Browse entries in the PDBbind-CN Database
HEADER 2HMH_COMPLEX COMPND 2HMH_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 68 SER GLU TYR GLN LEU VAL VAL ASN ALA VAL ARG LYS LEU SEQRES 2 A 68 GLN GLU SER GLY PHE TYR TRP SER ALA VAL THR GLY GLY SEQRES 3 A 68 GLU ALA ASN LEU LEU LEU SER ALA GLU PRO ALA GLY THR SEQRES 4 A 68 PHE LEU ILE ARG ASP SER SER ASP GLN ARG HIS PHE PHE SEQRES 5 A 68 THR LEU SER VAL LYS THR GLN SER GLY THR LYS ASN LEU SEQRES 6 A 68 ARG ILE GLN SEQRES 1 A 21 GLU GLY GLY SER PHE SER LEU GLN SER ASP PRO ARG SER SEQRES 2 A 21 THR GLN PRO VAL PRO ARG PHE ASP SEQRES 1 A 12 VAL LEU LYS LEU VAL HIS HIS TYR MET PRO PRO GLN SEQRES 1 A 5 ALA TYR TYR ILE TYR SEQRES 1 A 13 LYS ILE PRO LEU VAL LEU SER ARG PRO LEU SER SER ASN HET CAS A 1 1 HET CAS A 2 1 HET SER A 180 168 ATOM 1 N SER A 29 11.474 11.508 13.069 1.00 59.60 N ATOM 2 CA SER A 29 11.356 10.239 13.849 1.00 59.58 C ATOM 3 C SER A 29 12.620 9.379 13.759 1.00 59.44 C ATOM 4 O SER A 29 13.416 9.532 12.821 1.00 59.61 O ATOM 5 CB SER A 29 10.134 9.435 13.384 1.00 59.73 C ATOM 6 OG SER A 29 10.235 9.092 12.012 1.00 59.91 O ATOM 7 HA SER A 29 11.228 10.518 14.895 1.00 0.00 H ATOM 8 HB2 SER A 29 9.236 10.034 13.535 1.00 0.00 H ATOM 9 HB3 SER A 29 10.064 8.522 13.975 1.00 0.00 H ATOM 10 HG SER A 29 9.435 8.576 11.742 1.00 0.00 H ATOM 11 HN3 SER A 29 11.640 11.284 12.067 1.00 0.00 H ATOM 12 HN2 SER A 29 12.270 12.067 13.437 1.00 0.00 H ATOM 13 HN1 SER A 29 10.594 12.054 13.162 1.00 0.00 H ATOM 14 N GLU A 30 12.776 8.488 14.748 1.00 58.96 N ATOM 15 CA GLU A 30 13.881 7.508 14.882 1.00 58.44 C ATOM 16 C GLU A 30 15.258 8.089 15.250 1.00 57.84 C ATOM 17 O GLU A 30 16.149 7.360 15.702 1.00 57.93 O ATOM 18 CB GLU A 30 13.976 6.553 13.672 1.00 58.78 C ATOM 19 CG GLU A 30 14.947 6.975 12.563 1.00 59.23 C ATOM 20 CD GLU A 30 15.699 5.804 11.956 1.00 60.47 C ATOM 21 OE1 GLU A 30 15.220 4.651 12.077 1.00 60.44 O ATOM 22 OE2 GLU A 30 16.779 6.041 11.362 1.00 60.91 O ATOM 23 HA GLU A 30 13.590 6.928 15.758 1.00 0.00 H ATOM 24 HB2 GLU A 30 14.292 5.577 14.040 1.00 0.00 H ATOM 25 HB3 GLU A 30 12.982 6.470 13.233 1.00 0.00 H ATOM 26 HG2 GLU A 30 14.380 7.471 11.775 1.00 0.00 H ATOM 27 HG3 GLU A 30 15.671 7.674 12.982 1.00 0.00 H ATOM 28 H GLU A 30 12.052 8.483 15.494 1.00 0.00 H ATOM 29 N TYR A 31 15.416 9.393 15.040 1.00 56.85 N ATOM 30 CA TYR A 31 16.632 10.132 15.364 1.00 55.90 C ATOM 31 C TYR A 31 16.236 11.587 15.547 1.00 55.22 C ATOM 32 O TYR A 31 16.767 12.275 16.415 1.00 55.44 O ATOM 33 CB TYR A 31 17.692 9.984 14.257 1.00 55.71 C ATOM 34 CG TYR A 31 18.734 11.098 14.197 1.00 55.75 C ATOM 35 CD1 TYR A 31 19.999 10.936 14.769 1.00 56.02 C ATOM 36 CD2 TYR A 31 18.459 12.310 13.550 1.00 55.79 C ATOM 37 CE1 TYR A 31 20.962 11.959 14.709 1.00 55.54 C ATOM 38 CE2 TYR A 31 19.410 13.336 13.490 1.00 55.63 C ATOM 39 CZ TYR A 31 20.657 13.152 14.069 1.00 55.65 C ATOM 40 OH TYR A 31 21.589 14.166 14.007 1.00 55.19 O ATOM 41 HA TYR A 31 17.082 9.737 16.275 1.00 0.00 H ATOM 42 HB3 TYR A 31 17.175 9.954 13.298 1.00 0.00 H ATOM 43 HB2 TYR A 31 18.216 9.041 14.416 1.00 0.00 H ATOM 44 HD2 TYR A 31 17.485 12.457 13.084 1.00 0.00 H ATOM 45 HE2 TYR A 31 19.171 14.275 12.991 1.00 0.00 H ATOM 46 HE1 TYR A 31 21.943 11.816 15.163 1.00 0.00 H ATOM 47 HD1 TYR A 31 20.243 10.000 15.271 1.00 0.00 H ATOM 48 HH TYR A 31 22.419 13.878 14.463 1.00 0.00 H ATOM 49 H TYR A 31 14.624 9.919 14.619 1.00 0.00 H ATOM 50 N GLN A 32 15.301 12.050 14.720 1.00 54.30 N ATOM 51 CA GLN A 32 14.838 13.432 14.782 1.00 53.39 C ATOM 52 C GLN A 32 14.071 13.689 16.076 1.00 52.29 C ATOM 53 O GLN A 32 14.202 14.758 16.668 1.00 51.92 O ATOM 54 CB GLN A 32 13.976 13.787 13.568 1.00 53.51 C ATOM 55 CG GLN A 32 13.763 15.284 13.390 1.00 54.38 C ATOM 56 CD GLN A 32 12.568 15.615 12.519 1.00 55.70 C ATOM 57 OE1 GLN A 32 12.284 14.922 11.538 1.00 56.61 O ATOM 58 NE2 GLN A 32 11.863 16.689 12.868 1.00 55.83 N ATOM 59 HA GLN A 32 15.718 14.075 14.768 1.00 0.00 H ATOM 60 HB2 GLN A 32 14.463 13.399 12.673 1.00 0.00 H ATOM 61 HB3 GLN A 32 13.002 13.311 13.685 1.00 0.00 H ATOM 62 HG2 GLN A 32 13.612 15.732 14.372 1.00 0.00 H ATOM 63 HG3 GLN A 32 14.655 15.710 12.931 1.00 0.00 H ATOM 64 HE22 GLN A 32 12.139 17.244 13.703 1.00 0.00 H ATOM 65 HE21 GLN A 32 11.036 16.973 12.305 1.00 0.00 H ATOM 66 H GLN A 32 14.890 11.410 14.011 1.00 0.00 H ATOM 67 N LEU A 33 13.283 12.703 16.505 1.00 51.12 N ATOM 68 CA LEU A 33 12.529 12.796 17.749 1.00 49.95 C ATOM 69 C LEU A 33 13.461 12.847 18.958 1.00 48.99 C ATOM 70 O LEU A 33 13.236 13.640 19.876 1.00 48.80 O ATOM 71 CB LEU A 33 11.537 11.635 17.882 1.00 50.18 C ATOM 72 CG LEU A 33 10.127 11.799 17.301 1.00 50.23 C ATOM 73 CD1 LEU A 33 9.473 10.436 17.171 1.00 50.79 C ATOM 74 CD2 LEU A 33 9.251 12.730 18.144 1.00 50.51 C ATOM 75 HA LEU A 33 11.962 13.726 17.720 1.00 0.00 H ATOM 76 HB2 LEU A 33 11.987 10.771 17.393 1.00 0.00 H ATOM 77 HB3 LEU A 33 11.424 11.430 18.947 1.00 0.00 H ATOM 78 HG LEU A 33 10.225 12.261 16.319 1.00 0.00 H ATOM 79 HD21 LEU A 33 9.155 12.324 19.151 1.00 0.00 H ATOM 80 HD22 LEU A 33 9.712 13.716 18.192 1.00 0.00 H ATOM 81 HD23 LEU A 33 8.264 12.810 17.688 1.00 0.00 H ATOM 82 HD11 LEU A 33 10.070 9.810 16.508 1.00 0.00 H ATOM 83 HD12 LEU A 33 9.410 9.969 18.154 1.00 0.00 H ATOM 84 HD13 LEU A 33 8.471 10.553 16.758 1.00 0.00 H ATOM 85 H LEU A 33 13.204 11.838 15.933 1.00 0.00 H ATOM 86 N VAL A 34 14.497 12.002 18.939 1.00 47.67 N ATOM 87 CA VAL A 34 15.523 11.951 19.985 1.00 46.59 C ATOM 88 C VAL A 34 16.281 13.281 20.072 1.00 45.84 C ATOM 89 O VAL A 34 16.327 13.905 21.131 1.00 45.18 O ATOM 90 CB VAL A 34 16.517 10.763 19.770 1.00 46.72 C ATOM 91 CG1 VAL A 34 17.757 10.901 20.658 1.00 46.54 C ATOM 92 CG2 VAL A 34 15.827 9.425 20.028 1.00 46.54 C ATOM 93 HA VAL A 34 15.010 11.781 20.932 1.00 0.00 H ATOM 94 HB VAL A 34 16.843 10.794 18.730 1.00 0.00 H ATOM 95 HG11 VAL A 34 18.273 11.831 20.418 1.00 0.00 H ATOM 96 HG12 VAL A 34 17.453 10.912 21.705 1.00 0.00 H ATOM 97 HG13 VAL A 34 18.425 10.058 20.481 1.00 0.00 H ATOM 98 HG21 VAL A 34 15.463 9.398 21.055 1.00 0.00 H ATOM 99 HG22 VAL A 34 14.989 9.311 19.341 1.00 0.00 H ATOM 100 HG23 VAL A 34 16.539 8.614 19.872 1.00 0.00 H ATOM 101 H VAL A 34 14.580 11.344 18.138 1.00 0.00 H ATOM 102 N VAL A 35 16.846 13.713 18.942 1.00 44.93 N ATOM 103 CA VAL A 35 17.622 14.951 18.869 1.00 43.99 C ATOM 104 C VAL A 35 16.771 16.194 19.174 1.00 43.33 C ATOM 105 O VAL A 35 17.273 17.172 19.725 1.00 42.94 O ATOM 106 CB VAL A 35 18.371 15.064 17.504 1.00 44.12 C ATOM 107 CG1 VAL A 35 18.946 16.459 17.285 1.00 44.57 C ATOM 108 CG2 VAL A 35 19.483 14.033 17.435 1.00 43.98 C ATOM 109 HA VAL A 35 18.378 14.907 19.653 1.00 0.00 H ATOM 110 HB VAL A 35 17.644 14.876 16.714 1.00 0.00 H ATOM 111 HG11 VAL A 35 18.137 17.189 17.293 1.00 0.00 H ATOM 112 HG12 VAL A 35 19.652 16.689 18.083 1.00 0.00 H ATOM 113 HG13 VAL A 35 19.458 16.493 16.324 1.00 0.00 H ATOM 114 HG21 VAL A 35 20.189 14.207 18.247 1.00 0.00 H ATOM 115 HG22 VAL A 35 19.057 13.034 17.529 1.00 0.00 H ATOM 116 HG23 VAL A 35 19.999 14.120 16.479 1.00 0.00 H ATOM 117 H VAL A 35 16.730 13.146 18.078 1.00 0.00 H ATOM 118 N ASN A 36 15.489 16.153 18.829 1.00 42.61 N ATOM 119 CA ASN A 36 14.583 17.244 19.194 1.00 42.50 C ATOM 120 C ASN A 36 14.246 17.255 20.684 1.00 41.77 C ATOM 121 O ASN A 36 14.035 18.317 21.266 1.00 41.67 O ATOM 122 CB ASN A 36 13.302 17.213 18.354 1.00 42.67 C ATOM 123 CG ASN A 36 13.546 17.589 16.900 1.00 43.86 C ATOM 124 OD1 ASN A 36 14.693 17.653 16.438 1.00 45.35 O ATOM 125 ND2 ASN A 36 12.461 17.836 16.166 1.00 44.50 N ATOM 126 HA ASN A 36 15.117 18.169 18.977 1.00 0.00 H ATOM 127 HB2 ASN A 36 12.885 16.206 18.389 1.00 0.00 H ATOM 128 HB3 ASN A 36 12.587 17.916 18.781 1.00 0.00 H ATOM 129 HD22 ASN A 36 11.516 17.770 16.596 1.00 0.00 H ATOM 130 HD21 ASN A 36 12.559 18.094 15.163 1.00 0.00 H ATOM 131 H ASN A 36 15.125 15.338 18.295 1.00 0.00 H ATOM 132 N ALA A 37 14.200 16.068 21.292 1.00 41.07 N ATOM 133 CA ALA A 37 13.950 15.931 22.730 1.00 40.07 C ATOM 134 C ALA A 37 15.168 16.404 23.519 1.00 39.41 C ATOM 135 O ALA A 37 15.036 17.210 24.436 1.00 39.48 O ATOM 136 CB ALA A 37 13.601 14.495 23.081 1.00 39.90 C ATOM 137 HA ALA A 37 13.098 16.556 22.999 1.00 0.00 H ATOM 138 HB1 ALA A 37 12.704 14.197 22.537 1.00 0.00 H ATOM 139 HB2 ALA A 37 14.429 13.843 22.804 1.00 0.00 H ATOM 140 HB3 ALA A 37 13.420 14.418 24.153 1.00 0.00 H ATOM 141 H ALA A 37 14.347 15.209 20.725 1.00 0.00 H ATOM 142 N VAL A 38 16.346 15.907 23.145 1.00 38.87 N ATOM 143 CA VAL A 38 17.623 16.388 23.686 1.00 38.32 C ATOM 144 C VAL A 38 17.774 17.908 23.523 1.00 38.23 C ATOM 145 O VAL A 38 18.119 18.599 24.483 1.00 38.03 O ATOM 146 CB VAL A 38 18.832 15.641 23.056 1.00 38.18 C ATOM 147 CG1 VAL A 38 20.168 16.265 23.483 1.00 38.12 C ATOM 148 CG2 VAL A 38 18.799 14.180 23.418 1.00 37.52 C ATOM 149 HA VAL A 38 17.616 16.168 24.754 1.00 0.00 H ATOM 150 HB VAL A 38 18.749 15.739 21.974 1.00 0.00 H ATOM 151 HG11 VAL A 38 20.201 17.306 23.161 1.00 0.00 H ATOM 152 HG12 VAL A 38 20.260 16.216 24.568 1.00 0.00 H ATOM 153 HG13 VAL A 38 20.988 15.715 23.022 1.00 0.00 H ATOM 154 HG21 VAL A 38 18.844 14.074 24.502 1.00 0.00 H ATOM 155 HG22 VAL A 38 17.876 13.736 23.046 1.00 0.00 H ATOM 156 HG23 VAL A 38 19.654 13.676 22.967 1.00 0.00 H ATOM 157 H VAL A 38 16.362 15.144 22.438 1.00 0.00 H ATOM 158 N ARG A 39 17.505 18.424 22.319 1.00 38.14 N ATOM 159 CA ARG A 39 17.612 19.860 22.051 1.00 38.21 C ATOM 160 C ARG A 39 16.763 20.653 23.031 1.00 37.49 C ATOM 161 O ARG A 39 17.267 21.536 23.733 1.00 37.47 O ATOM 162 CB ARG A 39 17.198 20.204 20.612 1.00 38.32 C ATOM 163 CG ARG A 39 18.354 20.385 19.618 1.00 39.74 C ATOM 164 CD ARG A 39 17.868 20.913 18.243 1.00 40.02 C ATOM 165 NE ARG A 39 17.040 22.118 18.366 1.00 44.14 N ATOM 166 CZ ARG A 39 16.501 22.797 17.350 1.00 46.33 C ATOM 167 NH1 ARG A 39 16.683 22.414 16.086 1.00 47.14 N ATOM 168 NH2 ARG A 39 15.765 23.876 17.601 1.00 46.47 N ATOM 169 HA ARG A 39 18.660 20.133 22.178 1.00 0.00 H ATOM 170 HB2 ARG A 39 16.561 19.400 20.244 1.00 0.00 H ATOM 171 HB3 ARG A 39 16.629 21.133 20.639 1.00 0.00 H ATOM 172 HG2 ARG A 39 19.068 21.096 20.035 1.00 0.00 H ATOM 173 HG3 ARG A 39 18.845 19.423 19.471 1.00 0.00 H ATOM 174 HD2 ARG A 39 17.282 20.134 17.756 1.00 0.00 H ATOM 175 HD3 ARG A 39 18.739 21.147 17.630 1.00 0.00 H ATOM 176 HE ARG A 39 16.857 22.474 19.326 1.00 0.00 H ATOM 177 HH12 ARG A 39 16.254 22.958 15.311 1.00 0.00 H ATOM 178 HH11 ARG A 39 17.254 21.571 15.875 1.00 0.00 H ATOM 179 HH22 ARG A 39 15.342 24.411 16.816 1.00 0.00 H ATOM 180 HH21 ARG A 39 15.613 24.185 18.582 1.00 0.00 H ATOM 181 H ARG A 39 17.211 17.787 21.551 1.00 0.00 H ATOM 182 N LYS A 40 15.477 20.323 23.088 1.00 36.33 N ATOM 183 CA LYS A 40 14.537 21.042 23.937 1.00 35.54 C ATOM 184 C LYS A 40 14.917 20.915 25.418 1.00 34.62 C ATOM 185 O LYS A 40 14.787 21.881 26.172 1.00 34.13 O ATOM 186 CB LYS A 40 13.099 20.574 23.674 1.00 35.77 C ATOM 187 CG LYS A 40 12.441 21.124 22.373 1.00 36.78 C ATOM 188 CD LYS A 40 13.386 21.118 21.154 1.00 39.12 C ATOM 189 CE LYS A 40 12.639 20.914 19.838 1.00 40.18 C ATOM 190 NZ LYS A 40 13.590 20.697 18.719 1.00 42.06 N ATOM 191 HA LYS A 40 14.590 22.101 23.683 1.00 0.00 H ATOM 192 HB2 LYS A 40 13.106 19.486 23.613 1.00 0.00 H ATOM 193 HB3 LYS A 40 12.485 20.885 24.519 1.00 0.00 H ATOM 194 HG2 LYS A 40 11.572 20.509 22.139 1.00 0.00 