Browse entries in the PDBbind-CN Database
HEADER 1C7F_COMPLEX COMPND 1C7F_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 147 PRO LYS ALA LEU ILE VAL TYR GLY SER THR THR GLY ASN SEQRES 2 A 147 THR GLU TYR THR ALA GLU THR ILE ALA ARG GLU LEU ALA SEQRES 3 A 147 ASP ALA GLY TYR GLU VAL ASP SER ARG ASP ALA ALA SER SEQRES 4 A 147 VAL GLU ALA GLY GLY LEU PHE GLU GLY PHE ASP LEU VAL SEQRES 5 A 147 LEU LEU GLY CYS SER THR TRP GLY ASP ASP SER ILE GLU SEQRES 6 A 147 LEU GLN ASP ASP PHE ILE PRO LEU PHE ASP SER LEU GLU SEQRES 7 A 147 GLU THR GLY ALA GLN GLY ARG LYS VAL ALA CYS PHE GLY SEQRES 8 A 147 CYS GLY GLU SER SER TYR GLU TYR PHE CYS GLY ALA VAL SEQRES 9 A 147 ASP ALA ILE GLU GLU LYS LEU LYS ASN LEU GLY ALA GLU SEQRES 10 A 147 ILE VAL GLN ASP GLY LEU ARG ILE ASP GLY ASP PRO ARG SEQRES 11 A 147 ALA ALA ARG ASP ASP ILE VAL GLY TRP ALA HIS ASP VAL SEQRES 12 A 147 ARG GLY ALA ILE HET FMN A 214 50 ATOM 1 N PRO A 2 40.479 -2.323 -3.404 1.00 36.80 N ATOM 2 CA PRO A 2 39.742 -1.604 -2.330 1.00 34.91 C ATOM 3 C PRO A 2 38.899 -2.559 -1.484 1.00 34.89 C ATOM 4 O PRO A 2 38.729 -3.763 -1.808 1.00 33.51 O ATOM 5 CB PRO A 2 38.948 -0.506 -3.015 1.00 38.00 C ATOM 6 CG PRO A 2 39.281 -0.677 -4.467 1.00 38.14 C ATOM 7 CD PRO A 2 39.838 -2.049 -4.696 1.00 36.72 C ATOM 8 HA PRO A 2 40.420 -1.154 -1.605 1.00 0.00 H ATOM 9 HD3 PRO A 2 39.048 -2.769 -4.910 1.00 0.00 H ATOM 10 HD2 PRO A 2 40.563 -2.054 -5.510 1.00 0.00 H ATOM 11 HG3 PRO A 2 40.020 0.069 -4.760 1.00 0.00 H ATOM 12 HG2 PRO A 2 38.379 -0.547 -5.064 1.00 0.00 H ATOM 13 HB2 PRO A 2 37.879 -0.634 -2.844 1.00 0.00 H ATOM 14 HB3 PRO A 2 39.256 0.477 -2.659 1.00 0.00 H ATOM 15 N LYS A 3 38.549 -2.126 -0.283 1.00 27.00 N ATOM 16 CA LYS A 3 37.723 -2.868 0.630 1.00 25.71 C ATOM 17 C LYS A 3 36.327 -2.241 0.717 1.00 22.90 C ATOM 18 O LYS A 3 36.244 -1.042 0.997 1.00 21.86 O ATOM 19 CB LYS A 3 38.275 -2.751 2.064 1.00 31.27 C ATOM 20 CG LYS A 3 39.170 -3.902 2.467 1.00 48.83 C ATOM 21 CD LYS A 3 39.596 -3.768 3.917 1.00 56.71 C ATOM 22 CE LYS A 3 38.742 -4.578 4.869 1.00 62.23 C ATOM 23 NZ LYS A 3 39.140 -4.332 6.287 1.00 77.26 N ATOM 24 HA LYS A 3 37.700 -3.896 0.268 1.00 0.00 H ATOM 25 HB2 LYS A 3 38.848 -1.827 2.138 1.00 0.00 H ATOM 26 HB3 LYS A 3 37.433 -2.711 2.755 1.00 0.00 H ATOM 27 HG2 LYS A 3 38.628 -4.839 2.338 1.00 0.00 H ATOM 28 HG3 LYS A 3 40.056 -3.906 1.832 1.00 0.00 H ATOM 29 HD2 LYS A 3 40.629 -4.104 4.007 1.00 0.00 H ATOM 30 HD3 LYS A 3 39.531 -2.718 4.201 1.00 0.00 H ATOM 31 HE2 LYS A 3 38.863 -5.637 4.643 1.00 0.00 H ATOM 32 HE3 LYS A 3 37.697 -4.297 4.738 1.00 0.00 H ATOM 33 HZ1 LYS A 3 40.135 -4.603 6.418 1.00 0.00 H ATOM 34 HZ2 LYS A 3 39.022 -3.323 6.509 1.00 0.00 H ATOM 35 HZ3 LYS A 3 38.539 -4.899 6.918 1.00 0.00 H ATOM 36 H LYS A 3 38.893 -1.192 0.018 1.00 0.00 H ATOM 37 N ALA A 4 35.279 -3.007 0.567 1.00 21.40 N ATOM 38 CA ALA A 4 33.904 -2.480 0.672 1.00 20.12 C ATOM 39 C ALA A 4 33.161 -3.227 1.745 1.00 23.31 C ATOM 40 O ALA A 4 33.339 -4.436 1.984 1.00 21.63 O ATOM 41 CB ALA A 4 33.225 -2.649 -0.695 1.00 19.20 C ATOM 42 HA ALA A 4 33.909 -1.424 0.943 1.00 0.00 H ATOM 43 HB1 ALA A 4 33.785 -2.095 -1.448 1.00 0.00 H ATOM 44 HB2 ALA A 4 33.204 -3.706 -0.961 1.00 0.00 H ATOM 45 HB3 ALA A 4 32.206 -2.266 -0.643 1.00 0.00 H ATOM 46 H ALA A 4 35.418 -4.018 0.368 1.00 0.00 H ATOM 47 N LEU A 5 32.327 -2.501 2.473 1.00 18.12 N ATOM 48 CA LEU A 5 31.474 -3.070 3.495 1.00 17.91 C ATOM 49 C LEU A 5 30.028 -2.870 3.003 1.00 19.14 C ATOM 50 O LEU A 5 29.632 -1.766 2.546 1.00 17.60 O ATOM 51 CB LEU A 5 31.649 -2.428 4.846 1.00 15.04 C ATOM 52 CG LEU A 5 30.610 -2.723 5.892 1.00 22.16 C ATOM 53 CD1 LEU A 5 30.771 -4.132 6.465 1.00 21.70 C ATOM 54 CD2 LEU A 5 30.642 -1.785 7.107 1.00 22.84 C ATOM 55 HA LEU A 5 31.732 -4.120 3.637 1.00 0.00 H ATOM 56 HB2 LEU A 5 32.612 -2.753 5.240 1.00 0.00 H ATOM 57 HB3 LEU A 5 31.665 -1.349 4.696 1.00 0.00 H ATOM 58 HG LEU A 5 29.672 -2.592 5.352 1.00 0.00 H ATOM 59 HD21 LEU A 5 31.613 -1.859 7.596 1.00 0.00 H ATOM 60 HD22 LEU A 5 30.477 -0.759 6.777 1.00 0.00 H ATOM 61 HD23 LEU A 5 29.858 -2.073 7.808 1.00 0.00 H ATOM 62 HD11 LEU A 5 30.669 -4.863 5.663 1.00 0.00 H ATOM 63 HD12 LEU A 5 31.756 -4.227 6.922 1.00 0.00 H ATOM 64 HD13 LEU A 5 30.002 -4.307 7.217 1.00 0.00 H ATOM 65 H LEU A 5 32.283 -1.476 2.303 1.00 0.00 H ATOM 66 N ILE A 6 29.248 -3.949 3.078 1.00 16.80 N ATOM 67 CA ILE A 6 27.814 -3.832 2.742 1.00 16.63 C ATOM 68 C ILE A 6 27.047 -4.252 3.977 1.00 19.18 C ATOM 69 O ILE A 6 27.301 -5.353 4.551 1.00 19.49 O ATOM 70 CB ILE A 6 27.399 -4.711 1.561 1.00 21.15 C ATOM 71 CG1 ILE A 6 28.211 -4.465 0.323 1.00 23.01 C ATOM 72 CG2 ILE A 6 25.899 -4.453 1.294 1.00 22.62 C ATOM 73 CD1 ILE A 6 27.991 -5.353 -0.867 1.00 26.28 C ATOM 74 HA ILE A 6 27.602 -2.806 2.443 1.00 0.00 H ATOM 75 HB ILE A 6 27.581 -5.754 1.821 1.00 0.00 H ATOM 76 HG12 ILE A 6 28.009 -3.443 0.003 1.00 0.00 H ATOM 77 HG13 ILE A 6 29.260 -4.556 0.603 1.00 0.00 H ATOM 78 HD11 ILE A 6 28.207 -6.386 -0.593 1.00 0.00 H ATOM 79 HD12 ILE A 6 26.954 -5.271 -1.193 1.00 0.00 H ATOM 80 HD13 ILE A 6 28.653 -5.045 -1.676 1.00 0.00 H ATOM 81 HG21 ILE A 6 25.323 -4.712 2.183 1.00 0.00 H ATOM 82 HG22 ILE A 6 25.749 -3.400 1.057 1.00 0.00 H ATOM 83 HG23 ILE A 6 25.570 -5.066 0.455 1.00 0.00 H ATOM 84 H ILE A 6 29.645 -4.865 3.370 1.00 0.00 H ATOM 85 N VAL A 7 26.216 -3.379 4.539 1.00 15.08 N ATOM 86 CA VAL A 7 25.421 -3.737 5.698 1.00 17.10 C ATOM 87 C VAL A 7 23.957 -3.675 5.278 1.00 20.70 C ATOM 88 O VAL A 7 23.588 -2.619 4.756 1.00 20.16 O ATOM 89 CB VAL A 7 25.624 -2.811 6.904 1.00 19.54 C ATOM 90 CG1 VAL A 7 24.775 -3.272 8.075 1.00 16.70 C ATOM 91 CG2 VAL A 7 27.105 -2.806 7.304 1.00 27.85 C ATOM 92 HA VAL A 7 25.733 -4.731 6.020 1.00 0.00 H ATOM 93 HB VAL A 7 25.318 -1.801 6.629 1.00 0.00 H ATOM 94 HG11 VAL A 7 23.724 -3.257 7.788 1.00 0.00 H ATOM 95 HG12 VAL A 7 25.062 -4.286 8.353 1.00 0.00 H ATOM 96 HG13 VAL A 7 24.932 -2.603 8.921 1.00 0.00 H ATOM 97 HG21 VAL A 7 27.412 -3.818 7.567 1.00 0.00 H ATOM 98 HG22 VAL A 7 27.705 -2.449 6.467 1.00 0.00 H ATOM 99 HG23 VAL A 7 27.246 -2.147 8.161 1.00 0.00 H ATOM 100 H VAL A 7 26.135 -2.422 4.140 1.00 0.00 H ATOM 101 N TYR A 8 23.111 -4.659 5.610 1.00 20.79 N ATOM 102 CA TYR A 8 21.721 -4.617 5.180 1.00 17.98 C ATOM 103 C TYR A 8 20.785 -5.036 6.288 1.00 19.81 C ATOM 104 O TYR A 8 21.128 -5.831 7.144 1.00 21.29 O ATOM 105 CB TYR A 8 21.479 -5.485 3.906 1.00 19.01 C ATOM 106 CG TYR A 8 21.763 -6.969 4.197 1.00 18.25 C ATOM 107 CD1 TYR A 8 20.851 -7.860 4.738 1.00 22.40 C ATOM 108 CD2 TYR A 8 23.059 -7.411 3.903 1.00 21.03 C ATOM 109 CE1 TYR A 8 21.204 -9.193 4.985 1.00 22.13 C ATOM 110 CE2 TYR A 8 23.414 -8.728 4.151 1.00 26.10 C ATOM 111 CZ TYR A 8 22.483 -9.603 4.679 1.00 28.22 C ATOM 112 OH TYR A 8 22.934 -10.884 4.893 1.00 31.36 O ATOM 113 HA TYR A 8 21.505 -3.580 4.924 1.00 0.00 H ATOM 114 HB3 TYR A 8 22.140 -5.143 3.109 1.00 0.00 H ATOM 115 HB2 TYR A 8 20.442 -5.374 3.589 1.00 0.00 H ATOM 116 HD2 TYR A 8 23.788 -6.720 3.480 1.00 0.00 H ATOM 117 HE2 TYR A 8 24.424 -9.073 3.930 1.00 0.00 H ATOM 118 HE1 TYR A 8 20.482 -9.891 5.410 1.00 0.00 H ATOM 119 HD1 TYR A 8 19.843 -7.519 4.975 1.00 0.00 H ATOM 120 HH TYR A 8 22.201 -11.432 5.270 1.00 0.00 H ATOM 121 H TYR A 8 23.450 -5.460 6.180 1.00 0.00 H ATOM 122 N GLY A 9 19.582 -4.463 6.340 1.00 17.00 N ATOM 123 CA GLY A 9 18.532 -4.867 7.239 1.00 16.17 C ATOM 124 C GLY A 9 17.483 -5.474 6.215 1.00 19.03 C ATOM 125 O GLY A 9 16.954 -4.720 5.381 1.00 16.13 O ATOM 126 HA3 GLY A 9 18.118 -4.017 7.781 1.00 0.00 H ATOM 127 HA2 GLY A 9 18.879 -5.616 7.951 1.00 0.00 H ATOM 128 H GLY A 9 19.390 -3.674 5.690 1.00 0.00 H ATOM 129 N SER A 10 16.967 -6.678 6.516 1.00 14.37 N ATOM 130 CA SER A 10 16.031 -7.264 5.528 1.00 14.84 C ATOM 131 C SER A 10 15.147 -8.284 6.294 1.00 17.89 C ATOM 132 O SER A 10 15.683 -8.993 7.140 1.00 17.58 O ATOM 133 CB SER A 10 16.797 -8.058 4.475 1.00 14.12 C ATOM 134 OG SER A 10 15.934 -8.549 3.435 1.00 20.06 O ATOM 135 HA SER A 10 15.458 -6.469 5.051 1.00 0.00 H ATOM 136 HB2 SER A 10 17.283 -8.905 4.958 1.00 0.00 H ATOM 137 HB3 SER A 10 17.554 -7.412 4.029 1.00 0.00 H ATOM 138 HG SER A 10 15.493 -7.785 2.986 1.00 0.00 H ATOM 139 H SER A 10 17.212 -7.173 7.397 1.00 0.00 H ATOM 140 N THR A 11 13.868 -8.212 6.170 1.00 17.81 N ATOM 141 CA THR A 11 12.996 -9.117 6.933 1.00 19.84 C ATOM 142 C THR A 11 12.439 -10.224 6.042 1.00 22.49 C ATOM 143 O THR A 11 12.345 -11.364 6.504 1.00 23.05 O ATOM 144 CB THR A 11 11.825 -8.327 7.493 1.00 27.66 C ATOM 145 OG1 THR A 11 12.360 -7.378 8.424 1.00 22.88 O ATOM 146 CG2 THR A 11 10.799 -9.224 8.244 1.00 19.87 C ATOM 147 HA THR A 11 13.587 -9.564 7.733 1.00 0.00 H ATOM 148 HB THR A 11 11.299 -7.855 6.663 1.00 0.00 H ATOM 149 HG1 THR A 11 11.621 -6.844 8.810 1.00 0.00 H ATOM 150 HG23 THR A 11 10.380 -9.954 7.551 1.00 0.00 H ATOM 151 HG21 THR A 11 11.301 -9.743 9.060 1.00 0.00 H ATOM 152 HG22 THR A 11 9.999 -8.601 8.645 1.00 0.00 H ATOM 153 H THR A 11 13.449 -7.510 5.527 1.00 0.00 H ATOM 154 N THR A 12 12.176 -9.925 4.764 1.00 20.41 N ATOM 155 CA THR A 12 11.666 -11.021 3.937 1.00 25.28 C ATOM 156 C THR A 12 12.700 -11.498 2.950 1.00 26.54 C ATOM 157 O THR A 12 12.365 -12.341 2.123 1.00 28.51 O ATOM 158 CB THR A 12 10.311 -10.745 3.291 1.00 24.98 C ATOM 159 OG1 THR A 12 10.487 -9.869 2.199 1.00 22.80 O ATOM 160 CG2 THR A 12 9.323 -10.108 4.275 1.00 22.20 C ATOM 161 HA THR A 12 11.469 -11.843 4.626 1.00 0.00 H ATOM 162 HB THR A 12 9.900 -11.701 2.966 1.00 0.00 H ATOM 163 HG1 THR A 12 10.882 -9.020 2.519 1.00 0.00 H ATOM 164 HG23 THR A 12 9.177 -10.775 5.125 1.00 0.00 H ATOM 165 HG21 THR A 12 9.722 -9.155 4.623 1.00 0.00 H ATOM 166 HG22 THR A 12 8.369 -9.942 3.774 1.00 0.00 H ATOM 167 H THR A 12 12.325 -8.970 4.381 1.00 0.00 H ATOM 168 N GLY A 13 13.934 -11.000 3.005 1.00 22.98 N ATOM 169 CA GLY A 13 14.965 -11.435 2.067 1.00 17.98 C ATOM 170 C GLY A 13 15.152 -10.573 0.855 1.00 18.51 C ATOM 171 O GLY A 13 16.103 -10.807 0.094 1.00 17.00 O ATOM 172 HA3 GLY A 13 14.706 -12.438 1.727 1.00 0.00 H ATOM 173 HA2 GLY A 13 15.913 -11.468 2.604 1.00 0.00 H ATOM 174 H GLY A 13 14.167 -10.290 3.728 1.00 0.00 H ATOM 175 N ASN A 14 14.307 -9.552 0.556 1.00 15.16 N ATOM 176 CA ASN A 14 14.510 -8.840 -0.691 1.00 14.09 C ATOM 177 C ASN A 14 15.769 -7.904 -0.665 1.00 16.47 C ATOM 178 O ASN A 14 16.516 -7.903 -1.627 1.00 17.38 O ATOM 179 CB ASN A 14 13.308 -7.929 -0.972 1.00 13.30 C ATOM 180 CG ASN A 14 12.079 -8.798 -1.322 1.00 24.82 C ATOM 181 OD1 ASN A 14 12.251 -9.885 -1.834 1.00 23.33 O ATOM 182 ND2 ASN A 14 10.876 -8.366 -1.073 1.00 16.03 N ATOM 183 HA ASN A 14 14.643 -9.608 -1.453 1.00 0.00 H ATOM 184 HB2 ASN A 14 13.091 -7.330 -0.088 1.00 0.00 H ATOM 185 HB3 ASN A 14 13.538 -7.270 -1.809 1.00 0.00 H ATOM 186 HD22 ASN A 14 10.739 -7.433 -0.634 1.00 0.00 H ATOM 187 HD21 ASN A 14 10.052 -8.954 -1.313 1.00 0.00 H ATOM 188 H ASN A 14 13.537 -9.289 1.203 1.00 0.00 H ATOM 189 N THR A 15 15.903 -7.169 0.434 1.00 15.25 N ATOM 190 CA THR A 15 17.108 -6.282 0.512 1.00 18.21 C ATOM 191 C THR A 15 18.362 -7.131 0.666 1.00 20.21 C ATOM 192 O THR A 15 19.448 -6.768 0.196 1.00 17.81 O ATOM 193 CB THR A 15 16.986 -5.277 1.670 1.00 18.32 C ATOM 194 OG1 THR A 15 15.735 -4.598 1.512 1.00 14.80 O ATOM 195 CG2 THR A 15 18.139 -4.215 1.572 1.00 13.95 C ATOM 196 HA THR A 15 17.177 -5.709 -0.413 1.00 0.00 H ATOM 197 HB THR A 15 17.048 -5.792 2.629 1.00 0.00 H ATOM 198 HG1 THR A 15 14.997 -5.257 1.543 1.00 0.00 H ATOM 199 HG23 THR A 15 19.101 -4.713 1.690 1.00 0.00 H ATOM 200 HG21 THR A 15 18.099 -3.726 0.599 1.00 0.00 H ATOM 201 HG22 THR A 15 18.014 -3.472 2.359 1.00 0.00 H ATOM 202 H THR A 15 15.204 -7.208 1.204 1.00 0.00 H ATOM 203 N GLU A 16 18.226 -8.340 1.264 1.00 16.26 N ATOM 204 CA GLU A 16 19.384 -9.233 1.396 1.00 19.43 C ATOM 205 C GLU A 16 19.839 -9.724 0.044 1.00 17.59 C ATOM 206 O GLU A 16 21.026 -9.739 -0.381 1.00 19.14 O ATOM 207 CB GLU A 16 18.990 -10.427 2.314 1.00 22.05 C ATOM 208 CG GLU A 16 20.121 -11.465 2.292 1.00 30.05 C ATOM 209 CD GLU A 16 19.780 -12.603 3.257 1.00 38.48 C ATOM 210 OE1 GLU A 16 18.783 -12.625 3.978 1.00 38.70 O ATOM 211 OE2 GLU A 16 20.600 -13.524 3.251 1.00 46.95 O ATOM 212 HA GLU A 16 20.216 -8.688 1.842 1.00 0.00 H ATOM 213 HB2 GLU A 16 18.839 -10.071 3.333 1.00 0.00 H ATOM 214 HB3 GLU A 16 18.069 -10.881 1.949 1.00 0.00 H ATOM 215 HG2 GLU A 16 20.231 -11.863 1.283 1.00 0.00 H ATOM 216 HG3 GLU A 16 21.055 -10.994 2.599 1.00 0.00 H ATOM 217 H GLU A 16 17.299 -8.636 1.630 1.00 0.00 H ATOM 218 N TYR A 17 18.852 -10.102 -0.797 1.00 18.51 N ATOM 219 CA TYR A 17 19.156 -10.570 -2.152 1.00 19.98 C ATOM 220 C TYR A 17 19.832 -9.448 -2.938 1.00 20.08 C ATOM 221 O TYR A 17 20.723 -9.651 -3.739 1.00 19.39 O ATOM 222 CB TYR A 17 17.880 -11.003 -2.890 1.00 21.65 C ATOM 223 CG TYR A 17 18.032 -11.179 -4.365 1.00 21.96 C ATOM 224 CD1 TYR A 17 18.481 -12.388 -4.917 1.00 25.28 C ATOM 225 CD2 TYR A 17 17.824 -10.106 -5.218 1.00 20.88 C ATOM 226 CE1 TYR A 17 18.695 -12.516 -6.286 1.00 27.05 C ATOM 227 CE2 TYR A 17 18.013 -10.221 -6.587 1.00 21.92 C ATOM 228 CZ TYR A 17 18.396 -11.451 -7.108 1.00 27.07 C ATOM 229 OH TYR A 17 18.524 -11.503 -8.473 1.00 28.60 O ATOM 230 HA TYR A 17 19.820 -11.431 -2.074 1.00 0.00 H ATOM 231 HB3 TYR A 17 17.115 -10.246 -2.717 1.00 0.00 H ATOM 232 HB2 TYR A 17 17.551 -11.953 -2.468 1.00 0.00 H ATOM 233 HD2 TYR A 17 17.505 -9.150 -4.803 1.00 0.00 H ATOM 234 HE2 TYR A 17 17.864 -9.363 -7.242 1.00 0.00 H ATOM 235 HE1 TYR A 17 19.092 -13.442 -6.701 1.00 0.00 H ATOM 236 HD1 TYR A 17 18.665 -13.241 -4.263 1.00 0.00 H ATOM 237 HH TYR A 17 18.798 -12.415 -8.743 1.00 0.00 H ATOM 238 H TYR A 17 17.863 -10.060 -0.479 1.00 0.00 H ATOM 239 N THR A 18 19.321 -8.233 -2.724 1.00 17.90 N ATOM 240 CA THR A 18 19.903 -7.060 -3.419 1.00 18.73 C ATOM 241 C THR A 18 21.369 -6.870 -2.957 1.00 14.51 C ATOM 242 O THR A 18 22.215 -6.697 -3.802 1.00 18.12 O ATOM 243 CB THR A 18 19.052 -5.812 -3.136 1.00 21.29 C ATOM 244 OG1 THR A 18 17.676 -6.059 -3.534 1.00 19.16 O ATOM 245 CG2 THR A 18 19.567 -4.590 -3.876 1.00 16.71 C ATOM 246 HA THR A 18 19.903 -7.223 -4.497 1.00 0.00 H ATOM 247 HB THR A 18 19.113 -5.611 -2.066 1.00 0.00 H ATOM 248 HG1 THR A 18 17.318 -6.826 -3.020 1.00 0.00 H ATOM 249 HG23 THR A 18 20.599 -4.398 -3.583 1.00 0.00 H ATOM 250 HG21 THR A 18 19.520 -4.771 -4.950 1.00 0.00 H ATOM 251 HG22 THR A 18 18.950 -3.728 -3.624 1.00 0.00 H ATOM 252 H THR A 18 18.519 -8.110 -2.073 1.00 0.00 H ATOM 253 N ALA A 19 21.598 -6.904 -1.655 1.00 16.19 N ATOM 254 CA ALA A 19 22.962 -6.755 -1.120 1.00 15.21 C ATOM 255 C ALA A 19 23.922 -7.765 -1.693 1.00 19.91 C ATOM 256 O ALA A 19 25.043 -7.435 -2.103 1.00 19.79 O ATOM 257 CB ALA A 19 22.856 -6.913 0.392 1.00 9.92 C ATOM 258 HA ALA A 19 23.362 -5.779 -1.397 1.00 0.00 H ATOM 259 HB1 ALA A 19 22.195 -6.143 0.791 1.00 0.00 H ATOM 260 HB2 ALA A 19 22.452 -7.898 0.626 1.00 0.00 H ATOM 261 HB3 ALA A 19 23.846 -6.810 0.837 1.00 0.00 H ATOM 262 H ALA A 19 20.802 -7.038 -0.999 1.00 0.00 H ATOM 263 N GLU A 20 23.485 -9.051 -1.800 1.00 19.95 N ATOM 264 CA GLU A 20 24.390 -10.076 -2.361 1.00 23.33 C ATOM 265 C GLU A 20 24.660 -9.945 -3.808 1.00 21.86 C ATOM 266 O GLU A 20 25.778 -10.274 -4.292 1.00 22.67 O ATOM 267 CB GLU A 20 23.828 -11.526 -2.120 1.00 31.29 C ATOM 268 CG GLU A 20 23.278 -11.643 -0.742 1.00 46.54 C ATOM 269 CD GLU A 20 23.755 -12.714 0.179 1.00 68.72 C ATOM 270 OE1 GLU A 20 23.207 -13.838 0.108 1.00 74.61 O ATOM 271 OE2 GLU A 20 24.516 -12.354 1.114 1.00 76.29 O ATOM 272 HA GLU A 20 25.327 -9.910 -1.829 1.00 0.00 H ATOM 273 HB2 GLU A 20 23.037 -11.730 -2.842 1.00 0.00 H ATOM 274 HB3 GLU A 20 24.632 -12.250 -2.249 1.00 0.00 H ATOM 275 HG2 GLU A 20 23.477 -10.693 -0.245 1.00 0.00 H ATOM 276 HG3 GLU A 20 22.202 -11.778 -0.846 1.00 0.00 H ATOM 277 H GLU A 20 22.526 -9.308 -1.491 1.00 0.00 H ATOM 278 N THR A 21 23.698 -9.481 -4.593 1.00 19.52 N ATOM 279 CA THR A 21 23.947 -9.248 -6.015 1.00 20.05 C ATOM 280 C THR A 21 24.965 -8.102 -6.153 1.00 24.98 C ATOM 281 O THR A 21 25.888 -8.126 -6.975 