232 1.00 34.98 N ATOM 2497 HA HIS B 51 10.466 52.056 -16.869 1.00 0.00 H ATOM 2498 HB2 HIS B 51 11.966 54.494 -17.672 1.00 0.00 H ATOM 2499 HB3 HIS B 51 12.046 53.028 -18.676 1.00 0.00 H ATOM 2500 HD2 HIS B 51 8.648 52.506 -17.839 1.00 0.00 H ATOM 2501 HE1 HIS B 51 8.305 55.819 -20.499 1.00 0.00 H ATOM 2502 H HIS B 51 11.931 53.928 -14.966 1.00 0.00 H ATOM 2503 N SER B 52 12.542 51.216 -15.283 1.00 27.96 N ATOM 2504 CA SER B 52 13.664 50.413 -14.823 1.00 30.52 C ATOM 2505 C SER B 52 14.829 51.357 -14.536 1.00 29.08 C ATOM 2506 O SER B 52 16.005 50.981 -14.576 1.00 29.75 O ATOM 2507 CB SER B 52 14.024 49.317 -15.837 1.00 32.92 C ATOM 2508 OG SER B 52 12.936 48.400 -15.987 1.00 36.03 O ATOM 2509 HA SER B 52 13.402 49.883 -13.908 1.00 0.00 H ATOM 2510 HB2 SER B 52 14.903 48.777 -15.486 1.00 0.00 H ATOM 2511 HB3 SER B 52 14.242 49.777 -16.801 1.00 0.00 H ATOM 2512 HG SER B 52 13.183 47.701 -16.643 1.00 0.00 H ATOM 2513 H SER B 52 11.688 51.265 -14.691 1.00 0.00 H ATOM 2514 N GLU B 53 14.471 52.596 -14.210 1.00 28.13 N ATOM 2515 CA GLU B 53 15.451 53.613 -13.878 1.00 29.01 C ATOM 2516 C GLU B 53 15.924 53.326 -12.464 1.00 27.67 C ATOM 2517 O GLU B 53 15.158 52.800 -11.658 1.00 29.41 O ATOM 2518 CB GLU B 53 14.811 55.002 -13.922 1.00 29.49 C ATOM 2519 CG GLU B 53 14.062 55.278 -15.204 1.00 34.26 C ATOM 2520 CD GLU B 53 14.147 56.728 -15.667 1.00 35.62 C ATOM 2521 OE1 GLU B 53 14.695 57.583 -14.933 1.00 35.05 O ATOM 2522 OE2 GLU B 53 13.662 57.006 -16.791 1.00 37.64 O ATOM 2523 HA GLU B 53 16.277 53.594 -14.589 1.00 0.00 H ATOM 2524 HB2 GLU B 53 14.113 55.088 -13.089 1.00 0.00 H ATOM 2525 HB3 GLU B 53 15.598 55.749 -13.814 1.00 0.00 H ATOM 2526 HG2 GLU B 53 14.475 54.642 -15.987 1.00 0.00 H ATOM 2527 HG3 GLU B 53 13.012 55.027 -15.050 1.00 0.00 H ATOM 2528 H GLU B 53 13.461 52.842 -14.193 1.00 0.00 H ATOM 2529 N VAL B 54 17.181 53.638 -12.172 1.00 26.06 N ATOM 2530 CA VAL B 54 17.732 53.437 -10.834 1.00 25.17 C ATOM 2531 C VAL B 54 17.740 54.814 -10.175 1.00 24.79 C ATOM 2532 O VAL B 54 17.879 55.823 -10.861 1.00 25.45 O ATOM 2533 CB VAL B 54 19.185 52.923 -10.912 1.00 26.01 C ATOM 2534 CG1 VAL B 54 20.100 54.004 -11.473 1.00 26.67 C ATOM 2535 CG2 VAL B 54 19.676 52.481 -9.547 1.00 28.35 C ATOM 2536 HA VAL B 54 17.143 52.706 -10.281 1.00 0.00 H ATOM 2537 HB VAL B 54 19.205 52.062 -11.580 1.00 0.00 H ATOM 2538 HG11 VAL B 54 19.765 54.278 -12.473 1.00 0.00 H ATOM 2539 HG12 VAL B 54 20.066 54.879 -10.824 1.00 0.00 H ATOM 2540 HG13 VAL B 54 21.121 53.625 -11.521 1.00 0.00 H ATOM 2541 HG21 VAL B 54 19.638 53.325 -8.858 1.00 0.00 H ATOM 2542 HG22 VAL B 54 19.039 51.678 -9.176 1.00 0.00 H ATOM 2543 HG23 VAL B 54 20.702 52.123 -9.630 1.00 0.00 H ATOM 2544 H VAL B 54 17.790 54.036 -12.916 1.00 0.00 H ATOM 2545 N PRO B 55 17.503 54.894 -8.862 1.00 24.84 N ATOM 2546 CA PRO B 55 17.519 56.207 -8.211 1.00 22.98 C ATOM 2547 C PRO B 55 18.898 56.830 -8.386 1.00 21.20 C ATOM 2548 O PRO B 55 19.907 56.126 -8.400 1.00 22.11 O ATOM 2549 CB PRO B 55 17.280 55.860 -6.748 1.00 23.17 C ATOM 2550 CG PRO B 55 16.410 54.676 -6.838 1.00 24.46 C ATOM 2551 CD PRO B 55 17.076 53.852 -7.911 1.00 24.48 C ATOM 2552 HA PRO B 55 16.790 56.914 -8.608 1.00 0.00 H ATOM 2553 HD3 PRO B 55 17.929 53.299 -7.517 1.00 0.00 H ATOM 2554 HD2 PRO B 55 16.375 53.156 -8.371 1.00 0.00 H ATOM 2555 HG3 PRO B 55 15.397 54.954 -7.128 1.00 0.00 H ATOM 2556 HG2 PRO B 55 16.380 54.137 -5.891 1.00 0.00 H ATOM 2557 HB2 PRO B 55 18.216 55.624 -6.241 1.00 0.00 H ATOM 2558 HB3 PRO B 55 16.781 56.677 -6.226 1.00 0.00 H ATOM 2559 N VAL B 56 18.953 58.143 -8.515 1.00 19.54 N ATOM 2560 CA VAL B 56 20.229 58.789 -8.701 1.00 18.42 C ATOM 2561 C VAL B 56 20.642 59.550 -7.453 1.00 18.28 C ATOM 2562 O VAL B 56 19.791 60.068 -6.731 1.00 16.44 O ATOM 2563 CB VAL B 56 20.218 59.705 -9.940 1.00 19.27 C ATOM 2564 CG1 VAL B 56 19.272 60.880 -9.751 1.00 17.47 C ATOM 2565 CG2 VAL B 56 21.633 60.163 -10.239 1.00 23.80 C ATOM 2566 HA VAL B 56 20.973 58.012 -8.877 1.00 0.00 H ATOM 2567 HB VAL B 56 19.846 59.143 -10.796 1.00 0.00 H ATOM 2568 HG11 VAL B 56 18.261 60.508 -9.586 1.00 0.00 H ATOM 2569 HG12 VAL B 56 19.590 61.466 -8.889 1.00 0.00 H ATOM 2570 HG13 VAL B 56 19.289 61.506 -10.643 1.00 0.00 H ATOM 2571 HG21 VAL B 56 22.024 60.712 -9.383 1.00 0.00 H ATOM 2572 HG22 VAL B 56 22.261 59.294 -10.433 1.00 0.00 H ATOM 2573 HG23 VAL B 56 21.626 60.811 -11.115 1.00 0.00 H ATOM 2574 H VAL B 56 18.081 58.708 -8.483 1.00 0.00 H ATOM 2575 N SER B 57 21.948 59.572 -7.186 1.00 18.25 N ATOM 2576 CA SER B 57 22.498 60.260 -6.023 1.00 16.65 C ATOM 2577 C SER B 57 22.507 61.767 -6.244 1.00 17.60 C ATOM 2578 O SER B 57 22.809 62.238 -7.335 1.00 19.78 O ATOM 2579 CB SER B 57 23.909 59.750 -5.744 1.00 16.33 C ATOM 2580 OG SER B 57 24.579 60.546 -4.785 1.00 17.05 O ATOM 2581 HA SER B 57 21.868 60.051 -5.158 1.00 0.00 H ATOM 2582 HB2 SER B 57 24.479 59.763 -6.673 1.00 0.00 H ATOM 2583 HB3 SER B 57 23.847 58.727 -5.372 1.00 0.00 H ATOM 2584 HG SER B 57 25.487 60.183 -4.633 1.00 0.00 H ATOM 2585 H SER B 57 22.599 59.080 -7.831 1.00 0.00 H ATOM 2586 N LEU B 58 22.169 62.517 -5.205 1.00 16.27 N ATOM 2587 CA LEU B 58 22.135 63.967 -5.271 1.00 15.95 C ATOM 2588 C LEU B 58 23.397 64.574 -4.656 1.00 16.64 C ATOM 2589 O LEU B 58 23.507 65.789 -4.506 1.00 13.84 O ATOM 2590 CB LEU B 58 20.879 64.484 -4.577 1.00 15.46 C ATOM 2591 CG LEU B 58 19.541 64.003 -5.156 1.00 14.17 C ATOM 2592 CD1 LEU B 58 18.436 64.517 -4.253 1.00 14.15 C ATOM 2593 CD2 LEU B 58 19.328 64.487 -6.588 1.00 12.42 C ATOM 2594 HA LEU B 58 22.106 64.272 -6.317 1.00 0.00 H ATOM 2595 HB2 LEU B 58 20.922 64.172 -3.534 1.00 0.00 H ATOM 2596 HB3 LEU B 58 20.893 65.573 -4.630 1.00 0.00 H ATOM 2597 HG LEU B 58 19.537 62.914 -5.195 1.00 0.00 H ATOM 2598 HD21 LEU B 58 19.335 65.577 -6.607 1.00 0.00 H ATOM 2599 HD22 LEU B 58 20.129 64.107 -7.222 1.00 0.00 H ATOM 2600 HD23 LEU B 58 18.369 64.122 -6.955 1.00 0.00 H ATOM 2601 HD11 LEU B 58 18.578 64.123 -3.247 1.00 0.00 H ATOM 2602 HD12 LEU B 58 18.468 65.606 -4.226 1.00 0.00 H ATOM 2603 HD13 LEU B 58 17.471 64.190 -4.640 1.00 0.00 H ATOM 2604 H LEU B 58 21.919 62.050 -4.310 1.00 0.00 H ATOM 2605 N LYS B 59 24.355 63.703 -4.339 1.00 20.39 N ATOM 2606 CA LYS B 59 25.659 64.080 -3.781 1.00 21.12 C ATOM 2607 C LYS B 59 26.390 64.990 -4.756 1.00 21.34 C ATOM 2608 O LYS B 59 26.658 64.590 -5.884 1.00 20.65 O ATOM 2609 CB LYS B 59 26.511 62.829 -3.547 1.00 25.50 C ATOM 2610 CG LYS B 59 26.728 62.469 -2.090 1.00 31.56 C ATOM 2611 CD LYS B 59 28.215 62.560 -1.709 1.00 36.04 C ATOM 2612 CE LYS B 59 28.753 63.988 -1.891 1.00 38.73 C ATOM 2613 NZ LYS B 59 30.194 64.176 -1.524 1.00 41.32 N ATOM 2614 HA LYS B 59 25.497 64.598 -2.835 1.00 0.00 H ATOM 2615 HB2 LYS B 59 26.019 61.987 -4.035 1.00 0.00 H ATOM 2616 HB3 LYS B 59 27.487 62.993 -4.005 1.00 0.00 H ATOM 2617 HG2 LYS B 59 26.158 63.157 -1.465 1.00 0.00 H ATOM 2618 HG3 LYS B 59 26.379 61.451 -1.919 1.00 0.00 H ATOM 2619 HD2 LYS B 59 28.333 62.266 -0.666 1.00 0.00 H ATOM 2620 HD3 LYS B 59 28.786 61.882 -2.343 1.00 0.00 H ATOM 2621 HE2 LYS B 59 28.156 64.656 -1.270 1.00 0.00 H ATOM 2622 HE3 LYS B 59 28.632 64.264 -2.939 1.00 0.00 H ATOM 2623 HZ1 LYS B 59 30.330 63.932 -0.522 1.00 0.00 H ATOM 2624 HZ2 LYS B 59 30.785 63.558 -2.116 1.00 0.00 H ATOM 2625 HZ3 LYS B 59 30.464 65.168 -1.680 1.00 0.00 H ATOM 2626 H LYS B 59 24.166 62.693 -4.497 1.00 0.00 H ATOM 2627 N GLU B 60 26.675 66.217 -4.329 1.00 22.04 N ATOM 2628 CA GLU B 60 27.385 67.193 -5.152 1.00 25.74 C ATOM 2629 C GLU B 60 26.644 67.539 -6.441 1.00 24.68 C ATOM 2630 O GLU B 60 27.268 67.775 -7.482 1.00 25.77 O ATOM 2631 CB GLU B 60 28.798 66.708 -5.513 1.00 30.20 C ATOM 2632 CG GLU B 60 29.834 66.802 -4.414 1.00 35.53 C ATOM 2633 CD GLU B 60 31.250 66.568 -4.943 1.00 40.25 C ATOM 2634 OE1 GLU B 