H ATOM 195 HG3 LYS A 40 12.120 22.149 22.556 1.00 0.00 H ATOM 196 HD2 LYS A 40 13.912 22.072 21.114 1.00 0.00 H ATOM 197 HD3 LYS A 40 14.109 20.311 21.275 1.00 0.00 H ATOM 198 HE2 LYS A 40 12.036 21.798 19.628 1.00 0.00 H ATOM 199 HE3 LYS A 40 11.988 20.044 19.928 1.00 0.00 H ATOM 200 HZ1 LYS A 40 14.211 21.526 18.627 1.00 0.00 H ATOM 201 HZ2 LYS A 40 14.165 19.852 18.913 1.00 0.00 H ATOM 202 HZ3 LYS A 40 13.059 20.561 17.835 1.00 0.00 H ATOM 203 H LYS A 40 15.132 19.530 22.511 1.00 0.00 H ATOM 204 N LEU A 41 15.405 19.739 25.814 1.00 33.90 N ATOM 205 CA LEU A 41 15.909 19.517 27.179 1.00 33.72 C ATOM 206 C LEU A 41 17.104 20.427 27.487 1.00 33.65 C ATOM 207 O LEU A 41 17.130 21.084 28.528 1.00 33.36 O ATOM 208 CB LEU A 41 16.256 18.035 27.417 1.00 33.62 C ATOM 209 CG LEU A 41 16.698 17.622 28.841 1.00 34.17 C ATOM 210 CD1 LEU A 41 16.114 16.278 29.292 1.00 34.14 C ATOM 211 CD2 LEU A 41 18.211 17.613 28.980 1.00 33.13 C ATOM 212 HA LEU A 41 15.109 19.780 27.870 1.00 0.00 H ATOM 213 HB2 LEU A 41 15.372 17.449 27.167 1.00 0.00 H ATOM 214 HB3 LEU A 41 17.067 17.776 26.736 1.00 0.00 H ATOM 215 HG LEU A 41 16.290 18.385 29.504 1.00 0.00 H ATOM 216 HD21 LEU A 41 18.636 16.904 28.269 1.00 0.00 H ATOM 217 HD22 LEU A 41 18.599 18.611 28.776 1.00 0.00 H ATOM 218 HD23 LEU A 41 18.480 17.318 29.994 1.00 0.00 H ATOM 219 HD11 LEU A 41 15.026 16.337 29.290 1.00 0.00 H ATOM 220 HD12 LEU A 41 16.438 15.494 28.607 1.00 0.00 H ATOM 221 HD13 LEU A 41 16.465 16.050 30.299 1.00 0.00 H ATOM 222 H LEU A 41 15.430 18.952 25.135 1.00 0.00 H ATOM 223 N GLN A 42 18.079 20.466 26.574 1.00 33.81 N ATOM 224 CA GLN A 42 19.247 21.347 26.691 1.00 33.91 C ATOM 225 C GLN A 42 18.862 22.816 26.801 1.00 34.13 C ATOM 226 O GLN A 42 19.489 23.581 27.546 1.00 33.97 O ATOM 227 CB GLN A 42 20.161 21.194 25.482 1.00 34.06 C ATOM 228 CG GLN A 42 20.951 19.911 25.419 1.00 34.47 C ATOM 229 CD GLN A 42 21.698 19.778 24.095 1.00 36.84 C ATOM 230 OE1 GLN A 42 21.372 20.448 23.102 1.00 36.97 O ATOM 231 NE2 GLN A 42 22.698 18.905 24.071 1.00 36.97 N ATOM 232 HA GLN A 42 19.759 21.046 27.605 1.00 0.00 H ATOM 233 HB2 GLN A 42 19.544 21.252 24.585 1.00 0.00 H ATOM 234 HB3 GLN A 42 20.868 22.023 25.489 1.00 0.00 H ATOM 235 HG2 GLN A 42 21.673 19.899 26.236 1.00 0.00 H ATOM 236 HG3 GLN A 42 20.268 19.069 25.527 1.00 0.00 H ATOM 237 HE22 GLN A 42 22.937 18.365 24.927 1.00 0.00 H ATOM 238 HE21 GLN A 42 23.242 18.762 23.196 1.00 0.00 H ATOM 239 H GLN A 42 18.007 19.844 25.743 1.00 0.00 H ATOM 240 N GLU A 43 17.820 23.196 26.064 1.00 33.93 N ATOM 241 CA GLU A 43 17.328 24.571 26.023 1.00 34.29 C ATOM 242 C GLU A 43 16.497 25.004 27.237 1.00 33.29 C ATOM 243 O GLU A 43 16.256 26.195 27.419 1.00 33.34 O ATOM 244 CB GLU A 43 16.494 24.779 24.754 1.00 34.36 C ATOM 245 CG GLU A 43 17.273 24.615 23.453 1.00 35.94 C ATOM 246 CD GLU A 43 16.393 24.773 22.219 1.00 36.33 C ATOM 247 OE1 GLU A 43 15.196 25.113 22.367 1.00 39.20 O ATOM 248 OE2 GLU A 43 16.902 24.553 21.097 1.00 40.93 O ATOM 249 HA GLU A 43 18.222 25.195 26.033 1.00 0.00 H ATOM 250 HB2 GLU A 43 15.680 24.054 24.758 1.00 0.00 H ATOM 251 HB3 GLU A 43 16.081 25.787 24.779 1.00 0.00 H ATOM 252 HG2 GLU A 43 18.060 25.368 23.420 1.00 0.00 H ATOM 253 HG3 GLU A 43 17.722 23.622 23.437 1.00 0.00 H ATOM 254 H GLU A 43 17.333 22.479 25.490 1.00 0.00 H ATOM 255 N SER A 44 16.079 24.047 28.067 1.00 32.71 N ATOM 256 CA SER A 44 15.058 24.289 29.095 1.00 31.91 C ATOM 257 C SER A 44 15.481 25.180 30.263 1.00 31.85 C ATOM 258 O SER A 44 14.638 25.755 30.949 1.00 32.47 O ATOM 259 CB SER A 44 14.541 22.963 29.645 1.00 32.16 C ATOM 260 OG SER A 44 15.545 22.293 30.390 1.00 30.49 O ATOM 261 HA SER A 44 14.279 24.844 28.572 1.00 0.00 H ATOM 262 HB2 SER A 44 14.231 22.329 28.814 1.00 0.00 H ATOM 263 HB3 SER A 44 13.685 23.155 30.292 1.00 0.00 H ATOM 264 HG SER A 44 16.323 22.112 29.805 1.00 0.00 H ATOM 265 H SER A 44 16.491 23.096 27.983 1.00 0.00 H ATOM 266 N GLY A 45 16.775 25.287 30.515 1.00 30.98 N ATOM 267 CA GLY A 45 17.205 26.044 31.682 1.00 30.22 C ATOM 268 C GLY A 45 17.246 25.193 32.943 1.00 28.75 C ATOM 269 O GLY A 45 17.785 25.636 33.942 1.00 29.83 O ATOM 270 HA3 GLY A 45 16.511 26.870 31.839 1.00 0.00 H ATOM 271 HA2 GLY A 45 18.203 26.440 31.494 1.00 0.00 H ATOM 272 H GLY A 45 17.474 24.838 29.890 1.00 0.00 H ATOM 273 N PHE A 46 16.655 23.992 32.893 1.00 27.69 N ATOM 274 CA PHE A 46 16.770 22.972 33.958 1.00 26.03 C ATOM 275 C PHE A 46 18.090 22.233 33.860 1.00 23.84 C ATOM 276 O PHE A 46 18.520 21.612 34.822 1.00 22.14 O ATOM 277 CB PHE A 46 15.719 21.861 33.803 1.00 26.99 C ATOM 278 CG PHE A 46 14.309 22.293 33.983 1.00 28.70 C ATOM 279 CD1 PHE A 46 13.894 22.924 35.135 1.00 31.76 C ATOM 280 CD2 PHE A 46 13.372 22.003 33.002 1.00 30.33 C ATOM 281 CE1 PHE A 46 12.561 23.294 35.294 1.00 33.81 C ATOM 282 CE2 PHE A 46 12.059 22.370 33.136 1.00 31.68 C ATOM 283 CZ PHE A 46 11.640 23.020 34.282 1.00 32.10 C ATOM 284 HA PHE A 46 16.655 23.521 34.892 1.00 0.00 H ATOM 285 HB2 PHE A 46 15.818 21.441 32.802 1.00 0.00 H ATOM 286 HB3 PHE A 46 15.932 21.089 34.543 1.00 0.00 H ATOM 287 HD2 PHE A 46 13.688 21.471 32.104 1.00 0.00 H ATOM 288 HE2 PHE A 46 11.346 22.150 32.341 1.00 0.00 H ATOM 289 HZ PHE A 46 10.597 23.317 34.394 1.00 0.00 H ATOM 290 HE1 PHE A 46 12.238 23.796 36.206 1.00 0.00 H ATOM 291 HD1 PHE A 46 14.613 23.135 35.927 1.00 0.00 H ATOM 292 H PHE A 46 16.082 23.763 32.056 1.00 0.00 H ATOM 293 N TYR A 47 18.670 22.237 32.658 1.00 22.05 N ATOM 294 CA TYR A 47 19.774 21.362 32.302 1.00 20.92 C ATOM 295 C TYR A 47 21.131 21.991 32.587 1.00 20.92 C ATOM 296 O TYR A 47 21.388 23.126 32.187 1.00 20.98 O ATOM 297 CB TYR A 47 19.676 20.990 30.815 1.00 20.40 C ATOM 298 CG TYR A 47 20.856 20.201 30.286 1.00 20.53 C ATOM 299 CD1 TYR A 47 21.115 18.902 30.738 1.00 18.23 C ATOM 300 CD2 TYR A 47 21.717 20.755 29.331 1.00 17.85 C ATOM 301 CE1 TYR A 47 22.209 18.173 30.255 1.00 18.87 C ATOM 302 CE2 TYR A 47 22.806 20.036 28.840 1.00 19.31 C ATOM 303 CZ TYR A 47 23.048 18.747 29.298 1.00 20.13 C ATOM 304 OH TYR A 47 24.131 18.031 28.801 1.00 19.93 O ATOM 305 HA TYR A 47 19.696 20.468 32.921 1.00 0.00 H ATOM 306 HB3 TYR A 47 19.596 21.911 30.238 1.00 0.00 H ATOM 307 HB2 TYR A 47 18.775 20.393 30.672 1.00 0.00 H ATOM 308 HD2 TYR A 47 21.533 21.765 28.965 1.00 0.00 H ATOM 309 HE2 TYR A 47 23.466 20.485 28.098 1.00 0.00 H ATOM 310 HE1 TYR A 47 22.404 17.166 30.623 1.00 0.00 H ATOM 311 HD1 TYR A 47 20.454 18.450 31.478 1.00 0.00 H ATOM 312 HH TYR A 47 24.159 17.138 29.228 1.00 0.00 H ATOM 313 H TYR A 47 18.314 22.900 31.940 1.00 0.00 H ATOM 314 N TRP A 48 21.989 21.237 33.266 1.00 20.36 N ATOM 315 CA TRP A 48 23.332 21.682 33.620 1.00 20.55 C ATOM 316 C TRP A 48 24.366 20.763 32.985 1.00 22.17 C ATOM 317 O TRP A 48 24.652 19.665 33.476 1.00 21.65 O ATOM 318 CB TRP A 48 23.517 21.716 35.141 1.00 19.35 C ATOM 319 CG TRP A 48 22.690 22.752 35.809 1.00 17.55 C ATOM 320 CD1 TRP A 48 21.329 22.832 35.821 1.00 17.90 C ATOM 321 CD2 TRP A 48 23.170 23.871 36.555 1.00 16.94 C ATOM 322 NE1 TRP A 48 20.924 23.938 36.539 1.00 16.71 N ATOM 323 CE2 TRP A 48 22.044 24.595 36.991 1.00 16.77 C ATOM 324 CE3 TRP A 48 24.458 24.337 36.901 1.00 18.24 C ATOM 325 CZ2 TRP A 48 22.157 25.751 37.769 1.00 18.40 C ATOM 326 CZ3 TRP A 48 24.566 25.508 37.656 1.00 16.94 C ATOM 327 CH2 TRP A 48 23.432 26.188 38.090 1.00 18.13 C ATOM 328 HA TRP A 48 23.470 22.694 33.240 1.00 0.00 H ATOM 329 HB2 TRP A 48 23.244 20.741 35.545 1.00 0.00 H ATOM 330 HB3 TRP A 48 24.566 21.917 35.358 1.00 0.00 H ATOM 331 HE1 TRP A 48 19.939 24.226 36.709 1.00 0.00 H ATOM 332 HD1 TRP A 48 20.658 22.124 35.334 1.00 0.00 H ATOM 333 HZ2 TRP A 48 21.273 26.290 38.111 1.00 0.00 H ATOM 334 HH2 TRP A 48 23.550 27.086 38.697 1.00 0.00 H ATOM 335 HZ3 TRP A 48 25.553 25.895 37.909 1.00 0.00 H ATOM 336 HE3 TRP A 48 25.349 23.794 36.586 1.00 0.00 H ATOM 337 H TRP A 48 21.689 20.285 33.559 1.00 0.00 H ATOM 338 N SER A 49 24.921 21.238 31.879 1.00 24.22 N ATOM 339 CA SER A 49 25.968 20.536 31.169 1.00 26.20 C ATOM 340 C SER A 49 27.236 20.622 32.009 1.00 27.34 C ATOM 341 O SER A 49 27.410 21.576 32.769 1.00 28.73 O ATOM 342 CB SER A 49 26.187 21.212 29.819 1.00 26.01 C ATOM 343 OG SER A 49 27.339 20.700 29.183 1.00 27.65 O ATOM 344 HA SER A 49 25.701 19.492 31.002 1.00 0.00 H ATOM 345 HB2 SER A 49 26.309 22.284 29.972 1.00 0.00 H ATOM 346 HB3 SER A 49 25.319 21.033 29.185 1.00 0.00 H ATOM 347 HG SER A 49 27.461 21.152 28.311 1.00 0.00 H ATOM 348 H SER A 49 24.591 22.151 31.507 1.00 0.00 H ATOM 349 N ALA A 50 28.114 19.638 31.876 1.00 28.07 N ATOM 350 CA ALA A 50 29.365 19.633 32.635 1.00 29.25 C ATOM 351 C ALA A 50 29.143 19.795 34.152 1.00 29.12 C ATOM 352 O ALA A 50 29.821 20.589 34.820 1.00 30.18 O ATOM 353 CB ALA A 50 30.346 20.714 32.081 1.00 29.38 C ATOM 354 HA ALA A 50 29.819 18.651 32.500 1.00 0.00 H ATOM 355 HB1 ALA A 50 30.565 20.502 31.035 1.00 0.00 H ATOM 356 HB2 ALA A 50 29.885 21.698 32.164 1.00 0.00 H ATOM 357 HB3 ALA A 50 31.270 20.694 32.659 1.00 0.00 H ATOM 358 H ALA A 50 27.910 18.856 31.221 1.00 0.00 H ATOM 359 N VAL A 51 28.166 19.053 34.673 1.00 28.56 N ATOM 360 CA VAL A 51 27.969 18.884 36.111 1.00 27.41 C ATOM 361 C VAL A 51 27.888 17.376 36.409 1.00 27.11 C ATOM 362 O VAL A 51 27.077 16.659 35.822 1.00 27.25 O ATOM 363 CB VAL A 51 26.678 19.612 36.599 1.00 27.32 C ATOM 364 CG1 VAL A 51 26.240 19.101 37.949 1.00 26.06 C ATOM 365 CG2 VAL A 51 26.892 21.132 36.636 1.00 26.48 C ATOM 366 HA VAL A 51 28.806 19.330 36.648 1.00 0.00 H ATOM 367 HB VAL A 51 25.883 19.395 35.886 1.00 0.00 H ATOM 368 HG11 VAL A 51 26.033 18.033 37.882 1.00 0.00 H ATOM 369 HG12 VAL A 51 27.033 19.274 38.676 1.00 0.00 H ATOM 370 HG13 VAL A 51 25.338 19.628 38.261 1.00 0.00 H ATOM 371 HG21 VAL A 51 27.708 21.366 37.319 1.00 0.00 H ATOM 372 HG22 VAL A 51 27.140 21.487 35.636 1.00 0.00 H ATOM 373 HG23 VAL A 51 25.979 21.618 36.979 1.00 0.00 H ATOM 374 H VAL A 51 27.512 18.571 34.024 1.00 0.00 H ATOM 375 N THR A 52 28.742 16.905 37.312 1.00 27.16 N ATOM 376 CA THR A 52 28.734 15.502 37.736 1.00 26.45 C ATOM 377 C THR A 52 27.761 15.285 38.890 1.00 25.76 C ATOM 378 O THR A 52 27.153 16.237 39.398 1.00 25.01 O ATOM 379 CB THR A 52 30.122 15.047 38.210 1.00 26.75 C ATOM 380 OG1 THR A 52 30.487 15.788 39.383 1.00 26.95 O ATOM 381 CG2 THR A 52 31.173 15.251 37.110 1.00 27.32 C ATOM 382 HA THR A 52 28.430 14.920 36.866 1.00 0.00 H ATOM 383 HB THR A 52 30.082 13.983 38.444 1.00 0.00 H ATOM 384 HG1 THR A 52 30.509 16.754 39.168 1.00 0.00 H ATOM 385 HG23 THR A 52 30.885 14.684 36.225 1.00 0.00 H ATOM 386 HG21 THR A 52 31.235 16.310 36.860 1.00 0.00 H ATOM 387 HG22 THR A 52 32.143 14.903 37.467 1.00 0.00 H ATOM 388 H THR A 52 29.439 17.553 37.731 1.00 0.00 H ATOM 389 N GLY A 53 27.622 14.027 39.306 1.00 24.82 N ATOM 390 CA GLY A 53 26.828 13.702 40.475 1.00 23.71 C ATOM 391 C GLY A 53 27.327 14.411 41.712 1.00 23.34 C ATOM 392 O GLY A 53 26.533 14.957 42.474 1.00 23.70 O ATOM 393 HA3 GLY A 53 26.873 12.626 40.643 1.00 0.00 H ATOM 394 HA2 GLY A 53 25.795 13.997 40.292 1.00 0.00 H ATOM 395 H GLY A 53 28.093 13.262 38.781 1.00 0.00 H ATOM 396 N GLY A 54 28.648 14.411 41.906 1.00 22.77 N ATOM 397 CA GLY A 54 29.270 15.063 43.056 1.00 22.01 C ATOM 398 C GLY A 54 29.036 16.558 43.057 1.00 21.69 C ATOM 399 O GLY A 54 28.757 17.144 44.091 1.00 21.41 O ATOM 400 HA3 GLY A 54 30.343 14.875 43.029 1.00 0.00 