1.00 23.25 O ATOM 282 CB THR A 21 22.627 -8.870 -6.706 1.00 18.58 C ATOM 283 OG1 THR A 21 21.648 -9.917 -6.542 1.00 25.49 O ATOM 284 CG2 THR A 21 22.784 -8.520 -8.169 1.00 21.77 C ATOM 285 HA THR A 21 24.345 -10.148 -6.484 1.00 0.00 H ATOM 286 HB THR A 21 22.279 -7.963 -6.211 1.00 0.00 H ATOM 287 HG1 THR A 21 21.476 -10.058 -5.577 1.00 0.00 H ATOM 288 HG23 THR A 21 23.526 -7.729 -8.274 1.00 0.00 H ATOM 289 HG21 THR A 21 23.111 -9.402 -8.719 1.00 0.00 H ATOM 290 HG22 THR A 21 21.828 -8.178 -8.564 1.00 0.00 H ATOM 291 H THR A 21 22.758 -9.281 -4.194 1.00 0.00 H ATOM 292 N ILE A 22 24.810 -7.037 -5.326 1.00 23.95 N ATOM 293 CA ILE A 22 25.828 -5.949 -5.399 1.00 23.80 C ATOM 294 C ILE A 22 27.188 -6.515 -4.991 1.00 21.95 C ATOM 295 O ILE A 22 28.200 -6.306 -5.669 1.00 22.13 O ATOM 296 CB ILE A 22 25.418 -4.789 -4.461 1.00 23.18 C ATOM 297 CG1 ILE A 22 24.130 -4.121 -4.983 1.00 15.07 C ATOM 298 CG2 ILE A 22 26.551 -3.754 -4.341 1.00 22.82 C ATOM 299 CD1 ILE A 22 23.354 -3.424 -3.882 1.00 17.91 C ATOM 300 HA ILE A 22 25.892 -5.563 -6.416 1.00 0.00 H ATOM 301 HB ILE A 22 25.228 -5.197 -3.468 1.00 0.00 H ATOM 302 HG12 ILE A 22 24.399 -3.386 -5.742 1.00 0.00 H ATOM 303 HG13 ILE A 22 23.495 -4.886 -5.429 1.00 0.00 H ATOM 304 HD11 ILE A 22 23.072 -4.152 -3.121 1.00 0.00 H ATOM 305 HD12 ILE A 22 23.977 -2.651 -3.434 1.00 0.00 H ATOM 306 HD13 ILE A 22 22.457 -2.970 -4.303 1.00 0.00 H ATOM 307 HG21 ILE A 22 27.440 -4.236 -3.935 1.00 0.00 H ATOM 308 HG22 ILE A 22 26.775 -3.346 -5.327 1.00 0.00 H ATOM 309 HG23 ILE A 22 26.237 -2.949 -3.676 1.00 0.00 H ATOM 310 H ILE A 22 24.009 -6.981 -4.664 1.00 0.00 H ATOM 311 N ALA A 23 27.308 -7.231 -3.894 1.00 21.58 N ATOM 312 CA ALA A 23 28.544 -7.797 -3.416 1.00 22.50 C ATOM 313 C ALA A 23 29.262 -8.602 -4.500 1.00 26.57 C ATOM 314 O ALA A 23 30.509 -8.463 -4.611 1.00 25.98 O ATOM 315 CB ALA A 23 28.312 -8.696 -2.189 1.00 17.66 C ATOM 316 HA ALA A 23 29.176 -6.956 -3.131 1.00 0.00 H ATOM 317 HB1 ALA A 23 27.868 -8.106 -1.387 1.00 0.00 H ATOM 318 HB2 ALA A 23 27.639 -9.510 -2.459 1.00 0.00 H ATOM 319 HB3 ALA A 23 29.265 -9.106 -1.855 1.00 0.00 H ATOM 320 H ALA A 23 26.450 -7.401 -3.332 1.00 0.00 H ATOM 321 N ARG A 24 28.523 -9.416 -5.262 1.00 26.10 N ATOM 322 CA ARG A 24 29.127 -10.216 -6.321 1.00 29.39 C ATOM 323 C ARG A 24 29.715 -9.356 -7.416 1.00 30.49 C ATOM 324 O ARG A 24 30.819 -9.598 -7.951 1.00 29.62 O ATOM 325 CB ARG A 24 28.110 -11.186 -6.977 1.00 32.79 C ATOM 326 CG ARG A 24 28.671 -11.897 -8.201 1.00 49.77 C ATOM 327 CD ARG A 24 29.854 -12.804 -7.874 1.00 67.53 C ATOM 328 NE ARG A 24 29.916 -13.176 -6.467 1.00 89.43 N ATOM 329 CZ ARG A 24 30.858 -13.834 -5.808 1.00 98.06 C ATOM 330 NH1 ARG A 24 31.931 -14.283 -6.450 1.00102.51 N ATOM 331 NH2 ARG A 24 30.731 -14.076 -4.508 1.00102.48 N ATOM 332 HA ARG A 24 29.917 -10.787 -5.833 1.00 0.00 H ATOM 333 HB2 ARG A 24 27.821 -11.936 -6.241 1.00 0.00 H ATOM 334 HB3 ARG A 24 27.231 -10.616 -7.278 1.00 0.00 H ATOM 335 HG2 ARG A 24 27.880 -12.503 -8.644 1.00 0.00 H ATOM 336 HG3 ARG A 24 28.997 -11.146 -8.920 1.00 0.00 H ATOM 337 HD2 ARG A 24 30.774 -12.282 -8.136 1.00 0.00 H ATOM 338 HD3 ARG A 24 29.770 -13.713 -8.470 1.00 0.00 H ATOM 339 HE ARG A 24 29.099 -12.881 -5.895 1.00 0.00 H ATOM 340 HH12 ARG A 24 32.669 -14.799 -5.931 1.00 0.00 H ATOM 341 HH11 ARG A 24 32.032 -14.118 -7.472 1.00 0.00 H ATOM 342 HH22 ARG A 24 31.477 -14.594 -4.000 1.00 0.00 H ATOM 343 HH21 ARG A 24 29.886 -13.748 -3.998 1.00 0.00 H ATOM 344 H ARG A 24 27.498 -9.479 -5.096 1.00 0.00 H ATOM 345 N GLU A 25 28.976 -8.291 -7.770 1.00 27.21 N ATOM 346 CA GLU A 25 29.490 -7.398 -8.798 1.00 25.53 C ATOM 347 C GLU A 25 30.766 -6.691 -8.324 1.00 26.51 C ATOM 348 O GLU A 25 31.664 -6.457 -9.149 1.00 28.94 O ATOM 349 CB GLU A 25 28.510 -6.344 -9.246 1.00 27.34 C ATOM 350 CG GLU A 25 27.244 -6.912 -9.903 1.00 35.50 C ATOM 351 CD GLU A 25 27.688 -7.718 -11.123 1.00 41.99 C ATOM 352 OE1 GLU A 25 28.407 -7.203 -11.997 1.00 35.48 O ATOM 353 OE2 GLU A 25 27.417 -8.928 -11.218 1.00 36.98 O ATOM 354 HA GLU A 25 29.693 -8.047 -9.650 1.00 0.00 H ATOM 355 HB2 GLU A 25 28.213 -5.759 -8.376 1.00 0.00 H ATOM 356 HB3 GLU A 25 29.009 -5.695 -9.965 1.00 0.00 H ATOM 357 HG2 GLU A 25 26.716 -7.558 -9.201 1.00 0.00 H ATOM 358 HG3 GLU A 25 26.587 -6.099 -10.212 1.00 0.00 H ATOM 359 H GLU A 25 28.057 -8.109 -7.319 1.00 0.00 H ATOM 360 N LEU A 26 30.851 -6.273 -7.068 1.00 23.98 N ATOM 361 CA LEU A 26 32.054 -5.576 -6.616 1.00 24.52 C ATOM 362 C LEU A 26 33.194 -6.594 -6.528 1.00 27.91 C ATOM 363 O LEU A 26 34.309 -6.339 -6.963 1.00 30.14 O ATOM 364 CB LEU A 26 31.820 -4.920 -5.246 1.00 28.45 C ATOM 365 CG LEU A 26 30.777 -3.782 -5.290 1.00 37.03 C ATOM 366 CD1 LEU A 26 30.392 -3.382 -3.878 1.00 35.22 C ATOM 367 CD2 LEU A 26 31.310 -2.562 -6.013 1.00 33.69 C ATOM 368 HA LEU A 26 32.309 -4.786 -7.323 1.00 0.00 H ATOM 369 HB2 LEU A 26 31.472 -5.683 -4.550 1.00 0.00 H ATOM 370 HB3 LEU A 26 32.766 -4.511 -4.891 1.00 0.00 H ATOM 371 HG LEU A 26 29.908 -4.155 -5.832 1.00 0.00 H ATOM 372 HD21 LEU A 26 32.198 -2.195 -5.498 1.00 0.00 H ATOM 373 HD22 LEU A 26 31.568 -2.832 -7.037 1.00 0.00 H ATOM 374 HD23 LEU A 26 30.546 -1.784 -6.022 1.00 0.00 H ATOM 375 HD11 LEU A 26 29.966 -4.242 -3.361 1.00 0.00 H ATOM 376 HD12 LEU A 26 31.278 -3.039 -3.345 1.00 0.00 H ATOM 377 HD13 LEU A 26 29.656 -2.579 -3.917 1.00 0.00 H ATOM 378 H LEU A 26 30.065 -6.440 -6.408 1.00 0.00 H ATOM 379 N ALA A 27 32.948 -7.757 -5.973 1.00 28.26 N ATOM 380 CA ALA A 27 33.960 -8.818 -5.886 1.00 32.66 C ATOM 381 C ALA A 27 34.488 -9.165 -7.271 1.00 34.77 C ATOM 382 O ALA A 27 35.726 -9.163 -7.451 1.00 36.74 O ATOM 383 CB ALA A 27 33.354 -10.058 -5.251 1.00 26.45 C ATOM 384 HA ALA A 27 34.786 -8.459 -5.272 1.00 0.00 H ATOM 385 HB1 ALA A 27 32.999 -9.815 -4.249 1.00 0.00 H ATOM 386 HB2 ALA A 27 32.519 -10.405 -5.860 1.00 0.00 H ATOM 387 HB3 ALA A 27 34.111 -10.840 -5.190 1.00 0.00 H ATOM 388 H ALA A 27 32.002 -7.934 -5.580 1.00 0.00 H ATOM 389 N ASP A 28 33.659 -9.299 -8.310 1.00 34.31 N ATOM 390 CA ASP A 28 34.163 -9.572 -9.656 1.00 36.67 C ATOM 391 C ASP A 28 34.994 -8.417 -10.180 1.00 36.65 C ATOM 392 O ASP A 28 35.807 -8.580 -11.106 1.00 36.64 O ATOM 393 CB ASP A 28 33.059 -9.877 -10.661 1.00 39.12 C ATOM 394 CG ASP A 28 32.369 -11.197 -10.389 1.00 47.40 C ATOM 395 OD1 ASP A 28 32.821 -11.958 -9.503 1.00 51.88 O ATOM 396 OD2 ASP A 28 31.343 -11.502 -11.047 1.00 51.60 O ATOM 397 HA ASP A 28 34.783 -10.463 -9.555 1.00 0.00 H ATOM 398 HB2 ASP A 28 32.317 -9.080 -10.617 1.00 0.00 H ATOM 399 HB3 ASP A 28 33.495 -9.911 -11.659 1.00 0.00 H ATOM 400 H ASP A 28 32.634 -9.207 -8.159 1.00 0.00 H ATOM 401 N ALA A 29 34.843 -7.230 -9.622 1.00 35.46 N ATOM 402 CA ALA A 29 35.634 -6.073 -10.051 1.00 35.66 C ATOM 403 C ALA A 29 36.919 -5.973 -9.236 1.00 34.51 C ATOM 404 O ALA A 29 37.443 -4.862 -9.074 1.00 37.54 O ATOM 405 CB ALA A 29 34.798 -4.813 -9.814 1.00 37.88 C ATOM 406 HA ALA A 29 35.895 -6.180 -11.104 1.00 0.00 H ATOM 407 HB1 ALA A 29 33.877 -4.875 -10.394 1.00 0.00 H ATOM 408 HB2 ALA A 29 34.557 -4.732 -8.754 1.00 0.00 H ATOM 409 HB3 ALA A 29 35.367 -3.937 -10.126 1.00 0.00 H ATOM 410 H ALA A 29 34.146 -7.113 -8.859 1.00 0.00 H ATOM 411 N GLY A 30 37.222 -6.945 -8.380 1.00 33.91 N ATOM 412 CA GLY A 30 38.465 -6.872 -7.641 1.00 34.87 C ATOM 413 C GLY A 30 38.347 -6.271 -6.264 1.00 36.06 C ATOM 414 O GLY A 30 39.380 -6.189 -5.570 1.00 36.33 O ATOM 415 HA3 GLY A 30 39.167 -6.268 -8.216 1.00 0.00 H ATOM 416 HA2 GLY A 30 38.858 -7.883 -7.537 1.00 0.00 H ATOM 417 H GLY A 30 36.574 -7.747 -8.243 1.00 0.00 H ATOM 418 N TYR A 31 37.175 -5.951 -5.736 1.00 29.53 N ATOM 419 CA TYR A 31 37.124 -5.468 -4.363 1.00 25.93 C ATOM 420 C TYR A 31 37.210 -6.652 -3.405 1.00 26.77 C ATOM 421 O TYR A 31 36.562 -7.657 -3.756 1.00 26.01 O ATOM 422 CB TYR A 31 35.755 -4.835 -4.076 1.00 31.88 C ATOM 423 CG TYR A 31 35.626 -3.447 -4.644 1.00 37.92 C ATOM 424 CD1 TYR A 31 36.243 -2.379 -4.014 1.00 43.36 C ATOM 425 CD2 TYR A 31 34.737 -3.128 -5.650 1.00 45.69 C ATOM 426 CE1 TYR A 31 36.107 -1.073 -4.482 1.00 45.23 C ATOM 427 CE2 TYR A 31 34.599 -1.831 -6.110 1.00 47.49 C ATOM 428 CZ TYR A 31 35.329 -0.809 -5.571 1.00 45.37 C ATOM 429 OH TYR A 31 35.206 0.476 -6.032 1.00 46.80 O ATOM 430 HA TYR A 31 37.941 -4.758 -4.233 1.00 0.00 H ATOM 431 HB3 TYR A 31 35.613 -4.785 -2.996 1.00 0.00 H ATOM 432 HB2 TYR A 31 34.981 -5.465 -4.514 1.00 0.00 H ATOM 433 HD2 TYR A 31 34.129 -3.917 -6.093 1.00 0.00 H ATOM 434 HE2 TYR A 31 33.896 -1.620 -6.916 1.00 0.00 H ATOM 435 HE1 TYR A 31 36.625 -0.259 -3.975 1.00 0.00 H ATOM 436 HD1 TYR A 31 36.851 -2.565 -3.129 1.00 0.00 H ATOM 437 HH TYR A 31 35.812 1.068 -5.520 1.00 0.00 H ATOM 438 H TYR A 31 36.303 -6.043 -6.295 1.00 0.00 H ATOM 439 N GLU A 32 37.597 -6.426 -2.161 1.00 24.40 N ATOM 440 CA GLU A 32 37.372 -7.387 -1.095 1.00 29.25 C ATOM 441 C GLU A 32 36.102 -6.836 -0.423 1.00 29.59 C ATOM 442 O GLU A 32 36.111 -5.659 -0.055 1.00 30.70 O ATOM 443 CB GLU A 32 38.394 -7.584 0.000 1.00 32.31 C ATOM 444 CG GLU A 32 39.457 -6.535 0.179 1.00 61.49 C ATOM 445 CD GLU A 32 40.593 -7.064 1.052 1.00 72.60 C ATOM 446 OE1 GLU A 32 40.277 -7.651 2.115 1.00 70.49 O ATOM 447 OE2 GLU A 32 41.758 -6.887 0.643 1.00 75.11 O ATOM 448 HA GLU A 32 37.365 -8.369 -1.568 1.00 0.00 H ATOM 449 HB2 GLU A 32 37.849 -7.656 0.941 1.00 0.00 H ATOM 450 HB3 GLU A 32 38.902 -8.528 -0.198 1.00 0.00 H ATOM 451 HG2 GLU A 32 39.855 -6.257 -0.797 1.00 0.00 H ATOM 452 HG3 GLU A 32 39.018 -5.658 0.654 1.00 0.00 H ATOM 453 H GLU A 32 38.078 -5.531 -1.938 1.00 0.00 H ATOM 454 N VAL A 33 35.090 -7.681 -0.380 1.00 27.20 N ATOM 455 CA VAL A 33 33.786 -7.287 0.127 1.00 27.77 C ATOM 456 C VAL A 33 33.357 -8.047 1.347 1.00 26.55 C ATOM 457 O VAL A 33 33.469 -9.256 1.426 1.00 26.26 O ATOM 458 CB VAL A 33 32.744 -7.582 -0.997 1.00 28.23 C ATOM 459 CG1 VAL A 33 31.398 -7.025 -0.579 1.00 31.44 C ATOM 460 CG2 VAL A 33 33.196 -7.020 -2.324 1.00 29.02 C ATOM 461 HA VAL A 33 33.847 -6.235 0.405 1.00 0.00 H ATOM 462 HB VAL A 33 32.653 -8.660 -1.133 1.00 0.00 H ATOM 463 HG11 VAL A 33 31.082 -7.500 0.350 1.00 0.00 H ATOM 464 HG12 VAL A 33 31.483 -5.949 -0.428 1.00 0.00 H ATOM 465 HG13 VAL A 33 30.664 -7.227 -1.359 1.00 0.00 H ATOM 466 HG21 VAL A 33 33.318 -5.940 -2.237 1.00 0.00 H ATOM 467 HG22 VAL A 33 34.147 -7.473 -2.604 1.00 0.00 H ATOM 468 HG23 VAL A 33 32.448 -7.243 -3.085 1.00 0.00 H ATOM 469 H VAL A 33 35.229 -8.655 -0.718 1.00 0.00 H ATOM 470 N ASP A 34 32.959 -7.346 2.371 1.00 20.86 N ATOM 471 CA ASP A 34 32.458 -7.877 3.602 1.00 23.12 C ATOM 472 C ASP A 34 30.962 -7.540 3.618 1.00 26.81 C ATOM 473 O ASP A 34 30.611 -6.356 3.659 1.00 21.68 O ATOM 474 CB ASP A 34 33.228 -7.158 4.677 1.00 25.84 C ATOM 475 CG ASP A 34 33.197 -7.689 6.061 1.00 43.64 C ATOM 476 OD1 ASP A 34 32.148 -8.146 6.529 1.00 46.80 O ATOM 477 OD2 ASP A 34 34.218 -7.560 6.772 1.00 47.03 O ATOM 478 HA ASP A 34 32.573 -8.952 3.738 1.00 0.00 H ATOM 479 HB2 ASP A 34 34.272 -7.140 4.365 1.00 0.00 H ATOM 480 HB3 ASP A 34 32.845 -6.138 4.717 1.00 0.00 H ATOM 481 H ASP A 34 33.010 -6.311 2.286 1.00 0.00 H ATOM 482 N SER A 35 30.141 -8.575 3.582 1.00 20.86 N ATOM 483 CA SER A 35 28.687 -8.364 3.548 1.00 25.11 C ATOM 484 C SER A 35 28.016 -8.816 4.800 1.00 27.44 C ATOM 485 O SER A 35 28.246 -9.941 5.272 1.00 27.48 O ATOM 486 CB SER A 35 28.194 -9.084 2.266 1.00 31.26 C ATOM 487 OG SER A 35 26.841 -8.676 2.075 1.00 43.19 O ATOM 488 HA SER A 35 28.430 -7.306 3.506 1.00 0.00 H ATOM 489 HB2 SER A 35 28.248 -10.165 2.395 1.00 0.00 H ATOM 490 HB3 SER A 35 28.802 -8.790 1.410 1.00 0.00 H ATOM 491 HG SER A 35 26.478 -9.111 1.263 1.00 0.00 H ATOM 492 H SER A 35 30.525 -9.542 3.578 1.00 0.00 H ATOM 493 N ARG A 36 27.423 -7.935 5.613 1.00 20.02 N ATOM 494 CA ARG A 36 26.914 -8.281 6.913 1.00 20.27 C ATOM 495 C ARG A 36 25.475 -7.843 7.108 1.00 24.17 C ATOM 496 O ARG A 36 25.027 -6.750 6.737 1.00 17.92 O ATOM 497 CB ARG A 36 27.688 -7.603 8.067 1.00 19.82 C ATOM 498 CG ARG A 36 29.210 -7.642 7.847 1.00 29.63 C ATOM 499 CD ARG A 36 30.001 -7.259 9.083 1.00 40.21 C ATOM 500 NE ARG A 36 31.409 -7.005 8.794 1.00 47.17 N ATOM 501 CZ ARG A 36 32.296 -6.312 9.502 1.00 43.02 C ATOM 502 NH1 ARG A 36 32.017 -5.741 10.655 1.00 38.84 N ATOM 503 NH2 ARG A 36 33.537 -6.219 9.033 1.00 40.66 N ATOM 504 HA ARG A 36 27.020 -9.365 6.945 1.00 0.00 H ATOM 505 HB2 ARG A 36 27.370 -6.563 8.140 1.00 0.00 H ATOM 506 HB3 ARG A 36 27.454 -8.119 8.998 1.00 0.00 H ATOM 507 HG2 ARG A 36 29.492 -8.653 7.554 1.00 0.00 H ATOM 508 HG3 ARG A 36 29.463 -6.949 7.045 1.00 0.00 H ATOM 509 HD2 ARG A 36 29.934 -8.072 9.806 1.00 0.00 H ATOM 510 HD3 ARG A 36 29.564 -6.357 9.511 1.00 0.00 H ATOM 511 HE ARG A 36 31.768 -7.424 7.912 1.00 0.00 H ATOM 512 HH12 ARG A 36 32.753 -5.211 11.164 1.00 0.00 H ATOM 513 HH11 ARG A 36 31.061 -5.820 11.057 1.00 0.00 H ATOM 514 HH22 ARG A 36 34.254 -5.684 9.563 1.00 0.00 H ATOM 515 HH21 ARG A 36 33.790 -6.681 8.136 1.00 0.00 H ATOM 516 H ARG A 36 27.325 -6.952 5.289 1.00 0.00 H ATOM 517 N ASP A 37 24.773 -8.734 7.793 1.00 18.79 N ATOM 518 CA ASP A 37 23.401 -8.436 8.186 1.00 19.61 C ATOM 519 C ASP A 37 23.531 -7.436 9.311 1.00 18.97 C ATOM 520 O ASP A 37 24.316 -7.639 10.262 1.00 18.73 O ATOM 521 CB ASP A 37 22.742 -9.737 8.655 1.00 25.71 C ATOM 522 CG ASP A 37 21.317 -9.626 9.090 1.00 30.26 C ATOM 523 OD1 ASP A 37 20.749 -8.654 9.657 1.00 27.83 O ATOM 524 OD2 ASP A 37 20.667 -10.676 8.819 1.00 31.89 O ATOM 525 HA ASP A 37 22.786 -8.033 7.381 1.00 0.00 H ATOM 526 HB2 ASP A 37 22.786 -10.450 7.831 1.00 0.00 H ATOM 527 HB3 ASP A 37 23.320 -10.120 9.496 1.00 0.00 H ATOM 528 H ASP A 37 25.201 -9.646 8.050 1.00 0.00 H ATOM 529 N ALA A 38 22.606 -6.474 9.418 1.00 16.20 N ATOM 530 CA ALA A 38 22.652 -5.455 10.451 1.00 18.24 C ATOM 531 C ALA A 38 22.422 -6.001 11.826 1.00 20.39 C ATOM 532 O ALA A 38 22.866 -5.432 12.850 1.00 20.46 O ATOM 533 CB ALA A 38 21.600 -4.349 10.170 1.00 18.08 C ATOM 534 HA ALA A 38 23.660 -5.042 10.421 1.00 0.00 H ATOM 535 HB1 ALA A 38 21.810 -3.886 9.206 1.00 0.00 H ATOM 536 HB2 ALA A 38 20.604 -4.792 10.153 1.00 0.00 H ATOM 537 HB3 ALA A 38 21.650 -3.594 10.955 1.00 0.00 H ATOM 538 H ALA A 38 21.823 -6.456 8.734 1.00 0.00 H ATOM 539 N ALA A 39 21.748 -7.165 11.907 1.00 19.73 N ATOM 540 CA ALA A 39 21.435 -7.798 13.169 1.00 22.94 C ATOM 541 C ALA A 39 22.733 -8.236 13.857 1.00 23.73 C ATOM 542 O ALA A 39 22.788 -8.320 15.067 1.00 27.68 O ATOM 543 CB ALA A 39 20.545 -9.064 12.944 1.00 23.39 C ATOM 544 HA ALA A 39 20.896 -7.081 13.788 1.00 0.00 H ATOM 545 HB1 ALA A 39 19.616 -8.771 12.455 1.00 0.00 H ATOM 546 HB2 ALA A 39 21.080 -9.775 12.315 1.00 0.00 H ATOM 547 HB3 ALA A 39 20.321 -9.525 13.906 1.00 0.00 H ATOM 548 H ALA A 39 21.441 -7.626 11.027 1.00 0.00 H ATOM 549 N SER A 40 23.787 -8.509 13.157 1.00 24.04 N ATOM 550 CA SER A 40 25.022 -8.988 13.749 1.00 29.53 C ATOM 551 C SER A 40 26.133 -7.955 13.924 1.00 33.51 C ATOM 552 O SER A 40 27.266 -8.424 14.136 1.00 34.67 O ATOM 553 CB SER A 40 25.557 -10.073 12.796 1.00 24.72 C ATOM 554 OG SER A 40 26.122 -9.542 11.627 1.00 40.93 O ATOM 555 HA SER A 40 24.775 -9.322 14.757 1.00 0.00 H ATOM 556 HB2 SER A 40 24.732 -10.729 12.517 1.00 0.00 H ATOM 557 HB3 SER A 40 26.319 -10.651 13.319 1.00 0.00 H ATOM 558 HG SER A 40 25.437 -9.021 11.138 1.00 0.00 H ATOM 559 H SER A 40 23.747 -8.379 12.126 1.00 0.00 H ATOM 560 N VAL A 41 25.896 -6.655 13.728 1.00 29.34 N ATOM 561 CA VAL A 41 27.038 -5.725 13.811 1.00 30.10 C ATOM 562 C VAL A 41 26.884 -4.778 15.005 1.00 29.90 C ATOM 563 O VAL A 41 25.788 -4.600 15.528 1.00 26.91 O ATOM 564 CB VAL A 41 27.199 -4.838 12.558 1.00 30.24 C ATOM 565 CG1 VAL A 41 27.266 -5.553 11.234 1.00 26.06 C ATOM 566 CG2 VAL A 41 26.026 -3.848 12.433 1.00 23.02 C ATOM 567 HA VAL A 41 27.915 -6.365 13.912 1.00 0.00 H ATOM 568 HB VAL A 41 28.163 -4.361 12.732 1.00 0.00 H ATOM 569 HG11 VAL A 41 28.119 -6.231 11.232 1.00 0.00 H ATOM 570 HG12 VAL A 41 26.348 -6.121 11.082 1.00 0.00 H ATOM 571 HG13 VAL A 41 27.379 -4.822 10.433 1.00 0.00 H ATOM 572 HG21 VAL A 41 25.091 -4.403 