60 31.612 65.399 -5.227 1.00 41.32 O ATOM 2635 OE2 GLU B 60 32.007 67.565 -5.086 1.00 43.60 O ATOM 2636 HA GLU B 60 27.447 68.092 -4.539 1.00 0.00 H ATOM 2637 HB2 GLU B 60 28.725 65.663 -5.814 1.00 0.00 H ATOM 2638 HB3 GLU B 60 29.150 67.304 -6.355 1.00 0.00 H ATOM 2639 HG2 GLU B 60 29.784 67.795 -3.966 1.00 0.00 H ATOM 2640 HG3 GLU B 60 29.612 66.051 -3.655 1.00 0.00 H ATOM 2641 H GLU B 60 26.380 66.493 -3.370 1.00 0.00 H ATOM 2642 N ALA B 61 25.320 67.597 -6.370 1.00 22.56 N ATOM 2643 CA ALA B 61 24.505 67.921 -7.534 1.00 18.68 C ATOM 2644 C ALA B 61 24.372 69.427 -7.644 1.00 19.21 C ATOM 2645 O ALA B 61 24.458 70.136 -6.650 1.00 20.03 O ATOM 2646 CB ALA B 61 23.134 67.297 -7.389 1.00 16.84 C ATOM 2647 HA ALA B 61 24.980 67.529 -8.433 1.00 0.00 H ATOM 2648 HB1 ALA B 61 23.235 66.215 -7.309 1.00 0.00 H ATOM 2649 HB2 ALA B 61 22.653 67.685 -6.492 1.00 0.00 H ATOM 2650 HB3 ALA B 61 22.530 67.543 -8.262 1.00 0.00 H ATOM 2651 H ALA B 61 24.852 67.406 -5.461 1.00 0.00 H ATOM 2652 N ILE B 62 24.203 69.920 -8.861 1.00 18.06 N ATOM 2653 CA ILE B 62 24.007 71.344 -9.088 1.00 17.86 C ATOM 2654 C ILE B 62 22.543 71.472 -9.482 1.00 17.24 C ATOM 2655 O ILE B 62 22.080 70.779 -10.377 1.00 16.24 O ATOM 2656 CB ILE B 62 24.945 71.857 -10.214 1.00 20.09 C ATOM 2657 CG1 ILE B 62 26.400 71.848 -9.700 1.00 21.20 C ATOM 2658 CG2 ILE B 62 24.501 73.245 -10.724 1.00 22.24 C ATOM 2659 CD1 ILE B 62 27.449 71.770 -10.773 1.00 21.87 C ATOM 2660 HA ILE B 62 24.244 71.943 -8.209 1.00 0.00 H ATOM 2661 HB ILE B 62 24.884 71.191 -11.075 1.00 0.00 H ATOM 2662 HG12 ILE B 62 26.564 72.763 -9.131 1.00 0.00 H ATOM 2663 HG13 ILE B 62 26.522 70.987 -9.043 1.00 0.00 H ATOM 2664 HD11 ILE B 62 27.313 70.853 -11.346 1.00 0.00 H ATOM 2665 HD12 ILE B 62 27.355 72.631 -11.435 1.00 0.00 H ATOM 2666 HD13 ILE B 62 28.437 71.769 -10.314 1.00 0.00 H ATOM 2667 HG21 ILE B 62 23.487 73.178 -11.119 1.00 0.00 H ATOM 2668 HG22 ILE B 62 24.525 73.958 -9.900 1.00 0.00 H ATOM 2669 HG23 ILE B 62 25.179 73.575 -11.511 1.00 0.00 H ATOM 2670 H ILE B 62 24.211 69.273 -9.675 1.00 0.00 H ATOM 2671 N CYS B 63 21.805 72.302 -8.759 1.00 17.28 N ATOM 2672 CA CYS B 63 20.385 72.514 -9.022 1.00 18.72 C ATOM 2673 C CYS B 63 20.096 74.017 -9.033 1.00 18.16 C ATOM 2674 O CYS B 63 20.470 74.731 -8.101 1.00 18.74 O ATOM 2675 CB CYS B 63 19.559 71.831 -7.932 1.00 21.64 C ATOM 2676 SG CYS B 63 17.792 71.843 -8.219 1.00 24.53 S ATOM 2677 HA CYS B 63 20.119 72.088 -9.989 1.00 0.00 H ATOM 2678 HB2 CYS B 63 19.754 72.340 -6.988 1.00 0.00 H ATOM 2679 HB3 CYS B 63 19.885 70.793 -7.858 1.00 0.00 H ATOM 2680 HG CYS B 63 17.154 71.203 -7.176 1.00 0.00 H ATOM 2681 H CYS B 63 22.253 72.820 -7.977 1.00 0.00 H ATOM 2682 N GLU B 64 19.441 74.510 -10.079 1.00 18.03 N ATOM 2683 CA GLU B 64 19.162 75.943 -10.168 1.00 17.98 C ATOM 2684 C GLU B 64 18.052 76.248 -11.158 1.00 20.43 C ATOM 2685 O GLU B 64 17.642 75.366 -11.910 1.00 21.20 O ATOM 2686 CB GLU B 64 20.425 76.680 -10.606 1.00 20.21 C ATOM 2687 CG GLU B 64 20.994 76.182 -11.921 1.00 23.44 C ATOM 2688 CD GLU B 64 22.355 76.790 -12.252 1.00 28.17 C ATOM 2689 OE1 GLU B 64 23.108 77.162 -11.316 1.00 30.32 O ATOM 2690 OE2 GLU B 64 22.684 76.881 -13.457 1.00 27.85 O ATOM 2691 HA GLU B 64 18.839 76.276 -9.181 1.00 0.00 H ATOM 2692 HB2 GLU B 64 20.187 77.738 -10.712 1.00 0.00 H ATOM 2693 HB3 GLU B 64 21.183 76.555 -9.833 1.00 0.00 H ATOM 2694 HG2 GLU B 64 21.102 75.099 -11.865 1.00 0.00 H ATOM 2695 HG3 GLU B 64 20.297 76.436 -12.720 1.00 0.00 H ATOM 2696 H GLU B 64 19.125 73.873 -10.838 1.00 0.00 H ATOM 2697 N VAL B 65 17.553 77.488 -11.149 1.00 19.27 N ATOM 2698 CA VAL B 65 16.507 77.904 -12.090 1.00 19.89 C ATOM 2699 C VAL B 65 17.093 77.904 -13.509 1.00 18.94 C ATOM 2700 O VAL B 65 18.213 78.366 -13.739 1.00 17.30 O ATOM 2701 CB VAL B 65 15.914 79.309 -11.733 1.00 20.55 C ATOM 2702 CG1 VAL B 65 16.969 80.388 -11.816 1.00 21.04 C ATOM 2703 CG2 VAL B 65 14.779 79.653 -12.660 1.00 19.30 C ATOM 2704 HA VAL B 65 15.681 77.196 -12.027 1.00 0.00 H ATOM 2705 HB VAL B 65 15.546 79.257 -10.708 1.00 0.00 H ATOM 2706 HG11 VAL B 65 17.773 80.163 -11.116 1.00 0.00 H ATOM 2707 HG12 VAL B 65 17.368 80.427 -12.830 1.00 0.00 H ATOM 2708 HG13 VAL B 65 16.524 81.350 -11.562 1.00 0.00 H ATOM 2709 HG21 VAL B 65 15.144 79.672 -13.687 1.00 0.00 H ATOM 2710 HG22 VAL B 65 13.994 78.902 -12.566 1.00 0.00 H ATOM 2711 HG23 VAL B 65 14.380 80.633 -12.396 1.00 0.00 H ATOM 2712 H VAL B 65 17.915 78.175 -10.458 1.00 0.00 H ATOM 2713 N ALA B 66 16.357 77.333 -14.448 1.00 19.03 N ATOM 2714 CA ALA B 66 16.814 77.263 -15.822 1.00 19.91 C ATOM 2715 C ALA B 66 16.413 78.532 -16.574 1.00 22.57 C ATOM 2716 O ALA B 66 15.405 78.539 -17.269 1.00 24.39 O ATOM 2717 CB ALA B 66 16.219 76.034 -16.492 1.00 17.73 C ATOM 2718 HA ALA B 66 17.901 77.184 -15.839 1.00 0.00 H ATOM 2719 HB1 ALA B 66 16.538 75.140 -15.956 1.00 0.00 H ATOM 2720 HB2 ALA B 66 15.131 76.102 -16.473 1.00 0.00 H ATOM 2721 HB3 ALA B 66 16.563 75.982 -17.525 1.00 0.00 H ATOM 2722 H ALA B 66 15.433 76.927 -14.196 1.00 0.00 H ATOM 2723 N LEU B 67 17.183 79.608 -16.399 1.00 27.18 N ATOM 2724 CA LEU B 67 16.926 80.902 -17.064 1.00 30.15 C ATOM 2725 C LEU B 67 17.096 80.757 -18.565 1.00 30.21 C ATOM 2726 O LEU B 67 16.354 81.340 -19.359 1.00 31.74 O ATOM 2727 CB LEU B 67 17.936 81.963 -16.604 1.00 32.67 C ATOM 2728 CG LEU B 67 17.872 82.644 -15.238 1.00 33.66 C ATOM 2729 CD1 LEU B 67 19.194 82.462 -14.541 1.00 34.94 C ATOM 2730 CD2 LEU B 67 17.581 84.127 -15.416 1.00 34.74 C ATOM 2731 HA LEU B 67 15.911 81.204 -16.806 1.00 0.00 H ATOM 2732 HB2 LEU B 67 18.915 81.486 -16.655 1.00 0.00 H ATOM 2733 HB3 LEU B 67 17.884 82.765 -17.341 1.00 0.00 H ATOM 2734 HG LEU B 67 17.077 82.199 -14.640 1.00 0.00 H ATOM 2735 HD21 LEU B 67 18.373 84.583 -16.010 1.00 0.00 H ATOM 2736 HD22 LEU B 67 16.626 84.250 -15.926 1.00 0.00 H ATOM 2737 HD23 LEU B 67 17.537 84.607 -14.438 1.00 0.00 H ATOM 2738 HD11 LEU B 67 19.393 81.398 -14.414 1.00 0.00 H ATOM 2739 HD12 LEU B 67 19.985 82.912 -15.141 1.00 0.00 H ATOM 2740 HD13 LEU B 67 19.158 82.945 -13.565 1.00 0.00 H ATOM 2741 H LEU B 67 18.003 79.532 -15.764 1.00 0.00 H ATOM 2742 N ASP B 68 18.143 80.028 -18.927 1.00 29.13 N ATOM 2743 CA ASP B 68 18.486 79.758 -20.308 1.00 29.04 C ATOM 2744 C ASP B 68 17.409 78.983 -21.064 1.00 27.97 C ATOM 2745 O ASP B 68 17.325 79.079 -22.283 1.00 30.53 O ATOM 2746 CB ASP B 68 19.838 79.030 -20.369 1.00 31.62 C ATOM 2747 CG ASP B 68 19.872 77.724 -19.539 1.00 31.93 C ATOM 2748 OD1 ASP B 68 18.909 77.398 -18.821 1.00 34.02 O ATOM 2749 OD2 ASP B 68 20.884 77.002 -19.622 1.00 33.00 O ATOM 2750 HA ASP B 68 18.561 80.720 -20.815 1.00 0.00 H ATOM 2751 HB2 ASP B 68 20.052 78.784 -21.409 1.00 0.00 H ATOM 2752 HB3 ASP B 68 20.609 79.701 -19.990 1.00 0.00 H ATOM 2753 H ASP B 68 18.749 79.630 -18.181 1.00 0.00 H ATOM 2754 N TYR B 69 16.610 78.186 -20.362 1.00 23.97 N ATOM 2755 CA TYR B 69 15.555 77.452 -21.042 1.00 24.92 C ATOM 2756 C TYR B 69 14.345 78.372 -21.106 1.00 26.43 C ATOM 2757 O TYR B 69 13.792 78.774 -20.086 1.00 28.36 O ATOM 2758 CB TYR B 69 15.210 76.153 -20.327 1.00 21.51 C ATOM 2759 CG TYR B 69 14.175 75.336 -21.073 1.00 20.27 C ATOM 2760 CD1 TYR B 69 14.542 74.493 -22.121 1.00 19.42 C ATOM 2761 CD2 TYR B 69 12.832 75.396 -20.723 1.00 17.78 C ATOM 2762 CE1 TYR B 69 13.575 73.723 -22.795 1.00 19.52 C ATOM 2763 CE2 TYR B 69 11.879 74.645 -21.384 1.00 17.84 C ATOM 2764 CZ TYR B 69 12.250 73.813 -22.417 1.00 18.06 C ATOM 2765 OH TYR B 69 11.288 73.106 -23.092 1.00 19.50 O ATOM 2766 HA TYR B 69 15.886 77.166 -22.041 1.00 0.00 H ATOM 2767 HB3 TYR B 69 14.820 76.391 -19.337 1.00 0.00 H ATOM 2768 HB2 TYR B 69 16.118 75.558 -20.225 1.00 0.00 H ATOM 2769 HD2 TYR B 69 12.523 76.051 -19.908 1.00 0.00 H ATOM 2770 HE2 TYR B 69 10.832 74.711 -21.088 1.00 0.00 H