H ATOM 401 HA2 GLY A 54 28.851 14.641 43.969 1.00 0.00 H ATOM 402 H GLY A 54 29.256 13.929 41.213 1.00 0.00 H ATOM 403 N GLU A 55 29.127 17.170 41.880 1.00 21.66 N ATOM 404 CA GLU A 55 28.887 18.605 41.742 1.00 21.08 C ATOM 405 C GLU A 55 27.428 18.978 41.966 1.00 20.37 C ATOM 406 O GLU A 55 27.137 20.030 42.517 1.00 20.27 O ATOM 407 CB GLU A 55 29.391 19.096 40.389 1.00 21.12 C ATOM 408 CG GLU A 55 30.910 19.172 40.324 1.00 23.70 C ATOM 409 CD GLU A 55 31.464 19.223 38.913 1.00 27.77 C ATOM 410 OE1 GLU A 55 32.579 19.757 38.745 1.00 33.31 O ATOM 411 OE2 GLU A 55 30.822 18.715 37.973 1.00 29.25 O ATOM 412 HA GLU A 55 29.451 19.109 42.527 1.00 0.00 H ATOM 413 HB2 GLU A 55 29.042 18.411 39.616 1.00 0.00 H ATOM 414 HB3 GLU A 55 28.983 20.090 40.203 1.00 0.00 H ATOM 415 HG2 GLU A 55 31.232 20.070 40.852 1.00 0.00 H ATOM 416 HG3 GLU A 55 31.319 18.293 40.822 1.00 0.00 H ATOM 417 H GLU A 55 29.375 16.614 41.037 1.00 0.00 H ATOM 418 N ALA A 56 26.514 18.103 41.554 1.00 20.13 N ATOM 419 CA ALA A 56 25.092 18.275 41.872 1.00 19.64 C ATOM 420 C ALA A 56 24.832 18.333 43.384 1.00 19.46 C ATOM 421 O ALA A 56 24.105 19.211 43.854 1.00 18.97 O ATOM 422 CB ALA A 56 24.256 17.175 41.199 1.00 19.51 C ATOM 423 HA ALA A 56 24.782 19.240 41.471 1.00 0.00 H ATOM 424 HB1 ALA A 56 24.388 17.230 40.118 1.00 0.00 H ATOM 425 HB2 ALA A 56 24.585 16.200 41.557 1.00 0.00 H ATOM 426 HB3 ALA A 56 23.204 17.318 41.446 1.00 0.00 H ATOM 427 H ALA A 56 26.814 17.279 40.994 1.00 0.00 H ATOM 428 N ASN A 57 25.418 17.403 44.145 1.00 19.50 N ATOM 429 CA ASN A 57 25.403 17.448 45.610 1.00 20.20 C ATOM 430 C ASN A 57 25.811 18.826 46.156 1.00 20.10 C ATOM 431 O ASN A 57 25.076 19.431 46.952 1.00 20.05 O ATOM 432 CB ASN A 57 26.331 16.368 46.203 1.00 20.99 C ATOM 433 CG ASN A 57 25.667 14.994 46.319 1.00 22.70 C ATOM 434 OD1 ASN A 57 24.463 14.838 46.115 1.00 24.74 O ATOM 435 ND2 ASN A 57 26.466 13.990 46.629 1.00 23.36 N ATOM 436 HA ASN A 57 24.375 17.254 45.915 1.00 0.00 H ATOM 437 HB2 ASN A 57 27.208 16.275 45.562 1.00 0.00 H ATOM 438 HB3 ASN A 57 26.642 16.687 47.198 1.00 0.00 H ATOM 439 HD22 ASN A 57 27.478 14.163 46.794 1.00 0.00 H ATOM 440 HD21 ASN A 57 26.083 13.026 46.708 1.00 0.00 H ATOM 441 H ASN A 57 25.906 16.613 43.677 1.00 0.00 H ATOM 442 N LEU A 58 26.975 19.317 45.714 1.00 20.36 N ATOM 443 CA LEU A 58 27.458 20.669 46.079 1.00 20.82 C ATOM 444 C LEU A 58 26.465 21.758 45.711 1.00 20.00 C ATOM 445 O LEU A 58 26.114 22.588 46.549 1.00 20.35 O ATOM 446 CB LEU A 58 28.800 21.007 45.395 1.00 21.49 C ATOM 447 CG LEU A 58 30.214 20.729 45.921 1.00 24.37 C ATOM 448 CD1 LEU A 58 30.325 20.782 47.457 1.00 26.90 C ATOM 449 CD2 LEU A 58 30.748 19.426 45.369 1.00 27.74 C ATOM 450 HA LEU A 58 27.586 20.642 47.161 1.00 0.00 H ATOM 451 HB2 LEU A 58 28.757 20.499 44.431 1.00 0.00 H ATOM 452 HB3 LEU A 58 28.769 22.085 45.238 1.00 0.00 H ATOM 453 HG LEU A 58 30.840 21.543 45.557 1.00 0.00 H ATOM 454 HD21 LEU A 58 30.093 18.609 45.672 1.00 0.00 H ATOM 455 HD22 LEU A 58 30.782 19.481 44.281 1.00 0.00 H ATOM 456 HD23 LEU A 58 31.752 19.253 45.757 1.00 0.00 H ATOM 457 HD11 LEU A 58 30.037 21.773 47.807 1.00 0.00 H ATOM 458 HD12 LEU A 58 29.663 20.035 47.894 1.00 0.00 H ATOM 459 HD13 LEU A 58 31.354 20.575 47.753 1.00 0.00 H ATOM 460 H LEU A 58 27.563 18.727 45.091 1.00 0.00 H ATOM 461 N LEU A 59 26.011 21.763 44.459 1.00 19.49 N ATOM 462 CA LEU A 59 25.070 22.798 43.992 1.00 19.60 C ATOM 463 C LEU A 59 23.753 22.815 44.774 1.00 20.02 C ATOM 464 O LEU A 59 23.156 23.879 44.953 1.00 20.50 O ATOM 465 CB LEU A 59 24.797 22.668 42.478 1.00 19.31 C ATOM 466 CG LEU A 59 25.910 23.077 41.499 1.00 18.78 C ATOM 467 CD1 LEU A 59 25.752 22.354 40.166 1.00 19.04 C ATOM 468 CD2 LEU A 59 25.954 24.604 41.291 1.00 19.08 C ATOM 469 HA LEU A 59 25.561 23.753 44.181 1.00 0.00 H ATOM 470 HB2 LEU A 59 24.562 21.622 42.281 1.00 0.00 H ATOM 471 HB3 LEU A 59 23.926 23.284 42.253 1.00 0.00 H ATOM 472 HG LEU A 59 26.860 22.779 41.942 1.00 0.00 H ATOM 473 HD21 LEU A 59 25.000 24.942 40.887 1.00 0.00 H ATOM 474 HD22 LEU A 59 26.140 25.094 42.247 1.00 0.00 H ATOM 475 HD23 LEU A 59 26.754 24.851 40.593 1.00 0.00 H ATOM 476 HD11 LEU A 59 25.805 21.278 40.329 1.00 0.00 H ATOM 477 HD12 LEU A 59 24.787 22.609 39.728 1.00 0.00 H ATOM 478 HD13 LEU A 59 26.551 22.660 39.491 1.00 0.00 H ATOM 479 H LEU A 59 26.326 21.024 43.799 1.00 0.00 H ATOM 480 N LEU A 60 23.316 21.639 45.239 1.00 19.99 N ATOM 481 CA LEU A 60 22.033 21.469 45.928 1.00 20.98 C ATOM 482 C LEU A 60 22.137 21.433 47.468 1.00 22.65 C ATOM 483 O LEU A 60 21.131 21.525 48.158 1.00 22.75 O ATOM 484 CB LEU A 60 21.318 20.199 45.414 1.00 20.22 C ATOM 485 CG LEU A 60 20.895 20.201 43.933 1.00 17.34 C ATOM 486 CD1 LEU A 60 20.460 18.798 43.495 1.00 17.83 C ATOM 487 CD2 LEU A 60 19.792 21.248 43.669 1.00 14.79 C ATOM 488 HA LEU A 60 21.448 22.358 45.690 1.00 0.00 H ATOM 489 HB2 LEU A 60 21.991 19.355 45.565 1.00 0.00 H ATOM 490 HB3 LEU A 60 20.420 20.058 46.015 1.00 0.00 H ATOM 491 HG LEU A 60 21.758 20.485 43.331 1.00 0.00 H ATOM 492 HD21 LEU A 60 18.920 21.017 44.280 1.00 0.00 H ATOM 493 HD22 LEU A 60 20.165 22.239 43.926 1.00 0.00 H ATOM 494 HD23 LEU A 60 19.515 21.225 42.615 1.00 0.00 H ATOM 495 HD11 LEU A 60 21.291 18.104 43.625 1.00 0.00 H ATOM 496 HD12 LEU A 60 19.616 18.474 44.104 1.00 0.00 H ATOM 497 HD13 LEU A 60 20.165 18.821 42.446 1.00 0.00 H ATOM 498 H LEU A 60 23.918 20.802 45.105 1.00 0.00 H ATOM 499 N SER A 61 23.362 21.330 47.977 1.00 24.60 N ATOM 500 CA SER A 61 23.662 21.244 49.410 1.00 26.66 C ATOM 501 C SER A 61 22.933 22.269 50.269 1.00 27.16 C ATOM 502 O SER A 61 22.295 21.912 51.247 1.00 29.06 O ATOM 503 CB SER A 61 25.186 21.339 49.632 1.00 26.32 C ATOM 504 OG SER A 61 25.500 21.882 50.904 1.00 29.69 O ATOM 505 HA SER A 61 23.290 20.274 49.739 1.00 0.00 H ATOM 506 HB2 SER A 61 25.616 21.977 48.860 1.00 0.00 H ATOM 507 HB3 SER A 61 25.617 20.340 49.558 1.00 0.00 H ATOM 508 HG SER A 61 26.483 21.927 51.009 1.00 0.00 H ATOM 509 H SER A 61 24.162 21.309 47.313 1.00 0.00 H ATOM 510 N ALA A 62 23.016 23.535 49.882 1.00 28.20 N ATOM 511 CA ALA A 62 22.453 24.640 50.663 1.00 28.35 C ATOM 512 C ALA A 62 21.078 25.118 50.162 1.00 28.37 C ATOM 513 O ALA A 62 20.580 26.170 50.585 1.00 28.46 O ATOM 514 CB ALA A 62 23.438 25.791 50.686 1.00 28.47 C ATOM 515 HA ALA A 62 22.284 24.262 51.671 1.00 0.00 H ATOM 516 HB1 ALA A 62 24.371 25.460 51.142 1.00 0.00 H ATOM 517 HB2 ALA A 62 23.629 26.125 49.666 1.00 0.00 H ATOM 518 HB3 ALA A 62 23.020 26.613 51.267 1.00 0.00 H ATOM 519 H ALA A 62 23.500 23.752 48.988 1.00 0.00 H ATOM 520 N GLU A 63 20.466 24.338 49.267 1.00 27.48 N ATOM 521 CA GLU A 63 19.171 24.689 48.696 1.00 26.45 C ATOM 522 C GLU A 63 18.025 24.002 49.445 1.00 25.57 C ATOM 523 O GLU A 63 18.212 22.939 50.006 1.00 25.51 O ATOM 524 CB GLU A 63 19.144 24.336 47.205 1.00 26.43 C ATOM 525 CG GLU A 63 20.184 25.097 46.372 1.00 27.28 C ATOM 526 CD GLU A 63 19.871 26.579 46.195 1.00 28.46 C ATOM 527 OE1 GLU A 63 20.819 27.377 46.010 1.00 31.52 O ATOM 528 OE2 GLU A 63 18.684 26.958 46.226 1.00 30.11 O ATOM 529 HA GLU A 63 19.028 25.764 48.804 1.00 0.00 H ATOM 530 HB2 GLU A 63 19.334 23.268 47.100 1.00 0.00 H ATOM 531 HB3 GLU A 63 18.153 24.568 46.814 1.00 0.00 H ATOM 532 HG2 GLU A 63 21.152 25.007 46.866 1.00 0.00 H ATOM 533 HG3 GLU A 63 20.237 24.637 45.385 1.00 0.00 H ATOM 534 H GLU A 63 20.927 23.455 48.969 1.00 0.00 H ATOM 535 N PRO A 64 16.833 24.625 49.468 1.00 25.12 N ATOM 536 CA PRO A 64 15.677 24.001 50.114 1.00 24.76 C ATOM 537 C PRO A 64 15.197 22.745 49.408 1.00 24.69 C ATOM 538 O PRO A 64 15.447 22.557 48.198 1.00 23.97 O ATOM 539 CB PRO A 64 14.606 25.082 50.026 1.00 24.86 C ATOM 540 CG PRO A 64 15.007 25.910 48.883 1.00 25.58 C ATOM 541 CD PRO A 64 16.499 25.947 48.921 1.00 24.86 C ATOM 542 HA PRO A 64 15.918 23.677 51.127 1.00 0.00 H ATOM 543 HD3 PRO A 64 16.916 26.078 47.923 1.00 0.00 H ATOM 544 HD2 PRO A 64 16.858 26.745 49.571 1.00 0.00 H ATOM 545 HG3 PRO A 64 14.598 26.916 48.979 1.00 0.00 H ATOM 546 HG2 PRO A 64 14.660 25.466 47.950 1.00 0.00 H ATOM 547 HB2 PRO A 64 13.625 24.639 49.855 1.00 0.00 H ATOM 548 HB3 PRO A 64 14.581 25.675 50.941 1.00 0.00 H ATOM 549 N ALA A 65 14.504 21.900 50.169 1.00 24.03 N ATOM 550 CA ALA A 65 14.007 20.635 49.680 1.00 23.62 C ATOM 551 C ALA A 65 13.123 20.907 48.478 1.00 22.90 C ATOM 552 O ALA A 65 12.380 21.887 48.461 1.00 23.66 O ATOM 553 CB ALA A 65 13.226 19.898 50.782 1.00 23.82 C ATOM 554 HA ALA A 65 14.838 19.993 49.388 1.00 0.00 H ATOM 555 HB1 ALA A 65 13.884 19.715 51.632 1.00 0.00 H ATOM 556 HB2 ALA A 65 12.382 20.511 51.099 1.00 0.00 H ATOM 557 HB3 ALA A 65 12.860 18.948 50.393 1.00 0.00 H ATOM 558 H ALA A 65 14.313 22.162 51.157 1.00 0.00 H ATOM 559 N GLY A 66 13.236 20.058 47.461 1.00 22.07 N ATOM 560 CA GLY A 66 12.469 20.217 46.233 1.00 20.18 C ATOM 561 C GLY A 66 13.191 21.006 45.156 1.00 19.81 C ATOM 562 O GLY A 66 12.668 21.158 44.058 1.00 19.35 O ATOM 563 HA3 GLY A 66 11.540 20.734 46.473 1.00 0.00 H ATOM 564 HA2 GLY A 66 12.241 19.226 45.839 1.00 0.00 H ATOM 565 H GLY A 66 13.892 19.256 47.545 1.00 0.00 H ATOM 566 N THR A 67 14.370 21.548 45.473 1.00 18.16 N ATOM 567 CA THR A 67 15.192 22.190 44.455 1.00 17.23 C ATOM 568 C THR A 67 15.837 21.090 43.607 1.00 16.27 C ATOM 569 O THR A 67 16.316 20.081 44.138 1.00 15.75 O ATOM 570 CB THR A 67 16.283 23.090 45.059 1.00 17.70 C ATOM 571 OG1 THR A 67 15.683 24.017 45.981 1.00 18.23 O ATOM 572 CG2 THR A 67 17.026 23.857 43.967 1.00 16.90 C ATOM 573 HA THR A 67 14.555 22.835 43.850 1.00 0.00 H ATOM 574 HB THR A 67 17.002 22.460 45.583 1.00 0.00 H ATOM 575 HG1 THR A 67 15.230 23.515 46.704 1.00 0.00 H ATOM 576 HG23 THR A 67 17.478 23.150 43.272 1.00 0.00 H ATOM 577 HG21 THR A 67 16.324 24.496 43.432 1.00 0.00 H ATOM 578 HG22 THR A 67 17.804 24.470 44.421 1.00 0.00 H ATOM 579 H THR A 67 14.705 21.511 46.457 1.00 0.00 H ATOM 580 N PHE A 68 15.839 21.283 42.290 1.00 15.65 N ATOM 581 CA PHE A 68 16.288 20.216 41.397 1.00 14.74 C ATOM 582 C PHE A 68 17.063 20.746 40.185 1.00 15.07 C ATOM 583 O PHE A 68 17.031 21.951 39.869 1.00 15.01 O ATOM 584 CB PHE A 68 15.087 19.357 40.989 1.00 14.36 C ATOM 585 CG PHE A 68 14.154 20.041 40.025 1.00 14.69 C ATOM 586 CD1 PHE A 68 14.364 19.944 38.643 1.00 17.40 C ATOM 587 CD2 PHE A 68 13.093 20.808 40.499 1.00 16.78 C ATOM 588 CE1 PHE A 68 13.504 20.596 37.745 1.00 17.03 C ATOM 589 CE2 PHE A 68 12.224 21.467 39.619 1.00 16.75 C ATOM 590 CZ PHE A 68 12.434 21.355 38.243 1.00 16.07 C ATOM 591 HA PHE A 68 16.999 19.591 41.938 1.00 0.00 H ATOM 592 HB2 PHE A 68 15.459 18.445 40.521 1.00 0.00 H ATOM 593 HB3 PHE A 68 14.526 19.100 41.888 1.00 0.00 H ATOM 594 HD2 PHE A 68 12.935 20.897 41.574 1.00 0.00 H ATOM 595 HE2 PHE A 68 11.394 22.060 40.004 1.00 0.00 H ATOM 596 HZ PHE A 68 11.762 21.861 37.550 1.00 0.00 H ATOM 597 HE1 PHE A 68 13.666 20.513 36.670 1.00 0.00 H ATOM 598 HD1 PHE A 68 15.201 19.358 38.263 1.00 0.00 H ATOM 599 H PHE A 68 15.521 22.192 41.897 1.00 0.00 H ATOM 600 N LEU A 69 17.780 19.849 39.516 1.00 14.81 N ATOM 601 CA LEU A 69 18.404 20.162 38.218 1.00 14.83 C ATOM 602 C LEU A 69 18.479 18.877 37.421 1.00 14.82 C ATOM 603 O LEU A 69 18.439 17.787 37.994 1.00 14.66 O ATOM 604 CB LEU A 69 19.829 20.744 38.411 1.00 13.91 C ATOM 605 CG LEU A 69 20.872 19.901 39.169 1.00 14.50 C ATOM 606 CD1 LEU A 69 21.591 18.905 38.253 1.00 16.57 C