12.353 1.00 0.00 H ATOM 573 HG22 VAL A 41 25.996 -3.208 13.315 1.00 0.00 H ATOM 574 HG23 VAL A 41 26.163 -3.235 11.542 1.00 0.00 H ATOM 575 H VAL A 41 24.937 -6.310 13.523 1.00 0.00 H ATOM 576 N GLU A 42 27.984 -4.130 15.388 1.00 29.08 N ATOM 577 CA GLU A 42 27.959 -3.107 16.442 1.00 29.71 C ATOM 578 C GLU A 42 28.326 -1.757 15.760 1.00 25.27 C ATOM 579 O GLU A 42 29.265 -1.773 14.941 1.00 23.98 O ATOM 580 CB GLU A 42 29.033 -3.321 17.501 1.00 40.72 C ATOM 581 CG GLU A 42 29.052 -4.733 18.077 1.00 62.56 C ATOM 582 CD GLU A 42 28.508 -4.605 19.498 1.00 75.10 C ATOM 583 OE1 GLU A 42 27.269 -4.445 19.580 1.00 80.87 O ATOM 584 OE2 GLU A 42 29.346 -4.634 20.425 1.00 82.30 O ATOM 585 HA GLU A 42 26.977 -3.138 16.914 1.00 0.00 H ATOM 586 HB2 GLU A 42 30.005 -3.119 17.051 1.00 0.00 H ATOM 587 HB3 GLU A 42 28.858 -2.619 18.316 1.00 0.00 H ATOM 588 HG2 GLU A 42 28.419 -5.394 17.485 1.00 0.00 H ATOM 589 HG3 GLU A 42 30.069 -5.124 18.093 1.00 0.00 H ATOM 590 H GLU A 42 28.888 -4.356 14.926 1.00 0.00 H ATOM 591 N ALA A 43 27.635 -0.696 16.082 1.00 22.41 N ATOM 592 CA ALA A 43 27.901 0.571 15.397 1.00 23.85 C ATOM 593 C ALA A 43 29.317 1.123 15.617 1.00 24.83 C ATOM 594 O ALA A 43 29.903 1.639 14.675 1.00 23.84 O ATOM 595 CB ALA A 43 26.899 1.598 15.908 1.00 25.23 C ATOM 596 HA ALA A 43 27.808 0.380 14.328 1.00 0.00 H ATOM 597 HB1 ALA A 43 25.887 1.256 15.691 1.00 0.00 H ATOM 598 HB2 ALA A 43 27.020 1.718 16.985 1.00 0.00 H ATOM 599 HB3 ALA A 43 27.075 2.553 15.413 1.00 0.00 H ATOM 600 H ALA A 43 26.902 -0.751 16.818 1.00 0.00 H ATOM 601 N GLY A 44 29.804 1.052 16.861 1.00 25.07 N ATOM 602 CA GLY A 44 31.065 1.721 17.197 1.00 24.86 C ATOM 603 C GLY A 44 32.223 1.465 16.280 1.00 24.77 C ATOM 604 O GLY A 44 32.724 0.333 16.236 1.00 22.96 O ATOM 605 HA3 GLY A 44 31.356 1.397 18.196 1.00 0.00 H ATOM 606 HA2 GLY A 44 30.879 2.795 17.204 1.00 0.00 H ATOM 607 H GLY A 44 29.287 0.521 17.591 1.00 0.00 H ATOM 608 N GLY A 45 32.667 2.462 15.462 1.00 21.47 N ATOM 609 CA GLY A 45 33.790 2.167 14.581 1.00 22.02 C ATOM 610 C GLY A 45 33.552 1.191 13.447 1.00 24.10 C ATOM 611 O GLY A 45 34.455 0.730 12.760 1.00 21.03 O ATOM 612 HA3 GLY A 45 34.592 1.762 15.198 1.00 0.00 H ATOM 613 HA2 GLY A 45 34.115 3.109 14.139 1.00 0.00 H ATOM 614 H GLY A 45 32.219 3.401 15.467 1.00 0.00 H ATOM 615 N LEU A 46 32.281 0.943 13.113 1.00 21.15 N ATOM 616 CA LEU A 46 32.014 -0.067 12.042 1.00 19.87 C ATOM 617 C LEU A 46 32.635 0.225 10.742 1.00 19.17 C ATOM 618 O LEU A 46 33.034 -0.731 10.080 1.00 16.20 O ATOM 619 CB LEU A 46 30.487 -0.177 11.942 1.00 18.59 C ATOM 620 CG LEU A 46 29.988 -1.251 10.949 1.00 29.70 C ATOM 621 CD1 LEU A 46 30.557 -2.640 11.254 1.00 20.21 C ATOM 622 CD2 LEU A 46 28.462 -1.232 11.011 1.00 24.28 C ATOM 623 HA LEU A 46 32.479 -1.013 12.318 1.00 0.00 H ATOM 624 HB2 LEU A 46 30.097 -0.419 12.931 1.00 0.00 H ATOM 625 HB3 LEU A 46 30.095 0.789 11.625 1.00 0.00 H ATOM 626 HG LEU A 46 30.336 -1.023 9.941 1.00 0.00 H ATOM 627 HD21 LEU A 46 28.138 -1.462 12.026 1.00 0.00 H ATOM 628 HD22 LEU A 46 28.100 -0.244 10.728 1.00 0.00 H ATOM 629 HD23 LEU A 46 28.062 -1.977 10.323 1.00 0.00 H ATOM 630 HD11 LEU A 46 31.645 -2.607 11.195 1.00 0.00 H ATOM 631 HD12 LEU A 46 30.255 -2.943 12.257 1.00 0.00 H ATOM 632 HD13 LEU A 46 30.174 -3.356 10.527 1.00 0.00 H ATOM 633 H LEU A 46 31.499 1.439 13.585 1.00 0.00 H ATOM 634 N PHE A 47 32.749 1.475 10.240 1.00 15.92 N ATOM 635 CA PHE A 47 33.262 1.743 8.911 1.00 17.62 C ATOM 636 C PHE A 47 34.773 1.893 8.846 1.00 17.74 C ATOM 637 O PHE A 47 35.309 2.072 7.752 1.00 17.55 O ATOM 638 CB PHE A 47 32.652 3.064 8.337 1.00 22.38 C ATOM 639 CG PHE A 47 31.134 3.054 8.293 1.00 24.66 C ATOM 640 CD1 PHE A 47 30.357 1.912 8.487 1.00 21.83 C ATOM 641 CD2 PHE A 47 30.465 4.230 8.006 1.00 22.66 C ATOM 642 CE1 PHE A 47 28.976 1.946 8.463 1.00 23.60 C ATOM 643 CE2 PHE A 47 29.076 4.269 7.955 1.00 24.90 C ATOM 644 CZ PHE A 47 28.331 3.148 8.177 1.00 21.19 C ATOM 645 HA PHE A 47 32.974 0.869 8.327 1.00 0.00 H ATOM 646 HB2 PHE A 47 32.975 3.896 8.963 1.00 0.00 H ATOM 647 HB3 PHE A 47 33.027 3.207 7.324 1.00 0.00 H ATOM 648 HD2 PHE A 47 31.035 5.140 7.817 1.00 0.00 H ATOM 649 HE2 PHE A 47 28.574 5.211 7.734 1.00 0.00 H ATOM 650 HZ PHE A 47 27.243 3.192 8.131 1.00 0.00 H ATOM 651 HE1 PHE A 47 28.398 1.044 8.665 1.00 0.00 H ATOM 652 HD1 PHE A 47 30.857 0.960 8.664 1.00 0.00 H ATOM 653 H PHE A 47 32.456 2.278 10.832 1.00 0.00 H ATOM 654 N GLU A 48 35.452 1.812 9.991 1.00 20.78 N ATOM 655 CA GLU A 48 36.908 1.992 9.994 1.00 21.00 C ATOM 656 C GLU A 48 37.608 1.018 9.078 1.00 22.73 C ATOM 657 O GLU A 48 37.322 -0.174 9.186 1.00 22.99 O ATOM 658 CB GLU A 48 37.512 1.757 11.394 1.00 21.98 C ATOM 659 CG GLU A 48 37.088 2.805 12.399 1.00 22.00 C ATOM 660 CD GLU A 48 37.924 4.069 12.187 1.00 37.55 C ATOM 661 OE1 GLU A 48 39.102 4.049 11.759 1.00 19.83 O ATOM 662 OE2 GLU A 48 37.533 5.223 12.393 1.00 38.08 O ATOM 663 HA GLU A 48 37.061 3.019 9.661 1.00 0.00 H ATOM 664 HB2 GLU A 48 37.190 0.779 11.753 1.00 0.00 H ATOM 665 HB3 GLU A 48 38.599 1.772 11.312 1.00 0.00 H ATOM 666 HG2 GLU A 48 36.032 3.038 12.261 1.00 0.00 H ATOM 667 HG3 GLU A 48 37.246 2.428 13.409 1.00 0.00 H ATOM 668 H GLU A 48 34.950 1.621 10.881 1.00 0.00 H ATOM 669 N GLY A 49 38.523 1.500 8.258 1.00 22.50 N ATOM 670 CA GLY A 49 39.226 0.657 7.345 1.00 22.53 C ATOM 671 C GLY A 49 38.554 0.472 6.000 1.00 24.75 C ATOM 672 O GLY A 49 39.167 -0.223 5.192 1.00 26.24 O ATOM 673 HA3 GLY A 49 39.336 -0.324 7.806 1.00 0.00 H ATOM 674 HA2 GLY A 49 40.212 1.090 7.175 1.00 0.00 H ATOM 675 H GLY A 49 38.737 2.518 8.277 1.00 0.00 H ATOM 676 N PHE A 50 37.334 0.951 5.765 1.00 21.50 N ATOM 677 CA PHE A 50 36.716 0.583 4.467 1.00 19.84 C ATOM 678 C PHE A 50 36.810 1.709 3.484 1.00 19.04 C ATOM 679 O PHE A 50 36.451 2.826 3.918 1.00 21.75 O ATOM 680 CB PHE A 50 35.202 0.268 4.750 1.00 18.62 C ATOM 681 CG PHE A 50 35.104 -1.138 5.308 1.00 21.44 C ATOM 682 CD1 PHE A 50 35.327 -2.235 4.465 1.00 21.75 C ATOM 683 CD2 PHE A 50 34.824 -1.352 6.642 1.00 17.55 C ATOM 684 CE1 PHE A 50 35.214 -3.517 4.989 1.00 22.78 C ATOM 685 CE2 PHE A 50 34.729 -2.661 7.156 1.00 26.77 C ATOM 686 CZ PHE A 50 34.925 -3.752 6.310 1.00 22.72 C ATOM 687 HA PHE A 50 37.235 -0.275 4.040 1.00 0.00 H ATOM 688 HB2 PHE A 50 34.806 0.980 5.474 1.00 0.00 H ATOM 689 HB3 PHE A 50 34.631 0.338 3.824 1.00 0.00 H ATOM 690 HD2 PHE A 50 34.675 -0.500 7.305 1.00 0.00 H ATOM 691 HE2 PHE A 50 34.503 -2.820 8.210 1.00 0.00 H ATOM 692 HZ PHE A 50 34.850 -4.771 6.690 1.00 0.00 H ATOM 693 HE1 PHE A 50 35.361 -4.369 4.325 1.00 0.00 H ATOM 694 HD1 PHE A 50 35.585 -2.085 3.417 1.00 0.00 H ATOM 695 H PHE A 50 36.840 1.552 6.455 1.00 0.00 H ATOM 696 N ASP A 51 37.173 1.463 2.247 1.00 20.88 N ATOM 697 CA ASP A 51 37.140 2.468 1.199 1.00 21.53 C ATOM 698 C ASP A 51 35.727 2.860 0.768 1.00 24.08 C ATOM 699 O ASP A 51 35.509 3.950 0.255 1.00 21.88 O ATOM 700 CB ASP A 51 37.791 1.903 -0.072 1.00 21.93 C ATOM 701 CG ASP A 51 39.193 1.490 0.339 1.00 35.98 C ATOM 702 OD1 ASP A 51 39.932 2.413 0.719 1.00 33.10 O ATOM 703 OD2 ASP A 51 39.579 0.337 0.605 1.00 31.80 O ATOM 704 HA ASP A 51 37.655 3.333 1.617 1.00 0.00 H ATOM 705 HB2 ASP A 51 37.231 1.042 -0.436 1.00 0.00 H ATOM 706 HB3 ASP A 51 37.831 2.665 -0.851 1.00 0.00 H ATOM 707 H ASP A 51 37.499 0.505 2.006 1.00 0.00 H ATOM 708 N LEU A 52 34.820 1.894 0.818 1.00 20.37 N ATOM 709 CA LEU A 52 33.436 2.189 0.389 1.00 21.88 C ATOM 710 C LEU A 52 32.462 1.480 1.298 1.00 21.44 C ATOM 711 O LEU A 52 32.720 0.293 1.620 1.00 20.13 O ATOM 712 CB LEU A 52 33.299 1.609 -1.050 1.00 19.46 C ATOM 713 CG LEU A 52 31.855 1.649 -1.582 1.00 20.04 C ATOM 714 CD1 LEU A 52 31.292 3.055 -1.788 1.00 24.38 C ATOM 715 CD2 LEU A 52 31.777 0.939 -2.940 1.00 23.95 C ATOM 716 HA LEU A 52 33.228 3.258 0.421 1.00 0.00 H ATOM 717 HB2 LEU A 52 33.932 2.190 -1.720 1.00 0.00 H ATOM 718 HB3 LEU A 52 33.637 0.573 -1.040 1.00 0.00 H ATOM 719 HG LEU A 52 31.262 1.156 -0.811 1.00 0.00 H ATOM 720 HD21 LEU A 52 32.435 1.441 -3.649 1.00 0.00 H ATOM 721 HD22 LEU A 52 32.089 -0.099 -2.824 1.00 0.00 H ATOM 722 HD23 LEU A 52 30.751 0.973 -3.308 1.00 0.00 H ATOM 723 HD11 LEU A 52 31.294 3.589 -0.838 1.00 0.00 H ATOM 724 HD12 LEU A 52 31.910 3.591 -2.509 1.00 0.00 H ATOM 725 HD13 LEU A 52 30.271 2.985 -2.164 1.00 0.00 H ATOM 726 H LEU A 52 35.078 0.944 1.154 1.00 0.00 H ATOM 727 N VAL A 53 31.396 2.118 1.722 1.00 17.58 N ATOM 728 CA VAL A 53 30.390 1.509 2.577 1.00 14.63 C ATOM 729 C VAL A 53 29.049 1.595 1.830 1.00 20.14 C ATOM 730 O VAL A 53 28.609 2.694 1.418 1.00 18.46 O ATOM 731 CB VAL A 53 30.275 2.168 3.929 1.00 14.90 C ATOM 732 CG1 VAL A 53 29.165 1.554 4.749 1.00 17.69 C ATOM 733 CG2 VAL A 53 31.625 2.076 4.722 1.00 17.21 C ATOM 734 HA VAL A 53 30.680 0.478 2.778 1.00 0.00 H ATOM 735 HB VAL A 53 30.040 3.217 3.752 1.00 0.00 H ATOM 736 HG11 VAL A 53 28.218 1.674 4.223 1.00 0.00 H ATOM 737 HG12 VAL A 53 29.368 0.493 4.897 1.00 0.00 H ATOM 738 HG13 VAL A 53 29.111 2.053 5.717 1.00 0.00 H ATOM 739 HG21 VAL A 53 31.889 1.028 4.867 1.00 0.00 H ATOM 740 HG22 VAL A 53 32.412 2.576 4.157 1.00 0.00 H ATOM 741 HG23 VAL A 53 31.509 2.560 5.692 1.00 0.00 H ATOM 742 H VAL A 53 31.265 3.108 1.432 1.00 0.00 H ATOM 743 N LEU A 54 28.276 0.496 1.804 1.00 16.83 N ATOM 744 CA LEU A 54 26.965 0.462 1.152 1.00 18.05 C ATOM 745 C LEU A 54 25.983 0.032 2.218 1.00 18.11 C ATOM 746 O LEU A 54 26.182 -0.981 2.921 1.00 17.60 O ATOM 747 CB LEU A 54 26.902 -0.409 -0.090 1.00 14.73 C ATOM 748 CG LEU A 54 27.879 -0.163 -1.223 1.00 22.92 C ATOM 749 CD1 LEU A 54 27.638 -1.062 -2.429 1.00 27.44 C ATOM 750 CD2 LEU A 54 27.738 1.268 -1.757 1.00 25.98 C ATOM 751 HA LEU A 54 26.724 1.450 0.759 1.00 0.00 H ATOM 752 HB2 LEU A 54 27.047 -1.439 0.237 1.00 0.00 H ATOM 753 HB3 LEU A 54 25.900 -0.299 -0.505 1.00 0.00 H ATOM 754 HG LEU A 54 28.861 -0.361 -0.792 1.00 0.00 H ATOM 755 HD21 LEU A 54 26.723 1.418 -2.126 1.00 0.00 H ATOM 756 HD22 LEU A 54 27.942 1.976 -0.954 1.00 0.00 H ATOM 757 HD23 LEU A 54 28.448 1.423 -2.569 1.00 0.00 H ATOM 758 HD11 LEU A 54 27.737 -2.105 -2.129 1.00 0.00 H ATOM 759 HD12 LEU A 54 26.634 -0.888 -2.816 1.00 0.00 H ATOM 760 HD13 LEU A 54 28.371 -0.834 -3.203 1.00 0.00 H ATOM 761 H LEU A 54 28.624 -0.368 2.267 1.00 0.00 H ATOM 762 N LEU A 55 24.918 0.789 2.417 1.00 15.12 N ATOM 763 CA LEU A 55 23.953 0.541 3.462 1.00 16.16 C ATOM 764 C LEU A 55 22.601 0.295 2.784 1.00 21.02 C ATOM 765 O LEU A 55 22.170 1.156 2.010 1.00 17.98 O ATOM 766 CB LEU A 55 23.779 1.711 4.437 1.00 15.29 C ATOM 767 CG LEU A 55 25.089 2.143 5.119 1.00 24.26 C ATOM 768 CD1 LEU A 55 24.818 3.274 6.081 1.00 23.59 C ATOM 769 CD2 LEU A 55 25.630 1.024 6.050 1.00 19.89 C ATOM 770 HA LEU A 55 24.312 -0.308 4.043 1.00 0.00 H ATOM 771 HB2 LEU A 55 23.379 2.563 3.886 1.00 0.00 H ATOM 772 HB3 LEU A 55 23.069 1.414 5.209 1.00 0.00 H ATOM 773 HG LEU A 55 25.780 2.398 4.315 1.00 0.00 H ATOM 774 HD21 LEU A 55 24.891 0.805 6.821 1.00 0.00 H ATOM 775 HD22 LEU A 55 25.822 0.126 5.463 1.00 0.00 H ATOM 776 HD23 LEU A 55 26.556 1.358 6.518 1.00 0.00 H ATOM 777 HD11 LEU A 55 24.399 4.120 5.536 1.00 0.00 H ATOM 778 HD12 LEU A 55 24.109 2.942 6.840 1.00 0.00 H ATOM 779 HD13 LEU A 55 25.750 3.574 6.559 1.00 0.00 H ATOM 780 H LEU A 55 24.767 1.604 1.789 1.00 0.00 H ATOM 781 N GLY A 56 21.908 -0.736 3.289 1.00 18.98 N ATOM 782 CA GLY A 56 20.652 -1.088 2.565 1.00 18.29 C ATOM 783 C GLY A 56 19.621 -1.426 3.627 1.00 18.81 C ATOM 784 O GLY A 56 19.964 -2.042 4.629 1.00 15.96 O ATOM 785 HA3 GLY A 56 20.820 -1.947 1.916 1.00 0.00 H ATOM 786 HA2 GLY A 56 20.313 -0.243 1.966 1.00 0.00 H ATOM 787 H GLY A 56 22.226 -1.257 4.131 1.00 0.00 H ATOM 788 N CYS A 57 18.367 -1.045 3.363 1.00 16.35 N ATOM 789 CA CYS A 57 17.350 -1.321 4.352 1.00 18.79 C ATOM 790 C CYS A 57 15.965 -1.283 3.666 1.00 20.11 C ATOM 791 O CYS A 57 15.771 -0.336 2.882 1.00 16.86 O ATOM 792 CB CYS A 57 17.500 -0.039 5.230 1.00 22.28 C ATOM 793 SG CYS A 57 16.526 -0.064 6.652 1.00 21.44 S ATOM 794 HA CYS A 57 17.438 -2.275 4.872 1.00 0.00 H ATOM 795 HB2 CYS A 57 17.215 0.826 4.631 1.00 0.00 H ATOM 796 HB3 CYS A 57 18.544 0.056 5.528 1.00 0.00 H ATOM 797 HG CYS A 57 15.197 -0.169 6.296 1.00 0.00 H ATOM 798 H CYS A 57 18.130 -0.564 2.472 1.00 0.00 H ATOM 799 N SER A 58 15.031 -2.085 4.190 1.00 16.83 N ATOM 800 CA SER A 58 13.661 -1.973 3.639 1.00 18.20 C ATOM 801 C SER A 58 12.845 -1.015 4.520 1.00 15.51 C ATOM 802 O SER A 58 13.271 -0.631 5.633 1.00 17.28 O ATOM 803 CB SER A 58 12.985 -3.389 3.615 1.00 18.42 C ATOM 804 OG SER A 58 13.181 -3.981 4.903 1.00 16.60 O ATOM 805 HA SER A 58 13.701 -1.585 2.621 1.00 0.00 H ATOM 806 HB2 SER A 58 13.446 -4.009 2.846 1.00 0.00 H ATOM 807 HB3 SER A 58 11.919 -3.290 3.409 1.00 0.00 H ATOM 808 HG SER A 58 12.764 -4.879 4.919 1.00 0.00 H ATOM 809 H SER A 58 15.257 -2.757 4.951 1.00 0.00 H ATOM 810 N THR A 59 11.681 -0.606 4.067 1.00 16.24 N ATOM 811 CA THR A 59 10.844 0.386 4.738 1.00 18.63 C ATOM 812 C THR A 59 9.536 -0.199 5.229 1.00 20.69 C ATOM 813 O THR A 59 8.905 -1.017 4.538 1.00 18.83 O ATOM 814 CB THR A 59 10.533 1.546 3.760 1.00 21.24 C ATOM 815 OG1 THR A 59 11.790 2.051 3.322 1.00 20.89 O ATOM 816 CG2 THR A 59 9.666 2.651 4.372 1.00 20.08 C ATOM 817 HA THR A 59 11.400 0.744 5.605 1.00 0.00 H ATOM 818 HB THR A 59 9.937 1.170 2.928 1.00 0.00 H ATOM 819 HG1 THR A 59 12.294 1.330 2.868 1.00 0.00 H ATOM 820 HG23 THR A 59 8.715 2.228 4.695 1.00 0.00 H ATOM 821 HG21 THR A 59 10.182 3.083 5.229 1.00 0.00 H ATOM 822 HG22 THR A 59 9.486 3.425 3.626 1.00 0.00 H ATOM 823 H THR A 59 11.334 -1.014 3.175 1.00 0.00 H ATOM 824 N TRP A 60 9.154 0.080 6.473 1.00 21.30 N ATOM 825 CA TRP A 60 7.996 -0.492 7.132 1.00 27.41 C ATOM 826 C TRP A 60 7.163 0.639 7.770 1.00 29.03 C ATOM 827 O TRP A 60 7.444 1.811 7.491 1.00 27.00 O ATOM 828 CB TRP A 60 8.435 -1.470 8.272 1.00 23.51 C ATOM 829 CG TRP A 60 9.238 -2.562 7.616 1.00 24.62 C ATOM 830 CD1 TRP A 60 10.591 -2.573 7.415 1.00 23.70 C ATOM 831 CD2 TRP A 60 8.716 -3.736 6.978 1.00 26.55 C ATOM 832 NE1 TRP A 60 10.956 -3.692 6.708 1.00 23.36 N ATOM 833 CE2 TRP A 60 9.816 -4.422 6.420 1.00 25.25 C ATOM 834 CE3 TRP A 60 7.424 -4.274 6.839 1.00 22.92 C ATOM 835 CZ2 TRP A 60 9.680 -5.621 5.745 1.00 22.05 C ATOM 836 CZ3 TRP A 60 7.301 -5.486 6.141 1.00 25.29 C ATOM 837 CH2 TRP A 60 8.397 -6.168 5.607 1.00 25.47 C ATOM 838 HA TRP A 60 7.413 -1.035 6.389 1.00 0.00 H ATOM 839 HB2 TRP A 60 9.045 -0.943 9.006 1.00 0.00 H ATOM 840 HB3 TRP A 60 7.559 -1.891 8.765 1.00 0.00 H ATOM 841 HE1 TRP A 60 11.926 -3.948 6.435 1.00 0.00 H ATOM 842 HD1 TRP A 60 11.280 -1.804 7.765 1.00 0.00 H ATOM 843 HZ2 TRP A 60 10.550 -6.129 5.330 1.00 0.00 H ATOM 844 HH2 TRP A 60 8.256 -7.116 5.088 1.00 0.00 H ATOM 845 HZ3 TRP A 60 6.307 -5.913 6.010 1.00 0.00 H ATOM 846 HE3 TRP A 60 6.553 -3.770 7.257 1.00 0.00 H ATOM 847 H TRP A 60 9.729 0.759 7.012 1.00 0.00 H ATOM 848 N GLY A 61 6.262 0.275 8.656 1.00 30.12 N ATOM 849 CA GLY A 61 5.475 1.247 9.391 1.00 38.57 C ATOM 850 C GLY A 61 4.048 1.385 8.877 1.00 45.81 C ATOM 851 O GLY A 61 3.805 1.305 7.667 1.00 43.69 O ATOM 852 HA3 GLY A 61 5.965 2.218 9.314 1.00 0.00 H ATOM 853 HA2 GLY A 61 5.438 0.942 10.437 1.00 0.00 H ATOM 854 H GLY A 61 6.109 -0.738 8.835 1.00 0.00 H ATOM 855 N ASP A 62 3.110 1.557 9.787 1.00 54.98 N ATOM 856 CA ASP A 62 1.716 1.798 9.435 1.00 65.25 C ATOM 857 C ASP A 62 1.460 3.300 9.459 1.00 70.71 C ATOM 858 O ASP A 62 1.595 3.941 10.506 1.00 71.44 O ATOM 859 CB ASP A 62 0.737 1.117 10.387 1.00 79.74 C ATOM 860 CG ASP A 62 0.838 -0.395 10.316 1.00 91.58 C ATOM 861 OD1 ASP A 62 0.298 -0.972 9.347 1.00 95.78 O ATOM 862 OD2 ASP A 62 1.489 -0.987 11.205 1.00 98.08 O ATOM 863 HA ASP A 62 1.551 1.377 8.443 1.00 0.00 H ATOM 864 HB2 ASP A 62 0.955 1.438 11.406 1.00 0.00 H ATOM 865 HB3 ASP A 62 -0.277 1.416 10.123 1.00 0.00 H ATOM 866 H ASP A 62 3.374 1.519 10.792 1.00 0.00 H ATOM 867 N ASP A 63 1.416 3.933 8.303 1.00 75.21 N ATOM 868 CA ASP A 63 1.145 5.339 8.088 1.00 79.50 C ATOM 869 C ASP A 63 2.363 6.244 8.216 1.00 79.08 C ATOM 870 O ASP A 63 2.363 7.373 7.712 