ATOM 2771 HE1 TYR B 69 13.870 73.061 -23.609 1.00 0.00 H ATOM 2772 HD1 TYR B 69 15.588 74.429 -22.422 1.00 0.00 H ATOM 2773 HH TYR B 69 11.716 72.560 -23.799 1.00 0.00 H ATOM 2774 H TYR B 69 16.738 78.088 -19.335 1.00 0.00 H ATOM 2775 N LYS B 70 13.897 78.649 -22.317 1.00 28.52 N ATOM 2776 CA LYS B 70 12.797 79.573 -22.500 1.00 30.62 C ATOM 2777 C LYS B 70 11.527 78.991 -23.094 1.00 28.94 C ATOM 2778 O LYS B 70 10.524 79.687 -23.217 1.00 31.55 O ATOM 2779 CB LYS B 70 13.275 80.746 -23.357 1.00 34.43 C ATOM 2780 CG LYS B 70 14.623 81.304 -22.909 1.00 37.28 C ATOM 2781 CD LYS B 70 14.960 82.616 -23.592 1.00 40.55 C ATOM 2782 CE LYS B 70 16.283 83.163 -23.092 1.00 42.82 C ATOM 2783 NZ LYS B 70 16.522 84.531 -23.629 1.00 46.53 N ATOM 2784 HA LYS B 70 12.510 79.883 -21.495 1.00 0.00 H ATOM 2785 HB2 LYS B 70 13.365 80.408 -24.389 1.00 0.00 H ATOM 2786 HB3 LYS B 70 12.533 81.543 -23.300 1.00 0.00 H ATOM 2787 HG2 LYS B 70 14.595 81.467 -21.832 1.00 0.00 H ATOM 2788 HG3 LYS B 70 15.400 80.576 -23.145 1.00 0.00 H ATOM 2789 HD2 LYS B 70 15.025 82.452 -24.668 1.00 0.00 H ATOM 2790 HD3 LYS B 70 14.172 83.340 -23.383 1.00 0.00 H ATOM 2791 HE2 LYS B 70 17.089 82.505 -23.417 1.00 0.00 H ATOM 2792 HE3 LYS B 70 16.265 83.204 -22.003 1.00 0.00 H ATOM 2793 HZ1 LYS B 70 16.543 84.495 -24.668 1.00 0.00 H ATOM 2794 HZ2 LYS B 70 15.757 85.163 -23.318 1.00 0.00 H ATOM 2795 HZ3 LYS B 70 17.433 84.887 -23.275 1.00 0.00 H ATOM 2796 H LYS B 70 14.337 78.200 -23.145 1.00 0.00 H ATOM 2797 N LYS B 71 11.548 77.720 -23.448 1.00 27.22 N ATOM 2798 CA LYS B 71 10.369 77.139 -24.038 1.00 27.43 C ATOM 2799 C LYS B 71 9.228 76.993 -23.048 1.00 27.35 C ATOM 2800 O LYS B 71 8.098 76.732 -23.433 1.00 30.43 O ATOM 2801 CB LYS B 71 10.705 75.814 -24.717 1.00 28.44 C ATOM 2802 CG LYS B 71 11.759 75.952 -25.823 1.00 30.61 C ATOM 2803 CD LYS B 71 11.860 74.666 -26.644 1.00 33.20 C ATOM 2804 CE LYS B 71 13.101 74.621 -27.539 1.00 33.64 C ATOM 2805 NZ LYS B 71 13.159 75.684 -28.597 1.00 35.15 N ATOM 2806 HA LYS B 71 10.015 77.833 -24.801 1.00 0.00 H ATOM 2807 HB2 LYS B 71 11.082 75.124 -23.963 1.00 0.00 H ATOM 2808 HB3 LYS B 71 9.793 75.408 -25.155 1.00 0.00 H ATOM 2809 HG2 LYS B 71 11.480 76.775 -26.481 1.00 0.00 H ATOM 2810 HG3 LYS B 71 12.727 76.163 -25.369 1.00 0.00 H ATOM 2811 HD2 LYS B 71 11.895 73.819 -25.959 1.00 0.00 H ATOM 2812 HD3 LYS B 71 10.974 74.586 -27.274 1.00 0.00 H ATOM 2813 HE2 LYS B 71 13.127 73.650 -28.033 1.00 0.00 H ATOM 2814 HE3 LYS B 71 13.980 74.727 -26.904 1.00 0.00 H ATOM 2815 HZ1 LYS B 71 12.335 75.592 -29.225 1.00 0.00 H ATOM 2816 HZ2 LYS B 71 13.150 76.621 -28.146 1.00 0.00 H ATOM 2817 HZ3 LYS B 71 14.032 75.573 -29.151 1.00 0.00 H ATOM 2818 H LYS B 71 12.403 77.146 -23.303 1.00 0.00 H ATOM 2819 N LYS B 72 9.512 77.135 -21.764 1.00 27.26 N ATOM 2820 CA LYS B 72 8.450 77.038 -20.771 1.00 24.04 C ATOM 2821 C LYS B 72 8.846 77.575 -19.421 1.00 21.95 C ATOM 2822 O LYS B 72 10.015 77.820 -19.177 1.00 21.57 O ATOM 2823 CB LYS B 72 7.873 75.626 -20.680 1.00 24.38 C ATOM 2824 CG LYS B 72 8.781 74.561 -20.198 1.00 24.88 C ATOM 2825 CD LYS B 72 8.167 73.203 -20.479 1.00 25.32 C ATOM 2826 CE LYS B 72 8.044 72.989 -21.975 1.00 26.51 C ATOM 2827 NZ LYS B 72 7.600 71.620 -22.337 1.00 27.15 N ATOM 2828 HA LYS B 72 7.652 77.689 -21.128 1.00 0.00 H ATOM 2829 HB2 LYS B 72 7.019 75.662 -20.004 1.00 0.00 H ATOM 2830 HB3 LYS B 72 7.534 75.344 -21.677 1.00 0.00 H ATOM 2831 HG2 LYS B 72 9.739 74.640 -20.713 1.00 0.00 H ATOM 2832 HG3 LYS B 72 8.936 74.674 -19.125 1.00 0.00 H ATOM 2833 HD2 LYS B 72 8.801 72.425 -20.054 1.00 0.00 H ATOM 2834 HD3 LYS B 72 7.178 73.153 -20.024 1.00 0.00 H ATOM 2835 HE2 LYS B 72 9.017 73.170 -22.432 1.00 0.00 H ATOM 2836 HE3 LYS B 72 7.321 73.703 -22.369 1.00 0.00 H ATOM 2837 HZ1 LYS B 72 8.287 70.927 -21.976 1.00 0.00 H ATOM 2838 HZ2 LYS B 72 6.667 71.437 -21.916 1.00 0.00 H ATOM 2839 HZ3 LYS B 72 7.536 71.540 -23.372 1.00 0.00 H ATOM 2840 H LYS B 72 10.491 77.316 -21.464 1.00 0.00 H ATOM 2841 N LYS B 73 7.845 77.810 -18.582 1.00 21.34 N ATOM 2842 CA LYS B 73 8.027 78.380 -17.252 1.00 21.97 C ATOM 2843 C LYS B 73 8.163 77.399 -16.103 1.00 19.12 C ATOM 2844 O LYS B 73 7.785 76.235 -16.213 1.00 19.82 O ATOM 2845 CB LYS B 73 6.861 79.323 -16.956 1.00 22.73 C ATOM 2846 CG LYS B 73 6.939 80.626 -17.713 1.00 27.02 C ATOM 2847 CD LYS B 73 5.610 81.347 -17.717 1.00 31.18 C ATOM 2848 CE LYS B 73 5.727 82.739 -18.348 1.00 35.20 C ATOM 2849 NZ LYS B 73 6.428 83.741 -17.478 1.00 38.14 N ATOM 2850 HA LYS B 73 8.990 78.888 -17.299 1.00 0.00 H ATOM 2851 HB2 LYS B 73 5.932 78.821 -17.227 1.00 0.00 H ATOM 2852 HB3 LYS B 73 6.856 79.543 -15.888 1.00 0.00 H ATOM 2853 HG2 LYS B 73 7.687 81.265 -17.243 1.00 0.00 H ATOM 2854 HG3 LYS B 73 7.234 80.421 -18.742 1.00 0.00 H ATOM 2855 HD2 LYS B 73 4.890 80.759 -18.286 1.00 0.00 H ATOM 2856 HD3 LYS B 73 5.261 81.452 -16.690 1.00 0.00 H ATOM 2857 HE2 LYS B 73 4.723 83.108 -18.557 1.00 0.00 H ATOM 2858 HE3 LYS B 73 6.281 82.648 -19.282 1.00 0.00 H ATOM 2859 HZ1 LYS B 73 5.906 83.849 -16.585 1.00 0.00 H ATOM 2860 HZ2 LYS B 73 7.393 83.410 -17.278 1.00 0.00 H ATOM 2861 HZ3 LYS B 73 6.469 84.656 -17.970 1.00 0.00 H ATOM 2862 H LYS B 73 6.880 77.575 -18.889 1.00 0.00 H ATOM 2863 N HIS B 74 8.658 77.920 -14.984 1.00 18.70 N ATOM 2864 CA HIS B 74 8.840 77.171 -13.741 1.00 18.30 C ATOM 2865 C HIS B 74 9.718 75.934 -13.952 1.00 16.52 C ATOM 2866 O HIS B 74 9.462 74.873 -13.372 1.00 12.44 O ATOM 2867 CB HIS B 74 7.476 76.748 -13.166 1.00 18.63 C ATOM 2868 CG HIS B 74 6.349 77.691 -13.480 1.00 21.14 C ATOM 2869 ND1 HIS B 74 6.413 79.050 -13.226 1.00 23.56 N ATOM 2870 CD2 HIS B 74 5.127 77.463 -13.999 1.00 20.86 C ATOM 2871 CE1 HIS B 74 5.266 79.609 -13.570 1.00 22.05 C ATOM 2872 NE2 HIS B 74 4.467 78.676 -14.040 1.00 19.94 N ATOM 2873 HA HIS B 74 9.344 77.829 -13.033 1.00 0.00 H ATOM 2874 HB2 HIS B 74 7.224 75.768 -13.572 1.00 0.00 H ATOM 2875 HB3 HIS B 74 7.570 76.678 -12.082 1.00 0.00 H ATOM 2876 HD2 HIS B 74 4.732 76.501 -14.326 1.00 0.00 H ATOM 2877 HE1 HIS B 74 5.023 80.668 -13.479 1.00 0.00 H ATOM 2878 H HIS B 74 8.933 78.923 -14.993 1.00 0.00 H ATOM 2879 N VAL B 75 10.747 76.082 -14.786 1.00 15.43 N ATOM 2880 CA VAL B 75 11.671 74.988 -15.098 1.00 16.47 C ATOM 2881 C VAL B 75 13.003 75.113 -14.356 1.00 16.51 C ATOM 2882 O VAL B 75 13.636 76.172 -14.382 1.00 15.73 O ATOM 2883 CB VAL B 75 11.986 74.926 -16.622 1.00 15.31 C ATOM 2884 CG1 VAL B 75 12.973 73.787 -16.918 1.00 16.60 C ATOM 2885 CG2 VAL B 75 10.715 74.760 -17.424 1.00 10.91 C ATOM 2886 HA VAL B 75 11.161 74.080 -14.775 1.00 0.00 H ATOM 2887 HB VAL B 75 12.450 75.867 -16.918 1.00 0.00 H ATOM 2888 HG11 VAL B 75 13.899 73.959 -16.370 1.00 0.00 H ATOM 2889 HG12 VAL B 75 12.536 72.839 -16.606 1.00 0.00 H ATOM 2890 HG13 VAL B 75 13.182 73.758 -17.987 1.00 0.00 H ATOM 2891 HG21 VAL B 75 10.218 73.836 -17.128 1.00 0.00 H ATOM 2892 HG22 VAL B 75 10.054 75.606 -17.234 1.00 0.00 H ATOM 2893 HG23 VAL B 75 10.959 74.719 -18.485 1.00 0.00 H ATOM 2894 H VAL B 75 10.900 77.009 -15.232 1.00 0.00 H ATOM 2895 N PHE B 76 13.409 74.051 -13.666 1.00 16.44 N ATOM 2896 CA PHE B 76 14.693 74.065 -12.995 1.00 15.67 C ATOM 2897 C PHE B 76 15.623 73.023 -13.598 1.00 13.71 C ATOM 2898 O PHE B 76 15.179 72.070 -14.231 1.00 13.35 O ATOM 2899 CB PHE B 76 14.581 73.996 -11.452 1.00 15.35 C ATOM 2900 CG PHE B 76 14.129 72.670 -10.893 1.00 13.48 C ATOM 2901 CD1 PHE B 76 15.046 71.682 -10.599 1.00 14.05 C ATOM 2902 CD2 PHE B 76 12.786 72.453 -10.592 1.00 15.17 C ATOM 2903 CE1 PHE B 76 14.655 70.483 -10.014 1.00 16.28 C ATOM 2904 CE2 PHE B 76 12.374 71.249 -10.000 1.00 16.76 C ATOM 2905 CZ PHE B 76 13.312 70.266 -9.710 1.00 17.26 C ATOM 2906 HA PHE B 76 15.150 75.038 -13.175 1.00 0.00 H ATOM 2907 HB2 PHE B 76 15.562 74.221 -11.033 1.00 0.00 H ATOM 