ATOM 607 CD2 LEU A 69 21.931 20.754 39.855 1.00 15.26 C ATOM 608 HA LEU A 69 17.809 20.911 37.695 1.00 0.00 H ATOM 609 HB2 LEU A 69 20.234 20.940 37.418 1.00 0.00 H ATOM 610 HB3 LEU A 69 19.722 21.685 38.951 1.00 0.00 H ATOM 611 HG LEU A 69 20.298 19.362 39.922 1.00 0.00 H ATOM 612 HD21 LEU A 69 22.459 21.346 39.108 1.00 0.00 H ATOM 613 HD22 LEU A 69 21.451 21.418 40.574 1.00 0.00 H ATOM 614 HD23 LEU A 69 22.638 20.106 40.373 1.00 0.00 H ATOM 615 HD11 LEU A 69 20.861 18.225 37.814 1.00 0.00 H ATOM 616 HD12 LEU A 69 22.106 19.448 37.461 1.00 0.00 H ATOM 617 HD13 LEU A 69 22.315 18.336 38.835 1.00 0.00 H ATOM 618 H LEU A 69 17.904 18.899 39.920 1.00 0.00 H ATOM 619 N ILE A 70 18.625 19.002 36.106 1.00 15.30 N ATOM 620 CA ILE A 70 18.888 17.853 35.236 1.00 14.94 C ATOM 621 C ILE A 70 20.307 17.997 34.693 1.00 16.22 C ATOM 622 O ILE A 70 20.764 19.107 34.421 1.00 16.05 O ATOM 623 CB ILE A 70 17.827 17.727 34.087 1.00 14.63 C ATOM 624 CG1 ILE A 70 16.443 17.489 34.686 1.00 14.69 C ATOM 625 CG2 ILE A 70 18.179 16.572 33.156 1.00 14.43 C ATOM 626 CD1 ILE A 70 15.309 17.685 33.741 1.00 14.12 C ATOM 627 HA ILE A 70 18.802 16.929 35.808 1.00 0.00 H ATOM 628 HB ILE A 70 17.826 18.655 33.515 1.00 0.00 H ATOM 629 HG12 ILE A 70 16.405 16.464 35.054 1.00 0.00 H ATOM 630 HG13 ILE A 70 16.312 18.178 35.520 1.00 0.00 H ATOM 631 HD11 ILE A 70 15.319 18.710 33.371 1.00 0.00 H ATOM 632 HD12 ILE A 70 15.412 16.994 32.904 1.00 0.00 H ATOM 633 HD13 ILE A 70 14.369 17.493 34.259 1.00 0.00 H ATOM 634 HG21 ILE A 70 19.160 16.749 32.714 1.00 0.00 H ATOM 635 HG22 ILE A 70 18.198 15.642 33.724 1.00 0.00 H ATOM 636 HG23 ILE A 70 17.431 16.502 32.367 1.00 0.00 H ATOM 637 H ILE A 70 18.550 19.948 35.680 1.00 0.00 H ATOM 638 N ARG A 71 21.022 16.881 34.601 1.00 16.54 N ATOM 639 CA ARG A 71 22.431 16.894 34.241 1.00 18.30 C ATOM 640 C ARG A 71 22.710 15.646 33.408 1.00 18.97 C ATOM 641 O ARG A 71 21.829 14.802 33.250 1.00 18.66 O ATOM 642 CB ARG A 71 23.300 16.867 35.507 1.00 17.95 C ATOM 643 CG ARG A 71 23.067 15.598 36.369 1.00 18.77 C ATOM 644 CD ARG A 71 23.965 15.575 37.598 1.00 18.79 C ATOM 645 NE ARG A 71 23.733 14.446 38.513 1.00 19.37 N ATOM 646 CZ ARG A 71 24.078 13.178 38.302 1.00 18.33 C ATOM 647 NH1 ARG A 71 24.660 12.789 37.172 1.00 17.91 N ATOM 648 NH2 ARG A 71 23.828 12.277 39.240 1.00 19.12 N ATOM 649 HA ARG A 71 22.667 17.797 33.678 1.00 0.00 H ATOM 650 HB2 ARG A 71 24.348 16.900 35.211 1.00 0.00 H ATOM 651 HB3 ARG A 71 23.066 17.745 36.109 1.00 0.00 H ATOM 652 HG2 ARG A 71 22.026 15.577 36.692 1.00 0.00 H ATOM 653 HG3 ARG A 71 23.276 14.716 35.763 1.00 0.00 H ATOM 654 HD2 ARG A 71 23.804 16.499 38.153 1.00 0.00 H ATOM 655 HD3 ARG A 71 25.000 15.531 37.260 1.00 0.00 H ATOM 656 HE ARG A 71 23.253 14.659 39.411 1.00 0.00 H ATOM 657 HH12 ARG A 71 24.918 11.791 37.037 1.00 0.00 H ATOM 658 HH11 ARG A 71 24.858 13.483 36.423 1.00 0.00 H ATOM 659 HH22 ARG A 71 24.092 11.282 39.089 1.00 0.00 H ATOM 660 HH21 ARG A 71 23.368 12.564 40.127 1.00 0.00 H ATOM 661 H ARG A 71 20.560 15.969 34.792 1.00 0.00 H ATOM 662 N ASP A 72 23.931 15.526 32.894 1.00 20.74 N ATOM 663 CA ASP A 72 24.361 14.304 32.196 1.00 22.21 C ATOM 664 C ASP A 72 24.564 13.143 33.168 1.00 23.00 C ATOM 665 O ASP A 72 25.100 13.322 34.264 1.00 21.78 O ATOM 666 CB ASP A 72 25.666 14.542 31.421 1.00 22.70 C ATOM 667 CG ASP A 72 25.537 15.613 30.343 1.00 24.32 C ATOM 668 OD1 ASP A 72 26.505 16.378 30.153 1.00 29.75 O ATOM 669 OD2 ASP A 72 24.483 15.701 29.685 1.00 25.46 O ATOM 670 HA ASP A 72 23.566 14.044 31.497 1.00 0.00 H ATOM 671 HB2 ASP A 72 26.437 14.851 32.127 1.00 0.00 H ATOM 672 HB3 ASP A 72 25.963 13.607 30.947 1.00 0.00 H ATOM 673 H ASP A 72 24.600 16.317 32.988 1.00 0.00 H ATOM 674 N SER A 73 24.127 11.947 32.758 1.00 24.76 N ATOM 675 CA SER A 73 24.372 10.734 33.523 1.00 26.35 C ATOM 676 C SER A 73 25.788 10.269 33.226 1.00 28.31 C ATOM 677 O SER A 73 26.259 10.383 32.090 1.00 28.49 O ATOM 678 CB SER A 73 23.378 9.639 33.135 1.00 26.22 C ATOM 679 OG SER A 73 23.620 8.451 33.877 1.00 25.67 O ATOM 680 HA SER A 73 24.249 10.939 34.586 1.00 0.00 H ATOM 681 HB2 SER A 73 23.481 9.423 32.071 1.00 0.00 H ATOM 682 HB3 SER A 73 22.365 9.987 33.338 1.00 0.00 H ATOM 683 HG SER A 73 23.524 8.642 34.844 1.00 0.00 H ATOM 684 H SER A 73 23.596 11.882 31.866 1.00 0.00 H ATOM 685 N SER A 74 26.468 9.743 34.235 1.00 30.65 N ATOM 686 CA SER A 74 27.746 9.094 34.006 1.00 33.33 C ATOM 687 C SER A 74 27.567 7.608 33.671 1.00 34.82 C ATOM 688 O SER A 74 28.544 6.908 33.388 1.00 35.06 O ATOM 689 CB SER A 74 28.670 9.278 35.210 1.00 33.37 C ATOM 690 OG SER A 74 28.283 8.426 36.272 1.00 35.08 O ATOM 691 HA SER A 74 28.212 9.570 33.143 1.00 0.00 H ATOM 692 HB2 SER A 74 28.619 10.314 35.545 1.00 0.00 H ATOM 693 HB3 SER A 74 29.693 9.042 34.916 1.00 0.00 H ATOM 694 HG SER A 74 27.355 8.640 36.544 1.00 0.00 H ATOM 695 H SER A 74 26.082 9.796 35.199 1.00 0.00 H ATOM 696 N ASP A 75 26.322 7.131 33.698 1.00 36.54 N ATOM 697 CA ASP A 75 26.016 5.742 33.345 1.00 38.30 C ATOM 698 C ASP A 75 26.026 5.532 31.831 1.00 39.08 C ATOM 699 O ASP A 75 25.643 6.421 31.061 1.00 39.70 O ATOM 700 CB ASP A 75 24.674 5.294 33.944 1.00 38.36 C ATOM 701 CG ASP A 75 24.399 3.795 33.751 1.00 39.61 C ATOM 702 OD1 ASP A 75 23.672 3.436 32.795 1.00 40.66 O ATOM 703 OD2 ASP A 75 24.899 2.977 34.557 1.00 40.00 O ATOM 704 HA ASP A 75 26.803 5.122 33.775 1.00 0.00 H ATOM 705 HB2 ASP A 75 24.681 5.511 35.012 1.00 0.00 H ATOM 706 HB3 ASP A 75 23.874 5.858 33.465 1.00 0.00 H ATOM 707 H ASP A 75 25.545 7.763 33.978 1.00 0.00 H ATOM 708 N GLN A 76 26.462 4.337 31.430 1.00 40.06 N ATOM 709 CA GLN A 76 26.617 3.932 30.032 1.00 40.75 C ATOM 710 C GLN A 76 25.324 4.007 29.225 1.00 40.23 C ATOM 711 O GLN A 76 25.330 4.431 28.070 1.00 40.54 O ATOM 712 CB GLN A 76 27.173 2.498 29.986 1.00 40.80 C ATOM 713 CG GLN A 76 27.184 1.825 28.602 1.00 42.38 C ATOM 714 CD GLN A 76 27.750 0.409 28.635 1.00 42.54 C ATOM 715 OE1 GLN A 76 28.402 0.012 29.606 1.00 45.96 O ATOM 716 NE2 GLN A 76 27.506 -0.358 27.571 1.00 44.61 N ATOM 717 HA GLN A 76 27.307 4.638 29.570 1.00 0.00 H ATOM 718 HB2 GLN A 76 28.199 2.526 30.352 1.00 0.00 H ATOM 719 HB3 GLN A 76 26.567 1.883 30.652 1.00 0.00 H ATOM 720 HG2 GLN A 76 26.161 1.782 28.228 1.00 0.00 H ATOM 721 HG3 GLN A 76 27.792 2.427 27.927 1.00 0.00 H ATOM 722 HE22 GLN A 76 26.952 0.018 26.775 1.00 0.00 H ATOM 723 HE21 GLN A 76 27.870 -1.332 27.537 1.00 0.00 H ATOM 724 H GLN A 76 26.710 3.643 32.164 1.00 0.00 H ATOM 725 N ARG A 77 24.221 3.589 29.835 1.00 39.72 N ATOM 726 CA ARG A 77 22.969 3.424 29.099 1.00 39.27 C ATOM 727 C ARG A 77 21.946 4.536 29.349 1.00 37.54 C ATOM 728 O ARG A 77 20.754 4.360 29.075 1.00 37.81 O ATOM 729 CB ARG A 77 22.371 2.041 29.377 1.00 39.65 C ATOM 730 CG ARG A 77 23.342 0.883 29.084 1.00 40.94 C ATOM 731 CD ARG A 77 22.623 -0.465 29.059 1.00 41.35 C ATOM 732 NE ARG A 77 23.482 -1.556 29.533 1.00 45.15 N ATOM 733 CZ ARG A 77 23.954 -2.540 28.772 1.00 47.05 C ATOM 734 NH1 ARG A 77 23.655 -2.595 27.475 1.00 48.21 N ATOM 735 NH2 ARG A 77 24.724 -3.482 29.310 1.00 47.13 N ATOM 736 HA ARG A 77 23.220 3.503 28.041 1.00 0.00 H ATOM 737 HB2 ARG A 77 22.084 1.994 30.427 1.00 0.00 H ATOM 738 HB3 ARG A 77 21.486 1.916 28.754 1.00 0.00 H ATOM 739 HG2 ARG A 77 23.811 1.052 28.115 1.00 0.00 H ATOM 740 HG3 ARG A 77 24.109 0.860 29.858 1.00 0.00 H ATOM 741 HD2 ARG A 77 22.313 -0.680 28.036 1.00 0.00 H ATOM 742 HD3 ARG A 77 21.743 -0.406 29.699 1.00 0.00 H ATOM 743 HE ARG A 77 23.742 -1.560 30.540 1.00 0.00 H ATOM 744 HH12 ARG A 77 24.028 -3.368 26.888 1.00 0.00 H ATOM 745 HH11 ARG A 77 23.048 -1.865 27.050 1.00 0.00 H ATOM 746 HH22 ARG A 77 25.094 -4.252 28.717 1.00 0.00 H ATOM 747 HH21 ARG A 77 24.956 -3.448 30.323 1.00 0.00 H ATOM 748 H ARG A 77 24.248 3.376 30.853 1.00 0.00 H ATOM 749 N HIS A 78 22.421 5.678 29.848 1.00 35.24 N ATOM 750 CA HIS A 78 21.574 6.849 30.084 1.00 33.15 C ATOM 751 C HIS A 78 22.232 8.139 29.617 1.00 31.30 C ATOM 752 O HIS A 78 23.429 8.353 29.814 1.00 30.98 O ATOM 753 CB HIS A 78 21.236 6.983 31.565 1.00 33.22 C ATOM 754 CG HIS A 78 20.328 5.915 32.075 1.00 33.52 C ATOM 755 ND1 HIS A 78 18.956 6.032 32.046 1.00 33.72 N ATOM 756 CD2 HIS A 78 20.594 4.709 32.634 1.00 33.39 C ATOM 757 CE1 HIS A 78 18.414 4.944 32.568 1.00 34.44 C ATOM 758 NE2 HIS A 78 19.386 4.129 32.939 1.00 34.00 N ATOM 759 HA HIS A 78 20.664 6.692 29.504 1.00 0.00 H ATOM 760 HB2 HIS A 78 22.165 6.946 32.134 1.00 0.00 H ATOM 761 HB3 HIS A 78 20.754 7.948 31.722 1.00 0.00 H ATOM 762 HD2 HIS A 78 21.581 4.280 32.809 1.00 0.00 H ATOM 763 HE1 HIS A 78 17.346 4.752 32.674 1.00 0.00 H ATOM 764 H HIS A 78 23.433 5.739 30.079 1.00 0.00 H ATOM 765 N PHE A 79 21.430 9.006 29.016 1.00 29.19 N ATOM 766 CA PHE A 79 21.885 10.341 28.665 1.00 27.29 C ATOM 767 C PHE A 79 21.853 11.270 29.888 1.00 25.32 C ATOM 768 O PHE A 79 22.847 11.936 30.182 1.00 24.54 O ATOM 769 CB PHE A 79 21.044 10.907 27.513 1.00 27.89 C ATOM 770 CG PHE A 79 21.465 10.414 26.148 1.00 29.98 C ATOM 771 CD1 PHE A 79 22.223 9.247 26.002 1.00 31.44 C ATOM 772 CD2 PHE A 79 21.088 11.103 25.004 1.00 32.51 C ATOM 773 CE1 PHE A 79 22.621 8.791 24.727 1.00 32.52 C ATOM 774 CE2 PHE A 79 21.483 10.650 23.720 1.00 31.55 C ATOM 775 CZ PHE A 79 22.243 9.500 23.591 1.00 31.05 C ATOM 776 HA PHE A 79 22.920 10.276 28.328 1.00 0.00 H ATOM 777 HB2 PHE A 79 20.004 10.623 27.675 1.00 0.00 H ATOM 778 HB3 PHE A 79 21.129 11.994 27.527 1.00 0.00 H ATOM 779 HD2 PHE A 79 20.481 12.004 25.094 1.00 0.00 H ATOM 780 HE2 PHE A 79 21.188 11.209 22.832 1.00 0.00 H ATOM 781 HZ PHE A 79 22.544 9.151 22.603 1.00 0.00 H ATOM 782 HE1 PHE A 79 23.222 7.887 24.633 1.00 0.00 H ATOM 783 HD1 PHE A 79 22.511 8.681 26.888 1.00 0.00 H ATOM 784 H PHE A 79 20.454 8.725 28.791 1.00 0.00 H ATOM 785 N PHE A 80 20.723 11.275 30.605 1.00 22.99 N ATOM 786 CA PHE A 80 20.421 12.311 31.603 1.00 20.56 C ATOM 787 C PHE A 80 19.987 11.777 32.965 1.00 18.89 C ATOM 788 O PHE A 80 19.381 10.708 33.057 1.00 17.27 O ATOM 789 CB PHE A 80 19.317 13.239 31.088 1.00 21.01 C ATOM 790 CG PHE A 80 19.626 13.886 29.760 1.00 21.94 C ATOM 791 CD1 PHE A 80 18.826 13.632 28.652 1.00 23.35 C ATOM 792 CD2 PHE A 80 20.722 14.743 29.621 1.00 22.42 C ATOM 793 CE1 PHE A 80 19.113 14.223 27.416 1.00 23.77 C ATOM 794 CE2 PHE A 80 21.020 15.331 28.404 1.00 22.96 C ATOM 795 CZ PHE A 80 20.210 15.074 27.295 1.00 24.08 C ATOM 796 HA PHE A 80 21.363 12.840 31.748 1.00 0.00 H ATOM 797 HB2 PHE A 80 18.402 12.656 30.981 1.00 0.00 H ATOM 798 HB3 PHE A 80 19.160 14.027 31.825 1.00 0.00 H ATOM 799 HD2 PHE A 80 21.352 14.952 30.486 1.00 0.00 H ATOM 800 HE2 PHE A 80 21.882 15.991 28.311 1.00 0.00 H ATOM 801 HZ PHE A 80 20.436 15.539 26.335 1.00 0.00 H ATOM 802 HE1 PHE A 80 18.481 14.018 26.552 1.00 0.00 H ATOM 803 HD1 PHE A 80 17.968 12.967 28.746 1.00 0.00 H ATOM 804 H PHE A 80 20.030 10.515 30.450 1.00 0.00 H ATOM 805 N THR A 81 20.257 12.569 34.006 1.00 16.75 N ATOM 806 CA THR A 81 19.855 12.241 35.358 1.00 15.51 C ATOM 807 C THR A 81 19.237 13.462 36.029 1.00 14.87 C ATOM 808 O THR A 81 19.727 14.579 35.860 1.00 14.52 O ATOM 809 CB THR A 81 21.063 11.703 36.155 1.00 15.49 C ATOM 810 OG1 THR A 81 21.342 10.388 35.688 1.00 17.09 O ATOM 811 CG2 THR A 81 20.790 11.629 37.642 1.00 15.74 C ATOM 812 HA THR A 81 19.099 11.456 35.332 1.00 0.00 H ATOM 813 HB THR A 81 21.900 12.385 36.004 1.00 0.00 H ATOM 814 