1.00 80.54 O ATOM 871 CB ASP A 63 -0.028 5.845 8.907 1.00 98.78 C ATOM 872 CG ASP A 63 0.152 6.454 10.270 1.00110.40 C ATOM 873 OD1 ASP A 63 1.292 6.668 10.737 1.00114.45 O ATOM 874 OD2 ASP A 63 -0.896 6.690 10.921 1.00117.30 O ATOM 875 HA ASP A 63 0.854 5.398 7.039 1.00 0.00 H ATOM 876 HB2 ASP A 63 -0.521 6.602 8.298 1.00 0.00 H ATOM 877 HB3 ASP A 63 -0.697 4.995 9.039 1.00 0.00 H ATOM 878 H ASP A 63 1.595 3.360 7.454 1.00 0.00 H ATOM 879 N SER A 64 3.413 5.768 8.860 1.00 76.10 N ATOM 880 CA SER A 64 4.659 6.494 9.029 1.00 70.01 C ATOM 881 C SER A 64 5.808 5.751 8.349 1.00 63.50 C ATOM 882 O SER A 64 5.594 4.695 7.748 1.00 64.46 O ATOM 883 CB SER A 64 4.958 6.596 10.535 1.00 73.80 C ATOM 884 OG SER A 64 4.781 5.307 11.121 1.00 78.16 O ATOM 885 HA SER A 64 4.564 7.483 8.580 1.00 0.00 H ATOM 886 HB2 SER A 64 4.275 7.308 10.998 1.00 0.00 H ATOM 887 HB3 SER A 64 5.985 6.930 10.684 1.00 0.00 H ATOM 888 HG SER A 64 3.848 5.007 10.981 1.00 0.00 H ATOM 889 H SER A 64 3.343 4.815 9.271 1.00 0.00 H ATOM 890 N ILE A 65 7.004 6.322 8.407 1.00 53.99 N ATOM 891 CA ILE A 65 8.190 5.694 7.847 1.00 46.08 C ATOM 892 C ILE A 65 8.875 4.986 9.034 1.00 39.75 C ATOM 893 O ILE A 65 9.246 5.685 10.008 1.00 37.11 O ATOM 894 CB ILE A 65 9.223 6.615 7.211 1.00 48.22 C ATOM 895 CG1 ILE A 65 8.970 6.845 5.717 1.00 57.74 C ATOM 896 CG2 ILE A 65 10.667 6.069 7.276 1.00 46.26 C ATOM 897 CD1 ILE A 65 9.969 7.844 5.131 1.00 58.99 C ATOM 898 HA ILE A 65 7.851 5.055 7.032 1.00 0.00 H ATOM 899 HB ILE A 65 9.120 7.530 7.794 1.00 0.00 H ATOM 900 HG12 ILE A 65 9.066 5.896 5.190 1.00 0.00 H ATOM 901 HG13 ILE A 65 7.960 7.233 5.583 1.00 0.00 H ATOM 902 HD11 ILE A 65 9.874 8.798 5.650 1.00 0.00 H ATOM 903 HD12 ILE A 65 10.981 7.460 5.257 1.00 0.00 H ATOM 904 HD13 ILE A 65 9.761 7.984 4.070 1.00 0.00 H ATOM 905 HG21 ILE A 65 10.955 5.929 8.318 1.00 0.00 H ATOM 906 HG22 ILE A 65 10.717 5.114 6.752 1.00 0.00 H ATOM 907 HG23 ILE A 65 11.345 6.780 6.803 1.00 0.00 H ATOM 908 H ILE A 65 7.096 7.250 8.868 1.00 0.00 H ATOM 909 N GLU A 66 9.002 3.655 8.974 1.00 29.34 N ATOM 910 CA GLU A 66 9.858 3.037 9.988 1.00 26.28 C ATOM 911 C GLU A 66 10.942 2.260 9.254 1.00 23.56 C ATOM 912 O GLU A 66 10.706 1.758 8.124 1.00 23.87 O ATOM 913 CB GLU A 66 9.066 2.130 10.933 1.00 33.96 C ATOM 914 CG GLU A 66 8.505 2.892 12.115 1.00 55.06 C ATOM 915 CD GLU A 66 7.310 2.244 12.775 1.00 64.75 C ATOM 916 OE1 GLU A 66 7.379 1.065 13.189 1.00 55.82 O ATOM 917 OE2 GLU A 66 6.269 2.937 12.888 1.00 75.77 O ATOM 918 HA GLU A 66 10.300 3.808 10.619 1.00 0.00 H ATOM 919 HB2 GLU A 66 8.241 1.681 10.380 1.00 0.00 H ATOM 920 HB3 GLU A 66 9.725 1.344 11.302 1.00 0.00 H ATOM 921 HG2 GLU A 66 9.293 2.990 12.861 1.00 0.00 H ATOM 922 HG3 GLU A 66 8.207 3.882 11.770 1.00 0.00 H ATOM 923 H GLU A 66 8.519 3.090 8.246 1.00 0.00 H ATOM 924 N LEU A 67 12.114 2.197 9.862 1.00 18.67 N ATOM 925 CA LEU A 67 13.205 1.449 9.224 1.00 20.45 C ATOM 926 C LEU A 67 12.999 -0.025 9.647 1.00 19.35 C ATOM 927 O LEU A 67 12.400 -0.313 10.685 1.00 19.47 O ATOM 928 CB LEU A 67 14.500 1.987 9.806 1.00 25.34 C ATOM 929 CG LEU A 67 15.266 3.152 9.186 1.00 37.01 C ATOM 930 CD1 LEU A 67 14.390 4.166 8.531 1.00 28.53 C ATOM 931 CD2 LEU A 67 16.092 3.860 10.292 1.00 38.48 C ATOM 932 HA LEU A 67 13.228 1.538 8.138 1.00 0.00 H ATOM 933 HB2 LEU A 67 14.269 2.288 10.828 1.00 0.00 H ATOM 934 HB3 LEU A 67 15.194 1.146 9.825 1.00 0.00 H ATOM 935 HG LEU A 67 15.902 2.726 8.410 1.00 0.00 H ATOM 936 HD21 LEU A 67 15.419 4.232 11.065 1.00 0.00 H ATOM 937 HD22 LEU A 67 16.793 3.150 10.730 1.00 0.00 H ATOM 938 HD23 LEU A 67 16.642 4.694 9.855 1.00 0.00 H ATOM 939 HD11 LEU A 67 13.820 3.691 7.733 1.00 0.00 H ATOM 940 HD12 LEU A 67 13.705 4.584 9.269 1.00 0.00 H ATOM 941 HD13 LEU A 67 15.007 4.962 8.114 1.00 0.00 H ATOM 942 H LEU A 67 12.261 2.669 10.777 1.00 0.00 H ATOM 943 N GLN A 68 13.610 -0.945 8.925 1.00 19.42 N ATOM 944 CA GLN A 68 13.626 -2.362 9.247 1.00 17.23 C ATOM 945 C GLN A 68 14.222 -2.502 10.630 1.00 21.29 C ATOM 946 O GLN A 68 15.263 -1.855 10.994 1.00 19.61 O ATOM 947 CB GLN A 68 14.392 -3.086 8.100 1.00 16.13 C ATOM 948 CG GLN A 68 14.197 -4.613 8.152 1.00 19.26 C ATOM 949 CD GLN A 68 15.157 -5.285 9.074 1.00 28.51 C ATOM 950 OE1 GLN A 68 16.203 -4.792 9.574 1.00 20.24 O ATOM 951 NE2 GLN A 68 14.884 -6.525 9.464 1.00 16.33 N ATOM 952 HA GLN A 68 12.643 -2.831 9.296 1.00 0.00 H ATOM 953 HB2 GLN A 68 14.025 -2.716 7.143 1.00 0.00 H ATOM 954 HB3 GLN A 68 15.455 -2.863 8.191 1.00 0.00 H ATOM 955 HG2 GLN A 68 13.183 -4.824 8.490 1.00 0.00 H ATOM 956 HG3 GLN A 68 14.336 -5.017 7.149 1.00 0.00 H ATOM 957 HE22 GLN A 68 14.039 -7.010 9.101 1.00 0.00 H ATOM 958 HE21 GLN A 68 15.515 -7.011 10.133 1.00 0.00 H ATOM 959 H GLN A 68 14.113 -0.636 8.069 1.00 0.00 H ATOM 960 N ASP A 69 13.612 -3.316 11.495 1.00 16.79 N ATOM 961 CA ASP A 69 14.005 -3.411 12.884 1.00 19.72 C ATOM 962 C ASP A 69 15.477 -3.701 13.135 1.00 18.76 C ATOM 963 O ASP A 69 15.924 -3.331 14.256 1.00 19.72 O ATOM 964 CB ASP A 69 13.281 -4.563 13.669 1.00 23.12 C ATOM 965 CG ASP A 69 11.865 -4.231 14.028 1.00 30.56 C ATOM 966 OD1 ASP A 69 11.666 -2.992 14.154 1.00 24.08 O ATOM 967 OD2 ASP A 69 10.854 -4.919 14.213 1.00 35.10 O ATOM 968 HA ASP A 69 13.732 -2.413 13.227 1.00 0.00 H ATOM 969 HB2 ASP A 69 13.281 -5.459 13.048 1.00 0.00 H ATOM 970 HB3 ASP A 69 13.835 -4.759 14.587 1.00 0.00 H ATOM 971 H ASP A 69 12.824 -3.904 11.157 1.00 0.00 H ATOM 972 N ASP A 70 16.163 -4.562 12.356 1.00 18.56 N ATOM 973 CA ASP A 70 17.550 -4.856 12.731 1.00 19.84 C ATOM 974 C ASP A 70 18.429 -3.609 12.440 1.00 22.84 C ATOM 975 O ASP A 70 19.592 -3.556 12.886 1.00 20.83 O ATOM 976 CB ASP A 70 18.146 -6.033 11.942 1.00 19.50 C ATOM 977 CG ASP A 70 17.319 -7.324 12.203 1.00 24.50 C ATOM 978 OD1 ASP A 70 16.934 -7.549 13.356 1.00 23.82 O ATOM 979 OD2 ASP A 70 16.994 -8.021 11.231 1.00 26.86 O ATOM 980 HA ASP A 70 17.541 -5.119 13.789 1.00 0.00 H ATOM 981 HB2 ASP A 70 18.126 -5.801 10.877 1.00 0.00 H ATOM 982 HB3 ASP A 70 19.177 -6.194 12.258 1.00 0.00 H ATOM 983 H ASP A 70 15.725 -5.001 11.521 1.00 0.00 H ATOM 984 N PHE A 71 17.980 -2.784 11.506 1.00 17.19 N ATOM 985 CA PHE A 71 18.789 -1.608 11.137 1.00 20.65 C ATOM 986 C PHE A 71 18.610 -0.441 12.103 1.00 22.21 C ATOM 987 O PHE A 71 19.480 0.444 12.166 1.00 24.23 O ATOM 988 CB PHE A 71 18.387 -1.212 9.713 1.00 16.46 C ATOM 989 CG PHE A 71 19.492 -0.533 8.941 1.00 18.09 C ATOM 990 CD1 PHE A 71 19.579 0.848 9.040 1.00 23.91 C ATOM 991 CD2 PHE A 71 20.403 -1.212 8.165 1.00 19.77 C ATOM 992 CE1 PHE A 71 20.578 1.539 8.372 1.00 23.38 C ATOM 993 CE2 PHE A 71 21.416 -0.549 7.460 1.00 24.27 C ATOM 994 CZ PHE A 71 21.477 0.849 7.585 1.00 20.95 C ATOM 995 HA PHE A 71 19.847 -1.865 11.190 1.00 0.00 H ATOM 996 HB2 PHE A 71 18.093 -2.113 9.174 1.00 0.00 H ATOM 997 HB3 PHE A 71 17.538 -0.531 9.771 1.00 0.00 H ATOM 998 HD2 PHE A 71 20.335 -2.298 8.097 1.00 0.00 H ATOM 999 HE2 PHE A 71 22.127 -1.095 6.840 1.00 0.00 H ATOM 1000 HZ PHE A 71 22.250 1.400 7.049 1.00 0.00 H ATOM 1001 HE1 PHE A 71 20.653 2.622 8.468 1.00 0.00 H ATOM 1002 HD1 PHE A 71 18.857 1.394 9.647 1.00 0.00 H ATOM 1003 H PHE A 71 17.068 -2.964 11.039 1.00 0.00 H ATOM 1004 N ILE A 72 17.534 -0.358 12.878 1.00 19.60 N ATOM 1005 CA ILE A 72 17.301 0.763 13.799 1.00 20.47 C ATOM 1006 C ILE A 72 18.450 1.099 14.727 1.00 23.92 C ATOM 1007 O ILE A 72 18.818 2.297 14.837 1.00 24.05 O ATOM 1008 CB ILE A 72 15.955 0.599 14.518 1.00 23.15 C ATOM 1009 CG1 ILE A 72 14.829 0.766 13.475 1.00 21.71 C ATOM 1010 CG2 ILE A 72 15.746 1.532 15.692 1.00 28.27 C ATOM 1011 CD1 ILE A 72 13.415 0.645 13.995 1.00 26.05 C ATOM 1012 HA ILE A 72 17.246 1.654 13.174 1.00 0.00 H ATOM 1013 HB ILE A 72 15.943 -0.397 14.960 1.00 0.00 H ATOM 1014 HG12 ILE A 72 14.935 1.753 13.026 1.00 0.00 H ATOM 1015 HG13 ILE A 72 14.969 0.003 12.709 1.00 0.00 H ATOM 1016 HD11 ILE A 72 13.274 -0.342 14.435 1.00 0.00 H ATOM 1017 HD12 ILE A 72 13.241 1.410 14.752 1.00 0.00 H ATOM 1018 HD13 ILE A 72 12.714 0.780 13.172 1.00 0.00 H ATOM 1019 HG21 ILE A 72 16.524 1.358 16.435 1.00 0.00 H ATOM 1020 HG22 ILE A 72 15.795 2.565 15.347 1.00 0.00 H ATOM 1021 HG23 ILE A 72 14.769 1.342 16.136 1.00 0.00 H ATOM 1022 H ILE A 72 16.827 -1.119 12.831 1.00 0.00 H ATOM 1023 N PRO A 73 19.068 0.181 15.415 1.00 26.57 N ATOM 1024 CA PRO A 73 20.148 0.469 16.353 1.00 28.29 C ATOM 1025 C PRO A 73 21.358 1.055 15.629 1.00 27.65 C ATOM 1026 O PRO A 73 22.057 1.907 16.178 1.00 23.23 O ATOM 1027 CB PRO A 73 20.580 -0.870 16.972 1.00 30.89 C ATOM 1028 CG PRO A 73 19.381 -1.747 16.694 1.00 31.34 C ATOM 1029 CD PRO A 73 18.570 -1.193 15.549 1.00 26.39 C ATOM 1030 HA PRO A 73 19.800 1.184 17.099 1.00 0.00 H ATOM 1031 HD3 PRO A 73 18.744 -1.762 14.636 1.00 0.00 H ATOM 1032 HD2 PRO A 73 17.506 -1.202 15.784 1.00 0.00 H ATOM 1033 HG3 PRO A 73 18.756 -1.793 17.586 1.00 0.00 H ATOM 1034 HG2 PRO A 73 19.722 -2.750 16.439 1.00 0.00 H ATOM 1035 HB2 PRO A 73 21.476 -1.259 16.489 1.00 0.00 H ATOM 1036 HB3 PRO A 73 20.760 -0.772 18.043 1.00 0.00 H ATOM 1037 N LEU A 74 21.647 0.574 14.403 1.00 25.24 N ATOM 1038 CA LEU A 74 22.774 1.137 13.643 1.00 22.80 C ATOM 1039 C LEU A 74 22.426 2.580 13.250 1.00 25.80 C ATOM 1040 O LEU A 74 23.216 3.545 13.423 1.00 21.94 O ATOM 1041 CB LEU A 74 23.039 0.261 12.430 1.00 21.19 C ATOM 1042 CG LEU A 74 24.084 0.741 11.432 1.00 24.98 C ATOM 1043 CD1 LEU A 74 25.447 0.905 12.155 1.00 23.32 C ATOM 1044 CD2 LEU A 74 24.256 -0.240 10.288 1.00 24.86 C ATOM 1045 HA LEU A 74 23.685 1.159 14.241 1.00 0.00 H ATOM 1046 HB2 LEU A 74 23.360 -0.715 12.795 1.00 0.00 H ATOM 1047 HB3 LEU A 74 22.097 0.155 11.892 1.00 0.00 H ATOM 1048 HG LEU A 74 23.744 1.693 11.024 1.00 0.00 H ATOM 1049 HD21 LEU A 74 24.574 -1.205 10.683 1.00 0.00 H ATOM 1050 HD22 LEU A 74 23.307 -0.356 9.764 1.00 0.00 H ATOM 1051 HD23 LEU A 74 25.010 0.138 9.597 1.00 0.00 H ATOM 1052 HD11 LEU A 74 25.346 1.636 12.958 1.00 0.00 H ATOM 1053 HD12 LEU A 74 25.753 -0.054 12.572 1.00 0.00 H ATOM 1054 HD13 LEU A 74 26.196 1.249 11.442 1.00 0.00 H ATOM 1055 H LEU A 74 21.075 -0.193 13.996 1.00 0.00 H ATOM 1056 N PHE A 75 21.181 2.763 12.777 1.00 20.08 N ATOM 1057 CA PHE A 75 20.741 4.099 12.380 1.00 23.06 C ATOM 1058 C PHE A 75 20.842 5.080 13.568 1.00 24.60 C ATOM 1059 O PHE A 75 21.336 6.209 13.412 1.00 23.45 O ATOM 1060 CB PHE A 75 19.274 4.135 11.927 1.00 20.50 C ATOM 1061 CG PHE A 75 18.809 5.494 11.450 1.00 19.75 C ATOM 1062 CD1 PHE A 75 19.141 5.988 10.213 1.00 22.57 C ATOM 1063 CD2 PHE A 75 17.993 6.273 12.250 1.00 22.56 C ATOM 1064 CE1 PHE A 75 18.693 7.222 9.793 1.00 26.74 C ATOM 1065 CE2 PHE A 75 17.518 7.513 11.833 1.00 29.66 C ATOM 1066 CZ PHE A 75 17.879 7.994 10.588 1.00 30.72 C ATOM 1067 HA PHE A 75 21.393 4.382 11.554 1.00 0.00 H ATOM 1068 HB2 PHE A 75 19.150 3.424 11.110 1.00 0.00 H ATOM 1069 HB3 PHE A 75 18.648 3.834 12.767 1.00 0.00 H ATOM 1070 HD2 PHE A 75 17.713 5.905 13.237 1.00 0.00 H ATOM 1071 HE2 PHE A 75 16.867 8.099 12.482 1.00 0.00 H ATOM 1072 HZ PHE A 75 17.525 8.966 10.244 1.00 0.00 H ATOM 1073 HE1 PHE A 75 18.990 7.593 8.812 1.00 0.00 H ATOM 1074 HD1 PHE A 75 19.770 5.394 9.551 1.00 0.00 H ATOM 1075 H PHE A 75 20.532 1.955 12.694 1.00 0.00 H ATOM 1076 N ASP A 76 20.373 4.696 14.738 1.00 22.13 N ATOM 1077 CA ASP A 76 20.445 5.496 15.917 1.00 26.97 C ATOM 1078 C ASP A 76 21.886 5.793 16.376 1.00 29.74 C ATOM 1079 O ASP A 76 22.027 6.743 17.137 1.00 29.08 O ATOM 1080 CB ASP A 76 19.738 4.878 17.134 1.00 22.27 C ATOM 1081 CG ASP A 76 18.237 4.914 16.987 1.00 42.25 C ATOM 1082 OD1 ASP A 76 17.718 5.508 16.004 1.00 41.51 O ATOM 1083 OD2 ASP A 76 17.478 4.344 17.805 1.00 39.22 O ATOM 1084 HA ASP A 76 19.941 6.410 15.605 1.00 0.00 H ATOM 1085 HB2 ASP A 76 20.058 3.841 17.240 1.00 0.00 H ATOM 1086 HB3 ASP A 76 20.019 5.436 18.027 1.00 0.00 H ATOM 1087 H ASP A 76 19.926 3.759 14.806 1.00 0.00 H ATOM 1088 N SER A 77 22.889 5.058 15.976 1.00 26.88 N ATOM 1089 CA SER A 77 24.261 5.325 16.398 1.00 27.45 C ATOM 1090 C SER A 77 25.117 5.585 15.197 1.00 24.71 C ATOM 1091 O SER A 77 26.326 5.417 15.292 1.00 25.93 O ATOM 1092 CB SER A 77 24.766 4.067 17.144 1.00 31.65 C ATOM 1093 OG SER A 77 24.006 3.973 18.346 1.00 38.91 O ATOM 1094 HA SER A 77 24.305 6.200 17.046 1.00 0.00 H ATOM 1095 HB2 SER A 77 25.826 4.167 17.376 1.00 0.00 H ATOM 1096 HB3 SER A 77 24.612 3.179 16.531 1.00 0.00 H ATOM 1097 HG SER A 77 24.297 3.177 18.858 1.00 0.00 H ATOM 1098 H SER A 77 22.705 4.258 15.337 1.00 0.00 H ATOM 1099 N LEU A 78 24.526 6.097 14.096 1.00 18.61 N ATOM 1100 CA LEU A 78 25.356 6.308 12.923 1.00 21.35 C ATOM 1101 C LEU A 78 26.523 7.292 13.157 1.00 19.55 C ATOM 1102 O LEU A 78 27.490 7.282 12.392 1.00 18.99 O ATOM 1103 CB LEU A 78 24.470 6.910 11.841 1.00 20.68 C ATOM 1104 CG LEU A 78 24.535 6.414 10.415 1.00 39.00 C ATOM 1105 CD1 LEU A 78 25.374 5.157 10.231 1.00 38.43 C ATOM 1106 CD2 LEU A 78 23.160 6.036 9.870 1.00 35.00 C ATOM 1107 HA LEU A 78 25.788 5.344 12.653 1.00 0.00 H ATOM 1108 HB2 LEU A 78 23.440 6.771 12.171 1.00 0.00 H ATOM 1109 HB3 LEU A 78 24.700 7.975 11.809 1.00 0.00 H ATOM 1110 HG LEU A 78 24.980 7.258 9.887 1.00 0.00 H ATOM 1111 HD21 LEU A 78 22.732 5.244 10.484 1.00 0.00 H ATOM 1112 HD22 LEU A 78 22.508 6.909 9.895 1.00 0.00 H ATOM 1113 HD23 LEU A 78 23.261 5.686 8.843 1.00 0.00 H ATOM 1114 HD11 LEU A 78 26.398 5.355 10.549 1.00 0.00 H ATOM 1115 HD12 LEU A 78 24.955 4.351 10.833 1.00 0.00 H ATOM 1116 HD13 LEU A 78 25.368 4.868 9.180 1.00 0.00 H ATOM 1117 H LEU A 78 23.513 6.332 14.088 1.00 0.00 H ATOM 1118 N GLU A 79 26.375 8.166 14.135 1.00 21.12 N ATOM 1119 CA GLU A 79 27.448 9.156 14.406 1.00 25.82 C ATOM 1120 C GLU A 79 28.670 8.512 15.024 1.00 27.64 C ATOM 1121 O GLU A 79 29.744 9.131 15.026 1.00 26.63 O ATOM 1122 CB GLU A 79 26.888 10.269 15.314 1.00 29.48 C ATOM 1123 CG GLU A 79 26.629 9.865 16.730 1.00 32.45 C ATOM 1124 CD GLU A 79 25.251 9.242 16.912 1.00 50.42 C ATOM 1125 OE1 GLU A 79 24.421 9.115 15.962 1.00 46.55 O ATOM 1126 OE2 GLU A 79 24.956 8.847 18.078 1.00 53.49 O ATOM 1127 HA GLU A 79 27.772 9.587 13.458 1.00 0.00 H ATOM 1128 HB2 GLU A 79 27.605 11.090 15.323 1.00 0.00 H ATOM 1129 HB3 GLU A 79 25.948 10.614 14.884 1.00 0.00 H ATOM 1130 HG2 GLU A 79 27.384 9.139 17.031 1.00 0.00 H ATOM 1131 HG3 GLU A 79 26.701 10.748 17.365 1.00 0.00 H ATOM 1132 H GLU A 79 25.511 8.161 14.713 1.00 0.00 H ATOM 1133 N GLU A 80 28.606 7.214 15.418 1.00 22.13 N ATOM 1134 CA GLU A 80 29.801 6.559 15.931 1.00 24.95 C ATOM 1135 C GLU A 80 30.428 5.581 14.968 1.00 21.40 C ATOM 1136 O GLU A 80 31.324 4.833 15.390 1.00 22.71 O ATOM 1137 CB GLU A 80 29.402 5.774 17.189 1.00 25.63 C ATOM 1138 CG GLU A 80 28.587 6.577 18.189 1.00 41.90 C ATOM 1139 CD GLU A 80 28.369 5.753 19.456 1.00 46.40 C ATOM 1140 OE1 GLU A 80 28.072 4.541 19.377 1.00 57.39 O ATOM 1141 OE2 GLU A 80 28.663 6.345 20.511 1.00 60.72 O ATOM 1142 HA GLU A 80 30.535 7.342 16.120 1.00 0.00 H ATOM 1143 HB2 GLU A 80 28.812 4.910 16.881 1.00 0.00 H ATOM 1144 HB3 GLU A 80 30.312 5.434 17.683 1.00 0.00 H ATOM 1145 HG2 GLU A 80 29.122 7.493 18.440 1.00 0.00 H ATOM 1146 HG3 GLU A 80 27.622 6.830 17.750 1.00 0.00 H ATOM 1147 H GLU A 80 27.709 6.691 15.354 1.00 0.00 H ATOM 1148 N THR A 81 29.954 5.521 13.704 1.00 17.48 N ATOM 1149 CA THR A 81 30.514 4.569 12.779 1.00 19.87 C ATOM 1150 C THR A 81 31.757 4.973 12.029 1.00 22.36 C ATOM 1151 O THR A 81 32.376 4.057 11.474 1.00 21.34 O ATOM 1152 CB THR A 81 29.450 4.290 11.652 1.00 22.78 C ATOM 1153 OG1 THR A 81 29.058 5.489 11.005 1.00 18.51 O ATOM 1154 CG2 THR A 81 28.184 3.689 12.295 1.00 24.17 C ATOM 1155 HA THR A 81 30.782 3.728 13.418 1.00 0.00 H ATOM 1156 HB THR A 81 29.902 3.612 10.928 1.00 0.00 H ATOM 1157 HG1 THR A 81 28.660 6.106 11.669 1.00 0.00 H ATOM 1158 HG23 THR A 81 28.443 2.761 12.805 1.00 0.00 H ATOM 1159 HG21 THR A 81 27.772 4.398 13.013 1.00 0.00 H ATOM 1160 HG22 THR A 81 27.446 3.485 11.519 1.00 0.00 H ATOM 1161 H THR A 81 29.190 6.158 13.401 1.00 0.00 H ATOM 1162 N GLY A 82 32.110 6.259 11.968 1.00 21.80 N ATOM 1163 CA GLY A 82 33.272 6.675 11.157 1.00 21.24 C ATOM 