2908 HB3 PHE B 76 13.868 74.756 -11.132 1.00 0.00 H ATOM 2909 HD2 PHE B 76 12.050 73.224 -10.818 1.00 0.00 H ATOM 2910 HE2 PHE B 76 11.321 71.086 -9.768 1.00 0.00 H ATOM 2911 HZ PHE B 76 12.999 69.330 -9.247 1.00 0.00 H ATOM 2912 HE1 PHE B 76 15.396 69.715 -9.794 1.00 0.00 H ATOM 2913 HD1 PHE B 76 16.099 71.845 -10.830 1.00 0.00 H ATOM 2914 H PHE B 76 12.803 73.208 -13.608 1.00 0.00 H ATOM 2915 N LYS B 77 16.912 73.265 -13.461 1.00 11.79 N ATOM 2916 CA LYS B 77 17.941 72.395 -14.003 1.00 14.97 C ATOM 2917 C LYS B 77 18.655 71.619 -12.895 1.00 14.66 C ATOM 2918 O LYS B 77 18.970 72.179 -11.836 1.00 12.66 O ATOM 2919 CB LYS B 77 18.953 73.267 -14.735 1.00 15.92 C ATOM 2920 CG LYS B 77 20.013 72.528 -15.478 1.00 20.13 C ATOM 2921 CD LYS B 77 21.146 73.478 -15.802 1.00 24.66 C ATOM 2922 CE LYS B 77 20.632 74.781 -16.389 1.00 25.92 C ATOM 2923 NZ LYS B 77 21.728 75.778 -16.525 1.00 29.80 N ATOM 2924 HA LYS B 77 17.480 71.671 -14.675 1.00 0.00 H ATOM 2925 HB2 LYS B 77 18.410 73.886 -15.449 1.00 0.00 H ATOM 2926 HB3 LYS B 77 19.441 73.907 -13.999 1.00 0.00 H ATOM 2927 HG2 LYS B 77 20.387 71.710 -14.863 1.00 0.00 H ATOM 2928 HG3 LYS B 77 19.598 72.126 -16.402 1.00 0.00 H ATOM 2929 HD2 LYS B 77 21.699 73.695 -14.888 1.00 0.00 H ATOM 2930 HD3 LYS B 77 21.811 73.003 -16.523 1.00 0.00 H ATOM 2931 HE2 LYS B 77 19.861 75.187 -15.734 1.00 0.00 H ATOM 2932 HE3 LYS B 77 20.205 74.585 -17.373 1.00 0.00 H ATOM 2933 HZ1 LYS B 77 22.136 75.973 -15.588 1.00 0.00 H ATOM 2934 HZ2 LYS B 77 22.465 75.398 -17.153 1.00 0.00 H ATOM 2935 HZ3 LYS B 77 21.347 76.658 -16.928 1.00 0.00 H ATOM 2936 H LYS B 77 17.205 74.117 -12.942 1.00 0.00 H ATOM 2937 N LEU B 78 18.929 70.341 -13.156 1.00 14.83 N ATOM 2938 CA LEU B 78 19.617 69.483 -12.205 1.00 13.48 C ATOM 2939 C LEU B 78 20.762 68.767 -12.913 1.00 14.49 C ATOM 2940 O LEU B 78 20.530 67.981 -13.835 1.00 14.29 O ATOM 2941 CB LEU B 78 18.657 68.446 -11.613 1.00 12.68 C ATOM 2942 CG LEU B 78 19.272 67.335 -10.746 1.00 12.27 C ATOM 2943 CD1 LEU B 78 19.824 67.903 -9.450 1.00 14.18 C ATOM 2944 CD2 LEU B 78 18.229 66.292 -10.421 1.00 13.97 C ATOM 2945 HA LEU B 78 20.004 70.100 -11.394 1.00 0.00 H ATOM 2946 HB2 LEU B 78 17.935 68.981 -10.997 1.00 0.00 H ATOM 2947 HB3 LEU B 78 18.139 67.966 -12.443 1.00 0.00 H ATOM 2948 HG LEU B 78 20.086 66.881 -11.311 1.00 0.00 H ATOM 2949 HD21 LEU B 78 17.408 66.758 -9.876 1.00 0.00 H ATOM 2950 HD22 LEU B 78 17.852 65.857 -11.346 1.00 0.00 H ATOM 2951 HD23 LEU B 78 18.677 65.511 -9.807 1.00 0.00 H ATOM 2952 HD11 LEU B 78 20.595 68.639 -9.677 1.00 0.00 H ATOM 2953 HD12 LEU B 78 19.018 68.379 -8.891 1.00 0.00 H ATOM 2954 HD13 LEU B 78 20.253 67.097 -8.855 1.00 0.00 H ATOM 2955 H LEU B 78 18.640 69.943 -14.073 1.00 0.00 H ATOM 2956 N ARG B 79 21.993 69.061 -12.507 1.00 12.62 N ATOM 2957 CA ARG B 79 23.155 68.403 -13.078 1.00 13.89 C ATOM 2958 C ARG B 79 23.696 67.493 -11.992 1.00 13.25 C ATOM 2959 O ARG B 79 24.038 67.962 -10.916 1.00 12.28 O ATOM 2960 CB ARG B 79 24.241 69.413 -13.486 1.00 17.76 C ATOM 2961 CG ARG B 79 25.418 68.769 -14.272 1.00 24.67 C ATOM 2962 CD ARG B 79 26.437 69.778 -14.825 1.00 25.44 C ATOM 2963 NE ARG B 79 25.780 70.931 -15.431 1.00 28.35 N ATOM 2964 CZ ARG B 79 26.314 72.144 -15.499 1.00 29.87 C ATOM 2965 NH1 ARG B 79 27.531 72.363 -15.032 1.00 31.39 N ATOM 2966 NH2 ARG B 79 25.567 73.169 -15.888 1.00 30.92 N ATOM 2967 HA ARG B 79 22.874 67.859 -13.980 1.00 0.00 H ATOM 2968 HB2 ARG B 79 23.784 70.178 -14.113 1.00 0.00 H ATOM 2969 HB3 ARG B 79 24.640 69.876 -12.583 1.00 0.00 H ATOM 2970 HG2 ARG B 79 25.942 68.086 -13.603 1.00 0.00 H ATOM 2971 HG3 ARG B 79 25.003 68.209 -15.110 1.00 0.00 H ATOM 2972 HD2 ARG B 79 27.050 69.284 -15.579 1.00 0.00 H ATOM 2973 HD3 ARG B 79 27.073 70.122 -14.009 1.00 0.00 H ATOM 2974 HE ARG B 79 24.832 70.793 -15.836 1.00 0.00 H ATOM 2975 HH12 ARG B 79 27.946 73.315 -15.087 1.00 0.00 H ATOM 2976 HH11 ARG B 79 28.074 71.583 -14.609 1.00 0.00 H ATOM 2977 HH22 ARG B 79 25.980 74.122 -15.943 1.00 0.00 H ATOM 2978 HH21 ARG B 79 24.569 73.020 -16.138 1.00 0.00 H ATOM 2979 H ARG B 79 22.127 69.777 -11.765 1.00 0.00 H ATOM 2980 N LEU B 80 23.685 66.190 -12.250 1.00 12.62 N ATOM 2981 CA LEU B 80 24.202 65.210 -11.309 1.00 14.31 C ATOM 2982 C LEU B 80 25.731 65.172 -11.456 1.00 16.33 C ATOM 2983 O LEU B 80 26.273 65.566 -12.498 1.00 13.98 O ATOM 2984 CB LEU B 80 23.608 63.836 -11.620 1.00 15.19 C ATOM 2985 CG LEU B 80 22.086 63.800 -11.767 1.00 17.17 C ATOM 2986 CD1 LEU B 80 21.699 62.560 -12.543 1.00 19.02 C ATOM 2987 CD2 LEU B 80 21.410 63.847 -10.400 1.00 15.76 C ATOM 2988 HA LEU B 80 23.931 65.479 -10.288 1.00 0.00 H ATOM 2989 HB2 LEU B 80 24.045 63.483 -12.554 1.00 0.00 H ATOM 2990 HB3 LEU B 80 23.885 63.158 -10.812 1.00 0.00 H ATOM 2991 HG LEU B 80 21.746 64.678 -12.317 1.00 0.00 H ATOM 2992 HD21 LEU B 80 21.728 62.988 -9.809 1.00 0.00 H ATOM 2993 HD22 LEU B 80 21.693 64.766 -9.888 1.00 0.00 H ATOM 2994 HD23 LEU B 80 20.328 63.820 -10.530 1.00 0.00 H ATOM 2995 HD11 LEU B 80 22.165 62.589 -13.528 1.00 0.00 H ATOM 2996 HD12 LEU B 80 22.039 61.675 -12.005 1.00 0.00 H ATOM 2997 HD13 LEU B 80 20.615 62.525 -12.653 1.00 0.00 H ATOM 2998 H LEU B 80 23.294 65.860 -13.155 1.00 0.00 H ATOM 2999 N SER B 81 26.419 64.652 -10.444 1.00 16.04 N ATOM 3000 CA SER B 81 27.876 64.577 -10.461 1.00 18.11 C ATOM 3001 C SER B 81 28.464 63.769 -11.637 1.00 19.70 C ATOM 3002 O SER B 81 29.558 64.065 -12.127 1.00 20.75 O ATOM 3003 CB SER B 81 28.355 63.986 -9.145 1.00 19.59 C ATOM 3004 OG SER B 81 27.714 62.734 -8.956 1.00 25.20 O ATOM 3005 HA SER B 81 28.234 65.597 -10.598 1.00 0.00 H ATOM 3006 HB2 SER B 81 28.100 64.658 -8.325 1.00 0.00 H ATOM 3007 HB3 SER B 81 29.435 63.846 -9.176 1.00 0.00 H ATOM 3008 HG SER B 81 26.733 62.867 -8.931 1.00 0.00 H ATOM 3009 H SER B 81 25.904 64.288 -9.617 1.00 0.00 H ATOM 3010 N ASP B 82 27.726 62.771 -12.108 1.00 20.82 N ATOM 3011 CA ASP B 82 28.202 61.934 -13.207 1.00 23.69 C ATOM 3012 C ASP B 82 28.044 62.552 -14.599 1.00 23.86 C ATOM 3013 O ASP B 82 28.347 61.906 -15.608 1.00 24.91 O ATOM 3014 CB ASP B 82 27.512 60.571 -13.165 1.00 24.85 C ATOM 3015 CG ASP B 82 26.055 60.640 -13.568 1.00 27.57 C ATOM 3016 OD1 ASP B 82 25.445 61.724 -13.468 1.00 28.60 O ATOM 3017 OD2 ASP B 82 25.513 59.602 -14.003 1.00 29.22 O ATOM 3018 HA ASP B 82 29.276 61.831 -13.049 1.00 0.00 H ATOM 3019 HB2 ASP B 82 28.031 59.896 -13.846 1.00 0.00 H ATOM 3020 HB3 ASP B 82 27.575 60.179 -12.150 1.00 0.00 H ATOM 3021 H ASP B 82 26.794 62.582 -11.688 1.00 0.00 H ATOM 3022 N GLY B 83 27.530 63.779 -14.657 1.00 21.24 N ATOM 3023 CA GLY B 83 27.356 64.428 -15.939 1.00 18.00 C ATOM 3024 C GLY B 83 25.946 64.493 -16.503 1.00 15.72 C ATOM 3025 O GLY B 83 25.685 65.265 -17.420 1.00 17.12 O ATOM 3026 HA3 GLY B 83 27.974 63.896 -16.662 1.00 0.00 H ATOM 3027 HA2 GLY B 83 27.716 65.452 -15.839 1.00 0.00 H ATOM 3028 H GLY B 83 27.254 64.270 -13.783 1.00 0.00 H ATOM 3029 N ASN B 84 25.035 63.670 -16.016 1.00 14.62 N ATOM 3030 CA ASN B 84 23.678 63.728 -16.534 1.00 16.29 C ATOM 3031 C ASN B 84 22.992 64.991 -16.107 1.00 16.20 C ATOM 3032 O ASN B 84 23.133 65.438 -14.960 1.00 17.94 O ATOM 3033 CB ASN B 84 22.855 62.534 -16.098 1.00 17.51 C ATOM 3034 CG ASN B 84 23.213 61.291 -16.865 1.00 22.10 C ATOM 3035 OD1 ASN B 84 23.886 60.404 -16.343 1.00 26.21 O ATOM 3036 ND2 ASN B 84 22.802 61.231 -18.125 1.00 20.25 N ATOM 3037 HA ASN B 84 23.757 63.712 -17.621 1.00 0.00 H ATOM 3038 HB2 ASN B 84 23.029 62.355 -15.037 1.00 0.00 H ATOM 3039 HB3 ASN B 84 21.800 62.756 -16.260 1.00 0.00 H ATOM 3040 HD22 ASN B 84 22.234 62.006 -18.524 1.00 0.00 H ATOM 3041 HD21 ASN B 84 23.048 60.409 -18.713 1.00 0.00 H ATOM 3042 H ASN B 84 25.285 62.989 -15.271 1.00 0.00 H ATOM 3043 N GLU B 85 22.248 65.563 -17.040 1.00 14.83 N ATOM 3044 CA GLU B 85 