HG1 THR A 81 22.115 10.020 36.185 1.00 0.00 H ATOM 815 HG23 THR A 81 20.574 12.628 38.021 1.00 0.00 H ATOM 816 HG21 THR A 81 19.934 10.978 37.821 1.00 0.00 H ATOM 817 HG22 THR A 81 21.666 11.228 38.151 1.00 0.00 H ATOM 818 H THR A 81 20.776 13.455 33.839 1.00 0.00 H ATOM 819 N LEU A 82 18.155 13.241 36.772 1.00 13.87 N ATOM 820 CA LEU A 82 17.544 14.290 37.596 1.00 14.00 C ATOM 821 C LEU A 82 18.141 14.235 39.008 1.00 13.95 C ATOM 822 O LEU A 82 18.134 13.177 39.642 1.00 13.28 O ATOM 823 CB LEU A 82 16.017 14.094 37.650 1.00 13.84 C ATOM 824 CG LEU A 82 15.214 14.926 38.676 1.00 15.72 C ATOM 825 CD1 LEU A 82 15.095 16.342 38.179 1.00 16.51 C ATOM 826 CD2 LEU A 82 13.822 14.314 38.919 1.00 15.66 C ATOM 827 HA LEU A 82 17.750 15.267 37.158 1.00 0.00 H ATOM 828 HB2 LEU A 82 15.624 14.332 36.661 1.00 0.00 H ATOM 829 HB3 LEU A 82 15.833 13.042 37.870 1.00 0.00 H ATOM 830 HG LEU A 82 15.743 14.920 39.629 1.00 0.00 H ATOM 831 HD21 LEU A 82 13.269 14.289 37.980 1.00 0.00 H ATOM 832 HD22 LEU A 82 13.934 13.300 39.303 1.00 0.00 H ATOM 833 HD23 LEU A 82 13.281 14.921 39.645 1.00 0.00 H ATOM 834 HD11 LEU A 82 16.091 16.769 38.060 1.00 0.00 H ATOM 835 HD12 LEU A 82 14.579 16.347 37.219 1.00 0.00 H ATOM 836 HD13 LEU A 82 14.529 16.932 38.900 1.00 0.00 H ATOM 837 H LEU A 82 17.728 12.293 36.768 1.00 0.00 H ATOM 838 N SER A 83 18.640 15.371 39.504 1.00 13.84 N ATOM 839 CA SER A 83 19.140 15.466 40.890 1.00 14.14 C ATOM 840 C SER A 83 18.201 16.388 41.672 1.00 14.74 C ATOM 841 O SER A 83 17.941 17.517 41.243 1.00 13.68 O ATOM 842 CB SER A 83 20.582 16.016 40.944 1.00 13.72 C ATOM 843 OG SER A 83 21.541 15.112 40.393 1.00 14.30 O ATOM 844 HA SER A 83 19.160 14.468 41.328 1.00 0.00 H ATOM 845 HB2 SER A 83 20.843 16.209 41.985 1.00 0.00 H ATOM 846 HB3 SER A 83 20.620 16.949 40.382 1.00 0.00 H ATOM 847 HG SER A 83 21.522 14.262 40.901 1.00 0.00 H ATOM 848 H SER A 83 18.677 16.214 38.895 1.00 0.00 H ATOM 849 N VAL A 84 17.695 15.894 42.800 1.00 15.58 N ATOM 850 CA VAL A 84 16.709 16.603 43.613 1.00 17.05 C ATOM 851 C VAL A 84 17.068 16.628 45.113 1.00 18.53 C ATOM 852 O VAL A 84 17.374 15.594 45.710 1.00 18.55 O ATOM 853 CB VAL A 84 15.257 16.049 43.379 1.00 17.06 C ATOM 854 CG1 VAL A 84 15.179 14.543 43.608 1.00 18.31 C ATOM 855 CG2 VAL A 84 14.238 16.800 44.221 1.00 16.81 C ATOM 856 HA VAL A 84 16.730 17.639 43.276 1.00 0.00 H ATOM 857 HB VAL A 84 15.008 16.222 42.332 1.00 0.00 H ATOM 858 HG11 VAL A 84 15.854 14.036 42.918 1.00 0.00 H ATOM 859 HG12 VAL A 84 15.470 14.317 44.634 1.00 0.00 H ATOM 860 HG13 VAL A 84 14.158 14.203 43.435 1.00 0.00 H ATOM 861 HG21 VAL A 84 14.487 16.688 45.276 1.00 0.00 H ATOM 862 HG22 VAL A 84 14.255 17.856 43.953 1.00 0.00 H ATOM 863 HG23 VAL A 84 13.244 16.392 44.036 1.00 0.00 H ATOM 864 H VAL A 84 18.017 14.958 43.118 1.00 0.00 H ATOM 865 N LYS A 85 17.039 17.818 45.700 1.00 20.70 N ATOM 866 CA LYS A 85 17.190 17.971 47.147 1.00 23.30 C ATOM 867 C LYS A 85 15.890 17.502 47.798 1.00 25.19 C ATOM 868 O LYS A 85 14.857 18.140 47.660 1.00 25.12 O ATOM 869 CB LYS A 85 17.485 19.436 47.493 1.00 23.17 C ATOM 870 CG LYS A 85 17.813 19.723 48.978 1.00 23.05 C ATOM 871 CD LYS A 85 19.209 19.227 49.381 1.00 25.31 C ATOM 872 CE LYS A 85 19.583 19.695 50.815 1.00 25.55 C ATOM 873 NZ LYS A 85 19.770 21.198 50.949 1.00 25.26 N ATOM 874 HA LYS A 85 18.025 17.376 47.517 1.00 0.00 H ATOM 875 HB2 LYS A 85 18.337 19.757 46.894 1.00 0.00 H ATOM 876 HB3 LYS A 85 16.610 20.027 47.223 1.00 0.00 H ATOM 877 HG2 LYS A 85 17.763 20.799 49.145 1.00 0.00 H ATOM 878 HG3 LYS A 85 17.071 19.225 49.602 1.00 0.00 H ATOM 879 HD2 LYS A 85 19.222 18.138 49.348 1.00 0.00 H ATOM 880 HD3 LYS A 85 19.942 19.619 48.677 1.00 0.00 H ATOM 881 HE2 LYS A 85 20.514 19.207 51.103 1.00 0.00 H ATOM 882 HE3 LYS A 85 18.788 19.387 51.494 1.00 0.00 H ATOM 883 HZ1 LYS A 85 20.534 21.509 50.316 1.00 0.00 H ATOM 884 HZ2 LYS A 85 18.886 21.681 50.690 1.00 0.00 H ATOM 885 HZ3 LYS A 85 20.017 21.429 51.932 1.00 0.00 H ATOM 886 H LYS A 85 16.905 18.667 45.114 1.00 0.00 H ATOM 887 N THR A 86 15.914 16.354 48.459 1.00 28.79 N ATOM 888 CA THR A 86 14.704 15.908 49.163 1.00 32.11 C ATOM 889 C THR A 86 14.781 16.203 50.664 1.00 33.92 C ATOM 890 O THR A 86 15.826 16.645 51.174 1.00 34.44 O ATOM 891 CB THR A 86 14.388 14.406 48.943 1.00 31.82 C ATOM 892 OG1 THR A 86 15.363 13.603 49.614 1.00 33.01 O ATOM 893 CG2 THR A 86 14.360 14.047 47.459 1.00 31.90 C ATOM 894 HA THR A 86 13.888 16.483 48.726 1.00 0.00 H ATOM 895 HB THR A 86 13.398 14.209 49.355 1.00 0.00 H ATOM 896 HG1 THR A 86 16.262 13.806 49.252 1.00 0.00 H ATOM 897 HG23 THR A 86 13.616 14.661 46.952 1.00 0.00 H ATOM 898 HG21 THR A 86 15.342 14.230 47.024 1.00 0.00 H ATOM 899 HG22 THR A 86 14.102 12.994 47.346 1.00 0.00 H ATOM 900 H THR A 86 16.778 15.776 48.479 1.00 0.00 H ATOM 901 N GLN A 87 13.656 15.971 51.353 1.00 36.13 N ATOM 902 CA GLN A 87 13.585 15.998 52.814 1.00 37.61 C ATOM 903 C GLN A 87 14.665 15.116 53.447 1.00 37.72 C ATOM 904 O GLN A 87 15.113 15.376 54.571 1.00 38.34 O ATOM 905 CB GLN A 87 12.194 15.535 53.291 1.00 37.84 C ATOM 906 CG GLN A 87 11.808 14.100 52.856 1.00 38.78 C ATOM 907 CD GLN A 87 10.688 13.502 53.688 1.00 39.31 C ATOM 908 OE1 GLN A 87 9.606 14.091 53.818 1.00 42.33 O ATOM 909 NE2 GLN A 87 10.936 12.321 54.252 1.00 40.79 N ATOM 910 HA GLN A 87 13.756 17.027 53.131 1.00 0.00 H ATOM 911 HB2 GLN A 87 12.176 15.577 54.380 1.00 0.00 H ATOM 912 HB3 GLN A 87 11.450 16.224 52.890 1.00 0.00 H ATOM 913 HG2 GLN A 87 11.489 14.128 51.814 1.00 0.00 H ATOM 914 HG3 GLN A 87 12.687 13.462 52.948 1.00 0.00 H ATOM 915 HE22 GLN A 87 11.860 11.863 54.115 1.00 0.00 H ATOM 916 HE21 GLN A 87 10.206 11.857 54.829 1.00 0.00 H ATOM 917 H GLN A 87 12.787 15.761 50.821 1.00 0.00 H ATOM 918 N SER A 88 15.070 14.075 52.719 1.00 37.71 N ATOM 919 CA SER A 88 16.053 13.117 53.203 1.00 37.05 C ATOM 920 C SER A 88 17.396 13.195 52.456 1.00 36.54 C ATOM 921 O SER A 88 18.155 12.216 52.409 1.00 36.71 O ATOM 922 CB SER A 88 15.468 11.708 53.152 1.00 37.41 C ATOM 923 OG SER A 88 14.228 11.668 53.846 1.00 38.06 O ATOM 924 HA SER A 88 16.279 13.377 54.237 1.00 0.00 H ATOM 925 HB2 SER A 88 16.165 11.011 53.618 1.00 0.00 H ATOM 926 HB3 SER A 88 15.309 11.421 52.113 1.00 0.00 H ATOM 927 HG SER A 88 13.858 10.750 53.806 1.00 0.00 H ATOM 928 H SER A 88 14.668 13.942 51.769 1.00 0.00 H ATOM 929 N GLY A 89 17.692 14.369 51.896 1.00 35.01 N ATOM 930 CA GLY A 89 18.976 14.627 51.235 1.00 33.18 C ATOM 931 C GLY A 89 18.847 14.592 49.719 1.00 31.40 C ATOM 932 O GLY A 89 17.763 14.342 49.197 1.00 32.10 O ATOM 933 HA3 GLY A 89 19.693 13.867 51.546 1.00 0.00 H ATOM 934 HA2 GLY A 89 19.337 15.610 51.536 1.00 0.00 H ATOM 935 H GLY A 89 16.985 15.131 51.929 1.00 0.00 H ATOM 936 N THR A 90 19.949 14.812 49.012 1.00 29.44 N ATOM 937 CA THR A 90 19.939 14.786 47.537 1.00 27.90 C ATOM 938 C THR A 90 19.800 13.386 46.934 1.00 25.89 C ATOM 939 O THR A 90 20.593 12.476 47.220 1.00 25.68 O ATOM 940 CB THR A 90 21.152 15.523 46.931 1.00 27.90 C ATOM 941 OG1 THR A 90 21.116 16.891 47.350 1.00 29.90 O ATOM 942 CG2 THR A 90 21.101 15.497 45.398 1.00 28.72 C ATOM 943 HA THR A 90 19.034 15.327 47.262 1.00 0.00 H ATOM 944 HB THR A 90 22.061 15.026 47.269 1.00 0.00 H ATOM 945 HG1 THR A 90 21.891 17.373 46.966 1.00 0.00 H ATOM 946 HG23 THR A 90 21.127 14.464 45.052 1.00 0.00 H ATOM 947 HG21 THR A 90 20.181 15.972 45.058 1.00 0.00 H ATOM 948 HG22 THR A 90 21.959 16.037 44.998 1.00 0.00 H ATOM 949 H THR A 90 20.841 15.007 49.510 1.00 0.00 H ATOM 950 N LYS A 91 18.783 13.229 46.096 1.00 23.65 N ATOM 951 CA LYS A 91 18.539 11.963 45.415 1.00 22.08 C ATOM 952 C LYS A 91 18.757 12.136 43.929 1.00 20.65 C ATOM 953 O LYS A 91 18.672 13.249 43.407 1.00 19.78 O ATOM 954 CB LYS A 91 17.121 11.445 45.680 1.00 22.19 C ATOM 955 CG LYS A 91 16.733 11.405 47.157 1.00 23.61 C ATOM 956 CD LYS A 91 17.594 10.460 47.922 1.00 25.37 C ATOM 957 CE LYS A 91 17.423 10.701 49.419 1.00 28.87 C ATOM 958 NZ LYS A 91 18.215 9.705 50.184 1.00 29.84 N ATOM 959 HA LYS A 91 19.240 11.226 45.807 1.00 0.00 H ATOM 960 HB2 LYS A 91 16.417 12.094 45.159 1.00 0.00 H ATOM 961 HB3 LYS A 91 17.046 10.434 45.279 1.00 0.00 H ATOM 962 HG2 LYS A 91 16.841 12.404 47.579 1.00 0.00 H ATOM 963 HG3 LYS A 91 15.694 11.086 47.242 1.00 0.00 H ATOM 964 HD2 LYS A 91 17.307 9.436 47.685 1.00 0.00 H ATOM 965 HD3 LYS A 91 18.637 10.617 47.647 1.00 0.00 H ATOM 966 HE2 LYS A 91 16.370 10.606 49.683 1.00 0.00 H ATOM 967 HE3 LYS A 91 17.769 11.705 49.666 1.00 0.00 H ATOM 968 HZ1 LYS A 91 17.884 8.747 49.950 1.00 0.00 H ATOM 969 HZ2 LYS A 91 19.220 9.797 49.933 1.00 0.00 H ATOM 970 HZ3 LYS A 91 18.093 9.876 51.203 1.00 0.00 H ATOM 971 H LYS A 91 18.143 14.030 45.920 1.00 0.00 H ATOM 972 N ASN A 92 19.059 11.026 43.264 1.00 19.51 N ATOM 973 CA ASN A 92 19.313 11.027 41.836 1.00 18.72 C ATOM 974 C ASN A 92 18.437 10.005 41.164 1.00 18.55 C ATOM 975 O ASN A 92 18.397 8.846 41.581 1.00 17.98 O ATOM 976 CB ASN A 92 20.779 10.741 41.548 1.00 19.14 C ATOM 977 CG ASN A 92 21.689 11.845 42.056 1.00 19.81 C ATOM 978 OD1 ASN A 92 21.963 12.815 41.346 1.00 19.56 O ATOM 979 ND2 ASN A 92 22.171 11.693 43.281 1.00 19.69 N ATOM 980 HA ASN A 92 19.078 12.015 41.439 1.00 0.00 H ATOM 981 HB2 ASN A 92 21.057 9.806 42.034 1.00 0.00 H ATOM 982 HB3 ASN A 92 20.913 10.643 40.471 1.00 0.00 H ATOM 983 HD22 ASN A 92 21.911 10.857 43.842 1.00 0.00 H ATOM 984 HD21 ASN A 92 22.809 12.410 43.681 1.00 0.00 H ATOM 985 H ASN A 92 19.115 10.127 43.784 1.00 0.00 H ATOM 986 N LEU A 93 17.755 10.452 40.114 1.00 17.41 N ATOM 987 CA LEU A 93 16.765 9.661 39.413 1.00 18.66 C ATOM 988 C LEU A 93 17.123 9.675 37.942 1.00 17.84 C ATOM 989 O LEU A 93 17.045 10.716 37.292 1.00 16.77 O ATOM 990 CB LEU A 93 15.362 10.264 39.631 1.00 18.85 C ATOM 991 CG LEU A 93 14.882 10.225 41.092 1.00 21.05 C ATOM 992 CD1 LEU A 93 14.275 11.521 41.502 1.00 22.86 C ATOM 993 CD2 LEU A 93 13.898 9.115 41.277 1.00 23.77 C ATOM 994 HA LEU A 93 16.754 8.637 39.787 1.00 0.00 H ATOM 995 HB2 LEU A 93 15.381 11.304 39.304 1.00 0.00 H ATOM 996 HB3 LEU A 93 14.651 9.706 39.022 1.00 0.00 H ATOM 997 HG LEU A 93 15.751 10.048 41.726 1.00 0.00 H ATOM 998 HD21 LEU A 93 13.042 9.277 40.622 1.00 0.00 H ATOM 999 HD22 LEU A 93 14.372 8.165 41.029 1.00 0.00 H ATOM 1000 HD23 LEU A 93 13.564 9.096 42.315 1.00 0.00 H ATOM 1001 HD11 LEU A 93 15.015 12.315 41.403 1.00 0.00 H ATOM 1002 HD12 LEU A 93 13.419 11.738 40.863 1.00 0.00 H ATOM 1003 HD13 LEU A 93 13.948 11.455 42.540 1.00 0.00 H ATOM 1004 H LEU A 93 17.942 11.419 39.779 1.00 0.00 H ATOM 1005 N ARG A 94 17.589 8.540 37.436 1.00 17.99 N ATOM 1006 CA ARG A 94 17.913 8.449 36.010 1.00 18.48 C ATOM 1007 C ARG A 94 16.688 8.715 35.135 1.00 18.52 C ATOM 1008 O ARG A 94 15.569 8.313 35.457 1.00 18.59 O ATOM 1009 CB ARG A 94 18.599 7.118 35.663 1.00 18.70 C ATOM 1010 CG ARG A 94 19.962 6.981 36.355 1.00 21.95 C ATOM 1011 CD ARG A 94 20.947 6.110 35.597 1.00 25.30 C ATOM 1012 NE ARG A 94 22.270 6.151 36.225 1.00 28.31 N ATOM 1013 CZ ARG A 94 22.850 5.121 36.847 1.00 32.14 C ATOM 1014 NH1 ARG A 94 22.240 3.942 36.914 1.00 32.35 N ATOM 1015 NH2 ARG A 94 24.053 5.265 37.395 1.00 32.32 N ATOM 1016 HA ARG A 94 18.634 9.237 35.791 1.00 0.00 H ATOM 1017 HB2 ARG A 94 17.957 6.297 35.982 1.00 0.00 H ATOM 1018 HB3 ARG A 94 18.744 7.067 34.584 1.00 0.00 H ATOM 1019 HG2 ARG A 94 20.395 7.976 36.464 1.00 0.00 H ATOM 1020 HG3 