1164 C GLY A 82 32.796 7.119 9.783 1.00 20.70 C ATOM 1165 O GLY A 82 33.468 6.916 8.782 1.00 22.87 O ATOM 1166 HA3 GLY A 82 33.960 5.837 11.050 1.00 0.00 H ATOM 1167 HA2 GLY A 82 33.783 7.502 11.650 1.00 0.00 H ATOM 1168 H GLY A 82 31.564 6.971 12.494 1.00 0.00 H ATOM 1169 N ALA A 83 31.593 7.745 9.678 1.00 24.10 N ATOM 1170 CA ALA A 83 31.058 8.092 8.361 1.00 22.61 C ATOM 1171 C ALA A 83 31.593 9.413 7.797 1.00 25.94 C ATOM 1172 O ALA A 83 31.548 9.639 6.575 1.00 24.48 O ATOM 1173 CB ALA A 83 29.512 8.259 8.429 1.00 20.42 C ATOM 1174 HA ALA A 83 31.370 7.271 7.715 1.00 0.00 H ATOM 1175 HB1 ALA A 83 29.061 7.324 8.760 1.00 0.00 H ATOM 1176 HB2 ALA A 83 29.264 9.053 9.134 1.00 0.00 H ATOM 1177 HB3 ALA A 83 29.132 8.517 7.441 1.00 0.00 H ATOM 1178 H ALA A 83 31.052 7.977 10.535 1.00 0.00 H ATOM 1179 N GLN A 84 32.204 10.241 8.652 1.00 24.70 N ATOM 1180 CA GLN A 84 32.717 11.534 8.187 1.00 29.23 C ATOM 1181 C GLN A 84 33.797 11.354 7.155 1.00 25.82 C ATOM 1182 O GLN A 84 34.741 10.596 7.337 1.00 28.28 O ATOM 1183 CB GLN A 84 33.226 12.414 9.340 1.00 39.91 C ATOM 1184 CG GLN A 84 34.235 13.471 8.934 1.00 62.52 C ATOM 1185 CD GLN A 84 34.244 14.665 9.871 1.00 69.38 C ATOM 1186 OE1 GLN A 84 33.236 15.344 10.063 1.00 74.58 O ATOM 1187 NE2 GLN A 84 35.359 14.983 10.494 1.00 70.52 N ATOM 1188 HA GLN A 84 31.874 12.051 7.728 1.00 0.00 H ATOM 1189 HB2 GLN A 84 32.369 12.917 9.787 1.00 0.00 H ATOM 1190 HB3 GLN A 84 33.693 11.766 10.081 1.00 0.00 H ATOM 1191 HG2 GLN A 84 35.228 13.022 8.931 1.00 0.00 H ATOM 1192 HG3 GLN A 84 33.992 13.818 7.930 1.00 0.00 H ATOM 1193 HE22 GLN A 84 36.219 14.418 10.342 1.00 0.00 H ATOM 1194 HE21 GLN A 84 35.380 15.799 11.139 1.00 0.00 H ATOM 1195 H GLN A 84 32.316 9.967 9.649 1.00 0.00 H ATOM 1196 N GLY A 85 33.614 11.930 5.960 1.00 25.56 N ATOM 1197 CA GLY A 85 34.537 11.781 4.872 1.00 25.58 C ATOM 1198 C GLY A 85 34.534 10.413 4.202 1.00 28.28 C ATOM 1199 O GLY A 85 35.364 10.174 3.329 1.00 29.04 O ATOM 1200 HA3 GLY A 85 35.541 11.968 5.253 1.00 0.00 H ATOM 1201 HA2 GLY A 85 34.292 12.527 4.117 1.00 0.00 H ATOM 1202 H GLY A 85 32.764 12.512 5.814 1.00 0.00 H ATOM 1203 N ARG A 86 33.635 9.506 4.566 1.00 24.62 N ATOM 1204 CA ARG A 86 33.625 8.170 3.952 1.00 17.99 C ATOM 1205 C ARG A 86 32.776 8.146 2.674 1.00 16.90 C ATOM 1206 O ARG A 86 31.714 8.764 2.612 1.00 18.52 O ATOM 1207 CB ARG A 86 32.965 7.243 4.996 1.00 26.57 C ATOM 1208 CG ARG A 86 32.961 5.763 4.588 1.00 23.67 C ATOM 1209 CD ARG A 86 34.315 5.129 4.928 1.00 18.05 C ATOM 1210 NE ARG A 86 34.491 5.353 6.396 1.00 18.85 N ATOM 1211 CZ ARG A 86 35.714 5.083 6.899 1.00 19.59 C ATOM 1212 NH1 ARG A 86 36.679 4.543 6.190 1.00 17.09 N ATOM 1213 NH2 ARG A 86 35.953 5.366 8.172 1.00 20.48 N ATOM 1214 HA ARG A 86 34.636 7.866 3.681 1.00 0.00 H ATOM 1215 HB2 ARG A 86 33.508 7.340 5.936 1.00 0.00 H ATOM 1216 HB3 ARG A 86 31.933 7.564 5.139 1.00 0.00 H ATOM 1217 HG2 ARG A 86 32.171 5.241 5.127 1.00 0.00 H ATOM 1218 HG3 ARG A 86 32.782 5.683 3.516 1.00 0.00 H ATOM 1219 HD2 ARG A 86 35.116 5.612 4.368 1.00 0.00 H ATOM 1220 HD3 ARG A 86 34.307 4.063 4.701 1.00 0.00 H ATOM 1221 HE ARG A 86 33.714 5.698 6.996 1.00 0.00 H ATOM 1222 HH12 ARG A 86 37.604 4.356 6.628 1.00 0.00 H ATOM 1223 HH11 ARG A 86 36.518 4.303 5.191 1.00 0.00 H ATOM 1224 HH22 ARG A 86 36.888 5.167 8.582 1.00 0.00 H ATOM 1225 HH21 ARG A 86 35.206 5.787 8.760 1.00 0.00 H ATOM 1226 H ARG A 86 32.930 9.743 5.293 1.00 0.00 H ATOM 1227 N LYS A 87 33.238 7.400 1.669 1.00 16.05 N ATOM 1228 CA LYS A 87 32.425 7.214 0.464 1.00 19.79 C ATOM 1229 C LYS A 87 31.323 6.187 0.743 1.00 20.71 C ATOM 1230 O LYS A 87 31.627 5.066 1.206 1.00 18.45 O ATOM 1231 CB LYS A 87 33.347 6.690 -0.616 1.00 18.31 C ATOM 1232 CG LYS A 87 34.267 7.854 -1.054 1.00 27.70 C ATOM 1233 CD LYS A 87 35.102 7.417 -2.220 1.00 40.18 C ATOM 1234 CE LYS A 87 35.932 8.536 -2.838 1.00 53.53 C ATOM 1235 NZ LYS A 87 35.611 9.918 -2.388 1.00 54.16 N ATOM 1236 HA LYS A 87 31.957 8.150 0.158 1.00 0.00 H ATOM 1237 HB2 LYS A 87 33.948 5.868 -0.226 1.00 0.00 H ATOM 1238 HB3 LYS A 87 32.762 6.339 -1.466 1.00 0.00 H ATOM 1239 HG2 LYS A 87 33.658 8.710 -1.343 1.00 0.00 H ATOM 1240 HG3 LYS A 87 34.917 8.135 -0.226 1.00 0.00 H ATOM 1241 HD2 LYS A 87 35.780 6.633 -1.883 1.00 0.00 H ATOM 1242 HD3 LYS A 87 34.439 7.017 -2.987 1.00 0.00 H ATOM 1243 HE2 LYS A 87 35.792 8.497 -3.918 1.00 0.00 H ATOM 1244 HE3 LYS A 87 36.979 8.344 -2.602 1.00 0.00 H ATOM 1245 HZ1 LYS A 87 34.620 10.135 -2.618 1.00 0.00 H ATOM 1246 HZ2 LYS A 87 35.753 9.988 -1.360 1.00 0.00 H ATOM 1247 HZ3 LYS A 87 36.236 10.593 -2.873 1.00 0.00 H ATOM 1248 H LYS A 87 34.173 6.951 1.741 1.00 0.00 H ATOM 1249 N VAL A 88 30.080 6.586 0.600 1.00 19.69 N ATOM 1250 CA VAL A 88 28.966 5.696 0.873 1.00 18.16 C ATOM 1251 C VAL A 88 27.924 5.776 -0.256 1.00 22.99 C ATOM 1252 O VAL A 88 27.884 6.793 -0.970 1.00 20.45 O ATOM 1253 CB VAL A 88 28.215 6.074 2.148 1.00 26.37 C ATOM 1254 CG1 VAL A 88 29.005 5.767 3.406 1.00 33.23 C ATOM 1255 CG2 VAL A 88 27.815 7.534 2.199 1.00 32.28 C ATOM 1256 HA VAL A 88 29.403 4.702 0.968 1.00 0.00 H ATOM 1257 HB VAL A 88 27.317 5.457 2.114 1.00 0.00 H ATOM 1258 HG11 VAL A 88 29.218 4.699 3.448 1.00 0.00 H ATOM 1259 HG12 VAL A 88 29.941 6.326 3.391 1.00 0.00 H ATOM 1260 HG13 VAL A 88 28.421 6.057 4.280 1.00 0.00 H ATOM 1261 HG21 VAL A 88 28.708 8.156 2.148 1.00 0.00 H ATOM 1262 HG22 VAL A 88 27.164 7.761 1.355 1.00 0.00 H ATOM 1263 HG23 VAL A 88 27.286 7.732 3.131 1.00 0.00 H ATOM 1264 H VAL A 88 29.890 7.559 0.285 1.00 0.00 H ATOM 1265 N ALA A 89 27.029 4.766 -0.270 1.00 17.42 N ATOM 1266 CA ALA A 89 25.869 4.808 -1.161 1.00 17.91 C ATOM 1267 C ALA A 89 24.812 3.861 -0.564 1.00 20.07 C ATOM 1268 O ALA A 89 25.173 3.073 0.320 1.00 18.82 O ATOM 1269 CB ALA A 89 26.166 4.412 -2.580 1.00 18.06 C ATOM 1270 HA ALA A 89 25.523 5.840 -1.221 1.00 0.00 H ATOM 1271 HB1 ALA A 89 26.913 5.088 -2.996 1.00 0.00 H ATOM 1272 HB2 ALA A 89 26.547 3.391 -2.599 1.00 0.00 H ATOM 1273 HB3 ALA A 89 25.252 4.471 -3.171 1.00 0.00 H ATOM 1274 H ALA A 89 27.165 3.949 0.359 1.00 0.00 H ATOM 1275 N CYS A 90 23.559 4.166 -0.807 1.00 16.54 N ATOM 1276 CA CYS A 90 22.459 3.550 -0.097 1.00 18.98 C ATOM 1277 C CYS A 90 21.533 2.767 -1.044 1.00 17.94 C ATOM 1278 O CYS A 90 21.360 3.206 -2.168 1.00 18.10 O ATOM 1279 CB CYS A 90 21.608 4.609 0.612 1.00 26.91 C ATOM 1280 SG CYS A 90 22.579 5.427 1.925 1.00 27.50 S ATOM 1281 HA CYS A 90 22.905 2.867 0.626 1.00 0.00 H ATOM 1282 HB2 CYS A 90 20.734 4.131 1.055 1.00 0.00 H ATOM 1283 HB3 CYS A 90 21.284 5.355 -0.114 1.00 0.00 H ATOM 1284 HG CYS A 90 21.796 6.376 2.551 1.00 0.00 H ATOM 1285 H CYS A 90 23.349 4.877 -1.537 1.00 0.00 H ATOM 1286 N PHE A 91 20.850 1.768 -0.468 1.00 17.08 N ATOM 1287 CA PHE A 91 19.898 1.071 -1.386 1.00 15.69 C ATOM 1288 C PHE A 91 18.807 0.510 -0.509 1.00 14.69 C ATOM 1289 O PHE A 91 18.855 0.439 0.727 1.00 14.82 O ATOM 1290 CB PHE A 91 20.657 -0.003 -2.201 1.00 18.54 C ATOM 1291 CG PHE A 91 21.250 -1.105 -1.371 1.00 21.27 C ATOM 1292 CD1 PHE A 91 22.530 -0.970 -0.824 1.00 13.93 C ATOM 1293 CD2 PHE A 91 20.569 -2.258 -1.040 1.00 16.04 C ATOM 1294 CE1 PHE A 91 23.143 -1.959 -0.051 1.00 17.04 C ATOM 1295 CE2 PHE A 91 21.168 -3.269 -0.281 1.00 16.64 C ATOM 1296 CZ PHE A 91 22.455 -3.150 0.243 1.00 17.94 C ATOM 1297 HA PHE A 91 19.451 1.735 -2.126 1.00 0.00 H ATOM 1298 HB2 PHE A 91 19.961 -0.448 -2.912 1.00 0.00 H ATOM 1299 HB3 PHE A 91 21.465 0.488 -2.744 1.00 0.00 H ATOM 1300 HD2 PHE A 91 19.540 -2.384 -1.378 1.00 0.00 H ATOM 1301 HE2 PHE A 91 20.608 -4.185 -0.092 1.00 0.00 H ATOM 1302 HZ PHE A 91 22.904 -3.938 0.848 1.00 0.00 H ATOM 1303 HE1 PHE A 91 24.155 -1.808 0.325 1.00 0.00 H ATOM 1304 HD1 PHE A 91 23.077 -0.046 -1.010 1.00 0.00 H ATOM 1305 H PHE A 91 20.972 1.501 0.530 1.00 0.00 H ATOM 1306 N GLY A 92 17.700 0.045 -1.178 1.00 16.07 N ATOM 1307 CA GLY A 92 16.643 -0.517 -0.335 1.00 17.10 C ATOM 1308 C GLY A 92 15.472 -0.960 -1.260 1.00 20.11 C ATOM 1309 O GLY A 92 15.467 -0.630 -2.438 1.00 17.70 O ATOM 1310 HA3 GLY A 92 16.293 0.236 0.370 1.00 0.00 H ATOM 1311 HA2 GLY A 92 17.026 -1.377 0.214 1.00 0.00 H ATOM 1312 H GLY A 92 17.619 0.089 -2.214 1.00 0.00 H ATOM 1313 N CYS A 93 14.693 -1.854 -0.658 1.00 17.82 N ATOM 1314 CA CYS A 93 13.552 -2.381 -1.431 1.00 21.06 C ATOM 1315 C CYS A 93 12.322 -1.805 -0.752 1.00 18.06 C ATOM 1316 O CYS A 93 12.318 -1.567 0.450 1.00 16.27 O ATOM 1317 CB CYS A 93 13.533 -3.942 -1.237 1.00 17.36 C ATOM 1318 SG CYS A 93 14.849 -4.694 -2.216 1.00 22.48 S ATOM 1319 HA CYS A 93 13.599 -2.133 -2.491 1.00 0.00 H ATOM 1320 HB2 CYS A 93 12.570 -4.336 -1.561 1.00 0.00 H ATOM 1321 HB3 CYS A 93 13.685 -4.178 -0.184 1.00 0.00 H ATOM 1322 HG CYS A 93 14.826 -6.063 -2.041 1.00 0.00 H ATOM 1323 H CYS A 93 14.880 -2.168 0.316 1.00 0.00 H ATOM 1324 N GLY A 94 11.244 -1.637 -1.527 1.00 20.62 N ATOM 1325 CA GLY A 94 9.969 -1.233 -0.918 1.00 18.98 C ATOM 1326 C GLY A 94 8.862 -1.479 -1.992 1.00 20.36 C ATOM 1327 O GLY A 94 9.070 -2.225 -2.942 1.00 20.44 O ATOM 1328 HA3 GLY A 94 10.000 -0.178 -0.645 1.00 0.00 H ATOM 1329 HA2 GLY A 94 9.770 -1.832 -0.029 1.00 0.00 H ATOM 1330 H GLY A 94 11.308 -1.791 -2.553 1.00 0.00 H ATOM 1331 N GLU A 95 7.753 -0.777 -1.845 1.00 22.66 N ATOM 1332 CA GLU A 95 6.616 -0.988 -2.772 1.00 23.97 C ATOM 1333 C GLU A 95 5.977 0.348 -3.119 1.00 24.02 C ATOM 1334 O GLU A 95 5.765 1.130 -2.204 1.00 25.97 O ATOM 1335 CB GLU A 95 5.646 -1.891 -1.986 1.00 24.64 C ATOM 1336 CG GLU A 95 5.896 -3.348 -2.358 1.00 40.18 C ATOM 1337 CD GLU A 95 5.133 -4.255 -1.417 1.00 49.37 C ATOM 1338 OE1 GLU A 95 4.079 -3.781 -0.940 1.00 57.68 O ATOM 1339 OE2 GLU A 95 5.588 -5.387 -1.177 1.00 57.72 O ATOM 1340 HA GLU A 95 6.911 -1.441 -3.718 1.00 0.00 H ATOM 1341 HB2 GLU A 95 5.808 -1.755 -0.917 1.00 0.00 H ATOM 1342 HB3 GLU A 95 4.619 -1.623 -2.233 1.00 0.00 H ATOM 1343 HG2 GLU A 95 5.562 -3.523 -3.381 1.00 0.00 H ATOM 1344 HG3 GLU A 95 6.962 -3.563 -2.284 1.00 0.00 H ATOM 1345 H GLU A 95 7.678 -0.077 -1.080 1.00 0.00 H ATOM 1346 N SER A 96 5.853 0.722 -4.400 1.00 26.18 N ATOM 1347 CA SER A 96 5.390 2.058 -4.747 1.00 30.91 C ATOM 1348 C SER A 96 3.953 2.367 -4.356 1.00 34.49 C ATOM 1349 O SER A 96 3.572 3.548 -4.490 1.00 36.02 O ATOM 1350 CB SER A 96 5.448 2.346 -6.256 1.00 28.73 C ATOM 1351 OG SER A 96 5.171 1.152 -6.951 1.00 37.88 O ATOM 1352 HA SER A 96 6.082 2.677 -4.176 1.00 0.00 H ATOM 1353 HB2 SER A 96 6.442 2.706 -6.524 1.00 0.00 H ATOM 1354 HB3 SER A 96 4.707 3.103 -6.515 1.00 0.00 H ATOM 1355 HG SER A 96 5.845 0.468 -6.711 1.00 0.00 H ATOM 1356 H SER A 96 6.091 0.049 -5.156 1.00 0.00 H ATOM 1357 N SER A 97 3.184 1.432 -3.855 1.00 31.73 N ATOM 1358 CA SER A 97 1.821 1.653 -3.445 1.00 37.35 C ATOM 1359 C SER A 97 1.843 2.369 -2.104 1.00 40.71 C ATOM 1360 O SER A 97 0.794 2.932 -1.784 1.00 39.74 O ATOM 1361 CB SER A 97 1.060 0.339 -3.363 1.00 41.54 C ATOM 1362 OG SER A 97 1.652 -0.590 -2.463 1.00 45.54 O ATOM 1363 HA SER A 97 1.302 2.269 -4.179 1.00 0.00 H ATOM 1364 HB2 SER A 97 1.031 -0.109 -4.356 1.00 0.00 H ATOM 1365 HB3 SER A 97 0.043 0.546 -3.030 1.00 0.00 H ATOM 1366 HG SER A 97 1.117 -1.423 -2.451 1.00 0.00 H ATOM 1367 H SER A 97 3.580 0.476 -3.747 1.00 0.00 H ATOM 1368 N TYR A 98 2.950 2.310 -1.348 1.00 35.05 N ATOM 1369 CA TYR A 98 2.982 3.054 -0.095 1.00 34.59 C ATOM 1370 C TYR A 98 3.218 4.537 -0.365 1.00 34.33 C ATOM 1371 O TYR A 98 3.848 4.922 -1.341 1.00 36.50 O ATOM 1372 CB TYR A 98 4.082 2.554 0.866 1.00 30.95 C ATOM 1373 CG TYR A 98 3.631 1.220 1.426 1.00 28.47 C ATOM 1374 CD1 TYR A 98 3.914 0.042 0.743 1.00 30.41 C ATOM 1375 CD2 TYR A 98 2.858 1.169 2.576 1.00 29.14 C ATOM 1376 CE1 TYR A 98 3.478 -1.186 1.233 1.00 32.31 C ATOM 1377 CE2 TYR A 98 2.404 -0.041 3.068 1.00 33.11 C ATOM 1378 CZ TYR A 98 2.740 -1.205 2.390 1.00 34.88 C ATOM 1379 OH TYR A 98 2.261 -2.377 2.928 1.00 36.75 O ATOM 1380 HA TYR A 98 2.013 2.896 0.380 1.00 0.00 H ATOM 1381 HB3 TYR A 98 4.221 3.270 1.676 1.00 0.00 H ATOM 1382 HB2 TYR A 98 5.021 2.432 0.325 1.00 0.00 H ATOM 1383 HD2 TYR A 98 2.606 2.092 3.098 1.00 0.00 H ATOM 1384 HE2 TYR A 98 1.794 -0.080 3.971 1.00 0.00 H ATOM 1385 HE1 TYR A 98 3.717 -2.112 0.710 1.00 0.00 H ATOM 1386 HD1 TYR A 98 4.483 0.081 -0.186 1.00 0.00 H ATOM 1387 HH TYR A 98 2.557 -3.140 2.371 1.00 0.00 H ATOM 1388 H TYR A 98 3.769 1.745 -1.650 1.00 0.00 H ATOM 1389 N GLU A 99 2.856 5.366 0.599 1.00 34.72 N ATOM 1390 CA GLU A 99 3.053 6.811 0.483 1.00 38.72 C ATOM 1391 C GLU A 99 4.524 7.150 0.304 1.00 40.53 C ATOM 1392 O GLU A 99 4.892 7.995 -0.507 1.00 42.81 O ATOM 1393 CB GLU A 99 2.514 7.522 1.740 1.00 41.41 C ATOM 1394 CG GLU A 99 2.167 8.968 1.433 1.00 61.89 C ATOM 1395 CD GLU A 99 1.962 9.910 2.591 1.00 68.41 C ATOM 1396 OE1 GLU A 99 1.550 9.519 3.703 1.00 63.08 O ATOM 1397 OE2 GLU A 99 2.377 11.099 2.460 1.00 75.54 O ATOM 1398 HA GLU A 99 2.507 7.154 -0.395 1.00 0.00 H ATOM 1399 HB2 GLU A 99 1.619 7.005 2.088 1.00 0.00 H ATOM 1400 HB3 GLU A 99 3.274 7.494 2.521 1.00 0.00 H ATOM 1401 HG2 GLU A 99 2.976 9.373 0.825 1.00 0.00 H ATOM 1402 HG3 GLU A 99 1.245 8.963 0.852 1.00 0.00 H ATOM 1403 H GLU A 99 2.420 4.981 1.461 1.00 0.00 H ATOM 1404 N TYR A 100 5.362 6.622 1.209 1.00 35.33 N ATOM 1405 CA TYR A 100 6.791 6.915 1.190 1.00 33.56 C ATOM 1406 C TYR A 100 7.579 5.753 0.597 1.00 30.74 C ATOM 1407 O TYR A 100 8.043 4.922 1.380 1.00 29.48 O ATOM 1408 CB TYR A 100 7.237 7.163 2.642 1.00 38.29 C ATOM 1409 CG TYR A 100 6.599 8.329 3.352 1.00 54.00 C ATOM 1410 CD1 TYR A 100 5.320 8.784 3.094 1.00 60.04 C ATOM 1411 CD2 TYR A 100 7.221 9.067 4.339 1.00 61.49 C ATOM 1412 CE1 TYR A 100 4.733 9.834 3.723 1.00 62.61 C ATOM 1413 CE2 TYR A 100 6.649 10.105 5.039 1.00 64.70 C ATOM 1414 CZ TYR A 100 5.377 10.505 4.715 1.00 64.45 C ATOM 1415 OH TYR A 100 4.782 11.540 5.396 1.00 68.10 O ATOM 1416 HA TYR A 100 6.980 7.791 0.570 1.00 0.00 H ATOM 1417 HB3 TYR A 100 8.314 7.329 2.634 1.00 0.00 H ATOM 1418 HB2 TYR A 100 7.014 6.263 3.215 1.00 0.00 H ATOM 1419 HD2 TYR A 100 8.250 8.806 4.584 1.00 0.00 H ATOM 1420 HE2 TYR A 100 7.198 10.602 5.839 1.00 0.00 H ATOM 1421 HE1 TYR A 100 3.730 10.144 3.428 1.00 0.00 H ATOM 1422 HD1 TYR A 100 4.741 8.263 2.331 1.00 0.00 H ATOM 1423 HH TYR A 100 3.873 11.693 5.034 1.00 0.00 H ATOM 1424 H TYR A 100 4.984 5.988 1.942 1.00 0.00 H ATOM 1425 N PHE A 101 7.678 5.667 -0.707 1.00 26.63 N ATOM 1426 CA PHE A 101 8.349 4.599 -1.406 1.00 28.16 C ATOM 1427 C PHE A 101 9.845 4.567 -1.049 1.00 27.94 C ATOM 1428 O PHE A 101 10.512 5.603 -1.168 1.00 24.32 O ATOM 1429 CB PHE A 101 8.172 4.839 -2.903 1.00 24.66 C ATOM 1430 CG PHE A 101 8.964 3.864 -3.726 1.00 24.41 C ATOM 1431 CD1 PHE A 101 8.828 2.498 -3.529 1.00 25.87 C ATOM 1432 CD2 PHE A 101 9.832 4.334 -4.679 1.00 23.40 C ATOM 1433 CE1 PHE A 101 9.575 1.623 -4.298 1.00 25.69 C ATOM 1434 CE2 PHE A 101 10.601 3.454 -5.429 1.00 25.85 C ATOM 1435 CZ PHE A 101 10.463 2.105 -5.251 1.00 26.73 C ATOM 1436 HA PHE A 101 7.921 3.639 -1.117 1.00 0.00 H ATOM 1437 HB2 PHE A 101 7.116 4.736 -3.154 1.00 0.00 H ATOM 1438 HB3 PHE A 101 8.503 5.850 -3.139 1.00 0.00 H ATOM 1439 HD2 PHE A 101 9.919 5.407 -4.849 1.00 0.00 H ATOM 1440 HE2 PHE A 101 11.314 3.838 -6.159 1.00 0.00 H ATOM 1441 HZ PHE A 101 11.048 1.411 -5.855 1.00 0.00 H ATOM 1442 HE1 PHE A 101 9.466 0.548 -4.155 1.00 0.00 H ATOM 1443 HD1 PHE A 101 8.139 2.117 -2.775 1.00 0.00 H ATOM 1444 H PHE A 101 7.243 6.421 -1.277 1.00 0.00 H ATOM 1445 N CYS A 102 10.283 3.464 -0.423 1.00 25.34 N ATOM 1446 CA CYS A 102 11.643 3.341 0.061 1.00 22.67 C ATOM 1447 C CYS A 102 12.060 4.530 0.934 1.00 21.78 C ATOM 1448 O CYS A 102 13.222 5.005 0.814 1.00 24.05 O ATOM 1449 CB CYS A 102 12.649 3.217 -1.092 1.00 22.48 C ATOM 1450 SG CYS A 102 12.537 1.550 -1.875 1.00 24.71 S ATOM 1451 HA CYS A 102 11.656 2.432 0.662 1.00 0.00 H ATOM 1452 HB2 CYS A 102 13.657 3.365 -0.705 1.00 0.00 H ATOM 1453 HB3 CYS A 102 12.433 3.980 -1.840 1.00 0.00 H ATOM 1454 HG CYS A 102 13.450 1.466 -2.906 1.00 0.00 H ATOM 1455 H CYS A 102 9.625 2.672 -0.281 1.00 0.00 H ATOM 1456 N GLY A 103 11.191 4.971 1.838 1.00 19.77 N ATOM 1457 CA