21.526 66.796 -16.774 1.00 15.89 C ATOM 3045 C GLU B 85 20.053 66.710 -17.184 1.00 15.26 C ATOM 3046 O GLU B 85 19.706 66.300 -18.307 1.00 13.52 O ATOM 3047 CB GLU B 85 22.209 67.967 -17.472 1.00 16.80 C ATOM 3048 CG GLU B 85 21.562 69.279 -17.157 1.00 21.16 C ATOM 3049 CD GLU B 85 22.265 70.416 -17.814 1.00 23.74 C ATOM 3050 OE1 GLU B 85 23.450 70.624 -17.487 1.00 22.54 O ATOM 3051 OE2 GLU B 85 21.630 71.077 -18.664 1.00 26.34 O ATOM 3052 HA GLU B 85 21.546 66.958 -15.696 1.00 0.00 H ATOM 3053 HB2 GLU B 85 23.251 68.005 -17.153 1.00 0.00 H ATOM 3054 HB3 GLU B 85 22.166 67.805 -18.549 1.00 0.00 H ATOM 3055 HG2 GLU B 85 20.529 69.255 -17.504 1.00 0.00 H ATOM 3056 HG3 GLU B 85 21.578 69.430 -16.078 1.00 0.00 H ATOM 3057 H GLU B 85 22.179 65.123 -17.980 1.00 0.00 H ATOM 3058 N TYR B 86 19.190 67.066 -16.247 1.00 13.85 N ATOM 3059 CA TYR B 86 17.757 67.026 -16.464 1.00 12.47 C ATOM 3060 C TYR B 86 17.164 68.403 -16.220 1.00 12.81 C ATOM 3061 O TYR B 86 17.762 69.248 -15.539 1.00 11.68 O ATOM 3062 CB TYR B 86 17.089 66.024 -15.493 1.00 14.41 C ATOM 3063 CG TYR B 86 17.513 64.563 -15.616 1.00 16.29 C ATOM 3064 CD1 TYR B 86 16.844 63.691 -16.482 1.00 16.42 C ATOM 3065 CD2 TYR B 86 18.555 64.048 -14.840 1.00 18.49 C ATOM 3066 CE1 TYR B 86 17.197 62.346 -16.578 1.00 16.75 C ATOM 3067 CE2 TYR B 86 18.920 62.693 -14.929 1.00 18.94 C ATOM 3068 CZ TYR B 86 18.235 61.854 -15.800 1.00 19.18 C ATOM 3069 OH TYR B 86 18.605 60.536 -15.926 1.00 19.88 O ATOM 3070 HA TYR B 86 17.575 66.712 -17.492 1.00 0.00 H ATOM 3071 HB3 TYR B 86 16.013 66.071 -15.659 1.00 0.00 H ATOM 3072 HB2 TYR B 86 17.313 66.349 -14.477 1.00 0.00 H ATOM 3073 HD2 TYR B 86 19.092 64.706 -14.156 1.00 0.00 H ATOM 3074 HE2 TYR B 86 19.735 62.303 -14.319 1.00 0.00 H ATOM 3075 HE1 TYR B 86 16.661 61.685 -17.260 1.00 0.00 H ATOM 3076 HD1 TYR B 86 16.028 64.072 -17.096 1.00 0.00 H ATOM 3077 HH TYR B 86 18.523 60.086 -15.048 1.00 0.00 H ATOM 3078 H TYR B 86 19.551 67.385 -15.325 1.00 0.00 H ATOM 3079 N LEU B 87 16.019 68.638 -16.850 1.00 13.11 N ATOM 3080 CA LEU B 87 15.246 69.862 -16.701 1.00 13.14 C ATOM 3081 C LEU B 87 13.934 69.372 -16.104 1.00 11.91 C ATOM 3082 O LEU B 87 13.374 68.383 -16.578 1.00 12.47 O ATOM 3083 CB LEU B 87 14.982 70.519 -18.066 1.00 15.13 C ATOM 3084 CG LEU B 87 15.968 71.583 -18.555 1.00 16.43 C ATOM 3085 CD1 LEU B 87 17.392 71.055 -18.531 1.00 19.62 C ATOM 3086 CD2 LEU B 87 15.575 72.012 -19.953 1.00 17.90 C ATOM 3087 HA LEU B 87 15.756 70.609 -16.094 1.00 0.00 H ATOM 3088 HB2 LEU B 87 14.967 69.724 -18.811 1.00 0.00 H ATOM 3089 HB3 LEU B 87 13.999 70.987 -18.016 1.00 0.00 H ATOM 3090 HG LEU B 87 15.930 72.444 -17.888 1.00 0.00 H ATOM 3091 HD21 LEU B 87 15.604 71.149 -20.618 1.00 0.00 H ATOM 3092 HD22 LEU B 87 14.566 72.425 -19.935 1.00 0.00 H ATOM 3093 HD23 LEU B 87 16.273 72.770 -20.309 1.00 0.00 H ATOM 3094 HD11 LEU B 87 17.657 70.773 -17.512 1.00 0.00 H ATOM 3095 HD12 LEU B 87 17.466 70.183 -19.181 1.00 0.00 H ATOM 3096 HD13 LEU B 87 18.072 71.831 -18.883 1.00 0.00 H ATOM 3097 H LEU B 87 15.653 67.903 -17.488 1.00 0.00 H ATOM 3098 N PHE B 88 13.471 70.023 -15.042 1.00 12.93 N ATOM 3099 CA PHE B 88 12.220 69.641 -14.399 1.00 13.91 C ATOM 3100 C PHE B 88 11.279 70.823 -14.391 1.00 14.67 C ATOM 3101 O PHE B 88 11.696 71.929 -14.089 1.00 16.26 O ATOM 3102 CB PHE B 88 12.453 69.204 -12.952 1.00 14.83 C ATOM 3103 CG PHE B 88 13.204 67.918 -12.811 1.00 15.66 C ATOM 3104 CD1 PHE B 88 12.526 66.700 -12.771 1.00 14.83 C ATOM 3105 CD2 PHE B 88 14.592 67.922 -12.686 1.00 15.07 C ATOM 3106 CE1 PHE B 88 13.223 65.504 -12.581 1.00 15.85 C ATOM 3107 CE2 PHE B 88 15.291 66.732 -12.499 1.00 15.69 C ATOM 3108 CZ PHE B 88 14.611 65.527 -12.451 1.00 14.48 C ATOM 3109 HA PHE B 88 11.794 68.808 -14.959 1.00 0.00 H ATOM 3110 HB2 PHE B 88 13.018 69.987 -12.445 1.00 0.00 H ATOM 3111 HB3 PHE B 88 11.482 69.088 -12.470 1.00 0.00 H ATOM 3112 HD2 PHE B 88 15.136 68.865 -12.735 1.00 0.00 H ATOM 3113 HE2 PHE B 88 16.375 66.749 -12.390 1.00 0.00 H ATOM 3114 HZ PHE B 88 15.161 64.596 -12.312 1.00 0.00 H ATOM 3115 HE1 PHE B 88 12.684 64.558 -12.535 1.00 0.00 H ATOM 3116 HD1 PHE B 88 11.443 66.681 -12.889 1.00 0.00 H ATOM 3117 H PHE B 88 14.014 70.824 -14.661 1.00 0.00 H ATOM 3118 N GLN B 89 10.003 70.585 -14.693 1.00 14.73 N ATOM 3119 CA GLN B 89 9.019 71.654 -14.705 1.00 15.18 C ATOM 3120 C GLN B 89 7.988 71.456 -13.610 1.00 15.70 C ATOM 3121 O GLN B 89 7.355 70.407 -13.519 1.00 14.21 O ATOM 3122 CB GLN B 89 8.297 71.745 -16.049 1.00 15.76 C ATOM 3123 CG GLN B 89 7.524 73.051 -16.171 1.00 17.55 C ATOM 3124 CD GLN B 89 6.401 73.042 -17.192 1.00 19.30 C ATOM 3125 OE1 GLN B 89 6.010 72.000 -17.731 1.00 19.45 O ATOM 3126 NE2 GLN B 89 5.860 74.224 -17.450 1.00 20.30 N ATOM 3127 HA GLN B 89 9.565 72.582 -14.533 1.00 0.00 H ATOM 3128 HB2 GLN B 89 9.032 71.690 -16.852 1.00 0.00 H ATOM 3129 HB3 GLN B 89 7.602 70.910 -16.137 1.00 0.00 H ATOM 3130 HG2 GLN B 89 7.093 73.281 -15.197 1.00 0.00 H ATOM 3131 HG3 GLN B 89 8.228 73.835 -16.450 1.00 0.00 H ATOM 3132 HE22 GLN B 89 6.220 75.076 -16.974 1.00 0.00 H ATOM 3133 HE21 GLN B 89 5.076 74.300 -18.129 1.00 0.00 H ATOM 3134 H GLN B 89 9.706 69.616 -14.925 1.00 0.00 H ATOM 3135 N ALA B 90 7.827 72.485 -12.790 1.00 19.53 N ATOM 3136 CA ALA B 90 6.867 72.478 -11.695 1.00 20.37 C ATOM 3137 C ALA B 90 5.615 73.240 -12.126 1.00 21.84 C ATOM 3138 O ALA B 90 5.635 73.962 -13.124 1.00 17.60 O ATOM 3139 CB ALA B 90 7.491 73.143 -10.470 1.00 20.17 C ATOM 3140 HA ALA B 90 6.596 71.453 -11.442 1.00 0.00 H ATOM 3141 HB1 ALA B 90 8.385 72.593 -10.175 1.00 0.00 H ATOM 3142 HB2 ALA B 90 7.759 74.171 -10.713 1.00 0.00 H ATOM 3143 HB3 ALA B 90 6.773 73.138 -9.650 1.00 0.00 H ATOM 3144 H ALA B 90 8.411 73.333 -12.935 1.00 0.00 H ATOM 3145 N LYS B 91 4.552 73.120 -11.329 1.00 24.94 N ATOM 3146 CA LYS B 91 3.267 73.786 -11.593 1.00 26.08 C ATOM 3147 C LYS B 91 3.336 75.303 -11.478 1.00 25.41 C ATOM 3148 O LYS B 91 2.569 76.014 -12.127 1.00 26.52 O ATOM 3149 CB LYS B 91 2.162 73.232 -10.678 1.00 28.66 C ATOM 3150 CG LYS B 91 2.456 73.333 -9.181 1.00 33.02 C ATOM 3151 CD LYS B 91 1.248 72.995 -8.299 1.00 37.27 C ATOM 3152 CE LYS B 91 0.525 71.716 -8.730 1.00 37.79 C ATOM 3153 NZ LYS B 91 1.350 70.488 -8.573 1.00 39.95 N ATOM 3154 HA LYS B 91 3.022 73.562 -12.631 1.00 0.00 H ATOM 3155 HB2 LYS B 91 1.245 73.785 -10.881 1.00 0.00 H ATOM 3156 HB3 LYS B 91 2.013 72.181 -10.924 1.00 0.00 H ATOM 3157 HG2 LYS B 91 3.264 72.642 -8.940 1.00 0.00 H ATOM 3158 HG3 LYS B 91 2.772 74.352 -8.959 1.00 0.00 H ATOM 3159 HD2 LYS B 91 1.593 72.869 -7.273 1.00 0.00 H ATOM 3160 HD3 LYS B 91 0.542 73.824 -8.345 1.00 0.00 H ATOM 3161 HE2 LYS B 91 0.246 71.813 -9.779 1.00 0.00 H ATOM 3162 HE3 LYS B 91 -0.375 71.607 -8.125 1.00 0.00 H ATOM 3163 HZ1 LYS B 91 2.209 70.572 -9.153 1.00 0.00 H ATOM 3164 HZ2 LYS B 91 1.615 70.375 -7.574 1.00 0.00 H ATOM 3165 HZ3 LYS B 91 0.801 69.661 -8.882 1.00 0.00 H ATOM 3166 H LYS B 91 4.636 72.526 -10.479 1.00 0.00 H ATOM 3167 N ASP B 92 4.213 75.802 -10.614 1.00 23.85 N ATOM 3168 CA ASP B 92 4.400 77.236 -10.446 1.00 22.19 C ATOM 3169 C ASP B 92 5.782 77.494 -9.872 1.00 21.99 C ATOM 3170 O ASP B 92 6.517 76.560 -9.587 1.00 20.60 O ATOM 3171 CB ASP B 92 3.292 77.883 -9.589 1.00 25.78 C ATOM 3172 CG ASP B 92 3.202 77.316 -8.191 1.00 28.13 C ATOM 3173 OD1 ASP B 92 4.211 76.826 -7.660 1.00 31.25 O ATOM 3174 OD2 ASP B 92 2.110 77.355 -7.590 1.00 30.34 O ATOM 3175 HA ASP B 92 4.324 77.710 -11.425 1.00 0.00 H ATOM 3176 HB2 ASP B 92 3.492 78.952 -9.516 1.00 0.00 H ATOM 3177 HB3 ASP B 92 2.335 77.727 -10.087 1.00 0.00 H ATOM 3178 H ASP B 92 4.783 75.148 -10.040 1.00 0.00 H ATOM 3179 N ASP B 93 6.126 78.757 -9.681 1.00 21.61 N ATOM 3180 CA ASP B 93 7.439 79.121 -9.173 1.00 22.66 C ATOM 3181 C ASP B 93 7.726 78.774 -7.731 1.00 22.50 