ARG A 94 19.805 6.545 37.342 1.00 0.00 H ATOM 1021 HD2 ARG A 94 21.027 6.470 34.571 1.00 0.00 H ATOM 1022 HD3 ARG A 94 20.585 5.082 35.593 1.00 0.00 H ATOM 1023 HE ARG A 94 22.796 7.047 36.183 1.00 0.00 H ATOM 1024 HH12 ARG A 94 22.699 3.146 37.400 1.00 0.00 H ATOM 1025 HH11 ARG A 94 21.303 3.816 36.480 1.00 0.00 H ATOM 1026 HH22 ARG A 94 24.503 4.462 37.879 1.00 0.00 H ATOM 1027 HH21 ARG A 94 24.543 6.180 37.340 1.00 0.00 H ATOM 1028 H ARG A 94 17.724 7.714 38.053 1.00 0.00 H ATOM 1029 N ILE A 95 16.913 9.430 34.044 1.00 18.81 N ATOM 1030 CA ILE A 95 15.864 9.730 33.085 1.00 19.43 C ATOM 1031 C ILE A 95 15.945 8.722 31.935 1.00 20.63 C ATOM 1032 O ILE A 95 17.030 8.450 31.414 1.00 20.48 O ATOM 1033 CB ILE A 95 15.976 11.195 32.558 1.00 19.49 C ATOM 1034 CG1 ILE A 95 15.834 12.179 33.725 1.00 18.88 C ATOM 1035 CG2 ILE A 95 14.924 11.474 31.451 1.00 18.73 C ATOM 1036 CD1 ILE A 95 16.177 13.627 33.398 1.00 19.64 C ATOM 1037 HA ILE A 95 14.894 9.645 33.576 1.00 0.00 H ATOM 1038 HB ILE A 95 16.959 11.332 32.108 1.00 0.00 H ATOM 1039 HG12 ILE A 95 14.801 12.147 34.070 1.00 0.00 H ATOM 1040 HG13 ILE A 95 16.494 11.849 34.527 1.00 0.00 H ATOM 1041 HD11 ILE A 95 17.213 13.687 33.065 1.00 0.00 H ATOM 1042 HD12 ILE A 95 15.518 13.985 32.607 1.00 0.00 H ATOM 1043 HD13 ILE A 95 16.044 14.241 34.289 1.00 0.00 H ATOM 1044 HG21 ILE A 95 15.085 10.790 30.618 1.00 0.00 H ATOM 1045 HG22 ILE A 95 13.923 11.325 31.857 1.00 0.00 H ATOM 1046 HG23 ILE A 95 15.027 12.502 31.104 1.00 0.00 H ATOM 1047 H ILE A 95 17.873 9.789 33.867 1.00 0.00 H ATOM 1048 N GLN A 96 14.802 8.153 31.571 1.00 21.24 N ATOM 1049 CA GLN A 96 14.744 7.219 30.463 1.00 22.95 C ATOM 1050 C GLN A 96 14.159 7.934 29.253 1.00 24.01 C ATOM 1051 O GLN A 96 13.248 8.737 29.394 1.00 23.30 O ATOM 1052 CB GLN A 96 13.932 5.978 30.840 1.00 22.55 C ATOM 1053 CG GLN A 96 14.575 5.176 31.965 1.00 24.18 C ATOM 1054 CD GLN A 96 13.858 3.872 32.211 1.00 27.39 C ATOM 1055 OE1 GLN A 96 12.824 3.834 32.883 1.00 27.99 O ATOM 1056 NE2 GLN A 96 14.387 2.793 31.650 1.00 28.67 N ATOM 1057 HA GLN A 96 15.747 6.872 30.216 1.00 0.00 H ATOM 1058 HB2 GLN A 96 12.939 6.294 31.160 1.00 0.00 H ATOM 1059 HB3 GLN A 96 13.843 5.339 29.962 1.00 0.00 H ATOM 1060 HG2 GLN A 96 15.610 4.964 31.699 1.00 0.00 H ATOM 1061 HG3 GLN A 96 14.550 5.769 32.879 1.00 0.00 H ATOM 1062 HE22 GLN A 96 15.261 2.873 31.092 1.00 0.00 H ATOM 1063 HE21 GLN A 96 13.928 1.867 31.769 1.00 0.00 H ATOM 1064 H GLN A 96 13.931 8.382 32.091 1.00 0.00 H TER 1065 GLN A 96 ATOM 1066 N GLU A 98 13.308 6.328 26.057 1.00 29.35 N ATOM 1067 CA GLU A 98 12.685 5.435 25.058 1.00 29.87 C ATOM 1068 C GLU A 98 11.710 6.143 24.121 1.00 29.95 C ATOM 1069 O GLU A 98 10.813 6.868 24.566 1.00 29.52 O ATOM 1070 CB GLU A 98 11.990 4.249 25.731 1.00 29.75 C ATOM 1071 CG GLU A 98 12.934 3.114 26.108 1.00 31.74 C ATOM 1072 CD GLU A 98 13.558 3.280 27.483 1.00 33.89 C ATOM 1073 OE1 GLU A 98 13.497 4.391 28.061 1.00 34.05 O ATOM 1074 OE2 GLU A 98 14.110 2.285 27.995 1.00 36.42 O ATOM 1075 HA GLU A 98 13.509 5.075 24.442 1.00 0.00 H ATOM 1076 HB2 GLU A 98 11.502 4.606 26.638 1.00 0.00 H ATOM 1077 HB3 GLU A 98 11.238 3.857 25.046 1.00 0.00 H ATOM 1078 HG2 GLU A 98 12.374 2.179 26.093 1.00 0.00 H ATOM 1079 HG3 GLU A 98 13.734 3.069 25.369 1.00 0.00 H ATOM 1080 HN3 GLU A 98 12.567 6.756 26.648 1.00 0.00 H ATOM 1081 HN2 GLU A 98 13.838 7.077 25.568 1.00 0.00 H ATOM 1082 HN1 GLU A 98 13.956 5.778 26.656 1.00 0.00 H ATOM 1083 N GLY A 99 11.915 5.938 22.819 1.00 30.27 N ATOM 1084 CA GLY A 99 11.048 6.505 21.790 1.00 29.99 C ATOM 1085 C GLY A 99 11.081 8.019 21.676 1.00 29.79 C ATOM 1086 O GLY A 99 10.208 8.613 21.043 1.00 30.42 O ATOM 1087 HA3 GLY A 99 10.023 6.206 22.010 1.00 0.00 H ATOM 1088 HA2 GLY A 99 11.348 6.088 20.829 1.00 0.00 H ATOM 1089 H GLY A 99 12.723 5.352 22.526 1.00 0.00 H ATOM 1090 N GLY A 100 12.078 8.654 22.286 1.00 29.22 N ATOM 1091 CA GLY A 100 12.175 10.125 22.264 1.00 28.55 C ATOM 1092 C GLY A 100 11.257 10.855 23.239 1.00 27.53 C ATOM 1093 O GLY A 100 11.082 12.078 23.145 1.00 27.99 O ATOM 1094 HA3 GLY A 100 11.933 10.463 21.256 1.00 0.00 H ATOM 1095 HA2 GLY A 100 13.203 10.398 22.501 1.00 0.00 H ATOM 1096 H GLY A 100 12.803 8.102 22.788 1.00 0.00 H ATOM 1097 N SER A 101 10.648 10.101 24.150 1.00 26.32 N ATOM 1098 CA SER A 101 9.840 10.657 25.235 1.00 25.24 C ATOM 1099 C SER A 101 10.493 10.369 26.588 1.00 24.30 C ATOM 1100 O SER A 101 11.172 9.350 26.744 1.00 23.98 O ATOM 1101 CB SER A 101 8.437 10.076 25.208 1.00 24.84 C ATOM 1102 OG SER A 101 7.703 10.650 24.148 1.00 27.14 O ATOM 1103 HA SER A 101 9.777 11.736 25.093 1.00 0.00 H ATOM 1104 HB2 SER A 101 7.938 10.291 26.153 1.00 0.00 H ATOM 1105 HB3 SER A 101 8.494 8.997 25.066 1.00 0.00 H ATOM 1106 HG SER A 101 6.790 10.268 24.135 1.00 0.00 H ATOM 1107 H SER A 101 10.751 9.068 24.088 1.00 0.00 H ATOM 1108 N PHE A 102 10.266 11.254 27.558 1.00 22.35 N ATOM 1109 CA PHE A 102 11.003 11.209 28.825 1.00 21.37 C ATOM 1110 C PHE A 102 10.215 10.527 29.918 1.00 19.42 C ATOM 1111 O PHE A 102 9.018 10.675 29.985 1.00 18.86 O ATOM 1112 CB PHE A 102 11.331 12.619 29.328 1.00 22.06 C ATOM 1113 CG PHE A 102 12.142 13.446 28.382 1.00 22.86 C ATOM 1114 CD1 PHE A 102 11.520 14.313 27.493 1.00 24.27 C ATOM 1115 CD2 PHE A 102 13.531 13.408 28.419 1.00 25.28 C ATOM 1116 CE1 PHE A 102 12.271 15.100 26.629 1.00 23.25 C ATOM 1117 CE2 PHE A 102 14.294 14.212 27.552 1.00 25.47 C ATOM 1118 CZ PHE A 102 13.657 15.051 26.664 1.00 23.92 C ATOM 1119 HA PHE A 102 11.913 10.648 28.614 1.00 0.00 H ATOM 1120 HB2 PHE A 102 10.392 13.140 29.516 1.00 0.00 H ATOM 1121 HB3 PHE A 102 11.887 12.526 30.261 1.00 0.00 H ATOM 1122 HD2 PHE A 102 14.034 12.749 29.127 1.00 0.00 H ATOM 1123 HE2 PHE A 102 15.383 14.171 27.583 1.00 0.00 H ATOM 1124 HZ PHE A 102 14.242 15.676 25.989 1.00 0.00 H ATOM 1125 HE1 PHE A 102 11.769 15.759 25.920 1.00 0.00 H ATOM 1126 HD1 PHE A 102 10.432 14.377 27.473 1.00 0.00 H ATOM 1127 H PHE A 102 9.550 11.994 27.413 1.00 0.00 H ATOM 1128 N SER A 103 10.905 9.791 30.787 1.00 18.00 N ATOM 1129 CA SER A 103 10.306 9.343 32.046 1.00 16.62 C ATOM 1130 C SER A 103 11.392 9.142 33.093 1.00 15.78 C ATOM 1131 O SER A 103 12.566 8.964 32.753 1.00 15.91 O ATOM 1132 CB SER A 103 9.479 8.049 31.861 1.00 16.35 C ATOM 1133 OG SER A 103 10.275 7.014 31.295 1.00 17.25 O ATOM 1134 HA SER A 103 9.619 10.118 32.386 1.00 0.00 H ATOM 1135 HB2 SER A 103 8.637 8.255 31.200 1.00 0.00 H ATOM 1136 HB3 SER A 103 9.105 7.722 32.831 1.00 0.00 H ATOM 1137 HG SER A 103 11.039 6.821 31.895 1.00 0.00 H ATOM 1138 H SER A 103 11.887 9.529 30.568 1.00 0.00 H ATOM 1139 N LEU A 104 10.994 9.177 34.362 1.00 15.05 N ATOM 1140 CA LEU A 104 11.893 8.873 35.473 1.00 14.46 C ATOM 1141 C LEU A 104 11.893 7.367 35.760 1.00 14.80 C ATOM 1142 O LEU A 104 10.837 6.734 35.759 1.00 15.16 O ATOM 1143 CB LEU A 104 11.453 9.637 36.728 1.00 13.78 C ATOM 1144 CG LEU A 104 11.391 11.160 36.659 1.00 12.67 C ATOM 1145 CD1 LEU A 104 11.029 11.711 38.028 1.00 10.02 C ATOM 1146 CD2 LEU A 104 12.746 11.751 36.178 1.00 8.71 C ATOM 1147 HA LEU A 104 12.902 9.182 35.199 1.00 0.00 H ATOM 1148 HB2 LEU A 104 10.455 9.284 36.989 1.00 0.00 H ATOM 1149 HB3 LEU A 104 12.149 9.377 37.526 1.00 0.00 H ATOM 1150 HG LEU A 104 10.627 11.449 35.937 1.00 0.00 H ATOM 1151 HD21 LEU A 104 13.534 11.464 36.874 1.00 0.00 H ATOM 1152 HD22 LEU A 104 12.978 11.364 35.186 1.00 0.00 H ATOM 1153 HD23 LEU A 104 12.673 12.838 36.138 1.00 0.00 H ATOM 1154 HD11 LEU A 104 10.058 11.319 38.331 1.00 0.00 H ATOM 1155 HD12 LEU A 104 11.786 11.409 38.752 1.00 0.00 H ATOM 1156 HD13 LEU A 104 10.984 12.799 37.980 1.00 0.00 H ATOM 1157 H LEU A 104 10.007 9.430 34.571 1.00 0.00 H ATOM 1158 N GLN A 105 13.070 6.803 36.005 1.00 15.48 N ATOM 1159 CA GLN A 105 13.194 5.369 36.281 1.00 16.29 C ATOM 1160 C GLN A 105 12.209 4.975 37.365 1.00 16.31 C ATOM 1161 O GLN A 105 12.135 5.630 38.416 1.00 16.49 O ATOM 1162 CB GLN A 105 14.624 5.005 36.697 1.00 16.27 C ATOM 1163 CG GLN A 105 14.872 3.488 36.707 1.00 17.70 C ATOM 1164 CD GLN A 105 16.268 3.110 37.183 1.00 19.14 C ATOM 1165 OE1 GLN A 105 17.143 3.966 37.365 1.00 19.88 O ATOM 1166 NE2 GLN A 105 16.484 1.802 37.390 1.00 22.77 N ATOM 1167 HA GLN A 105 12.967 4.818 35.368 1.00 0.00 H ATOM 1168 HB2 GLN A 105 15.319 5.468 35.997 1.00 0.00 H ATOM 1169 HB3 GLN A 105 14.806 5.395 37.699 1.00 0.00 H ATOM 1170 HG2 GLN A 105 14.142 3.022 37.369 1.00 0.00 H ATOM 1171 HG3 GLN A 105 14.737 3.108 35.694 1.00 0.00 H ATOM 1172 HE22 GLN A 105 15.720 1.116 37.224 1.00 0.00 H ATOM 1173 HE21 GLN A 105 17.416 1.474 37.716 1.00 0.00 H ATOM 1174 H GLN A 105 13.926 7.394 36.001 1.00 0.00 H ATOM 1175 N SER A 106 11.450 3.916 37.095 1.00 16.14 N ATOM 1176 CA SER A 106 10.300 3.554 37.918 1.00 16.81 C ATOM 1177 C SER A 106 10.513 2.230 38.652 1.00 16.66 C ATOM 1178 O SER A 106 11.045 1.286 38.085 1.00 15.58 O ATOM 1179 CB SER A 106 9.062 3.474 37.025 1.00 16.32 C ATOM 1180 OG SER A 106 7.891 3.209 37.775 1.00 18.52 O ATOM 1181 HA SER A 106 10.166 4.320 38.681 1.00 0.00 H ATOM 1182 HB2 SER A 106 9.203 2.676 36.296 1.00 0.00 H ATOM 1183 HB3 SER A 106 8.940 4.423 36.504 1.00 0.00 H ATOM 1184 HG SER A 106 7.753 3.933 38.436 1.00 0.00 H ATOM 1185 H SER A 106 11.684 3.327 36.271 1.00 0.00 H ATOM 1186 N ASP A 107 10.111 2.200 39.919 1.00 16.94 N ATOM 1187 CA ASP A 107 10.189 1.008 40.747 1.00 17.65 C ATOM 1188 C ASP A 107 9.179 0.007 40.195 1.00 17.42 C ATOM 1189 O ASP A 107 8.031 0.364 39.942 1.00 17.65 O ATOM 1190 CB ASP A 107 9.861 1.367 42.213 1.00 17.90 C ATOM 1191 CG ASP A 107 10.222 0.267 43.190 1.00 18.93 C ATOM 1192 OD1 ASP A 107 9.610 -0.820 43.138 1.00 19.87 O ATOM 1193 OD2 ASP A 107 11.115 0.502 44.020 1.00 19.73 O ATOM 1194 HA ASP A 107 11.191 0.580 40.728 1.00 0.00 H ATOM 1195 HB2 ASP A 107 10.415 2.266 42.482 1.00 0.00 H ATOM 1196 HB3 ASP A 107 8.792 1.564 42.291 1.00 0.00 H ATOM 1197 H ASP A 107 9.723 3.070 40.337 1.00 0.00 H ATOM 1198 N PRO A 108 9.604 -1.249 39.986 1.00 18.07 N ATOM 1199 CA PRO A 108 8.654 -2.247 39.481 1.00 18.98 C ATOM 1200 C PRO A 108 7.470 -2.506 40.399 1.00 19.43 C ATOM 1201 O PRO A 108 6.471 -3.058 39.951 1.00 19.98 O ATOM 1202 CB PRO A 108 9.513 -3.512 39.312 1.00 19.38 C ATOM 1203 CG PRO A 108 10.676 -3.303 40.158 1.00 18.54 C ATOM 1204 CD PRO A 108 10.943 -1.822 40.186 1.00 18.04 C ATOM 1205 HA PRO A 108 8.184 -1.903 38.559 1.00 0.00 H ATOM 1206 HD3 PRO A 108 11.363 -1.516 41.144 1.00 0.00 H ATOM 1207 HD2 PRO A 108 11.620 -1.529 39.384 1.00 0.00 H ATOM 1208 HG3 PRO A 108 11.537 -3.831 39.748 1.00 0.00 H ATOM 1209 HG2 PRO A 108 10.476 -3.666 41.166 1.00 0.00 H ATOM 1210 HB2 PRO A 108 8.960 -4.395 39.634 1.00 0.00 H ATOM 1211 HB3 PRO A 108 9.814 -3.633 38.271 1.00 0.00 H ATOM 1212 N ARG A 109 7.561 -2.100 41.662 1.00 19.80 N ATOM 1213 CA ARG A 109 6.415 -2.225 42.567 1.00 20.68 C ATOM 1214 C ARG A 109 5.313 -1.184 42.320 1.00 20.74 C ATOM 1215 O ARG A 109 4.262 -1.230 42.961 1.00 21.11 O ATOM 1216 CB ARG A 109 6.868 -2.185 44.026 1.00 21.10 C ATOM 1217 CG ARG A 109 7.602 -3.426 44.484 1.00 21.03 C ATOM 1218 CD ARG A 109 8.325 -3.151 45.810 1.00 21.96 C ATOM 1219 NE ARG A 109 9.435 -2.215 45.634 1.00 21.94 N ATOM 1220 CZ ARG A 109 10.320 -1.938 46.578 1.00 22.22 C ATOM 1221 NH1 ARG A 109 10.223 -2.515 47.770 1.00 24.99 N ATOM 1222 NH2 ARG A 109 11.303 -1.093 46.339 1.00 23.73 N ATOM 1223 HA ARG A 109 5.971 -3.196 