GLY A 103 11.491 6.118 2.666 1.00 23.25 C ATOM 1458 C GLY A 103 12.662 5.900 3.613 1.00 27.27 C ATOM 1459 O GLY A 103 13.363 6.859 3.909 1.00 22.56 O ATOM 1460 HA3 GLY A 103 10.608 6.355 3.259 1.00 0.00 H ATOM 1461 HA2 GLY A 103 11.727 6.960 2.015 1.00 0.00 H ATOM 1462 H GLY A 103 10.280 4.483 1.952 1.00 0.00 H ATOM 1463 N ALA A 104 12.989 4.637 3.964 1.00 23.04 N ATOM 1464 CA ALA A 104 14.199 4.395 4.723 1.00 22.95 C ATOM 1465 C ALA A 104 15.464 4.856 4.013 1.00 19.92 C ATOM 1466 O ALA A 104 16.416 5.252 4.724 1.00 21.92 O ATOM 1467 CB ALA A 104 14.322 2.885 4.951 1.00 24.40 C ATOM 1468 HA ALA A 104 14.115 4.963 5.650 1.00 0.00 H ATOM 1469 HB1 ALA A 104 13.453 2.530 5.505 1.00 0.00 H ATOM 1470 HB2 ALA A 104 14.373 2.376 3.988 1.00 0.00 H ATOM 1471 HB3 ALA A 104 15.227 2.678 5.522 1.00 0.00 H ATOM 1472 H ALA A 104 12.375 3.843 3.691 1.00 0.00 H ATOM 1473 N VAL A 105 15.543 4.765 2.707 1.00 18.93 N ATOM 1474 CA VAL A 105 16.688 5.144 1.921 1.00 22.49 C ATOM 1475 C VAL A 105 16.873 6.663 2.042 1.00 26.19 C ATOM 1476 O VAL A 105 18.014 7.079 2.152 1.00 22.74 O ATOM 1477 CB VAL A 105 16.589 4.779 0.420 1.00 25.01 C ATOM 1478 CG1 VAL A 105 17.775 5.253 -0.387 1.00 27.00 C ATOM 1479 CG2 VAL A 105 16.466 3.251 0.243 1.00 22.94 C ATOM 1480 HA VAL A 105 17.534 4.582 2.316 1.00 0.00 H ATOM 1481 HB VAL A 105 15.700 5.288 0.049 1.00 0.00 H ATOM 1482 HG11 VAL A 105 17.851 6.338 -0.316 1.00 0.00 H ATOM 1483 HG12 VAL A 105 18.685 4.797 0.004 1.00 0.00 H ATOM 1484 HG13 VAL A 105 17.642 4.965 -1.430 1.00 0.00 H ATOM 1485 HG21 VAL A 105 17.344 2.765 0.669 1.00 0.00 H ATOM 1486 HG22 VAL A 105 15.570 2.898 0.754 1.00 0.00 H ATOM 1487 HG23 VAL A 105 16.398 3.014 -0.819 1.00 0.00 H ATOM 1488 H VAL A 105 14.715 4.390 2.201 1.00 0.00 H ATOM 1489 N ASP A 106 15.775 7.418 1.994 1.00 26.39 N ATOM 1490 CA ASP A 106 15.879 8.876 2.134 1.00 27.95 C ATOM 1491 C ASP A 106 16.358 9.220 3.542 1.00 26.03 C ATOM 1492 O ASP A 106 17.200 10.106 3.668 1.00 26.31 O ATOM 1493 CB ASP A 106 14.519 9.597 1.959 1.00 28.58 C ATOM 1494 CG ASP A 106 13.951 9.324 0.565 1.00 28.81 C ATOM 1495 OD1 ASP A 106 14.684 9.289 -0.426 1.00 36.58 O ATOM 1496 OD2 ASP A 106 12.734 9.108 0.497 1.00 40.72 O ATOM 1497 HA ASP A 106 16.570 9.205 1.357 1.00 0.00 H ATOM 1498 HB2 ASP A 106 13.819 9.233 2.711 1.00 0.00 H ATOM 1499 HB3 ASP A 106 14.661 10.670 2.086 1.00 0.00 H ATOM 1500 H ASP A 106 14.845 6.974 1.857 1.00 0.00 H ATOM 1501 N ALA A 107 15.825 8.566 4.565 1.00 20.34 N ATOM 1502 CA ALA A 107 16.217 8.875 5.919 1.00 19.86 C ATOM 1503 C ALA A 107 17.695 8.560 6.163 1.00 24.79 C ATOM 1504 O ALA A 107 18.389 9.334 6.825 1.00 21.05 O ATOM 1505 CB ALA A 107 15.331 8.174 6.926 1.00 22.70 C ATOM 1506 HA ALA A 107 16.085 9.948 6.057 1.00 0.00 H ATOM 1507 HB1 ALA A 107 14.298 8.493 6.784 1.00 0.00 H ATOM 1508 HB2 ALA A 107 15.403 7.096 6.783 1.00 0.00 H ATOM 1509 HB3 ALA A 107 15.656 8.430 7.934 1.00 0.00 H ATOM 1510 H ALA A 107 15.118 7.824 4.390 1.00 0.00 H ATOM 1511 N ILE A 108 18.206 7.424 5.610 1.00 21.32 N ATOM 1512 CA ILE A 108 19.615 7.134 5.795 1.00 19.75 C ATOM 1513 C ILE A 108 20.488 8.116 5.025 1.00 19.69 C ATOM 1514 O ILE A 108 21.522 8.563 5.551 1.00 19.18 O ATOM 1515 CB ILE A 108 19.895 5.678 5.357 1.00 19.43 C ATOM 1516 CG1 ILE A 108 19.109 4.766 6.345 1.00 19.16 C ATOM 1517 CG2 ILE A 108 21.369 5.296 5.439 1.00 17.25 C ATOM 1518 CD1 ILE A 108 18.939 3.392 5.695 1.00 23.62 C ATOM 1519 HA ILE A 108 19.865 7.246 6.850 1.00 0.00 H ATOM 1520 HB ILE A 108 19.594 5.565 4.316 1.00 0.00 H ATOM 1521 HG12 ILE A 108 19.664 4.667 7.278 1.00 0.00 H ATOM 1522 HG13 ILE A 108 18.131 5.201 6.550 1.00 0.00 H ATOM 1523 HD11 ILE A 108 18.386 3.499 4.762 1.00 0.00 H ATOM 1524 HD12 ILE A 108 19.920 2.965 5.490 1.00 0.00 H ATOM 1525 HD13 ILE A 108 18.390 2.737 6.371 1.00 0.00 H ATOM 1526 HG21 ILE A 108 21.950 5.952 4.790 1.00 0.00 H ATOM 1527 HG22 ILE A 108 21.714 5.402 6.468 1.00 0.00 H ATOM 1528 HG23 ILE A 108 21.493 4.262 5.117 1.00 0.00 H ATOM 1529 H ILE A 108 17.598 6.778 5.067 1.00 0.00 H ATOM 1530 N GLU A 109 20.204 8.421 3.761 1.00 16.67 N ATOM 1531 CA GLU A 109 21.000 9.350 2.993 1.00 25.68 C ATOM 1532 C GLU A 109 21.072 10.724 3.681 1.00 25.18 C ATOM 1533 O GLU A 109 22.133 11.333 3.761 1.00 28.01 O ATOM 1534 CB GLU A 109 20.457 9.620 1.590 1.00 24.26 C ATOM 1535 CG GLU A 109 20.665 8.437 0.678 1.00 29.87 C ATOM 1536 CD GLU A 109 20.269 8.700 -0.756 1.00 31.30 C ATOM 1537 OE1 GLU A 109 19.409 9.571 -0.967 1.00 35.63 O ATOM 1538 OE2 GLU A 109 20.867 8.087 -1.656 1.00 32.35 O ATOM 1539 HA GLU A 109 21.974 8.866 2.924 1.00 0.00 H ATOM 1540 HB2 GLU A 109 19.390 9.832 1.658 1.00 0.00 H ATOM 1541 HB3 GLU A 109 20.972 10.485 1.171 1.00 0.00 H ATOM 1542 HG2 GLU A 109 21.721 8.166 0.700 1.00 0.00 H ATOM 1543 HG3 GLU A 109 20.070 7.604 1.053 1.00 0.00 H ATOM 1544 H GLU A 109 19.380 7.975 3.310 1.00 0.00 H ATOM 1545 N GLU A 110 19.947 11.176 4.167 1.00 24.24 N ATOM 1546 CA GLU A 110 19.889 12.459 4.849 1.00 26.84 C ATOM 1547 C GLU A 110 20.736 12.414 6.119 1.00 28.12 C ATOM 1548 O GLU A 110 21.425 13.416 6.358 1.00 26.78 O ATOM 1549 CB GLU A 110 18.445 12.836 5.167 1.00 38.48 C ATOM 1550 CG GLU A 110 18.377 13.987 6.155 1.00 56.91 C ATOM 1551 CD GLU A 110 17.034 14.085 6.844 1.00 75.89 C ATOM 1552 OE1 GLU A 110 16.032 14.052 6.087 1.00 82.23 O ATOM 1553 OE2 GLU A 110 16.945 14.210 8.084 1.00 85.20 O ATOM 1554 HA GLU A 110 20.295 13.226 4.190 1.00 0.00 H ATOM 1555 HB2 GLU A 110 17.944 13.130 4.245 1.00 0.00 H ATOM 1556 HB3 GLU A 110 17.938 11.971 5.595 1.00 0.00 H ATOM 1557 HG2 GLU A 110 19.148 13.844 6.912 1.00 0.00 H ATOM 1558 HG3 GLU A 110 18.564 14.918 5.620 1.00 0.00 H ATOM 1559 H GLU A 110 19.080 10.610 4.065 1.00 0.00 H ATOM 1560 N LYS A 111 20.671 11.347 6.945 1.00 21.69 N ATOM 1561 CA LYS A 111 21.482 11.341 8.149 1.00 18.60 C ATOM 1562 C LYS A 111 22.956 11.282 7.777 1.00 23.32 C ATOM 1563 O LYS A 111 23.782 12.023 8.346 1.00 25.91 O ATOM 1564 CB LYS A 111 21.069 10.276 9.140 1.00 22.94 C ATOM 1565 CG LYS A 111 21.919 10.308 10.418 1.00 28.21 C ATOM 1566 CD LYS A 111 21.046 9.791 11.562 1.00 27.24 C ATOM 1567 CE LYS A 111 21.839 9.753 12.854 1.00 32.76 C ATOM 1568 NZ LYS A 111 21.106 9.032 13.925 1.00 31.26 N ATOM 1569 HA LYS A 111 21.308 12.277 8.679 1.00 0.00 H ATOM 1570 HB2 LYS A 111 20.025 10.433 9.409 1.00 0.00 H ATOM 1571 HB3 LYS A 111 21.178 9.298 8.670 1.00 0.00 H ATOM 1572 HG2 LYS A 111 22.795 9.670 10.299 1.00 0.00 H ATOM 1573 HG3 LYS A 111 22.241 11.328 10.626 1.00 0.00 H ATOM 1574 HD2 LYS A 111 20.187 10.451 11.686 1.00 0.00 H ATOM 1575 HD3 LYS A 111 20.698 8.786 11.323 1.00 0.00 H ATOM 1576 HE2 LYS A 111 22.030 10.775 13.182 1.00 0.00 H ATOM 1577 HE3 LYS A 111 22.788 9.248 12.672 1.00 0.00 H ATOM 1578 HZ1 LYS A 111 20.202 9.512 14.108 1.00 0.00 H ATOM 1579 HZ2 LYS A 111 20.925 8.054 13.622 1.00 0.00 H ATOM 1580 HZ3 LYS A 111 21.679 9.027 14.793 1.00 0.00 H ATOM 1581 H LYS A 111 20.050 10.543 6.722 1.00 0.00 H ATOM 1582 N LEU A 112 23.362 10.522 6.765 1.00 20.01 N ATOM 1583 CA LEU A 112 24.748 10.455 6.351 1.00 22.55 C ATOM 1584 C LEU A 112 25.287 11.829 5.901 1.00 26.51 C ATOM 1585 O LEU A 112 26.452 12.173 6.047 1.00 23.35 O ATOM 1586 CB LEU A 112 24.813 9.499 5.160 1.00 24.37 C ATOM 1587 CG LEU A 112 25.379 8.094 5.275 1.00 31.52 C ATOM 1588 CD1 LEU A 112 25.416 7.500 6.638 1.00 24.35 C ATOM 1589 CD2 LEU A 112 24.673 7.090 4.353 1.00 22.09 C ATOM 1590 HA LEU A 112 25.354 10.121 7.193 1.00 0.00 H ATOM 1591 HB2 LEU A 112 23.789 9.386 4.805 1.00 0.00 H ATOM 1592 HB3 LEU A 112 25.406 10.004 4.397 1.00 0.00 H ATOM 1593 HG LEU A 112 26.412 8.258 4.968 1.00 0.00 H ATOM 1594 HD21 LEU A 112 23.615 7.045 4.610 1.00 0.00 H ATOM 1595 HD22 LEU A 112 24.784 7.410 3.317 1.00 0.00 H ATOM 1596 HD23 LEU A 112 25.121 6.105 4.480 1.00 0.00 H ATOM 1597 HD11 LEU A 112 26.031 8.123 7.288 1.00 0.00 H ATOM 1598 HD12 LEU A 112 24.403 7.446 7.037 1.00 0.00 H ATOM 1599 HD13 LEU A 112 25.841 6.498 6.585 1.00 0.00 H ATOM 1600 H LEU A 112 22.658 9.954 6.251 1.00 0.00 H ATOM 1601 N LYS A 113 24.520 12.522 5.057 1.00 24.43 N ATOM 1602 CA LYS A 113 24.897 13.833 4.542 1.00 30.15 C ATOM 1603 C LYS A 113 25.160 14.787 5.710 1.00 31.18 C ATOM 1604 O LYS A 113 26.221 15.394 5.729 1.00 30.39 O ATOM 1605 CB LYS A 113 23.858 14.417 3.624 1.00 32.85 C ATOM 1606 CG LYS A 113 23.874 13.985 2.169 1.00 38.50 C ATOM 1607 CD LYS A 113 22.627 14.602 1.537 1.00 51.92 C ATOM 1608 CE LYS A 113 22.286 14.089 0.157 1.00 63.75 C ATOM 1609 NZ LYS A 113 20.933 14.597 -0.247 1.00 69.88 N ATOM 1610 HA LYS A 113 25.804 13.702 3.952 1.00 0.00 H ATOM 1611 HB2 LYS A 113 22.881 14.155 4.030 1.00 0.00 H ATOM 1612 HB3 LYS A 113 23.979 15.500 3.643 1.00 0.00 H ATOM 1613 HG2 LYS A 113 24.772 14.353 1.674 1.00 0.00 H ATOM 1614 HG3 LYS A 113 23.839 12.898 2.095 1.00 0.00 H ATOM 1615 HD2 LYS A 113 21.780 14.398 2.192 1.00 0.00 H ATOM 1616 HD3 LYS A 113 22.781 15.679 1.469 1.00 0.00 H ATOM 1617 HE2 LYS A 113 22.277 12.999 0.166 1.00 0.00 H ATOM 1618 HE3 LYS A 113 23.033 14.439 -0.556 1.00 0.00 H ATOM 1619 HZ1 LYS A 113 20.221 14.262 0.433 1.00 0.00 H ATOM 1620 HZ2 LYS A 113 20.943 15.637 -0.256 1.00 0.00 H ATOM 1621 HZ3 LYS A 113 20.700 14.243 -1.197 1.00 0.00 H ATOM 1622 H LYS A 113 23.615 12.109 4.754 1.00 0.00 H ATOM 1623 N ASN A 114 24.293 14.778 6.710 1.00 31.89 N ATOM 1624 CA ASN A 114 24.427 15.539 7.921 1.00 33.58 C ATOM 1625 C ASN A 114 25.663 15.192 8.737 1.00 36.75 C ATOM 1626 O ASN A 114 26.268 16.107 9.314 1.00 35.32 O ATOM 1627 CB ASN A 114 23.186 15.397 8.793 1.00 40.20 C ATOM 1628 CG ASN A 114 21.997 16.013 8.070 1.00 59.04 C ATOM 1629 OD1 ASN A 114 21.831 16.128 6.852 1.00 63.28 O ATOM 1630 ND2 ASN A 114 21.086 16.523 8.904 1.00 68.14 N ATOM 1631 HA ASN A 114 24.543 16.574 7.598 1.00 0.00 H ATOM 1632 HB2 ASN A 114 22.991 14.341 8.983 1.00 0.00 H ATOM 1633 HB3 ASN A 114 23.344 15.912 9.741 1.00 0.00 H ATOM 1634 HD22 ASN A 114 21.214 16.433 9.932 1.00 0.00 H ATOM 1635 HD21 ASN A 114 20.249 17.010 8.525 1.00 0.00 H ATOM 1636 H ASN A 114 23.452 14.175 6.612 1.00 0.00 H ATOM 1637 N LEU A 115 26.149 13.961 8.641 1.00 29.75 N ATOM 1638 CA LEU A 115 27.380 13.567 9.329 1.00 28.64 C ATOM 1639 C LEU A 115 28.612 13.828 8.504 1.00 28.85 C ATOM 1640 O LEU A 115 29.711 13.421 8.894 1.00 28.63 O ATOM 1641 CB LEU A 115 27.298 12.071 9.706 1.00 26.71 C ATOM 1642 CG LEU A 115 26.205 11.755 10.718 1.00 29.64 C ATOM 1643 CD1 LEU A 115 26.049 10.229 10.862 1.00 31.89 C ATOM 1644 CD2 LEU A 115 26.466 12.426 12.047 1.00 31.51 C ATOM 1645 HA LEU A 115 27.468 14.178 10.228 1.00 0.00 H ATOM 1646 HB2 LEU A 115 27.105 11.497 8.800 1.00 0.00 H ATOM 1647 HB3 LEU A 115 28.256 11.769 10.128 1.00 0.00 H ATOM 1648 HG LEU A 115 25.262 12.160 10.350 1.00 0.00 H ATOM 1649 HD21 LEU A 115 27.418 12.078 12.448 1.00 0.00 H ATOM 1650 HD22 LEU A 115 26.503 13.506 11.906 1.00 0.00 H ATOM 1651 HD23 LEU A 115 25.664 12.176 12.742 1.00 0.00 H ATOM 1652 HD11 LEU A 115 25.781 9.800 9.897 1.00 0.00 H ATOM 1653 HD12 LEU A 115 26.991 9.799 11.203 1.00 0.00 H ATOM 1654 HD13 LEU A 115 25.265 10.012 11.588 1.00 0.00 H ATOM 1655 H LEU A 115 25.644 13.259 8.063 1.00 0.00 H ATOM 1656 N GLY A 116 28.449 14.398 7.312 1.00 26.25 N ATOM 1657 CA GLY A 116 29.622 14.669 6.490 1.00 29.88 C ATOM 1658 C GLY A 116 30.113 13.525 5.634 1.00 31.60 C ATOM 1659 O GLY A 116 31.264 13.569 5.181 1.00 26.27 O ATOM 1660 HA3 GLY A 116 30.435 14.960 7.155 1.00 0.00 H ATOM 1661 HA2 GLY A 116 29.380 15.501 5.828 1.00 0.00 H ATOM 1662 H GLY A 116 27.498 14.646 6.972 1.00 0.00 H ATOM 1663 N ALA A 117 29.241 12.513 5.363 1.00 23.56 N ATOM 1664 CA ALA A 117 29.735 11.439 4.482 1.00 24.03 C ATOM 1665 C ALA A 117 29.718 11.946 3.045 1.00 24.01 C ATOM 1666 O ALA A 117 29.027 12.908 2.763 1.00 25.70 O ATOM 1667 CB ALA A 117 28.740 10.249 4.496 1.00 20.12 C ATOM 1668 HA ALA A 117 30.728 11.143 4.820 1.00 0.00 H ATOM 1669 HB1 ALA A 117 28.646 9.868 5.513 1.00 0.00 H ATOM 1670 HB2 ALA A 117 27.766 10.587 4.142 1.00 0.00 H ATOM 1671 HB3 ALA A 117 29.111 9.459 3.843 1.00 0.00 H ATOM 1672 H ALA A 117 28.279 12.499 5.757 1.00 0.00 H ATOM 1673 N GLU A 118 30.399 11.298 2.122 1.00 20.92 N ATOM 1674 CA GLU A 118 30.376 11.568 0.730 1.00 22.85 C ATOM 1675 C GLU A 118 29.471 10.570 -0.035 1.00 25.75 C ATOM 1676 O GLU A 118 29.936 9.458 -0.296 1.00 23.02 O ATOM 1677 CB GLU A 118 31.800 11.487 0.149 1.00 26.40 C ATOM 1678 CG GLU A 118 31.780 11.778 -1.349 1.00 50.33 C ATOM 1679 CD GLU A 118 33.147 11.752 -2.001 1.00 62.32 C ATOM 1680 OE1 GLU A 118 34.108 12.316 -1.430 1.00 69.04 O ATOM 1681 OE2 GLU A 118 33.329 11.163 -3.090 1.00 68.40 O ATOM 1682 HA GLU A 118 29.972 12.573 0.605 1.00 0.00 H ATOM 1683 HB2 GLU A 118 32.435 12.219 0.649 1.00 0.00 H ATOM 1684 HB3 GLU A 118 32.200 10.487 0.316 1.00 0.00 H ATOM 1685 HG2 GLU A 118 31.154 11.030 -1.835 1.00 0.00 H ATOM 1686 HG3 GLU A 118 31.347 12.767 -1.500 1.00 0.00 H ATOM 1687 H GLU A 118 31.008 10.519 2.443 1.00 0.00 H ATOM 1688 N ILE A 119 28.259 11.033 -0.366 1.00 23.54 N ATOM 1689 CA ILE A 119 27.322 10.105 -1.066 1.00 23.62 C ATOM 1690 C ILE A 119 27.774 9.947 -2.498 1.00 27.34 C ATOM 1691 O ILE A 119 27.846 10.923 -3.240 1.00 24.10 O ATOM 1692 CB ILE A 119 25.877 10.610 -1.092 1.00 29.72 C ATOM 1693 CG1 ILE A 119 25.291 10.817 0.296 1.00 31.25 C ATOM 1694 CG2 ILE A 119 25.005 9.676 -1.925 1.00 31.77 C ATOM 1695 CD1 ILE A 119 25.274 9.586 1.139 1.00 40.17 C ATOM 1696 HA ILE A 119 27.341 9.165 -0.515 1.00 0.00 H ATOM 1697 HB ILE A 119 25.893 11.594 -1.560 1.00 0.00 H ATOM 1698 HG12 ILE A 119 25.883 11.575 0.808 1.00 0.00 H ATOM 1699 HG13 ILE A 119 24.266 11.171 0.186 1.00 0.00 H ATOM 1700 HD11 ILE A 119 24.675 8.819 0.648 1.00 0.00 H ATOM 1701 HD12 ILE A 119 26.293 9.223 1.271 1.00 0.00 H ATOM 1702 HD13 ILE A 119 24.841 9.819 2.112 1.00 0.00 H ATOM 1703 HG21 ILE A 119 25.388 9.637 -2.945 1.00 0.00 H ATOM 1704 HG22 ILE A 119 25.026 8.677 -1.490 1.00 0.00 H ATOM 1705 HG23 ILE A 119 23.981 10.049 -1.934 1.00 0.00 H ATOM 1706 H ILE A 119 27.979 12.009 -0.142 1.00 0.00 H ATOM 1707 N VAL A 120 28.180 8.746 -2.943 1.00 21.85 N ATOM 1708 CA VAL A 120 28.792 8.639 -4.249 1.00 24.52 C ATOM 1709 C VAL A 120 27.773 8.606 -5.385 1.00 29.08 C ATOM 1710 O VAL A 120 28.124 8.973 -6.508 1.00 29.11 O ATOM 1711 CB VAL A 120 29.611 7.338 -4.408 1.00 31.45 C ATOM 1712 CG1 VAL A 120 30.727 7.623 -5.384 1.00 43.44 C ATOM 1713 CG2 VAL A 120 30.159 6.865 -3.079 1.00 45.91 C ATOM 1714 HA VAL A 120 29.422 9.526 -4.312 1.00 0.00 H ATOM 1715 HB VAL A 120 28.973 6.537 -4.781 1.00 0.00 H ATOM 1716 HG11 VAL A 120 30.302 7.927 -6.341 1.00 0.00 H ATOM 1717 HG12 VAL A 120 31.354 8.424 -4.993 1.00 0.00 H ATOM 1718 HG13 VAL A 120 31.327 6.723 -5.520 1.00 0.00 H ATOM 1719 HG21 VAL A 120 30.808 7.634 -2.661 1.00 0.00 H ATOM 1720 HG22 VAL A 120 29.333 6.673 -2.394 1.00 0.00 H ATOM 1721 HG23 VAL A 120 30.729 5.948 -3.228 1.00 0.00 H ATOM 1722 H VAL A 120 28.055 7.899 -2.352 1.00 0.00 H ATOM 1723 N GLN A 121 26.601 8.063 -5.089 1.00 25.02 N ATOM 1724 CA GLN A 121 25.590 7.940 -6.194 1.00 27.16 C ATOM 1725 C GLN A 121 24.230 8.072 -5.567 1.00 23.96 C ATOM 1726 O GLN A 121 24.187 7.744 -4.389 1.00 23.25 O ATOM 1727 CB GLN A 121 25.855 6.539 -6.747 1.00 35.15 C ATOM 1728 CG GLN A 121 25.221 6.073 -8.010 1.00 46.66 C ATOM 1729 CD GLN A 121 25.771 6.758 -9.240 1.00 54.31 C ATOM 1730 OE1 GLN A 121 26.912 7.230 -9.290 1.00 60.22 O ATOM 1731 NE2 GLN A 121 24.893 6.817 -10.242 1.00 51.73 N ATOM 1732 HA GLN A 121 25.649 8.687 -6.985 1.00 0.00 H ATOM 1733 HB2 GLN A 121 26.932 6.465 -6.897 1.00 0.00 H ATOM 1734 HB3 GLN A 121 25.548 5.838 -5.971 1.00 0.00 H ATOM 1735 HG2 GLN A 121 25.388 5.000 -8.107 1.00 0.00 H ATOM 1736 HG3 GLN A 121 24.150 6.269 -7.953 1.00 0.00 H ATOM 1737 HE22 GLN A 121 23.948 6.398 -10.131 1.00 0.00 H ATOM 1738 HE21 GLN A 121 25.153 7.282 -11.135 1.00 0.00 H ATOM 1739 H GLN A 121 26.388 7.734 -4.126 1.00 0.00 H ATOM 1740 N ASP A 122 23.161 8.496 -6.213 1.00 21.35 N ATOM 1741 CA ASP A 122 21.841 8.534 -5.606 1.00 22.89 C ATOM 1742 C ASP A 122 21.368 7.098 -5.233 1.00 20.59 C ATOM 1743 O ASP A 