C ATOM 3182 O ASP B 93 8.864 78.436 -7.410 1.00 21.64 O ATOM 3183 CB ASP B 93 7.707 80.612 -9.406 1.00 24.62 C ATOM 3184 CG ASP B 93 8.000 80.942 -10.864 1.00 24.52 C ATOM 3185 OD1 ASP B 93 8.311 80.026 -11.658 1.00 25.98 O ATOM 3186 OD2 ASP B 93 7.962 82.139 -11.197 1.00 25.75 O ATOM 3187 HA ASP B 93 8.122 78.496 -9.748 1.00 0.00 H ATOM 3188 HB2 ASP B 93 6.829 81.177 -9.091 1.00 0.00 H ATOM 3189 HB3 ASP B 93 8.565 80.910 -8.803 1.00 0.00 H ATOM 3190 H ASP B 93 5.441 79.508 -9.900 1.00 0.00 H ATOM 3191 N GLU B 94 6.712 78.858 -6.867 1.00 24.20 N ATOM 3192 CA GLU B 94 6.866 78.549 -5.440 1.00 27.18 C ATOM 3193 C GLU B 94 7.300 77.110 -5.264 1.00 26.55 C ATOM 3194 O GLU B 94 8.260 76.829 -4.536 1.00 28.37 O ATOM 3195 CB GLU B 94 5.557 78.778 -4.685 1.00 32.42 C ATOM 3196 CG GLU B 94 5.747 79.181 -3.211 1.00 39.70 C ATOM 3197 CD GLU B 94 5.521 78.044 -2.196 1.00 42.16 C ATOM 3198 OE1 GLU B 94 4.341 77.718 -1.929 1.00 43.38 O ATOM 3199 OE2 GLU B 94 6.515 77.520 -1.624 1.00 43.28 O ATOM 3200 HA GLU B 94 7.627 79.215 -5.032 1.00 0.00 H ATOM 3201 HB2 GLU B 94 5.004 79.571 -5.189 1.00 0.00 H ATOM 3202 HB3 GLU B 94 4.977 77.856 -4.717 1.00 0.00 H ATOM 3203 HG2 GLU B 94 6.766 79.548 -3.088 1.00 0.00 H ATOM 3204 HG3 GLU B 94 5.044 79.983 -2.985 1.00 0.00 H ATOM 3205 H GLU B 94 5.778 79.153 -7.218 1.00 0.00 H ATOM 3206 N GLU B 95 6.596 76.203 -5.943 1.00 25.45 N ATOM 3207 CA GLU B 95 6.900 74.769 -5.922 1.00 23.76 C ATOM 3208 C GLU B 95 8.290 74.535 -6.530 1.00 20.75 C ATOM 3209 O GLU B 95 9.090 73.754 -6.013 1.00 19.35 O ATOM 3210 CB GLU B 95 5.844 73.987 -6.706 1.00 25.66 C ATOM 3211 CG GLU B 95 6.161 72.515 -6.795 1.00 30.00 C ATOM 3212 CD GLU B 95 5.034 71.686 -7.372 1.00 32.69 C ATOM 3213 OE1 GLU B 95 4.808 71.726 -8.605 1.00 30.42 O ATOM 3214 OE2 GLU B 95 4.394 70.955 -6.587 1.00 34.16 O ATOM 3215 HA GLU B 95 6.891 74.417 -4.890 1.00 0.00 H ATOM 3216 HB2 GLU B 95 4.880 74.108 -6.211 1.00 0.00 H ATOM 3217 HB3 GLU B 95 5.786 74.394 -7.716 1.00 0.00 H ATOM 3218 HG2 GLU B 95 7.040 72.389 -7.427 1.00 0.00 H ATOM 3219 HG3 GLU B 95 6.380 72.148 -5.792 1.00 0.00 H ATOM 3220 H GLU B 95 5.792 76.529 -6.516 1.00 0.00 H ATOM 3221 N MET B 96 8.582 75.248 -7.611 1.00 19.54 N ATOM 3222 CA MET B 96 9.880 75.134 -8.239 1.00 19.10 C ATOM 3223 C MET B 96 10.958 75.393 -7.183 1.00 19.84 C ATOM 3224 O MET B 96 11.867 74.569 -6.992 1.00 18.51 O ATOM 3225 CB MET B 96 10.038 76.137 -9.385 1.00 19.08 C ATOM 3226 CG MET B 96 11.429 76.074 -9.989 1.00 17.27 C ATOM 3227 SD MET B 96 11.701 77.249 -11.244 1.00 19.40 S ATOM 3228 CE MET B 96 12.012 78.710 -10.316 1.00 19.19 C ATOM 3229 HA MET B 96 9.980 74.132 -8.656 1.00 0.00 H ATOM 3230 HB2 MET B 96 9.305 75.910 -10.159 1.00 0.00 H ATOM 3231 HB3 MET B 96 9.862 77.143 -9.003 1.00 0.00 H ATOM 3232 HG2 MET B 96 11.577 75.080 -10.410 1.00 0.00 H ATOM 3233 HG3 MET B 96 12.157 76.243 -9.195 1.00 0.00 H ATOM 3234 HE1 MET B 96 11.144 78.938 -9.698 1.00 0.00 H ATOM 3235 HE2 MET B 96 12.883 78.556 -9.679 1.00 0.00 H ATOM 3236 HE3 MET B 96 12.202 79.539 -10.998 1.00 0.00 H ATOM 3237 H MET B 96 7.871 75.894 -8.010 1.00 0.00 H ATOM 3238 N ASN B 97 10.821 76.498 -6.453 1.00 19.85 N ATOM 3239 CA ASN B 97 11.800 76.852 -5.424 1.00 20.41 C ATOM 3240 C ASN B 97 11.803 75.875 -4.260 1.00 19.68 C ATOM 3241 O ASN B 97 12.856 75.591 -3.674 1.00 20.08 O ATOM 3242 CB ASN B 97 11.630 78.297 -4.965 1.00 20.90 C ATOM 3243 CG ASN B 97 12.059 79.292 -6.037 1.00 25.96 C ATOM 3244 OD1 ASN B 97 11.293 80.182 -6.417 1.00 31.98 O ATOM 3245 ND2 ASN B 97 13.282 79.136 -6.549 1.00 26.96 N ATOM 3246 HA ASN B 97 12.785 76.773 -5.884 1.00 0.00 H ATOM 3247 HB2 ASN B 97 10.581 78.469 -4.725 1.00 0.00 H ATOM 3248 HB3 ASN B 97 12.236 78.457 -4.073 1.00 0.00 H ATOM 3249 HD22 ASN B 97 13.898 78.373 -6.202 1.00 0.00 H ATOM 3250 HD21 ASN B 97 13.619 79.777 -7.295 1.00 0.00 H ATOM 3251 H ASN B 97 10.004 77.121 -6.617 1.00 0.00 H ATOM 3252 N THR B 98 10.633 75.324 -3.967 1.00 19.73 N ATOM 3253 CA THR B 98 10.492 74.334 -2.919 1.00 18.74 C ATOM 3254 C THR B 98 11.383 73.145 -3.308 1.00 20.07 C ATOM 3255 O THR B 98 12.149 72.632 -2.473 1.00 18.79 O ATOM 3256 CB THR B 98 9.033 73.867 -2.809 1.00 18.79 C ATOM 3257 OG1 THR B 98 8.194 74.989 -2.539 1.00 24.14 O ATOM 3258 CG2 THR B 98 8.862 72.860 -1.692 1.00 20.97 C ATOM 3259 HA THR B 98 10.782 74.754 -1.956 1.00 0.00 H ATOM 3260 HB THR B 98 8.758 73.398 -3.754 1.00 0.00 H ATOM 3261 HG1 THR B 98 8.276 75.646 -3.275 1.00 0.00 H ATOM 3262 HG23 THR B 98 9.497 71.995 -1.884 1.00 0.00 H ATOM 3263 HG21 THR B 98 9.146 73.318 -0.745 1.00 0.00 H ATOM 3264 HG22 THR B 98 7.820 72.544 -1.646 1.00 0.00 H ATOM 3265 H THR B 98 9.791 75.611 -4.506 1.00 0.00 H ATOM 3266 N TRP B 99 11.293 72.718 -4.575 1.00 18.24 N ATOM 3267 CA TRP B 99 12.098 71.604 -5.078 1.00 17.49 C ATOM 3268 C TRP B 99 13.597 71.938 -5.111 1.00 16.95 C ATOM 3269 O TRP B 99 14.435 71.112 -4.747 1.00 16.17 O ATOM 3270 CB TRP B 99 11.640 71.197 -6.470 1.00 16.62 C ATOM 3271 CG TRP B 99 10.455 70.317 -6.481 1.00 16.73 C ATOM 3272 CD1 TRP B 99 9.164 70.665 -6.794 1.00 16.91 C ATOM 3273 CD2 TRP B 99 10.444 68.915 -6.226 1.00 16.09 C ATOM 3274 NE1 TRP B 99 8.357 69.553 -6.760 1.00 17.44 N ATOM 3275 CE2 TRP B 99 9.115 68.463 -6.417 1.00 17.04 C ATOM 3276 CE3 TRP B 99 11.426 67.984 -5.872 1.00 15.63 C ATOM 3277 CZ2 TRP B 99 8.753 67.124 -6.253 1.00 15.11 C ATOM 3278 CZ3 TRP B 99 11.063 66.656 -5.709 1.00 14.85 C ATOM 3279 CH2 TRP B 99 9.737 66.240 -5.902 1.00 15.82 C ATOM 3280 HA TRP B 99 11.953 70.774 -4.386 1.00 0.00 H ATOM 3281 HB2 TRP B 99 11.401 72.101 -7.030 1.00 0.00 H ATOM 3282 HB3 TRP B 99 12.460 70.673 -6.961 1.00 0.00 H ATOM 3283 HE1 TRP B 99 7.337 69.540 -6.962 1.00 0.00 H ATOM 3284 HD1 TRP B 99 8.829 71.674 -7.034 1.00 0.00 H ATOM 3285 HZ2 TRP B 99 7.724 66.795 -6.399 1.00 0.00 H ATOM 3286 HH2 TRP B 99 9.485 65.188 -5.769 1.00 0.00 H ATOM 3287 HZ3 TRP B 99 11.819 65.924 -5.427 1.00 0.00 H ATOM 3288 HE3 TRP B 99 12.460 68.298 -5.727 1.00 0.00 H ATOM 3289 H TRP B 99 10.631 73.193 -5.221 1.00 0.00 H ATOM 3290 N ILE B 100 13.932 73.149 -5.537 1.00 17.89 N ATOM 3291 CA ILE B 100 15.327 73.564 -5.597 1.00 20.15 C ATOM 3292 C ILE B 100 15.975 73.551 -4.205 1.00 20.83 C ATOM 3293 O ILE B 100 17.119 73.141 -4.065 1.00 22.07 O ATOM 3294 CB ILE B 100 15.465 74.953 -6.266 1.00 18.90 C ATOM 3295 CG1 ILE B 100 15.098 74.855 -7.747 1.00 17.28 C ATOM 3296 CG2 ILE B 100 16.885 75.483 -6.121 1.00 20.35 C ATOM 3297 CD1 ILE B 100 15.107 76.198 -8.470 1.00 15.50 C ATOM 3298 HA ILE B 100 15.861 72.841 -6.214 1.00 0.00 H ATOM 3299 HB ILE B 100 14.785 75.644 -5.769 1.00 0.00 H ATOM 3300 HG12 ILE B 100 15.814 74.195 -8.237 1.00 0.00 H ATOM 3301 HG13 ILE B 100 14.099 74.427 -7.827 1.00 0.00 H ATOM 3302 HD11 ILE B 100 14.387 76.867 -8.000 1.00 0.00 H ATOM 3303 HD12 ILE B 100 16.104 76.635 -8.410 1.00 0.00 H ATOM 3304 HD13 ILE B 100 14.837 76.048 -9.515 1.00 0.00 H ATOM 3305 HG21 ILE B 100 17.131 75.575 -5.063 1.00 0.00 H ATOM 3306 HG22 ILE B 100 17.580 74.792 -6.598 1.00 0.00 H ATOM 3307 HG23 ILE B 100 16.957 76.460 -6.599 1.00 0.00 H ATOM 3308 H ILE B 100 13.187 73.812 -5.833 1.00 0.00 H ATOM 3309 N GLN B 101 15.237 73.981 -3.183 1.00 22.89 N ATOM 3310 CA GLN B 101 15.741 73.990 -1.798 1.00 23.20 C ATOM 3311 C GLN B 101 15.867 72.565 -1.266 1.00 20.44 C ATOM 3312 O GLN B 101 16.866 72.216 -0.631 1.00 21.18 O ATOM 3313 CB GLN B 101 14.797 74.783 -0.883 1.00 29.27 C ATOM 3314 CG GLN B 101 14.764 76.300 -1.119 1.00 34.97 C ATOM 3315 CD GLN B 101 16.061 77.010 -0.719 1.00 38.55 C ATOM 3316 OE1 GLN B 101 17.113 76.380 -0.529 1.00 38.92 O ATOM 3317 NE2 GLN B 101 15.988 78.336 -0.599 1.00 38.89 N ATOM 3318 HA GLN B 101 16.722 74.465 -1.803 1.00 0.00 H ATOM 3319 HB2 GLN B 101 13.787 74.399 -1.028 1.00 0.00 H ATOM 3320 HB3 GLN B 101 15.105 74.610 