42.350 1.00 0.00 H ATOM 1224 HB2 ARG A 109 7.531 -1.329 44.155 1.00 0.00 H ATOM 1225 HB3 ARG A 109 5.986 -2.058 44.654 1.00 0.00 H ATOM 1226 HG2 ARG A 109 6.887 -4.237 44.624 1.00 0.00 H ATOM 1227 HG3 ARG A 109 8.332 -3.713 43.728 1.00 0.00 H ATOM 1228 HD2 ARG A 109 8.713 -4.091 46.203 1.00 0.00 H ATOM 1229 HD3 ARG A 109 7.614 -2.728 46.520 1.00 0.00 H ATOM 1230 HE ARG A 109 9.534 -1.740 44.714 1.00 0.00 H ATOM 1231 HH12 ARG A 109 10.919 -2.297 48.511 1.00 0.00 H ATOM 1232 HH11 ARG A 109 9.451 -3.185 47.962 1.00 0.00 H ATOM 1233 HH22 ARG A 109 11.996 -0.878 47.084 1.00 0.00 H ATOM 1234 HH21 ARG A 109 11.385 -0.641 45.406 1.00 0.00 H ATOM 1235 H ARG A 109 8.452 -1.691 42.010 1.00 0.00 H ATOM 1236 N SER A 110 5.544 -0.267 41.379 1.00 20.33 N ATOM 1237 CA SER A 110 4.519 0.679 40.945 1.00 20.06 C ATOM 1238 C SER A 110 3.224 -0.043 40.570 1.00 20.21 C ATOM 1239 O SER A 110 3.258 -1.058 39.886 1.00 19.87 O ATOM 1240 CB SER A 110 5.015 1.475 39.726 1.00 19.82 C ATOM 1241 OG SER A 110 6.165 2.241 40.035 1.00 19.63 O ATOM 1242 HA SER A 110 4.320 1.355 41.777 1.00 0.00 H ATOM 1243 HB2 SER A 110 4.222 2.145 39.395 1.00 0.00 H ATOM 1244 HB3 SER A 110 5.259 0.778 38.924 1.00 0.00 H ATOM 1245 HG SER A 110 6.892 1.638 40.331 1.00 0.00 H ATOM 1246 H SER A 110 6.486 -0.224 40.940 1.00 0.00 H ATOM 1247 N THR A 111 2.093 0.498 41.010 1.00 20.77 N ATOM 1248 CA THR A 111 0.793 -0.073 40.683 1.00 22.43 C ATOM 1249 C THR A 111 0.261 0.565 39.408 1.00 22.18 C ATOM 1250 O THR A 111 -0.677 0.051 38.810 1.00 22.17 O ATOM 1251 CB THR A 111 -0.249 0.089 41.831 1.00 22.36 C ATOM 1252 OG1 THR A 111 -0.468 1.473 42.099 1.00 24.64 O ATOM 1253 CG2 THR A 111 0.224 -0.587 43.107 1.00 24.46 C ATOM 1254 HA THR A 111 0.940 -1.143 40.539 1.00 0.00 H ATOM 1255 HB THR A 111 -1.175 -0.383 41.505 1.00 0.00 H ATOM 1256 HG1 THR A 111 0.386 1.894 42.371 1.00 0.00 H ATOM 1257 HG23 THR A 111 0.395 -1.646 42.914 1.00 0.00 H ATOM 1258 HG21 THR A 111 1.152 -0.123 43.440 1.00 0.00 H ATOM 1259 HG22 THR A 111 -0.537 -0.475 43.879 1.00 0.00 H ATOM 1260 H THR A 111 2.137 1.351 41.603 1.00 0.00 H ATOM 1261 N GLN A 112 0.872 1.679 38.991 1.00 21.89 N ATOM 1262 CA GLN A 112 0.493 2.355 37.741 1.00 22.69 C ATOM 1263 C GLN A 112 1.594 2.215 36.695 1.00 21.81 C ATOM 1264 O GLN A 112 2.761 2.047 37.064 1.00 21.80 O ATOM 1265 CB GLN A 112 0.244 3.851 37.986 1.00 22.47 C ATOM 1266 CG GLN A 112 -0.813 4.160 39.033 1.00 26.50 C ATOM 1267 CD GLN A 112 -2.131 3.484 38.735 1.00 29.34 C ATOM 1268 OE1 GLN A 112 -2.656 3.588 37.627 1.00 32.97 O ATOM 1269 NE2 GLN A 112 -2.670 2.771 39.720 1.00 32.20 N ATOM 1270 HA GLN A 112 -0.421 1.883 37.379 1.00 0.00 H ATOM 1271 HB2 GLN A 112 1.182 4.303 38.308 1.00 0.00 H ATOM 1272 HB3 GLN A 112 -0.070 4.301 37.044 1.00 0.00 H ATOM 1273 HG2 GLN A 112 -0.455 3.818 40.004 1.00 0.00 H ATOM 1274 HG3 GLN A 112 -0.971 5.238 39.064 1.00 0.00 H ATOM 1275 HE22 GLN A 112 -2.191 2.711 40.641 1.00 0.00 H ATOM 1276 HE21 GLN A 112 -3.571 2.273 39.569 1.00 0.00 H ATOM 1277 H GLN A 112 1.639 2.080 39.568 1.00 0.00 H ATOM 1278 N PRO A 113 1.239 2.292 35.391 1.00 21.34 N ATOM 1279 CA PRO A 113 2.286 2.387 34.364 1.00 20.93 C ATOM 1280 C PRO A 113 3.085 3.680 34.518 1.00 20.69 C ATOM 1281 O PRO A 113 2.597 4.622 35.163 1.00 19.98 O ATOM 1282 CB PRO A 113 1.507 2.431 33.045 1.00 21.12 C ATOM 1283 CG PRO A 113 0.121 2.690 33.385 1.00 21.44 C ATOM 1284 CD PRO A 113 -0.113 2.285 34.801 1.00 21.64 C ATOM 1285 HA PRO A 113 2.996 1.562 34.426 1.00 0.00 H ATOM 1286 HD3 PRO A 113 -0.763 2.998 35.308 1.00 0.00 H ATOM 1287 HD2 PRO A 113 -0.556 1.290 34.854 1.00 0.00 H ATOM 1288 HG3 PRO A 113 -0.531 2.115 32.727 1.00 0.00 H ATOM 1289 HG2 PRO A 113 -0.092 3.752 33.268 1.00 0.00 H ATOM 1290 HB2 PRO A 113 1.892 3.227 32.408 1.00 0.00 H ATOM 1291 HB3 PRO A 113 1.594 1.477 32.525 1.00 0.00 H ATOM 1292 N VAL A 114 4.283 3.722 33.933 1.00 19.77 N ATOM 1293 CA VAL A 114 5.128 4.906 34.007 1.00 19.93 C ATOM 1294 C VAL A 114 4.535 6.048 33.176 1.00 19.92 C ATOM 1295 O VAL A 114 4.332 5.893 31.969 1.00 19.54 O ATOM 1296 CB VAL A 114 6.569 4.660 33.469 1.00 19.96 C ATOM 1297 CG1 VAL A 114 7.429 5.828 33.852 1.00 19.03 C ATOM 1298 CG2 VAL A 114 7.162 3.360 34.005 1.00 20.50 C ATOM 1299 HA VAL A 114 5.176 5.160 35.066 1.00 0.00 H ATOM 1300 HB VAL A 114 6.527 4.564 32.384 1.00 0.00 H ATOM 1301 HG11 VAL A 114 7.019 6.738 33.414 1.00 0.00 H ATOM 1302 HG12 VAL A 114 7.449 5.922 34.938 1.00 0.00 H ATOM 1303 HG13 VAL A 114 8.442 5.669 33.481 1.00 0.00 H ATOM 1304 HG21 VAL A 114 7.206 3.404 35.093 1.00 0.00 H ATOM 1305 HG22 VAL A 114 6.535 2.523 33.699 1.00 0.00 H ATOM 1306 HG23 VAL A 114 8.167 3.228 33.604 1.00 0.00 H ATOM 1307 H VAL A 114 4.622 2.889 33.411 1.00 0.00 H ATOM 1308 N PRO A 115 4.267 7.206 33.805 1.00 20.54 N ATOM 1309 CA PRO A 115 3.859 8.327 32.948 1.00 20.28 C ATOM 1310 C PRO A 115 5.044 8.783 32.092 1.00 20.58 C ATOM 1311 O PRO A 115 6.185 8.784 32.560 1.00 20.68 O ATOM 1312 CB PRO A 115 3.432 9.410 33.949 1.00 20.75 C ATOM 1313 CG PRO A 115 4.085 9.041 35.248 1.00 19.83 C ATOM 1314 CD PRO A 115 4.287 7.561 35.241 1.00 20.66 C ATOM 1315 HA PRO A 115 3.060 8.079 32.249 1.00 0.00 H ATOM 1316 HD3 PRO A 115 5.243 7.298 35.693 1.00 0.00 H ATOM 1317 HD2 PRO A 115 3.483 7.057 35.777 1.00 0.00 H ATOM 1318 HG3 PRO A 115 3.444 9.326 36.082 1.00 0.00 H ATOM 1319 HG2 PRO A 115 5.045 9.548 35.340 1.00 0.00 H ATOM 1320 HB2 PRO A 115 3.773 10.391 33.617 1.00 0.00 H ATOM 1321 HB3 PRO A 115 2.348 9.421 34.058 1.00 0.00 H ATOM 1322 N ARG A 116 4.786 9.115 30.829 1.00 20.92 N ATOM 1323 CA ARG A 116 5.846 9.555 29.929 1.00 21.33 C ATOM 1324 C ARG A 116 5.470 10.889 29.273 1.00 21.81 C ATOM 1325 O ARG A 116 4.287 11.226 29.205 1.00 21.86 O ATOM 1326 CB ARG A 116 6.151 8.484 28.882 1.00 21.85 C ATOM 1327 CG ARG A 116 6.304 7.077 29.452 1.00 22.19 C ATOM 1328 CD ARG A 116 7.192 6.213 28.590 1.00 22.66 C ATOM 1329 NE ARG A 116 8.597 6.455 28.915 1.00 24.26 N ATOM 1330 CZ ARG A 116 9.507 6.846 28.034 1.00 25.63 C ATOM 1331 NH1 ARG A 116 9.152 7.008 26.758 1.00 27.48 N ATOM 1332 NH2 ARG A 116 10.765 7.046 28.422 1.00 22.95 N ATOM 1333 HA ARG A 116 6.754 9.711 30.512 1.00 0.00 H ATOM 1334 HB2 ARG A 116 5.337 8.473 28.157 1.00 0.00 H ATOM 1335 HB3 ARG A 116 7.080 8.752 28.379 1.00 0.00 H ATOM 1336 HG2 ARG A 116 6.740 7.146 30.449 1.00 0.00 H ATOM 1337 HG3 ARG A 116 5.319 6.615 29.518 1.00 0.00 H ATOM 1338 HD2 ARG A 116 7.018 6.451 27.541 1.00 0.00 H ATOM 1339 HD3 ARG A 116 6.956 5.164 28.767 1.00 0.00 H ATOM 1340 HE ARG A 116 8.901 6.311 29.899 1.00 0.00 H ATOM 1341 HH12 ARG A 116 9.857 7.314 26.057 1.00 0.00 H ATOM 1342 HH11 ARG A 116 8.171 6.828 26.464 1.00 0.00 H ATOM 1343 HH22 ARG A 116 11.480 7.353 27.731 1.00 0.00 H ATOM 1344 HH21 ARG A 116 11.033 6.895 29.416 1.00 0.00 H ATOM 1345 H ARG A 116 3.809 9.060 30.477 1.00 0.00 H ATOM 1346 N PHE A 117 6.475 11.627 28.802 1.00 21.55 N ATOM 1347 CA PHE A 117 6.308 13.042 28.409 1.00 22.24 C ATOM 1348 C PHE A 117 7.124 13.392 27.180 1.00 22.74 C ATOM 1349 O PHE A 117 8.251 12.962 27.050 1.00 22.30 O ATOM 1350 CB PHE A 117 6.698 13.967 29.575 1.00 21.57 C ATOM 1351 CG PHE A 117 6.035 13.590 30.865 1.00 20.08 C ATOM 1352 CD1 PHE A 117 4.756 14.048 31.160 1.00 19.08 C ATOM 1353 CD2 PHE A 117 6.663 12.735 31.755 1.00 19.30 C ATOM 1354 CE1 PHE A 117 4.118 13.667 32.319 1.00 19.63 C ATOM 1355 CE2 PHE A 117 6.034 12.356 32.929 1.00 19.28 C ATOM 1356 CZ PHE A 117 4.766 12.822 33.208 1.00 20.07 C ATOM 1357 HA PHE A 117 5.257 13.188 28.161 1.00 0.00 H ATOM 1358 HB2 PHE A 117 7.778 13.918 29.712 1.00 0.00 H ATOM 1359 HB3 PHE A 117 6.411 14.987 29.321 1.00 0.00 H ATOM 1360 HD2 PHE A 117 7.660 12.357 31.530 1.00 0.00 H ATOM 1361 HE2 PHE A 117 6.539 11.692 33.630 1.00 0.00 H ATOM 1362 HZ PHE A 117 4.270 12.525 34.132 1.00 0.00 H ATOM 1363 HE1 PHE A 117 3.112 14.026 32.536 1.00 0.00 H ATOM 1364 HD1 PHE A 117 4.251 14.718 30.464 1.00 0.00 H ATOM 1365 H PHE A 117 7.414 11.190 28.707 1.00 0.00 H ATOM 1366 N ASP A 118 6.533 14.165 26.273 1.00 24.45 N ATOM 1367 CA ASP A 118 7.225 14.591 25.061 1.00 25.77 C ATOM 1368 C ASP A 118 8.067 15.836 25.291 1.00 25.68 C ATOM 1369 O ASP A 118 8.744 16.315 24.377 1.00 26.46 O ATOM 1370 CB ASP A 118 6.242 14.796 23.888 1.00 26.49 C ATOM 1371 CG ASP A 118 5.097 15.746 24.216 1.00 29.03 C ATOM 1372 OD1 ASP A 118 5.208 16.574 25.152 1.00 31.21 O ATOM 1373 OD2 ASP A 118 4.067 15.675 23.503 1.00 33.39 O ATOM 1374 HA ASP A 118 7.906 13.785 24.789 1.00 0.00 H ATOM 1375 HB2 ASP A 118 6.795 15.201 23.040 1.00 0.00 H ATOM 1376 HB3 ASP A 118 5.821 13.828 23.617 1.00 0.00 H ATOM 1377 H ASP A 118 5.553 14.474 26.432 1.00 0.00 H TER 1378 ASP A 118 ATOM 1379 N VAL A 120 10.249 18.151 28.698 1.00 21.42 N ATOM 1380 CA VAL A 120 10.758 18.119 30.057 1.00 21.22 C ATOM 1381 C VAL A 120 9.966 19.023 31.013 1.00 20.09 C ATOM 1382 O VAL A 120 9.874 18.752 32.197 1.00 18.90 O ATOM 1383 CB VAL A 120 12.304 18.326 30.106 1.00 21.55 C ATOM 1384 CG1 VAL A 120 12.671 19.795 30.154 1.00 22.88 C ATOM 1385 CG2 VAL A 120 12.877 17.619 31.307 1.00 23.67 C ATOM 1386 HA VAL A 120 10.590 17.112 30.439 1.00 0.00 H ATOM 1387 HB VAL A 120 12.725 17.905 29.193 1.00 0.00 H ATOM 1388 HG11 VAL A 120 12.285 20.294 29.265 1.00 0.00 H ATOM 1389 HG12 VAL A 120 12.235 20.248 31.044 1.00 0.00 H ATOM 1390 HG13 VAL A 120 13.756 19.896 30.187 1.00 0.00 H ATOM 1391 HG21 VAL A 120 12.430 18.026 32.214 1.00 0.00 H ATOM 1392 HG22 VAL A 120 12.658 16.553 31.239 1.00 0.00 H ATOM 1393 HG23 VAL A 120 13.956 17.768 31.334 1.00 0.00 H ATOM 1394 HN3 VAL A 120 10.302 19.123 28.332 1.00 0.00 H ATOM 1395 HN2 VAL A 120 9.260 17.830 28.692 1.00 0.00 H ATOM 1396 HN1 VAL A 120 10.822 17.523 28.100 1.00 0.00 H ATOM 1397 N LEU A 121 9.343 20.060 30.459 1.00 19.16 N ATOM 1398 CA LEU A 121 8.522 20.975 31.227 1.00 19.19 C ATOM 1399 C LEU A 121 7.281 20.251 31.785 1.00 17.51 C ATOM 1400 O LEU A 121 6.878 20.474 32.923 1.00 18.20 O ATOM 1401 CB LEU A 121 8.137 22.164 30.324 1.00 19.03 C ATOM 1402 CG LEU A 121 8.015 23.609 30.812 1.00 21.64 C ATOM 1403 CD1 LEU A 121 8.969 23.996 31.946 1.00 20.20 C ATOM 1404 CD2 LEU A 121 8.188 24.529 29.595 1.00 20.54 C ATOM 1405 HA LEU A 121 9.079 21.351 32.086 1.00 0.00 H ATOM 1406 HB2 LEU A 121 8.882 22.183 29.528 1.00 0.00 H ATOM 1407 HB3 LEU A 121 7.164 21.912 29.903 1.00 0.00 H ATOM 1408 HG LEU A 121 7.028 23.721 31.261 1.00 0.00 H ATOM 1409 HD21 LEU A 121 9.169 24.360 29.150 1.00 0.00 H ATOM 1410 HD22 LEU A 121 7.412 24.309 28.862 1.00 0.00 H ATOM 1411 HD23 LEU A 121 8.106 25.569 29.912 1.00 0.00 H ATOM 1412 HD11 LEU A 121 8.782 23.359 32.810 1.00 0.00 H ATOM 1413 HD12 LEU A 121 9.999 23.866 31.613 1.00 0.00 H ATOM 1414 HD13 LEU A 121 8.803 25.038 32.219 1.00 0.00 H ATOM 1415 H LEU A 121 9.449 20.220 29.437 1.00 0.00 H ATOM 1416 N LYS A 122 6.697 19.382 30.970 1.00 16.80 N ATOM 1417 CA LYS A 122 5.572 18.549 31.361 1.00 16.61 C ATOM 1418 C LYS A 122 6.007 17.489 32.381 1.00 16.34 C ATOM 1419 O LYS A 122 5.307 17.265 33.367 1.00 15.31 O ATOM 1420 CB LYS A 122 4.923 17.911 30.125 1.00 16.30 C ATOM 1421 CG LYS A 122 4.146 18.906 29.250 1.00 16.82 C ATOM 1422 CD LYS A 122 3.771 18.264 27.911 1.00 18.32 C ATOM 1423 CE LYS A 122 2.959 19.248 27.047 1.00 21.80 C ATOM 1424 NZ LYS A 122 2.616 18.650 25.711 1.00 21.31 N ATOM 1425 HA LYS A 122 4.824 19.178 31.844 1.00 0.00 H ATOM 1426 HB2 LYS A 122 5.708 17.460 29.518 1.00 0.00 H ATOM 1427 HB3 LYS