122 21.754 6.192 -5.951 1.00 21.40 O ATOM 1744 CB ASP A 122 20.847 9.013 -6.694 1.00 33.63 C ATOM 1745 CG ASP A 122 20.986 10.501 -6.984 1.00 52.03 C ATOM 1746 OD1 ASP A 122 21.445 11.296 -6.136 1.00 53.48 O ATOM 1747 OD2 ASP A 122 20.586 10.919 -8.100 1.00 61.37 O ATOM 1748 HA ASP A 122 21.878 9.174 -4.725 1.00 0.00 H ATOM 1749 HB2 ASP A 122 21.036 8.457 -7.612 1.00 0.00 H ATOM 1750 HB3 ASP A 122 19.831 8.815 -6.353 1.00 0.00 H ATOM 1751 H ASP A 122 23.267 8.816 -7.197 1.00 0.00 H ATOM 1752 N GLY A 123 20.615 6.964 -4.176 1.00 24.37 N ATOM 1753 CA GLY A 123 20.213 5.653 -3.668 1.00 25.78 C ATOM 1754 C GLY A 123 19.524 4.746 -4.687 1.00 25.58 C ATOM 1755 O GLY A 123 18.732 5.239 -5.488 1.00 26.18 O ATOM 1756 HA3 GLY A 123 19.526 5.809 -2.836 1.00 0.00 H ATOM 1757 HA2 GLY A 123 21.106 5.141 -3.309 1.00 0.00 H ATOM 1758 H GLY A 123 20.290 7.817 -3.678 1.00 0.00 H ATOM 1759 N LEU A 124 19.719 3.428 -4.556 1.00 20.92 N ATOM 1760 CA LEU A 124 19.004 2.488 -5.450 1.00 20.38 C ATOM 1761 C LEU A 124 17.695 2.137 -4.756 1.00 20.93 C ATOM 1762 O LEU A 124 17.696 1.731 -3.593 1.00 21.95 O ATOM 1763 CB LEU A 124 19.840 1.255 -5.670 1.00 20.61 C ATOM 1764 CG LEU A 124 19.209 0.084 -6.421 1.00 25.61 C ATOM 1765 CD1 LEU A 124 18.962 0.466 -7.886 1.00 25.45 C ATOM 1766 CD2 LEU A 124 20.112 -1.137 -6.269 1.00 22.52 C ATOM 1767 HA LEU A 124 18.813 2.932 -6.427 1.00 0.00 H ATOM 1768 HB2 LEU A 124 20.725 1.559 -6.228 1.00 0.00 H ATOM 1769 HB3 LEU A 124 20.140 0.887 -4.689 1.00 0.00 H ATOM 1770 HG LEU A 124 18.235 -0.165 -6.001 1.00 0.00 H ATOM 1771 HD21 LEU A 124 21.094 -0.915 -6.686 1.00 0.00 H ATOM 1772 HD22 LEU A 124 20.212 -1.384 -5.212 1.00 0.00 H ATOM 1773 HD23 LEU A 124 19.673 -1.981 -6.801 1.00 0.00 H ATOM 1774 HD11 LEU A 124 18.289 1.322 -7.928 1.00 0.00 H ATOM 1775 HD12 LEU A 124 19.910 0.724 -8.358 1.00 0.00 H ATOM 1776 HD13 LEU A 124 18.512 -0.378 -8.409 1.00 0.00 H ATOM 1777 H LEU A 124 20.370 3.066 -3.830 1.00 0.00 H ATOM 1778 N ARG A 125 16.574 2.341 -5.439 1.00 19.20 N ATOM 1779 CA ARG A 125 15.269 2.125 -4.815 1.00 20.53 C ATOM 1780 C ARG A 125 14.517 1.045 -5.603 1.00 25.96 C ATOM 1781 O ARG A 125 14.290 1.246 -6.792 1.00 26.08 O ATOM 1782 CB ARG A 125 14.502 3.454 -4.855 1.00 24.41 C ATOM 1783 CG ARG A 125 15.034 4.459 -3.833 1.00 22.69 C ATOM 1784 CD ARG A 125 14.578 5.881 -4.144 1.00 36.90 C ATOM 1785 NE ARG A 125 14.991 6.792 -3.072 1.00 35.72 N ATOM 1786 CZ ARG A 125 16.142 7.462 -3.015 1.00 51.69 C ATOM 1787 NH1 ARG A 125 17.063 7.371 -3.979 1.00 43.37 N ATOM 1788 NH2 ARG A 125 16.396 8.245 -1.962 1.00 45.07 N ATOM 1789 HA ARG A 125 15.373 1.794 -3.782 1.00 0.00 H ATOM 1790 HB2 ARG A 125 14.596 3.884 -5.852 1.00 0.00 H ATOM 1791 HB3 ARG A 125 13.451 3.260 -4.642 1.00 0.00 H ATOM 1792 HG2 ARG A 125 14.672 4.181 -2.843 1.00 0.00 H ATOM 1793 HG3 ARG A 125 16.124 4.428 -3.842 1.00 0.00 H ATOM 1794 HD2 ARG A 125 13.492 5.899 -4.234 1.00 0.00 H ATOM 1795 HD3 ARG A 125 15.025 6.205 -5.084 1.00 0.00 H ATOM 1796 HE ARG A 125 14.325 6.928 -2.284 1.00 0.00 H ATOM 1797 HH12 ARG A 125 17.950 7.908 -3.903 1.00 0.00 H ATOM 1798 HH11 ARG A 125 16.892 6.763 -4.806 1.00 0.00 H ATOM 1799 HH22 ARG A 125 17.291 8.771 -1.909 1.00 0.00 H ATOM 1800 HH21 ARG A 125 15.698 8.328 -1.195 1.00 0.00 H ATOM 1801 H ARG A 125 16.625 2.658 -6.428 1.00 0.00 H ATOM 1802 N ILE A 126 14.296 -0.108 -5.006 1.00 23.89 N ATOM 1803 CA ILE A 126 13.727 -1.224 -5.795 1.00 22.25 C ATOM 1804 C ILE A 126 12.260 -1.393 -5.428 1.00 20.72 C ATOM 1805 O ILE A 126 11.899 -1.422 -4.270 1.00 19.94 O ATOM 1806 CB ILE A 126 14.525 -2.506 -5.603 1.00 27.37 C ATOM 1807 CG1 ILE A 126 15.876 -2.354 -6.357 1.00 28.56 C ATOM 1808 CG2 ILE A 126 13.835 -3.728 -6.212 1.00 25.65 C ATOM 1809 CD1 ILE A 126 16.921 -3.180 -5.652 1.00 43.27 C ATOM 1810 HA ILE A 126 13.793 -0.989 -6.857 1.00 0.00 H ATOM 1811 HB ILE A 126 14.638 -2.656 -4.529 1.00 0.00 H ATOM 1812 HG12 ILE A 126 15.764 -2.703 -7.384 1.00 0.00 H ATOM 1813 HG13 ILE A 126 16.178 -1.307 -6.361 1.00 0.00 H ATOM 1814 HD11 ILE A 126 17.028 -2.829 -4.626 1.00 0.00 H ATOM 1815 HD12 ILE A 126 16.614 -4.226 -5.649 1.00 0.00 H ATOM 1816 HD13 ILE A 126 17.873 -3.081 -6.173 1.00 0.00 H ATOM 1817 HG21 ILE A 126 12.862 -3.866 -5.741 1.00 0.00 H ATOM 1818 HG22 ILE A 126 13.703 -3.573 -7.283 1.00 0.00 H ATOM 1819 HG23 ILE A 126 14.450 -4.612 -6.044 1.00 0.00 H ATOM 1820 H ILE A 126 14.517 -0.232 -3.997 1.00 0.00 H ATOM 1821 N ASP A 127 11.421 -1.466 -6.464 1.00 20.00 N ATOM 1822 CA ASP A 127 9.968 -1.658 -6.228 1.00 24.59 C ATOM 1823 C ASP A 127 9.567 -3.105 -6.466 1.00 24.04 C ATOM 1824 O ASP A 127 9.911 -3.563 -7.553 1.00 26.16 O ATOM 1825 CB ASP A 127 9.256 -0.829 -7.325 1.00 24.78 C ATOM 1826 CG ASP A 127 7.768 -0.731 -7.089 1.00 24.09 C ATOM 1827 OD1 ASP A 127 7.250 -1.172 -6.060 1.00 25.08 O ATOM 1828 OD2 ASP A 127 7.129 -0.130 -7.989 1.00 34.61 O ATOM 1829 HA ASP A 127 9.714 -1.372 -5.207 1.00 0.00 H ATOM 1830 HB2 ASP A 127 9.677 0.176 -7.335 1.00 0.00 H ATOM 1831 HB3 ASP A 127 9.428 -1.303 -8.291 1.00 0.00 H ATOM 1832 H ASP A 127 11.785 -1.388 -7.435 1.00 0.00 H ATOM 1833 N GLY A 128 8.959 -3.782 -5.544 1.00 25.47 N ATOM 1834 CA GLY A 128 8.566 -5.165 -5.748 1.00 27.61 C ATOM 1835 C GLY A 128 9.760 -6.127 -5.686 1.00 31.57 C ATOM 1836 O GLY A 128 10.733 -5.985 -4.930 1.00 27.66 O ATOM 1837 HA3 GLY A 128 8.094 -5.255 -6.727 1.00 0.00 H ATOM 1838 HA2 GLY A 128 7.851 -5.444 -4.974 1.00 0.00 H ATOM 1839 H GLY A 128 8.747 -3.324 -4.635 1.00 0.00 H ATOM 1840 N ASP A 129 9.625 -7.177 -6.485 1.00 27.69 N ATOM 1841 CA ASP A 129 10.604 -8.276 -6.437 1.00 29.86 C ATOM 1842 C ASP A 129 11.895 -7.861 -7.091 1.00 25.72 C ATOM 1843 O ASP A 129 11.999 -7.627 -8.299 1.00 25.40 O ATOM 1844 CB ASP A 129 9.918 -9.447 -7.168 1.00 34.36 C ATOM 1845 CG ASP A 129 10.749 -10.705 -7.099 1.00 40.79 C ATOM 1846 OD1 ASP A 129 11.671 -10.860 -6.289 1.00 40.95 O ATOM 1847 OD2 ASP A 129 10.413 -11.580 -7.931 1.00 44.06 O ATOM 1848 HA ASP A 129 10.877 -8.559 -5.420 1.00 0.00 H ATOM 1849 HB2 ASP A 129 8.950 -9.636 -6.704 1.00 0.00 H ATOM 1850 HB3 ASP A 129 9.772 -9.175 -8.213 1.00 0.00 H ATOM 1851 H ASP A 129 8.825 -7.224 -7.148 1.00 0.00 H ATOM 1852 N PRO A 130 12.996 -7.902 -6.323 1.00 24.72 N ATOM 1853 CA PRO A 130 14.317 -7.517 -6.780 1.00 25.42 C ATOM 1854 C PRO A 130 14.843 -8.450 -7.845 1.00 25.40 C ATOM 1855 O PRO A 130 15.615 -8.070 -8.718 1.00 23.60 O ATOM 1856 CB PRO A 130 15.257 -7.486 -5.540 1.00 23.65 C ATOM 1857 CG PRO A 130 14.495 -8.340 -4.570 1.00 24.60 C ATOM 1858 CD PRO A 130 12.988 -8.258 -4.910 1.00 23.00 C ATOM 1859 HA PRO A 130 14.270 -6.532 -7.244 1.00 0.00 H ATOM 1860 HD3 PRO A 130 12.496 -9.217 -4.749 1.00 0.00 H ATOM 1861 HD2 PRO A 130 12.492 -7.492 -4.314 1.00 0.00 H ATOM 1862 HG3 PRO A 130 14.662 -7.980 -3.555 1.00 0.00 H ATOM 1863 HG2 PRO A 130 14.833 -9.373 -4.648 1.00 0.00 H ATOM 1864 HB2 PRO A 130 16.233 -7.915 -5.768 1.00 0.00 H ATOM 1865 HB3 PRO A 130 15.386 -6.472 -5.163 1.00 0.00 H ATOM 1866 N ARG A 131 14.391 -9.719 -7.804 1.00 27.73 N ATOM 1867 CA ARG A 131 14.803 -10.678 -8.841 1.00 31.61 C ATOM 1868 C ARG A 131 14.346 -10.238 -10.221 1.00 34.92 C ATOM 1869 O ARG A 131 15.067 -10.495 -11.186 1.00 38.60 O ATOM 1870 CB ARG A 131 14.261 -12.079 -8.523 1.00 34.49 C ATOM 1871 CG ARG A 131 15.032 -12.631 -7.309 1.00 32.02 C ATOM 1872 CD ARG A 131 13.997 -13.289 -6.390 1.00 51.97 C ATOM 1873 NE ARG A 131 14.566 -13.465 -5.054 1.00 61.14 N ATOM 1874 CZ ARG A 131 14.144 -12.815 -3.974 1.00 60.44 C ATOM 1875 NH1 ARG A 131 13.129 -11.970 -4.044 1.00 60.81 N ATOM 1876 NH2 ARG A 131 14.686 -13.062 -2.789 1.00 62.39 N ATOM 1877 HA ARG A 131 15.892 -10.712 -8.845 1.00 0.00 H ATOM 1878 HB2 ARG A 131 13.198 -12.019 -8.289 1.00 0.00 H ATOM 1879 HB3 ARG A 131 14.406 -12.735 -9.382 1.00 0.00 H ATOM 1880 HG2 ARG A 131 15.768 -13.367 -7.634 1.00 0.00 H ATOM 1881 HG3 ARG A 131 15.538 -11.820 -6.785 1.00 0.00 H ATOM 1882 HD2 ARG A 131 13.717 -14.261 -6.796 1.00 0.00 H ATOM 1883 HD3 ARG A 131 13.113 -12.655 -6.327 1.00 0.00 H ATOM 1884 HE ARG A 131 15.349 -14.140 -4.942 1.00 0.00 H ATOM 1885 HH12 ARG A 131 12.810 -11.469 -3.191 1.00 0.00 H ATOM 1886 HH11 ARG A 131 12.650 -11.807 -4.953 1.00 0.00 H ATOM 1887 HH22 ARG A 131 14.352 -12.550 -1.947 1.00 0.00 H ATOM 1888 HH21 ARG A 131 15.445 -13.767 -2.701 1.00 0.00 H ATOM 1889 H ARG A 131 13.752 -10.020 -7.041 1.00 0.00 H ATOM 1890 N ALA A 132 13.275 -9.483 -10.331 1.00 33.74 N ATOM 1891 CA ALA A 132 12.820 -8.946 -11.606 1.00 36.68 C ATOM 1892 C ALA A 132 13.526 -7.644 -11.960 1.00 38.62 C ATOM 1893 O ALA A 132 13.290 -7.146 -13.055 1.00 39.37 O ATOM 1894 CB ALA A 132 11.314 -8.662 -11.514 1.00 36.12 C ATOM 1895 HA ALA A 132 13.045 -9.683 -12.377 1.00 0.00 H ATOM 1896 HB1 ALA A 132 10.784 -9.588 -11.292 1.00 0.00 H ATOM 1897 HB2 ALA A 132 11.130 -7.938 -10.721 1.00 0.00 H ATOM 1898 HB3 ALA A 132 10.963 -8.259 -12.464 1.00 0.00 H ATOM 1899 H ALA A 132 12.731 -9.260 -9.473 1.00 0.00 H ATOM 1900 N ALA A 133 14.394 -7.101 -11.101 1.00 34.81 N ATOM 1901 CA ALA A 133 15.086 -5.844 -11.379 1.00 32.89 C ATOM 1902 C ALA A 133 16.586 -6.042 -11.294 1.00 32.30 C ATOM 1903 O ALA A 133 17.353 -5.104 -11.093 1.00 31.34 O ATOM 1904 CB ALA A 133 14.607 -4.833 -10.345 1.00 28.63 C ATOM 1905 HA ALA A 133 14.866 -5.488 -12.386 1.00 0.00 H ATOM 1906 HB1 ALA A 133 13.528 -4.707 -10.435 1.00 0.00 H ATOM 1907 HB2 ALA A 133 14.850 -5.194 -9.346 1.00 0.00 H ATOM 1908 HB3 ALA A 133 15.101 -3.877 -10.517 1.00 0.00 H ATOM 1909 H ALA A 133 14.584 -7.590 -10.203 1.00 0.00 H ATOM 1910 N ARG A 134 17.041 -7.252 -11.566 1.00 30.63 N ATOM 1911 CA ARG A 134 18.442 -7.621 -11.415 1.00 35.03 C ATOM 1912 C ARG A 134 19.355 -6.755 -12.268 1.00 39.42 C ATOM 1913 O ARG A 134 20.445 -6.360 -11.832 1.00 35.97 O ATOM 1914 CB ARG A 134 18.579 -9.123 -11.661 1.00 36.79 C ATOM 1915 CG ARG A 134 19.994 -9.625 -11.783 1.00 51.42 C ATOM 1916 CD ARG A 134 20.164 -10.960 -11.112 1.00 67.63 C ATOM 1917 NE ARG A 134 21.388 -11.678 -11.327 1.00 81.14 N ATOM 1918 CZ ARG A 134 22.617 -11.320 -11.619 1.00 87.63 C ATOM 1919 NH1 ARG A 134 22.969 -10.061 -11.787 1.00 94.28 N ATOM 1920 NH2 ARG A 134 23.591 -12.214 -11.767 1.00 97.16 N ATOM 1921 HA ARG A 134 18.777 -7.424 -10.397 1.00 0.00 H ATOM 1922 HB2 ARG A 134 18.106 -9.646 -10.830 1.00 0.00 H ATOM 1923 HB3 ARG A 134 18.055 -9.363 -12.586 1.00 0.00 H ATOM 1924 HG2 ARG A 134 20.245 -9.724 -12.839 1.00 0.00 H ATOM 1925 HG3 ARG A 134 20.667 -8.905 -11.317 1.00 0.00 H ATOM 1926 HD2 ARG A 134 19.350 -11.599 -11.454 1.00 0.00 H ATOM 1927 HD3 ARG A 134 20.070 -10.796 -10.038 1.00 0.00 H ATOM 1928 HE ARG A 134 21.277 -12.708 -11.230 1.00 0.00 H ATOM 1929 HH12 ARG A 134 23.955 -9.823 -12.018 1.00 0.00 H ATOM 1930 HH11 ARG A 134 22.261 -9.306 -11.689 1.00 0.00 H ATOM 1931 HH22 ARG A 134 24.555 -11.899 -11.998 1.00 0.00 H ATOM 1932 HH21 ARG A 134 23.389 -13.228 -11.651 1.00 0.00 H ATOM 1933 H ARG A 134 16.370 -7.972 -11.902 1.00 0.00 H ATOM 1934 N ASP A 135 18.893 -6.386 -13.463 1.00 39.34 N ATOM 1935 CA ASP A 135 19.637 -5.563 -14.393 1.00 38.45 C ATOM 1936 C ASP A 135 19.868 -4.164 -13.826 1.00 35.38 C ATOM 1937 O ASP A 135 20.953 -3.654 -14.022 1.00 32.81 O ATOM 1938 CB ASP A 135 18.922 -5.459 -15.744 1.00 49.69 C ATOM 1939 CG ASP A 135 19.120 -6.745 -16.533 1.00 58.57 C ATOM 1940 OD1 ASP A 135 20.172 -7.405 -16.420 1.00 63.02 O ATOM 1941 OD2 ASP A 135 18.186 -7.075 -17.295 1.00 72.45 O ATOM 1942 HA ASP A 135 20.602 -6.046 -14.546 1.00 0.00 H ATOM 1943 HB2 ASP A 135 17.857 -5.296 -15.578 1.00 0.00 H ATOM 1944 HB3 ASP A 135 19.333 -4.621 -16.308 1.00 0.00 H ATOM 1945 H ASP A 135 17.944 -6.708 -13.743 1.00 0.00 H ATOM 1946 N ASP A 136 18.896 -3.610 -13.140 1.00 31.41 N ATOM 1947 CA ASP A 136 19.010 -2.320 -12.505 1.00 29.64 C ATOM 1948 C ASP A 136 20.025 -2.414 -11.348 1.00 28.28 C ATOM 1949 O ASP A 136 20.728 -1.440 -11.075 1.00 26.70 O ATOM 1950 CB ASP A 136 17.690 -1.885 -11.863 1.00 30.68 C ATOM 1951 CG ASP A 136 16.634 -1.591 -12.920 1.00 51.36 C ATOM 1952 OD1 ASP A 136 16.778 -2.068 -14.065 1.00 55.95 O ATOM 1953 OD2 ASP A 136 15.605 -0.935 -12.683 1.00 53.63 O ATOM 1954 HA ASP A 136 19.309 -1.610 -13.276 1.00 0.00 H ATOM 1955 HB2 ASP A 136 17.330 -2.683 -11.213 1.00 0.00 H ATOM 1956 HB3 ASP A 136 17.861 -0.986 -11.271 1.00 0.00 H ATOM 1957 H ASP A 136 17.998 -4.127 -13.050 1.00 0.00 H ATOM 1958 N ILE A 137 19.969 -3.520 -10.622 1.00 23.27 N ATOM 1959 CA ILE A 137 20.881 -3.636 -9.460 1.00 26.09 C ATOM 1960 C ILE A 137 22.315 -3.679 -9.945 1.00 26.26 C ATOM 1961 O ILE A 137 23.207 -2.958 -9.439 1.00 26.19 O ATOM 1962 CB ILE A 137 20.500 -4.858 -8.593 1.00 22.91 C ATOM 1963 CG1 ILE A 137 19.039 -4.756 -8.116 1.00 25.54 C ATOM 1964 CG2 ILE A 137 21.460 -5.036 -7.408 1.00 18.84 C ATOM 1965 CD1 ILE A 137 18.475 -6.046 -7.522 1.00 23.50 C ATOM 1966 HA ILE A 137 20.781 -2.761 -8.818 1.00 0.00 H ATOM 1967 HB ILE A 137 20.592 -5.747 -9.218 1.00 0.00 H ATOM 1968 HG12 ILE A 137 18.982 -3.977 -7.355 1.00 0.00 H ATOM 1969 HG13 ILE A 137 18.421 -4.475 -8.969 1.00 0.00 H ATOM 1970 HD11 ILE A 137 18.510 -6.836 -8.273 1.00 0.00 H ATOM 1971 HD12 ILE A 137 19.072 -6.338 -6.658 1.00 0.00 H ATOM 1972 HD13 ILE A 137 17.443 -5.881 -7.213 1.00 0.00 H ATOM 1973 HG21 ILE A 137 22.473 -5.183 -7.782 1.00 0.00 H ATOM 1974 HG22 ILE A 137 21.428 -4.146 -6.780 1.00 0.00 H ATOM 1975 HG23 ILE A 137 21.157 -5.905 -6.824 1.00 0.00 H ATOM 1976 H ILE A 137 19.305 -4.284 -10.860 1.00 0.00 H ATOM 1977 N VAL A 138 22.581 -4.522 -10.937 1.00 24.09 N ATOM 1978 CA VAL A 138 23.934 -4.672 -11.463 1.00 29.33 C ATOM 1979 C VAL A 138 24.417 -3.358 -12.091 1.00 29.75 C ATOM 1980 O VAL A 138 25.596 -3.029 -11.997 1.00 29.05 O ATOM 1981 CB VAL A 138 23.943 -5.810 -12.516 1.00 32.54 C ATOM 1982 CG1 VAL A 138 25.197 -5.792 -13.347 1.00 35.65 C ATOM 1983 CG2 VAL A 138 23.790 -7.168 -11.842 1.00 31.49 C ATOM 1984 HA VAL A 138 24.613 -4.924 -10.648 1.00 0.00 H ATOM 1985 HB VAL A 138 23.095 -5.641 -13.180 1.00 0.00 H ATOM 1986 HG11 VAL A 138 25.270 -4.839 -13.871 1.00 0.00 H ATOM 1987 HG12 VAL A 138 26.063 -5.919 -12.698 1.00 0.00 H ATOM 1988 HG13 VAL A 138 25.163 -6.605 -14.072 1.00 0.00 H ATOM 1989 HG21 VAL A 138 24.616 -7.323 -11.148 1.00 0.00 H ATOM 1990 HG22 VAL A 138 22.846 -7.198 -11.298 1.00 0.00 H ATOM 1991 HG23 VAL A 138 23.799 -7.951 -12.600 1.00 0.00 H ATOM 1992 H VAL A 138 21.809 -5.086 -11.347 1.00 0.00 H ATOM 1993 N GLY A 139 23.573 -2.664 -12.825 1.00 29.20 N ATOM 1994 CA GLY A 139 23.900 -1.388 -13.440 1.00 30.71 C ATOM 1995 C GLY A 139 24.301 -0.354 -12.367 1.00 30.75 C ATOM 1996 O GLY A 139 25.217 0.442 -12.574 1.00 28.85 O ATOM 1997 HA3 GLY A 139 23.031 -1.020 -13.985 1.00 0.00 H ATOM 1998 HA2 GLY A 139 24.730 -1.526 -14.133 1.00 0.00 H ATOM 1999 H GLY A 139 22.619 -3.050 -12.973 1.00 0.00 H ATOM 2000 N TRP A 140 23.522 -0.298 -11.295 1.00 26.94 N ATOM 2001 CA TRP A 140 23.785 0.593 -10.174 1.00 26.91 C ATOM 2002 C TRP A 140 25.110 0.252 -9.517 1.00 25.17 C ATOM 2003 O TRP A 140 25.906 1.199 -9.265 1.00 23.80 O ATOM 2004 CB TRP A 140 22.656 0.614 -9.165 1.00 23.81 C ATOM 2005 CG TRP A 140 22.760 1.563 -8.020 1.00 23.42 C ATOM 2006 CD1 TRP A 140 22.381 2.875 -8.000 1.00 20.79 C ATOM 2007 CD2 TRP A 140 23.323 1.292 -6.712 1.00 24.97 C ATOM 2008 NE1 TRP A 140 22.537 3.405 -6.749 1.00 24.25 N ATOM 2009 CE2 TRP A 140 23.182 2.458 -5.957 1.00 21.42 C ATOM 2010 CE3 TRP A 140 23.943 0.167 -6.148 1.00 20.64 C ATOM 2011 CZ2 TRP A 140 23.535 2.545 -4.613 1.00 21.95 C ATOM 2012 CZ3 TRP A 140 24.271 0.244 -4.799 1.00 27.27 C ATOM 2013 CH2 TRP A 140 24.091 1.425 -4.038 1.00 24.77 C ATOM 2014 HA TRP A 140 23.850 1.603 -10.578 1.00 0.00 H ATOM 2015 HB2 TRP A 140 21.741 0.857 -9.706 1.00 0.00 H ATOM 2016 HB3 TRP A 140 22.574 -0.390 -8.748 1.00 0.00 H ATOM 2017 HE1 TRP A 140 22.228 4.350 -6.443 1.00 0.00 H ATOM 2018 HD1 TRP A 140 22.006 3.425 -8.863 1.00 0.00 H ATOM 2019 HZ2 TRP A 140 23.378 3.460 -4.041 1.00 0.00 H ATOM 2020 HH2 TRP A 140 24.394 1.447 -2.991 1.00 0.00 H ATOM 2021 HZ3 TRP A 140 24.682 -0.638 -4.308 1.00 0.00 H ATOM 2022 HE3 TRP A 140 