0.148 1.00 0.00 H ATOM 3321 HG2 GLN B 101 14.584 76.481 -2.179 1.00 0.00 H ATOM 3322 HG3 GLN B 101 13.945 76.722 -0.536 1.00 0.00 H ATOM 3323 HE22 GLN B 101 15.085 78.824 -0.767 1.00 0.00 H ATOM 3324 HE21 GLN B 101 16.834 78.882 -0.337 1.00 0.00 H ATOM 3325 H GLN B 101 14.272 74.322 -3.369 1.00 0.00 H ATOM 3326 N ALA B 102 14.839 71.755 -1.505 1.00 16.13 N ATOM 3327 CA ALA B 102 14.851 70.362 -1.088 1.00 16.24 C ATOM 3328 C ALA B 102 16.087 69.646 -1.614 1.00 16.18 C ATOM 3329 O ALA B 102 16.825 69.041 -0.856 1.00 18.24 O ATOM 3330 CB ALA B 102 13.615 69.663 -1.584 1.00 17.73 C ATOM 3331 HA ALA B 102 14.871 70.336 0.002 1.00 0.00 H ATOM 3332 HB1 ALA B 102 12.732 70.153 -1.172 1.00 0.00 H ATOM 3333 HB2 ALA B 102 13.584 69.711 -2.673 1.00 0.00 H ATOM 3334 HB3 ALA B 102 13.636 68.621 -1.265 1.00 0.00 H ATOM 3335 H ALA B 102 14.005 72.128 -2.003 1.00 0.00 H ATOM 3336 N ILE B 103 16.308 69.710 -2.921 1.00 18.21 N ATOM 3337 CA ILE B 103 17.476 69.075 -3.555 1.00 19.38 C ATOM 3338 C ILE B 103 18.802 69.668 -3.088 1.00 22.15 C ATOM 3339 O ILE B 103 19.754 68.951 -2.783 1.00 21.29 O ATOM 3340 CB ILE B 103 17.416 69.200 -5.110 1.00 19.54 C ATOM 3341 CG1 ILE B 103 16.182 68.472 -5.650 1.00 18.45 C ATOM 3342 CG2 ILE B 103 18.735 68.755 -5.748 1.00 16.19 C ATOM 3343 CD1 ILE B 103 15.974 68.605 -7.118 1.00 18.15 C ATOM 3344 HA ILE B 103 17.432 68.029 -3.253 1.00 0.00 H ATOM 3345 HB ILE B 103 17.300 70.247 -5.391 1.00 0.00 H ATOM 3346 HG12 ILE B 103 16.283 67.412 -5.416 1.00 0.00 H ATOM 3347 HG13 ILE B 103 15.303 68.872 -5.145 1.00 0.00 H ATOM 3348 HD11 ILE B 103 15.856 69.658 -7.373 1.00 0.00 H ATOM 3349 HD12 ILE B 103 16.837 68.197 -7.644 1.00 0.00 H ATOM 3350 HD13 ILE B 103 15.077 68.057 -7.408 1.00 0.00 H ATOM 3351 HG21 ILE B 103 19.546 69.382 -5.377 1.00 0.00 H ATOM 3352 HG22 ILE B 103 18.930 67.715 -5.488 1.00 0.00 H ATOM 3353 HG23 ILE B 103 18.664 68.853 -6.831 1.00 0.00 H ATOM 3354 H ILE B 103 15.632 70.227 -3.519 1.00 0.00 H ATOM 3355 N SER B 104 18.874 70.987 -3.015 1.00 25.76 N ATOM 3356 CA SER B 104 20.102 71.635 -2.605 1.00 29.50 C ATOM 3357 C SER B 104 20.453 71.425 -1.148 1.00 31.59 C ATOM 3358 O SER B 104 21.562 71.761 -0.721 1.00 32.75 O ATOM 3359 CB SER B 104 20.037 73.135 -2.935 1.00 30.37 C ATOM 3360 OG SER B 104 19.952 73.351 -4.349 1.00 31.89 O ATOM 3361 HA SER B 104 20.904 71.161 -3.171 1.00 0.00 H ATOM 3362 HB2 SER B 104 20.934 73.622 -2.554 1.00 0.00 H ATOM 3363 HB3 SER B 104 19.159 73.567 -2.456 1.00 0.00 H ATOM 3364 HG SER B 104 19.136 72.914 -4.700 1.00 0.00 H ATOM 3365 H SER B 104 18.042 71.563 -3.254 1.00 0.00 H ATOM 3366 N SER B 105 19.571 70.808 -0.378 1.00 32.61 N ATOM 3367 CA SER B 105 19.842 70.620 1.033 1.00 32.03 C ATOM 3368 C SER B 105 19.942 69.149 1.399 1.00 32.49 C ATOM 3369 O SER B 105 20.384 68.850 2.480 1.00 36.02 O ATOM 3370 CB SER B 105 18.728 71.317 1.813 1.00 33.18 C ATOM 3371 OG SER B 105 18.587 72.622 1.318 1.00 34.43 O ATOM 3372 HA SER B 105 20.809 71.055 1.286 1.00 0.00 H ATOM 3373 HB2 SER B 105 18.986 71.351 2.872 1.00 0.00 H ATOM 3374 HB3 SER B 105 17.793 70.772 1.685 1.00 0.00 H ATOM 3375 HG SER B 105 18.355 72.586 0.356 1.00 0.00 H ATOM 3376 H SER B 105 18.681 70.457 -0.787 1.00 0.00 H ATOM 3377 N ALA B 106 19.726 68.293 0.402 1.00 32.46 N ATOM 3378 CA ALA B 106 19.786 66.855 0.596 1.00 31.86 C ATOM 3379 C ALA B 106 21.179 66.500 1.037 1.00 34.81 C ATOM 3380 O ALA B 106 22.153 66.923 0.358 1.00 34.40 O ATOM 3381 CB ALA B 106 19.431 66.140 -0.684 1.00 32.17 C ATOM 3382 HA ALA B 106 19.069 66.546 1.356 1.00 0.00 H ATOM 3383 OXT ALA B 106 21.291 65.849 2.118 1.00 37.18 O ATOM 3384 HB1 ALA B 106 18.421 66.418 -0.986 1.00 0.00 H ATOM 3385 HB2 ALA B 106 20.136 66.424 -1.465 1.00 0.00 H ATOM 3386 HB3 ALA B 106 19.480 65.063 -0.523 1.00 0.00 H ATOM 3387 H ALA B 106 19.508 68.666 -0.544 1.00 0.00 H TER 3388 ALA B 106 HETATM 3389 O HOH 1 -0.596 64.792 10.693 1.00 2.01 O HETATM 3390 O HOH 2 3.306 62.245 -0.298 1.00 2.06 O HETATM 3391 O HOH 3 -9.016 53.500 3.884 1.00 5.56 O HETATM 3392 O HOH 4 -9.321 56.735 17.871 1.00 5.72 O HETATM 3393 O HOH 5 3.508 42.882 28.486 1.00 7.30 O HETATM 3394 O HOH 6 1.886 42.526 1.985 1.00 7.44 O HETATM 3395 O HOH 7 -4.568 45.118 17.900 1.00 7.65 O HETATM 3396 O HOH 8 -13.917 55.413 10.087 1.00 8.31 O HETATM 3397 O HOH 9 10.244 47.255 19.121 1.00 8.60 O HETATM 3398 O HOH 10 9.624 48.228 15.549 1.00 9.04 O HETATM 3399 O HOH 11 -9.983 68.935 8.224 1.00 11.26 O HETATM 3400 O HOH 12 -7.982 48.646 2.969 1.00 13.02 O HETATM 3401 O HOH 13 0.255 39.480 9.323 1.00 13.37 O HETATM 3402 O HOH 14 6.283 55.294 21.600 1.00 14.99 O HETATM 3403 O HOH 15 -16.850 56.166 24.645 1.00 16.06 O HETATM 3404 O HOH 16 9.531 65.437 14.930 1.00 16.55 O HETATM 3405 O HOH 17 -9.737 67.129 13.248 1.00 17.45 O HETATM 3406 O HOH 18 6.504 56.859 19.255 1.00 18.10 O HETATM 3407 O HOH 19 15.894 62.676 11.954 1.00 19.97 O HETATM 3408 O HOH 20 0.781 65.367 4.537 1.00 20.43 O HETATM 3409 O HOH 21 -9.572 56.457 15.274 1.00 20.66 O HETATM 3410 O HOH 22 2.660 60.739 25.537 1.00 20.78 O HETATM 3411 O HOH 23 4.737 44.230 7.985 1.00 20.80 O HETATM 3412 O HOH 24 -12.276 67.593 7.530 1.00 22.85 O HETATM 3413 O HOH 25 7.080 57.308 -2.002 1.00 23.67 O HETATM 3414 O HOH 26 7.529 64.637 22.856 1.00 24.76 O HETATM 3415 O HOH 27 0.563 41.481 10.704 1.00 24.80 O HETATM 3416 O HOH 28 2.609 66.479 7.069 1.00 25.19 O HETATM 3417 O HOH 29 -1.098 64.159 13.276 1.00 25.87 O HETATM 3418 O HOH 30 -10.292 50.761 8.410 1.00 26.13 O HETATM 3419 O HOH 31 12.093 65.390 2.233 1.00 26.86 O HETATM 3420 O HOH 32 0.495 46.398 3.631 1.00 27.63 O HETATM 3421 O HOH 33 -3.623 56.926 -0.386 1.00 28.02 O HETATM 3422 O HOH 34 13.813 55.289 9.460 1.00 29.03 O HETATM 3423 O HOH 35 11.837 51.266 13.487 1.00 29.12 O HETATM 3424 O HOH 36 4.200 37.672 18.010 1.00 29.35 O HETATM 3425 O HOH 37 8.705 56.675 24.015 1.00 29.70 O HETATM 3426 O HOH 38 2.666 41.018 20.366 1.00 30.14 O HETATM 3427 O HOH 39 -4.289 45.792 6.111 1.00 30.17 O HETATM 3428 O HOH 40 12.050 54.802 3.286 1.00 30.20 O HETATM 3429 O HOH 41 10.608 44.988 8.519 1.00 31.06 O HETATM 3430 O HOH 42 12.829 50.545 2.148 1.00 31.92 O HETATM 3431 O HOH 43 0.490 63.479 7.446 1.00 32.55 O HETATM 3432 O HOH 44 3.447 64.131 20.211 1.00 32.78 O HETATM 3433 O HOH 45 9.895 52.093 18.145 1.00 32.78 O HETATM 3434 O HOH 46 -12.405 64.834 10.456 1.00 33.10 O HETATM 3435 O HOH 47 20.005 52.703 12.461 1.00 33.47 O HETATM 3436 O HOH 48 -9.009 53.986 24.732 1.00 33.67 O HETATM 3437 O HOH 49 1.934 65.017 12.949 1.00 33.81 O HETATM 3438 O HOH 50 17.445 61.639 15.856 1.00 33.89 O HETATM 3439 O HOH 51 13.023 68.522 2.080 1.00 34.00 O HETATM 3440 O HOH 52 8.979 55.319 20.634 1.00 34.03 O HETATM 3441 O HOH 53 11.546 58.712 20.586 1.00 34.74 O HETATM 3442 O HOH 54 1.329 41.959 18.260 1.00 36.17 O HETATM 3443 O HOH 55 -4.231 53.627 26.122 1.00 36.23 O HETATM 3444 O HOH 56 13.092 46.287 13.453 1.00 36.55 O HETATM 3445 O HOH 57 18.381 66.208 12.233 1.00 36.98 O HETATM 3446 O HOH 58 0.191 39.982 27.010 1.00 38.59 O HETATM 3447 O HOH 59 5.484 39.199 6.180 1.00 39.40 O HETATM 3448 O HOH 60 10.007 70.966 17.830 1.00 40.93 O HETATM 3449 O HOH 61 -0.935 71.232 9.334 1.00 42.27 O HETATM 3450 O HOH 62 -8.621 56.959 30.144 1.00 41.22 O HETATM 3451 O HOH 63 -13.026 68.105 18.022 1.00 41.52 O HETATM 3452 O HOH 64 5.398 36.917 26.452 1.00 41.77 O HETATM 3453 O HOH 65 1.527 39.610 14.461 1.00 42.20 O HETATM 3454 O HOH 66 -11.675 47.896 9.704 1.00 42.98 O HETATM 3455 O HOH 67 -4.041 46.771 21.920 1.00 43.35 O HETATM 3456 O HOH 68 -3.423 55.188 30.482 1.00 43.53 O HETATM 3457 O HOH 69 11.409 52.568 -3.922 1.00 43.86 O HETATM 3458 O HOH 70 12.989 60.442 23.390 1.00 43.89 O HETATM 3459 O HOH 71 5.498 45.180 29.074 1.00 43.97 O HETATM 3460 O HOH 72 9.209 50.019 12.991 1.00 45.13 O HETATM 3461 O HOH 73 9.143 66.687 19.165 1.00 46.48 O HETATM 3462 O HOH 74 -6.781 45.163 19.520 1.00 46.96 O HETATM 3463 O HOH 75 9.678 68.437 13.983 1.00 48.81 O HETATM 3464 O HOH 76 7.950 43.630 9.830 1.00 51.35 O HETATM 3465 O HOH 77 15.847 41.073 23.083 1.00 52.05 O HETATM 3466 O HOH 78 13.706 62.717 -21.600 1.00 14.99 O HETATM 3467 O HOH 79 12.141 62.496 -19.255 1.00 18.10 O HETATM 3468 O HOH 80 6.324 53.106 -11.954 1.00 19.97 O HETATM 3469 O HOH 81 12.543 78.572 -15.274 1.00 20.66 O HETATM 3470 O HOH 82 8.261 66.340 -25.537 1.00 20.78 O HETATM 3471 O HOH 83 24.770 64.263 -7.985 1.00 20.80 O HETATM 3472 O HOH 84 1.407 81.276 -7.530 1.00 22.85 O HETATM 3473 O HOH 85 11.692 61.920 2.002 1.00 23.67 O HETATM 3474 O HOH 86 4.363 61.471 -22.856 1.00 24.76 O HETATM 3475 O HOH 87 27.519 68.437 -10.704 1.00 24.80 O HETATM 3476 O HOH 88 2.521 66.391 -7.069 1.00 25.19 O HETATM 3477 O HOH 89 4.841 70.098 -13.276 1.00 25.87 O HETATM 3478 O HOH 90 18.239 79.292 -8.410 1.00 26.13 O HETATM 3479 O HOH 91 3.610 56.907 -2.233 1.00 26.86 O HETATM 3480 O HOH 92 22.602 68.505 -3.631 1.00 27.63 O HETATM 3481 O HOH 93 12.074 72.623 0.386 1.00 28.02 O HETATM 3482 O HOH 94 13.711 55.187 -9.460 1.00 29.03 O HETATM 3483 O HOH 95 17.734 57.163 -13.487 1.00 29.12 O HETATM 3484 O HOH 96 31.328 64.800 -18.010 1.00 29.35 O HETATM 3485 O HOH 97 12.325 60.295 -24.015 1.00 29.70 O HETATM 3486 O HOH 98 27.982 66.334 -20.366 1.00 30.14 O HETATM 3487 O HOH 99 23.208 73.289 -6.111 1.00 30.17 O HETATM 3488 O HOH 100 14.198 56.950 -3.286 1.00 30.20 O HETATM 3489 O HOH 101 24.012 58.392 -8.519 1.00 31.06 O HETATM 3490 O HOH 102 18.455 56.171 -2.148 1.00 31.92 O HETATM 3491 O HOH 103 5.521 68.510 -7.446 1.00 32.55 O HETATM 3492 O HOH 104 4.869 65.553 -20.211 1.00 32.78 O HETATM 3493 O HOH 105 16.907 59.105 -18.145 1.00 32.78 O HETATM 3494 O HOH 106 4.166 81.405 -10.456 1.00 33.10 O HETATM 3495 O HOH 107 16.297 48.995 -12.461 1.00 33.47 O HETATM 3496 O HOH 108 15.014 78.009 -24.732 1.00 33.67 O HETATM 3497 O HOH 109 3.983 67.066 -12.949 1.00 33.81 O HETATM 3498 O HOH 110 7.361 51.555 -15.856 1.00 33.89 O HETATM 3499 O HOH 111 0.478 55.977 -2.080 1.00 34.00 O HETATM 3500 O HOH 112 13.681 60.021 -20.634 1.00 34.03 O HETATM 3501 O HOH 113 10.288 57.454 -20.586 1.00 34.74 O HETATM 3502 O HOH 114 27.041 67.671 -18.260 1.00 36.17 O HETATM 3503 O HOH 115 15.373 73.231 -26.122 1.00 36.23 O HETATM 3504 O HOH 116 22.713 55.908 -13.453 1.00 36.55 O HETATM 3505 O HOH 117 2.792 50.619 -12.233 1.00 36.98 O HETATM 3506 O HOH 118 29.018 68.809 -27.010 1.00 38.59 O HETATM 3507 O HOH 119 29.801 63.516 -6.180 1.00 39.40 O HETATM 3508 O HOH 120 -1.966 58.993 -17.830 1.00 40.93 O HETATM 3509 O HOH 121 -2.232 69.935 -9.334 1.00 42.27 O HETATM 3510 O HOH 122 12.041 77.621 -30.144 1.00 41.22 O HETATM 3511 O HOH 123 0.895 82.026 -18.022 1.00 41.52 O HETATM 3512 O HOH 124 32.083 63.602 -26.452 1.00 41.77 O HETATM 3513 O HOH 125 29.390 67.473 -14.461 1.00 42.20 O HETATM 3514 O HOH 126 21.104 80.675 -9.704 1.00 42.98 O HETATM 3515 O HOH 127 22.229 73.041 -21.920 1.00 43.35 O HETATM 3516 O HOH 128 13.812 72.423 -30.482 1.00 43.53 O HETATM 3517 O HOH 129 16.432 57.591 3.922 1.00 43.86 O HETATM 3518 O HOH 130 8.558 56.011 -23.390 1.00 43.89 O HETATM 3519 O HOH 131 23.820 63.502 -29.074 1.00 43.97 O HETATM 3520 O HOH 132 18.981 59.791 -12.991 1.00 45.13 O HETATM 3521 O HOH 133 2.313 59.857 -19.165 1.00 46.48 O HETATM 3522 O HOH 134 23.837 75.781 -19.520 1.00 46.96 O HETATM 3523 O HOH 135 0.563 59.322 -13.983 1.00 48.81 O HETATM 3524 O HOH 136 25.370 61.050 -9.830 1.00 51.35 O HETATM 3525 O HOH 137 27.927 53.153 -23.083 1.00 52.05 O HETATM 3526 C1 I A 3 2.972 57.170 28.819 1.00 0.15 C HETATM 3527 C2 I A 3 2.402 58.343 28.135 1.00 0.12 C HETATM 3528 C3 I A 3 1.403 57.936 27.036 1.00 0.12 C HETATM 3529 C4 I A 3 0.339 57.030 27.607 1.00 0.15 C HETATM 3530 C5 I A 3 1.010 55.801 28.200 1.00 0.15 C HETATM 3531 C6 I A 3 1.966 56.227 29.313 1.00 0.12 C HETATM 3532 O6 I A 3 2.584 55.074 29.910 1.00 -0.39 O HETATM 3533 H9 I A 3 1.913 54.510 30.276 1.00 0.21 H HETATM 3534 H6 I A 3 1.378 56.738 30.089 1.00 0.07 H HETATM 3535 O5 I A 3 -0.014 54.949 28.781 1.00 -0.27 O HETATM 3536 P5 I A 3 -0.360 53.656 28.480 1.00 0.20 P HETATM 3537 O51 I A 3 -1.690 53.649 28.310 1.00 -0.55 O HETATM 3538 O52 I A 3 0.190 53.157 27.285 1.00 -0.55 O HETATM 3539 O53 I A 3 0.212 52.903 29.438 1.00 -0.55 O HETATM 3540 H5 I A 3 1.560 55.257 27.417 1.00 0.07 H HETATM 3541 O4 I A 3 -0.567 56.702 26.508 1.00 -0.27 O HETATM 3542 P4 I A 3 -1.980 57.014 26.290 1.00 0.20 P HETATM 3543 O41 I A 3 -2.762 56.883 27.426 1.00 -0.55 O HETATM 3544 O42 I A 3 -1.849 58.397 26.096 1.00 -0.55 O HETATM 3545 O43 I A 3 -2.368 56.622 25.032 1.00 -0.55 O HETATM 3546 H4 I A 3 -0.220 57.551 28.399 1.00 0.07 H HETATM 3547 O3 I A 3 0.780 59.090 26.511 1.00 -0.39 O HETATM 3548 H8 I A 3 1.441 59.668 26.148 1.00 0.21 H HETATM 3549 H3 I A 3 1.940 57.410 26.233 1.00 0.07 H HETATM 3550 O2 I A 3 1.780 59.229 29.064 1.00 -0.39 O HETATM 3551 H7 I A 3 1.485 60.008 28.608 1.00 0.21 H HETATM 3552 H2 I A 3 3.230 58.883 27.654 1.00 0.07 H HETATM 3553 O1 I A 3 3.925 57.540 29.889 1.00 -0.27 O HETATM 3554 P1 I A 3 5.333 57.881 29.854 1.00 0.20 P HETATM 3555 O11 I A 3 5.403 59.260 29.660 1.00 -0.55 O HETATM 3556 O12 I A 3 5.847 57.172 28.709 1.00 -0.55 O HETATM 3557 O13 I A 3 6.019 57.235 30.879 1.00 -0.55 O HETATM 3558 H1 I A 3 3.553 56.629 28.057 1.00 0.07 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 1695 1696 1711 1712 1713 CONECT 1711 1695 CONECT 1712 1695 CONECT 1713 1695 CONECT 3526 3527 3531 3553 3558 CONECT 3527 3526 3528 3550 3552 CONECT 3528 3527 3529 3547 3549 CONECT 3529 3528 3530 3541 3546 CONECT 3530 3529 3531 3535 3540 CONECT 3531 3526 3530 3532 3534 CONECT 3532 3531 3533 CONECT 3533 3532 CONECT 3534 3531 CONECT 3535 3530 3536 CONECT 3536 3535 3537 3538 3539 CONECT 3537 3536 CONECT 3538 3536 CONECT 3539 3536 CONECT 3540 3530 CONECT 3541 3529 3542 CONECT 3542 3541 3543 3544 3545 CONECT 3543 3542 CONECT 3544 3542 CONECT 3545 3542 CONECT 3546 3529 CONECT 3547 3528 3548 CONECT 3548 3547 CONECT 3549 3528 CONECT 3550 3527 3551 CONECT 3551 3550 CONECT 3552 3527 CONECT 3553 3526 3554 CONECT 3554 3553 3555 3556 3557 CONECT 3555 3554 CONECT 3556 3554 CONECT 3557 3554 CONECT 3558 3526 MASTER 0 0 0 0 0 0 0 0 3556 2 41 18 END
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Related entries of code: 1btn
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
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Ligand Name
1h0a
RCSB PDB
PDBbind
I3P
1mai
RCSB PDB
PDBbind
I3P
1n4k
RCSB PDB
PDBbind
I3P
2p0d
RCSB PDB
PDBbind
I3P
3t8s
RCSB PDB
PDBbind
I3P
4np9
RCSB PDB
PDBbind
I3P
5hjq
RCSB PDB
PDBbind
I3P
6cv8
RCSB PDB
PDBbind
I3P
Entry Information
PDB ID
1btn
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
beta-spectrin
Ligand Name
I3P
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=40uM
Release Year
1996
Protein/NA Sequence
Check fasta file
Primary Reference
EMBO J. v14 pp. 4676-85, 1995
Ligand Properties
Formula
C
6
H
1
8
O
1
5
P
3
Molecular Weight
423.119
Exact Mass
422.986
No. of atoms
42
No. of bonds
42
Polar Surface Area
311.22
LOGP Value
-7.48 (
Computed with XLOGP3
)
-4.80 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 12
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 1
Canonical SMILES
O[C@@H]1[C@@H](OP(O)(O)O)[C@H](OP(O)(O)O)[C@H]([C@@H]([C@@H]1O)OP(O)(O)O)O
InChI String
InChI=1S/C6H21O15P3/c7-1-2(8)5(20-23(13,14)15)6(21-24(16,17)18)3(9)4(1)19-22(10,11)12/h1-18,22-24H/t1-,2+,3+,4-,5-,6-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q62261
Entrez Gene ID
NCBI Entrez Gene ID:
20742
ASD
Information of known allosteric effects of PDB entries
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