24.157 -0.724 -6.738 1.00 0.00 H ATOM 2023 H TRP A 140 22.687 -0.917 -11.253 1.00 0.00 H ATOM 2024 N ALA A 141 25.393 -1.046 -9.340 1.00 22.88 N ATOM 2025 CA ALA A 141 26.650 -1.476 -8.763 1.00 26.16 C ATOM 2026 C ALA A 141 27.838 -1.064 -9.643 1.00 27.16 C ATOM 2027 O ALA A 141 28.868 -0.572 -9.130 1.00 27.93 O ATOM 2028 CB ALA A 141 26.633 -2.993 -8.599 1.00 27.32 C ATOM 2029 HA ALA A 141 26.768 -0.994 -7.792 1.00 0.00 H ATOM 2030 HB1 ALA A 141 25.811 -3.277 -7.941 1.00 0.00 H ATOM 2031 HB2 ALA A 141 26.498 -3.461 -9.574 1.00 0.00 H ATOM 2032 HB3 ALA A 141 27.578 -3.321 -8.165 1.00 0.00 H ATOM 2033 H ALA A 141 24.693 -1.761 -9.624 1.00 0.00 H ATOM 2034 N HIS A 142 27.673 -1.120 -10.945 1.00 27.33 N ATOM 2035 CA HIS A 142 28.644 -0.654 -11.911 1.00 30.31 C ATOM 2036 C HIS A 142 28.964 0.846 -11.777 1.00 29.00 C ATOM 2037 O HIS A 142 30.124 1.237 -11.854 1.00 28.87 O ATOM 2038 CB HIS A 142 27.966 -0.674 -13.286 1.00 46.56 C ATOM 2039 CG HIS A 142 28.665 -1.531 -14.265 1.00 69.71 C ATOM 2040 ND1 HIS A 142 28.617 -2.906 -14.164 1.00 76.18 N ATOM 2041 CD2 HIS A 142 29.384 -1.216 -15.376 1.00 81.09 C ATOM 2042 CE1 HIS A 142 29.302 -3.406 -15.188 1.00 85.67 C ATOM 2043 NE2 HIS A 142 29.780 -2.414 -15.931 1.00 88.52 N ATOM 2044 HA HIS A 142 29.527 -1.277 -11.772 1.00 0.00 H ATOM 2045 HB2 HIS A 142 26.948 -1.044 -13.166 1.00 0.00 H ATOM 2046 HB3 HIS A 142 27.938 0.344 -13.674 1.00 0.00 H ATOM 2047 HD2 HIS A 142 29.603 -0.217 -15.752 1.00 0.00 H ATOM 2048 HE1 HIS A 142 29.449 -4.468 -15.387 1.00 0.00 H ATOM 2049 H HIS A 142 26.786 -1.526 -11.305 1.00 0.00 H ATOM 2050 N ASP A 143 27.896 1.616 -11.713 1.00 25.74 N ATOM 2051 CA ASP A 143 28.002 3.055 -11.557 1.00 27.38 C ATOM 2052 C ASP A 143 28.721 3.421 -10.262 1.00 28.28 C ATOM 2053 O ASP A 143 29.596 4.289 -10.295 1.00 27.60 O ATOM 2054 CB ASP A 143 26.587 3.642 -11.466 1.00 25.06 C ATOM 2055 CG ASP A 143 25.957 3.698 -12.849 1.00 41.51 C ATOM 2056 OD1 ASP A 143 26.569 3.320 -13.863 1.00 36.24 O ATOM 2057 OD2 ASP A 143 24.807 4.170 -12.951 1.00 42.61 O ATOM 2058 HA ASP A 143 28.559 3.447 -12.408 1.00 0.00 H ATOM 2059 HB2 ASP A 143 25.977 3.015 -10.816 1.00 0.00 H ATOM 2060 HB3 ASP A 143 26.640 4.649 -11.052 1.00 0.00 H ATOM 2061 H ASP A 143 26.953 1.181 -11.776 1.00 0.00 H ATOM 2062 N VAL A 144 28.371 2.782 -9.132 1.00 25.30 N ATOM 2063 CA VAL A 144 29.051 3.209 -7.907 1.00 26.63 C ATOM 2064 C VAL A 144 30.536 2.921 -8.027 1.00 26.61 C ATOM 2065 O VAL A 144 31.361 3.725 -7.597 1.00 29.04 O ATOM 2066 CB VAL A 144 28.523 2.617 -6.595 1.00 37.69 C ATOM 2067 CG1 VAL A 144 27.200 3.288 -6.252 1.00 38.23 C ATOM 2068 CG2 VAL A 144 28.226 1.137 -6.674 1.00 44.83 C ATOM 2069 HA VAL A 144 28.842 4.276 -7.834 1.00 0.00 H ATOM 2070 HB VAL A 144 29.305 2.782 -5.854 1.00 0.00 H ATOM 2071 HG11 VAL A 144 27.357 4.361 -6.137 1.00 0.00 H ATOM 2072 HG12 VAL A 144 26.484 3.108 -7.054 1.00 0.00 H ATOM 2073 HG13 VAL A 144 26.815 2.874 -5.320 1.00 0.00 H ATOM 2074 HG21 VAL A 144 27.470 0.960 -7.439 1.00 0.00 H ATOM 2075 HG22 VAL A 144 29.138 0.598 -6.931 1.00 0.00 H ATOM 2076 HG23 VAL A 144 27.857 0.790 -5.709 1.00 0.00 H ATOM 2077 H VAL A 144 27.657 2.026 -9.128 1.00 0.00 H ATOM 2078 N ARG A 145 30.941 1.765 -8.477 1.00 27.03 N ATOM 2079 CA ARG A 145 32.330 1.390 -8.682 1.00 32.96 C ATOM 2080 C ARG A 145 33.106 2.325 -9.604 1.00 37.37 C ATOM 2081 O ARG A 145 34.256 2.664 -9.308 1.00 39.53 O ATOM 2082 CB ARG A 145 32.173 0.081 -9.445 1.00 37.74 C ATOM 2083 CG ARG A 145 32.901 -1.112 -8.905 1.00 42.83 C ATOM 2084 CD ARG A 145 33.304 -1.907 -10.135 1.00 49.17 C ATOM 2085 NE ARG A 145 32.263 -2.728 -10.748 1.00 49.07 N ATOM 2086 CZ ARG A 145 32.391 -3.084 -12.037 1.00 52.74 C ATOM 2087 NH1 ARG A 145 33.451 -2.661 -12.720 1.00 59.29 N ATOM 2088 NH2 ARG A 145 31.504 -3.848 -12.650 1.00 54.97 N ATOM 2089 HA ARG A 145 32.870 1.379 -7.735 1.00 0.00 H ATOM 2090 HB2 ARG A 145 31.111 -0.163 -9.465 1.00 0.00 H ATOM 2091 HB3 ARG A 145 32.525 0.249 -10.463 1.00 0.00 H ATOM 2092 HG2 ARG A 145 33.781 -0.803 -8.341 1.00 0.00 H ATOM 2093 HG3 ARG A 145 32.248 -1.702 -8.262 1.00 0.00 H ATOM 2094 HD2 ARG A 145 34.123 -2.568 -9.850 1.00 0.00 H ATOM 2095 HD3 ARG A 145 33.655 -1.200 -10.887 1.00 0.00 H ATOM 2096 HE ARG A 145 31.436 -3.032 -10.195 1.00 0.00 H ATOM 2097 HH12 ARG A 145 33.566 -2.927 -13.719 1.00 0.00 H ATOM 2098 HH11 ARG A 145 34.165 -2.064 -12.255 1.00 0.00 H ATOM 2099 HH22 ARG A 145 31.639 -4.102 -13.650 1.00 0.00 H ATOM 2100 HH21 ARG A 145 30.671 -4.195 -12.133 1.00 0.00 H ATOM 2101 H ARG A 145 30.214 1.058 -8.707 1.00 0.00 H ATOM 2102 N GLY A 146 32.508 2.767 -10.707 1.00 38.72 N ATOM 2103 CA GLY A 146 33.137 3.739 -11.589 1.00 48.41 C ATOM 2104 C GLY A 146 33.256 5.133 -10.980 1.00 53.07 C ATOM 2105 O GLY A 146 34.024 5.936 -11.493 1.00 54.88 O ATOM 2106 HA3 GLY A 146 32.544 3.811 -12.501 1.00 0.00 H ATOM 2107 HA2 GLY A 146 34.138 3.384 -11.835 1.00 0.00 H ATOM 2108 H GLY A 146 31.562 2.407 -10.946 1.00 0.00 H ATOM 2109 N ALA A 147 32.517 5.438 -9.938 1.00 58.31 N ATOM 2110 CA ALA A 147 32.461 6.727 -9.286 1.00 64.61 C ATOM 2111 C ALA A 147 33.566 6.909 -8.256 1.00 68.38 C ATOM 2112 O ALA A 147 34.041 8.028 -8.050 1.00 70.77 O ATOM 2113 CB ALA A 147 31.105 6.856 -8.591 1.00 61.50 C ATOM 2114 HA ALA A 147 32.597 7.496 -10.047 1.00 0.00 H ATOM 2115 HB1 ALA A 147 30.309 6.777 -9.332 1.00 0.00 H ATOM 2116 HB2 ALA A 147 30.998 6.059 -7.855 1.00 0.00 H ATOM 2117 HB3 ALA A 147 31.044 7.824 -8.093 1.00 0.00 H ATOM 2118 H ALA A 147 31.918 4.684 -9.546 1.00 0.00 H ATOM 2119 N ILE A 148 33.866 5.851 -7.519 1.00 71.30 N ATOM 2120 CA ILE A 148 34.813 5.978 -6.418 1.00 74.36 C ATOM 2121 C ILE A 148 36.210 5.626 -6.898 1.00 76.83 C ATOM 2122 O ILE A 148 36.365 5.461 -8.122 1.00 77.30 O ATOM 2123 CB ILE A 148 34.426 5.147 -5.189 1.00 68.29 C ATOM 2124 CG1 ILE A 148 34.660 3.645 -5.403 1.00 67.17 C ATOM 2125 CG2 ILE A 148 32.953 5.377 -4.862 1.00 72.53 C ATOM 2126 CD1 ILE A 148 34.595 2.871 -4.093 1.00 65.56 C ATOM 2127 HA ILE A 148 34.791 7.018 -6.092 1.00 0.00 H ATOM 2128 OXT ILE A 148 37.135 5.435 -6.076 1.00 80.32 O ATOM 2129 HB ILE A 148 35.061 5.471 -4.365 1.00 0.00 H ATOM 2130 HG12 ILE A 148 33.896 3.261 -6.078 1.00 0.00 H ATOM 2131 HG13 ILE A 148 35.644 3.501 -5.850 1.00 0.00 H ATOM 2132 HD11 ILE A 148 35.361 3.244 -3.414 1.00 0.00 H ATOM 2133 HD12 ILE A 148 33.612 3.004 -3.642 1.00 0.00 H ATOM 2134 HD13 ILE A 148 34.766 1.812 -4.289 1.00 0.00 H ATOM 2135 HG21 ILE A 148 32.789 6.434 -4.653 1.00 0.00 H ATOM 2136 HG22 ILE A 148 32.342 5.075 -5.713 1.00 0.00 H ATOM 2137 HG23 ILE A 148 32.679 4.786 -3.988 1.00 0.00 H ATOM 2138 H ILE A 148 33.427 4.931 -7.725 1.00 0.00 H TER 2139 ILE A 148 HETATM 2140 O HOH 1 13.555 0.612 1.580 1.00 17.13 O HETATM 2141 O HOH 2 23.019 6.698 -1.850 1.00 19.94 O HETATM 2142 O HOH 3 18.382 -7.885 8.640 1.00 20.59 O HETATM 2143 O HOH 4 10.311 -1.738 11.923 1.00 25.09 O HETATM 2144 O HOH 5 10.399 -4.733 -2.675 1.00 26.89 O HETATM 2145 O HOH 6 14.628 -8.429 14.156 1.00 28.55 O HETATM 2146 O HOH 7 36.610 7.176 10.677 1.00 26.57 O HETATM 2147 O HOH 8 36.022 6.208 1.870 1.00 26.20 O HETATM 2148 O HOH 9 17.272 -13.409 0.108 1.00 33.32 O HETATM 2149 O HOH 10 6.927 -7.923 -7.446 1.00 39.65 O HETATM 2150 O HOH 11 11.146 -14.220 -7.145 1.00 55.18 O HETATM 2151 O HOH 12 7.635 -1.109 11.893 1.00 33.98 O HETATM 2152 O HOH 13 21.526 -12.111 -8.668 1.00 35.67 O HETATM 2153 O HOH 14 12.510 -12.696 8.776 1.00 33.47 O HETATM 2154 O HOH 15 32.022 8.887 13.669 1.00 30.06 O HETATM 2155 O HOH 16 14.507 -9.461 10.401 1.00 32.64 O HETATM 2156 O HOH 17 5.449 -2.194 9.905 1.00 31.02 O HETATM 2157 O HOH 18 30.523 -5.268 14.439 1.00 33.07 O HETATM 2158 O HOH 19 29.654 8.715 11.837 1.00 26.96 O HETATM 2159 O HOH 20 36.494 13.199 11.595 1.00 50.72 O HETATM 2160 O HOH 21 39.814 3.324 4.752 1.00 39.54 O HETATM 2161 O HOH 22 37.741 7.974 5.992 1.00 41.32 O HETATM 2162 O HOH 23 36.297 -1.446 13.108 1.00 35.10 O HETATM 2163 O HOH 24 25.876 -9.945 -9.368 1.00 43.58 O HETATM 2164 O HOH 25 27.887 13.700 -0.239 1.00 38.82 O HETATM 2165 O HOH 26 25.784 -11.221 8.708 1.00 39.33 O HETATM 2166 O HOH 27 12.456 -1.537 -9.307 1.00 38.89 O HETATM 2167 O HOH 28 18.035 -10.488 7.557 1.00 36.99 O HETATM 2168 O HOH 29 28.867 17.015 9.485 1.00 35.34 O HETATM 2169 O HOH 30 32.995 10.142 11.390 1.00 38.49 O HETATM 2170 O HOH 31 11.123 -11.269 -14.049 1.00 64.57 O HETATM 2171 O HOH 32 12.362 3.552 12.283 1.00 35.83 O HETATM 2172 O HOH 33 28.325 15.406 3.527 1.00 29.86 O HETATM 2173 O HOH 34 20.398 0.908 -12.326 1.00 40.74 O HETATM 2174 O HOH 35 18.115 -8.523 15.415 1.00 66.61 O HETATM 2175 O HOH 36 23.054 18.406 9.606 1.00 65.34 O HETATM 2176 O HOH 37 22.781 -3.816 -16.002 1.00 50.04 O HETATM 2177 O HOH 38 4.429 5.325 3.233 1.00 52.37 O HETATM 2178 O HOH 39 17.191 11.201 8.509 1.00 35.48 O HETATM 2179 O HOH 40 29.106 -4.940 -12.625 1.00 71.92 O HETATM 2180 O HOH 41 -1.078 4.513 -3.089 1.00 40.26 O HETATM 2181 O HOH 42 10.810 -5.216 -9.377 1.00 41.72 O HETATM 2182 O HOH 43 35.845 -1.889 10.687 1.00 37.14 O HETATM 2183 O HOH 44 16.662 -11.831 5.071 1.00 50.09 O HETATM 2184 O HOH 45 8.005 -6.497 -2.301 1.00 38.38 O HETATM 2185 O HOH 46 31.812 -2.042 15.130 1.00 35.37 O HETATM 2186 O HOH 47 22.159 -2.838 13.652 1.00 36.21 O HETATM 2187 O HOH 48 18.684 9.856 -3.406 1.00 42.90 O HETATM 2188 O HOH 49 16.814 -8.106 -14.708 1.00 62.25 O HETATM 2189 O HOH 50 23.905 9.581 -8.985 1.00 51.77 O HETATM 2190 O HOH 51 25.270 1.045 -15.530 1.00 53.53 O HETATM 2191 O HOH 52 37.686 2.387 -4.818 1.00 52.51 O HETATM 2192 O HOH 53 19.205 10.601 14.845 1.00 54.58 O HETATM 2193 O HOH 54 23.952 -2.286 15.759 1.00 49.62 O HETATM 2194 O HOH 55 16.550 3.749 -7.977 1.00 37.02 O HETATM 2195 O HOH 56 4.834 2.702 6.034 1.00 40.69 O HETATM 2196 O HOH 57 2.582 5.092 4.951 1.00 66.86 O HETATM 2197 O HOH 58 12.817 7.055 -1.697 1.00 49.67 O HETATM 2198 O HOH 59 20.261 17.795 11.153 1.00 62.69 O HETATM 2199 O HOH 60 18.432 -6.038 16.104 1.00 68.97 O HETATM 2200 O HOH 61 6.567 7.761 -2.345 1.00 63.15 O HETATM 2201 O HOH 62 15.050 -2.634 16.604 1.00 48.70 O HETATM 2202 O HOH 63 28.475 0.465 19.374 1.00 44.66 O HETATM 2203 O HOH 64 31.274 -11.351 3.216 1.00 61.76 O HETATM 2204 O HOH 65 3.241 1.730 12.655 1.00 56.56 O HETATM 2205 O HOH 66 25.532 1.158 19.716 1.00 69.28 O HETATM 2206 N1 FMN A 67 7.449 -0.185 1.286 1.00 -0.25 N HETATM 2207 C2 FMN A 67 7.724 1.169 1.082 1.00 0.24 C HETATM 2208 O2 FMN A 67 8.366 1.512 -0.035 1.00 -0.39 O HETATM 2209 N3 FMN A 67 7.276 2.155 1.922 1.00 -0.19 N HETATM 2210 C4 FMN A 67 6.610 1.857 3.075 1.00 0.27 C HETATM 2211 O4 FMN A 67 6.169 2.716 4.027 1.00 -0.37 O HETATM 2212 C4A FMN A 67 6.345 0.452 3.292 1.00 0.21 C HETATM 2213 N5 FMN A 67 5.684 0.203 4.465 1.00 -0.24 N HETATM 2214 C5A FMN A 67 5.304 -1.148 4.589 1.00 0.09 C HETATM 2215 C6 FMN A 67 4.462 -1.424 5.697 1.00 -0.04 C HETATM 2216 C7 FMN A 67 4.070 -2.756 5.832 1.00 -0.04 C HETATM 2217 C7M FMN A 67 3.191 -3.087 6.916 1.00 -0.04 C HETATM 2218 H3 FMN A 67 2.983 -2.184 7.508 1.00 0.04 H HETATM 2219 H4 FMN A 67 3.667 -3.844 7.556 1.00 0.04 H HETATM 2220 H5 FMN A 67 2.248 -3.487 6.515 1.00 0.04 H HETATM 2221 C8 FMN A 67 4.463 -3.764 4.951 1.00 -0.04 C HETATM 2222 C8M FMN A 67 4.019 -5.125 5.100 1.00 -0.03 C HETATM 2223 H6 FMN A 67 4.451 -5.742 4.298 1.00 0.04 H HETATM 2224 H7 FMN A 67 2.921 -5.161 5.039 1.00 0.04 H HETATM 2225 H8 FMN A 67 4.345 -5.512 6.076 1.00 0.04 H HETATM 2226 C9 FMN A 67 5.301 -3.472 3.867 1.00 -0.03 C HETATM 2227 C9A FMN A 67 5.737 -2.115 3.719 1.00 0.10 C HETATM 2228 N10 FMN A 67 6.551 -1.907 2.636 1.00 -0.21 N HETATM 2229 C10 FMN A 67 6.802 -0.542 2.435 1.00 0.19 C HETATM 2230 C1 FMN A 67 6.974 -2.856 1.704 1.00 0.09 C HETATM 2231 C2 FMN A 67 8.240 -3.608 2.163 1.00 0.11 C HETATM 2232 O2 FMN A 67 9.297 -2.667 2.331 1.00 -0.39 O HETATM 2233 H13 FMN A 67 9.047 -2.026 2.986 1.00 0.21 H HETATM 2234 C3 FMN A 67 8.673 -4.567 0.978 1.00 0.11 C HETATM 2235 O3 FMN A 67 7.793 -5.693 1.183 1.00 -0.39 O HETATM 2236 H15 FMN A 67 7.962 -6.350 0.518 1.00 0.21 H HETATM 2237 C4 FMN A 67 10.083 -4.973 0.921 1.00 0.11 C HETATM 2238 O4 FMN A 67 10.426 -5.739 -0.258 1.00 -0.39 O HETATM 2239 H17 FMN A 67 10.251 -5.219 -1.034 1.00 0.21 H HETATM 2240 C5 FMN A 67 10.591 -5.634 2.131 1.00 0.11 C HETATM 2241 O5 FMN A 67 11.992 -5.861 1.857 1.00 -0.27 O HETATM 2242 P FMN A 67 12.893 -6.808 2.910 1.00 0.20 P HETATM 2243 O1P FMN A 67 12.635 -6.544 4.504 1.00 -0.55 O HETATM 2244 O2P FMN A 67 14.497 -6.670 2.465 1.00 -0.55 O HETATM 2245 O3P FMN A 67 12.527 -8.408 2.499 1.00 -0.55 O HETATM 2246 H18 FMN A 67 10.069 -6.587 2.302 1.00 0.06 H HETATM 2247 H19 FMN A 67 10.467 -4.985 3.010 1.00 0.06 H HETATM 2248 H16 FMN A 67 10.646 -4.031 0.841 1.00 0.06 H HETATM 2249 H14 FMN A 67 8.442 -4.077 0.020 1.00 0.06 H HETATM 2250 H12 FMN A 67 8.054 -4.169 3.091 1.00 0.06 H HETATM 2251 H10 FMN A 67 7.191 -2.346 0.754 1.00 0.06 H HETATM 2252 H11 FMN A 67 6.165 -3.586 1.552 1.00 0.06 H HETATM 2253 H9 FMN A 67 5.607 -4.242 3.168 1.00 0.05 H HETATM 2254 H2 FMN A 67 4.145 -0.653 6.391 1.00 0.06 H HETATM 2255 H1 FMN A 67 7.441 3.112 1.685 1.00 0.22 H CONECT 2206 2207 2229 CONECT 2207 2206 2208 2209 CONECT 2208 2207 CONECT 2209 2207 2210 2255 CONECT 2210 2209 2211 2212 CONECT 2211 2210 CONECT 2212 2210 2213 2229 CONECT 2213 2212 2214 CONECT 2214 2213 2215 2227 CONECT 2215 2214 2216 2254 CONECT 2216 2215 2217 2221 CONECT 2217 2216 2218 2219 2220 CONECT 2218 2217 CONECT 2219 2217 CONECT 2220 2217 CONECT 2221 2216 2222 2226 CONECT 2222 2221 2223 2224 2225 CONECT 2223 2222 CONECT 2224 2222 CONECT 2225 2222 CONECT 2226 2221 2227 2253 CONECT 2227 2214 2226 2228 CONECT 2228 2227 2229 2230 CONECT 2229 2206 2212 2228 CONECT 2230 2228 2231 2251 2252 CONECT 2231 2230 2232 2234 2250 CONECT 2232 2231 2233 CONECT 2233 2232 CONECT 2234 2231 2235 2237 2249 CONECT 2235 2234 2236 CONECT 2236 2235 CONECT 2237 2234 2238 2240 2248 CONECT 2238 2237 2239 CONECT 2239 2238 CONECT 2240 2237 2241 2246 2247 CONECT 2241 2240 2242 CONECT 2242 2241 2243 2244 2245 CONECT 2243 2242 CONECT 2244 2242 CONECT 2245 2242 CONECT 2246 2240 CONECT 2247 2240 CONECT 2248 2237 CONECT 2249 2234 CONECT 2250 2231 CONECT 2251 2230 CONECT 2252 2230 CONECT 2253 2226 CONECT 2254 2215 CONECT 2255 2209 MASTER 0 0 0 0 0 0 0 0 2254 1 50 12 END
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Related entries of code: 1c7f
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1akq
RCSB PDB
PDBbind
147aa, >1AKQ_1|Chain... *
1akr
RCSB PDB
PDBbind
147aa, >1AKR_1|Chain... at 98%
1akt
RCSB PDB
PDBbind
147aa, >1AKT_1|Chain... at 98%
1aku
RCSB PDB
PDBbind
147aa, >1AKU_1|Chain... at 100%
1akv
RCSB PDB
PDBbind
147aa, >1AKV_1|Chain... at 100%
1akw
RCSB PDB
PDBbind
147aa, >1AKW_1|Chain... at 98%
1azl
RCSB PDB
PDBbind
147aa, >1AZL_1|Chain... at 98%
1c7e
RCSB PDB
PDBbind
147aa, >1C7E_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1akq
RCSB PDB
PDBbind
FMN ox
1akr
RCSB PDB
PDBbind
FMN ox
1akt
RCSB PDB
PDBbind
FMN ox
1akw
RCSB PDB
PDBbind
FMN ox
1azl
RCSB PDB
PDBbind
FMN ox
1czk
RCSB PDB
PDBbind
FMN ox
1czr
RCSB PDB
PDBbind
FMN ox
Entry Information
PDB ID
1c7f
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
flavodoxin
Ligand Name
FMN ox
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=0.30nM
Release Year
2000
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistry v41 pp. 10950-62, 2002
Ligand Properties
Formula
C
1
7
H
2
2
N
4
O
9
P
Molecular Weight
457.352
Exact Mass
457.112
No. of atoms
53
No. of bonds
55
Polar Surface Area
224.84
LOGP Value
-2.56 (
Computed with XLOGP3
)
-2.00 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 13
No. of Rings: 3
Canonical SMILES
O=c1[nH]c(=O)c2c(n1)n(C[C@@H]([C@@H]([C@@H](COP(O)(O)O)O)O)O)c1c(n2)cc(c(c1)C)C
InChI String
InChI=1S/C17H23N4O9P/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29/h3-4,11-12,14,22-24,27-29,31H,5-6H2,1-2H3,(H,20,25,26)/t11-,12+,14-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00323
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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