A 122 4.234 17.136 30.460 1.00 0.00 H ATOM 1428 HG2 LYS A 122 3.237 19.208 29.770 1.00 0.00 H ATOM 1429 HG3 LYS A 122 4.766 19.783 29.066 1.00 0.00 H ATOM 1430 HD2 LYS A 122 4.681 17.986 27.379 1.00 0.00 H ATOM 1431 HD3 LYS A 122 3.173 17.372 28.096 1.00 0.00 H ATOM 1432 HE2 LYS A 122 3.547 20.152 26.891 1.00 0.00 H ATOM 1433 HE3 LYS A 122 2.037 19.502 27.570 1.00 0.00 H ATOM 1434 HZ1 LYS A 122 3.492 18.410 25.205 1.00 0.00 H ATOM 1435 HZ2 LYS A 122 2.050 17.789 25.853 1.00 0.00 H ATOM 1436 HZ3 LYS A 122 2.070 19.338 25.155 1.00 0.00 H ATOM 1437 H LYS A 122 7.063 19.292 30.001 1.00 0.00 H ATOM 1438 N LEU A 123 7.157 16.844 32.141 1.00 16.33 N ATOM 1439 CA LEU A 123 7.735 15.884 33.100 1.00 16.80 C ATOM 1440 C LEU A 123 7.826 16.541 34.471 1.00 16.83 C ATOM 1441 O LEU A 123 7.264 16.060 35.447 1.00 17.28 O ATOM 1442 CB LEU A 123 9.135 15.412 32.643 1.00 17.03 C ATOM 1443 CG LEU A 123 9.895 14.337 33.459 1.00 17.12 C ATOM 1444 CD1 LEU A 123 11.133 13.927 32.696 1.00 19.33 C ATOM 1445 CD2 LEU A 123 10.311 14.849 34.836 1.00 18.11 C ATOM 1446 HA LEU A 123 7.089 15.008 33.151 1.00 0.00 H ATOM 1447 HB2 LEU A 123 9.020 15.018 31.633 1.00 0.00 H ATOM 1448 HB3 LEU A 123 9.772 16.296 32.617 1.00 0.00 H ATOM 1449 HG LEU A 123 9.224 13.491 33.604 1.00 0.00 H ATOM 1450 HD21 LEU A 123 10.965 15.713 34.719 1.00 0.00 H ATOM 1451 HD22 LEU A 123 9.423 15.138 35.398 1.00 0.00 H ATOM 1452 HD23 LEU A 123 10.840 14.060 35.371 1.00 0.00 H ATOM 1453 HD11 LEU A 123 10.843 13.519 31.728 1.00 0.00 H ATOM 1454 HD12 LEU A 123 11.772 14.798 32.548 1.00 0.00 H ATOM 1455 HD13 LEU A 123 11.674 13.170 33.264 1.00 0.00 H ATOM 1456 H LEU A 123 7.659 17.027 31.249 1.00 0.00 H ATOM 1457 N VAL A 124 8.517 17.672 34.524 1.00 17.30 N ATOM 1458 CA VAL A 124 8.722 18.404 35.748 1.00 17.44 C ATOM 1459 C VAL A 124 7.393 18.796 36.440 1.00 17.78 C ATOM 1460 O VAL A 124 7.235 18.563 37.646 1.00 17.09 O ATOM 1461 CB VAL A 124 9.670 19.615 35.480 1.00 18.46 C ATOM 1462 CG1 VAL A 124 9.517 20.680 36.518 1.00 18.21 C ATOM 1463 CG2 VAL A 124 11.127 19.112 35.390 1.00 19.97 C ATOM 1464 HA VAL A 124 9.215 17.751 36.468 1.00 0.00 H ATOM 1465 HB VAL A 124 9.395 20.073 34.530 1.00 0.00 H ATOM 1466 HG11 VAL A 124 8.489 21.042 36.516 1.00 0.00 H ATOM 1467 HG12 VAL A 124 9.756 20.267 37.498 1.00 0.00 H ATOM 1468 HG13 VAL A 124 10.194 21.504 36.294 1.00 0.00 H ATOM 1469 HG21 VAL A 124 11.403 18.632 36.329 1.00 0.00 H ATOM 1470 HG22 VAL A 124 11.212 18.394 34.575 1.00 0.00 H ATOM 1471 HG23 VAL A 124 11.791 19.956 35.203 1.00 0.00 H ATOM 1472 H VAL A 124 8.928 18.046 33.645 1.00 0.00 H ATOM 1473 N HIS A 125 6.438 19.347 35.680 1.00 17.39 N ATOM 1474 CA HIS A 125 5.100 19.689 36.206 1.00 17.57 C ATOM 1475 C HIS A 125 4.425 18.491 36.881 1.00 17.62 C ATOM 1476 O HIS A 125 3.767 18.628 37.913 1.00 16.72 O ATOM 1477 CB HIS A 125 4.205 20.247 35.073 1.00 18.33 C ATOM 1478 CG HIS A 125 2.767 20.483 35.458 1.00 20.24 C ATOM 1479 ND1 HIS A 125 1.746 19.622 35.101 1.00 22.55 N ATOM 1480 CD2 HIS A 125 2.176 21.497 36.138 1.00 22.55 C ATOM 1481 CE1 HIS A 125 0.596 20.081 35.563 1.00 21.82 C ATOM 1482 NE2 HIS A 125 0.827 21.217 36.197 1.00 24.35 N ATOM 1483 HA HIS A 125 5.233 20.457 36.968 1.00 0.00 H ATOM 1484 HB2 HIS A 125 4.628 21.196 34.744 1.00 0.00 H ATOM 1485 HB3 HIS A 125 4.222 19.537 34.246 1.00 0.00 H ATOM 1486 HD2 HIS A 125 2.674 22.370 36.559 1.00 0.00 H ATOM 1487 HE1 HIS A 125 -0.377 19.604 35.442 1.00 0.00 H ATOM 1488 H HIS A 125 6.646 19.542 34.680 1.00 0.00 H ATOM 1489 N HIS A 126 4.626 17.305 36.315 1.00 17.71 N ATOM 1490 CA HIS A 126 3.935 16.118 36.790 1.00 18.15 C ATOM 1491 C HIS A 126 4.384 15.736 38.205 1.00 18.36 C ATOM 1492 O HIS A 126 3.608 15.176 38.987 1.00 18.10 O ATOM 1493 CB HIS A 126 4.168 14.964 35.814 1.00 17.63 C ATOM 1494 CG HIS A 126 3.325 13.765 36.099 1.00 18.26 C ATOM 1495 ND1 HIS A 126 2.038 13.634 35.621 1.00 16.97 N ATOM 1496 CD2 HIS A 126 3.582 12.644 36.814 1.00 17.18 C ATOM 1497 CE1 HIS A 126 1.536 12.486 36.042 1.00 19.46 C ATOM 1498 NE2 HIS A 126 2.455 11.866 36.762 1.00 17.77 N ATOM 1499 HA HIS A 126 2.868 16.335 36.839 1.00 0.00 H ATOM 1500 HB2 HIS A 126 3.943 15.313 34.806 1.00 0.00 H ATOM 1501 HB3 HIS A 126 5.216 14.671 35.870 1.00 0.00 H ATOM 1502 HD2 HIS A 126 4.510 12.405 37.333 1.00 0.00 H ATOM 1503 HE1 HIS A 126 0.534 12.113 35.831 1.00 0.00 H ATOM 1504 H HIS A 126 5.290 17.225 35.518 1.00 0.00 H ATOM 1505 N TYR A 127 5.648 16.014 38.515 1.00 18.53 N ATOM 1506 CA TYR A 127 6.216 15.700 39.821 1.00 19.21 C ATOM 1507 C TYR A 127 6.295 16.932 40.723 1.00 21.17 C ATOM 1508 O TYR A 127 7.120 16.976 41.638 1.00 20.57 O ATOM 1509 CB TYR A 127 7.589 15.024 39.669 1.00 18.41 C ATOM 1510 CG TYR A 127 7.487 13.715 38.907 1.00 17.00 C ATOM 1511 CD1 TYR A 127 7.105 12.536 39.560 1.00 15.73 C ATOM 1512 CD2 TYR A 127 7.747 13.657 37.532 1.00 14.87 C ATOM 1513 CE1 TYR A 127 6.990 11.327 38.855 1.00 14.82 C ATOM 1514 CE2 TYR A 127 7.627 12.452 36.820 1.00 14.40 C ATOM 1515 CZ TYR A 127 7.253 11.300 37.490 1.00 15.26 C ATOM 1516 OH TYR A 127 7.135 10.112 36.794 1.00 17.13 O ATOM 1517 HA TYR A 127 5.544 14.996 40.311 1.00 0.00 H ATOM 1518 HB3 TYR A 127 7.997 14.826 40.660 1.00 0.00 H ATOM 1519 HB2 TYR A 127 8.257 15.696 39.130 1.00 0.00 H ATOM 1520 HD2 TYR A 127 8.048 14.563 37.005 1.00 0.00 H ATOM 1521 HE2 TYR A 127 7.827 12.424 35.749 1.00 0.00 H ATOM 1522 HE1 TYR A 127 6.696 10.415 39.375 1.00 0.00 H ATOM 1523 HD1 TYR A 127 6.894 12.557 40.629 1.00 0.00 H ATOM 1524 HH TYR A 127 8.007 9.883 36.384 1.00 0.00 H ATOM 1525 H TYR A 127 6.251 16.471 37.802 1.00 0.00 H ATOM 1526 N MET A 128 5.421 17.910 40.469 1.00 22.98 N ATOM 1527 CA MET A 128 5.264 19.099 41.329 1.00 26.13 C ATOM 1528 C MET A 128 3.893 19.081 42.014 1.00 27.70 C ATOM 1529 O MET A 128 2.976 19.803 41.588 1.00 28.20 O ATOM 1530 CB MET A 128 5.379 20.392 40.504 1.00 25.75 C ATOM 1531 CG MET A 128 6.782 20.793 40.087 1.00 25.70 C ATOM 1532 SD MET A 128 6.686 22.236 38.999 1.00 28.93 S ATOM 1533 CE MET A 128 8.318 22.899 39.207 1.00 27.32 C ATOM 1534 HA MET A 128 6.057 19.073 42.076 1.00 0.00 H ATOM 1535 HB2 MET A 128 4.786 20.264 39.599 1.00 0.00 H ATOM 1536 HB3 MET A 128 4.962 21.205 41.098 1.00 0.00 H ATOM 1537 HG2 MET A 128 7.256 19.967 39.557 1.00 0.00 H ATOM 1538 HG3 MET A 128 7.369 21.040 40.971 1.00 0.00 H ATOM 1539 HE1 MET A 128 8.477 23.148 40.256 1.00 0.00 H ATOM 1540 HE2 MET A 128 9.053 22.158 38.893 1.00 0.00 H ATOM 1541 HE3 MET A 128 8.424 23.798 38.599 1.00 0.00 H ATOM 1542 H MET A 128 4.821 17.829 39.623 1.00 0.00 H ATOM 1543 N PRO A 129 3.723 18.251 43.063 1.00 29.44 N ATOM 1544 CA PRO A 129 2.433 18.326 43.747 1.00 30.54 C ATOM 1545 C PRO A 129 2.382 19.546 44.669 1.00 32.10 C ATOM 1546 O PRO A 129 3.434 20.001 45.129 1.00 32.16 O ATOM 1547 CB PRO A 129 2.392 17.025 44.559 1.00 30.38 C ATOM 1548 CG PRO A 129 3.840 16.737 44.877 1.00 29.83 C ATOM 1549 CD PRO A 129 4.617 17.239 43.668 1.00 29.35 C ATOM 1550 HA PRO A 129 1.589 18.431 43.065 1.00 0.00 H ATOM 1551 HD3 PRO A 129 5.562 17.689 43.974 1.00 0.00 H ATOM 1552 HD2 PRO A 129 4.813 16.427 42.968 1.00 0.00 H ATOM 1553 HG3 PRO A 129 3.996 15.667 45.016 1.00 0.00 H ATOM 1554 HG2 PRO A 129 4.148 17.268 45.778 1.00 0.00 H ATOM 1555 HB2 PRO A 129 1.815 17.159 45.474 1.00 0.00 H ATOM 1556 HB3 PRO A 129 1.957 16.216 43.971 1.00 0.00 H ATOM 1557 N PRO A 130 1.164 20.065 44.948 1.00 33.83 N ATOM 1558 CA PRO A 130 0.979 21.070 45.997 1.00 34.83 C ATOM 1559 C PRO A 130 1.200 20.414 47.370 1.00 36.03 C ATOM 1560 O PRO A 130 1.135 19.184 47.479 1.00 35.99 O ATOM 1561 CB PRO A 130 -0.496 21.455 45.844 1.00 34.93 C ATOM 1562 CG PRO A 130 -1.148 20.219 45.274 1.00 34.32 C ATOM 1563 CD PRO A 130 -0.121 19.695 44.311 1.00 33.99 C ATOM 1564 HA PRO A 130 1.660 21.917 45.921 1.00 0.00 H ATOM 1565 HD3 PRO A 130 -0.205 18.614 44.200 1.00 0.00 H ATOM 1566 HD2 PRO A 130 -0.224 20.168 43.334 1.00 0.00 H ATOM 1567 HG3 PRO A 130 -2.075 20.469 44.758 1.00 0.00 H ATOM 1568 HG2 PRO A 130 -1.355 19.491 46.058 1.00 0.00 H ATOM 1569 HB2 PRO A 130 -0.931 21.710 46.810 1.00 0.00 H ATOM 1570 HB3 PRO A 130 -0.606 22.299 45.163 1.00 0.00 H ATOM 1571 N GLN A 131 1.462 21.214 48.403 1.00 37.20 N ATOM 1572 CA GLN A 131 1.553 20.661 49.756 1.00 38.37 C ATOM 1573 C GLN A 131 0.210 20.763 50.480 1.00 38.40 C ATOM 1574 O GLN A 131 -0.334 21.858 50.660 1.00 38.68 O ATOM 1575 CB GLN A 131 2.650 21.333 50.576 1.00 38.88 C ATOM 1576 CG GLN A 131 3.247 20.404 51.637 1.00 41.41 C ATOM 1577 CD GLN A 131 3.611 21.120 52.924 1.00 45.14 C ATOM 1578 OE1 GLN A 131 3.044 22.167 53.254 1.00 48.02 O ATOM 1579 NE2 GLN A 131 4.560 20.554 53.668 1.00 45.91 N ATOM 1580 HA GLN A 131 1.816 19.608 49.652 1.00 0.00 H ATOM 1581 HB2 GLN A 131 3.446 21.650 49.902 1.00 0.00 H ATOM 1582 HB3 GLN A 131 2.228 22.206 51.074 1.00 0.00 H ATOM 1583 HG2 GLN A 131 2.518 19.627 51.867 1.00 0.00 H ATOM 1584 HG3 GLN A 131 4.148 19.946 51.229 1.00 0.00 H ATOM 1585 HE22 GLN A 131 5.011 19.672 53.352 1.00 0.00 H ATOM 1586 HE21 GLN A 131 4.850 20.994 54.565 1.00 0.00 H ATOM 1587 H GLN A 131 1.602 22.233 48.248 1.00 0.00 H TER 1588 GLN A 131 ATOM 1589 N ALA A 141 0.943 13.187 44.015 1.00 35.14 N ATOM 1590 CA ALA A 141 2.194 12.958 44.757 1.00 34.98 C ATOM 1591 C ALA A 141 2.696 11.501 44.714 1.00 34.69 C ATOM 1592 O ALA A 141 1.946 10.576 45.039 1.00 35.08 O ATOM 1593 CB ALA A 141 2.046 13.430 46.186 1.00 34.86 C ATOM 1594 HA ALA A 141 2.959 13.545 44.249 1.00 0.00 H ATOM 1595 HB1 ALA A 141 1.815 14.495 46.193 1.00 0.00 H ATOM 1596 HB2 ALA A 141 1.238 12.879 46.668 1.00 0.00 H ATOM 1597 HB3 ALA A 141 2.978 13.255 46.723 1.00 0.00 H ATOM 1598 HN3 ALA A 141 0.190 12.592 44.416 1.00 0.00 H ATOM 1599 HN2 ALA A 141 1.085 12.942 43.014 1.00 0.00 H ATOM 1600 HN1 ALA A 141 0.674 14.188 44.093 1.00 0.00 H ATOM 1601 N TYR A 142 3.962 11.323 44.316 1.00 34.07 N ATOM 1602 CA TYR A 142 4.637 10.011 44.243 1.00 33.55 C ATOM 1603 C TYR A 142 5.792 9.899 45.241 1.00 33.73 C ATOM 1604 O TYR A 142 6.197 10.898 45.835 1.00 33.60 O ATOM 1605 CB TYR A 142 5.210 9.790 42.848 1.00 33.31 C ATOM 1606 CG TYR A 142 4.206 9.876 41.737 1.00 32.55 C ATOM 1607 CD1 TYR A 142 4.154 10.994 40.914 1.00 31.75 C ATOM 1608 CD2 TYR A 142 3.302 8.847 41.513 1.00 31.75 C ATOM 1609 CE1 TYR A 142 3.241 11.075 39.883 1.00 31.55 C ATOM 1610 CE2 TYR A 142 2.377 8.921 40.490 1.00 32.48 C ATOM 1611 CZ TYR A 142 2.361 10.032 39.673 1.00 32.59 C ATOM 1612 OH TYR A 142 1.450 10.104 38.650 1.00 33.83 O ATOM 1613 HA TYR A 142 3.883 9.261 44.482 1.00 0.00 H ATOM 1614 HB3 TYR A 142 5.664 8.799 42.820 1.00 0.00 H ATOM 1615 HB2 TYR A 142 5.977 10.544 42.672 1.00 0.00 H ATOM 1616 HD2 TYR A 142 3.322 7.966 42.155 1.00 0.00 H ATOM 1617 HE2 TYR A 142 1.667 8.110 40.330 1.00 0.00 H ATOM 1618 HE1 TYR A 142 3.215 11.955 39.240 1.00 0.00 H ATOM 1619 HD1 TYR A 142 4.845 11.819 41.085 1.00 0.00 H ATOM 1620 HH TYR A 142 1.592 9.346 38.029 1.00 0.00 H ATOM 1621 H TYR A 142 4.507 12.165 44.040 1.00 0.00 H ATOM 1622 N TYR A 143 6.343 8.697 45.410 1.00 33.75 N ATOM 1623 CA TYR A 143 7.345 8.469 46.464 1.00 34.46 C ATOM 1624 C TYR A 143 8.560 7.642 46.008 1.00 34.58 C ATOM 1625 O TYR A 143 8.487 6.937 45.004 1.00 34.35 O ATOM 1626 CB TYR A 143 6.646 7.881 47.708 1.00 35.06 C ATOM 1627 CG TYR A 143 5.507 8.774 48.207 1.00 36.17 C ATOM 1628 CD1 TYR A 143 4.214 8.686 47.676 1.00 35.86 C ATOM 1629 CD2 TYR A 143 5.733 9.726 49.188 1.00 36.33 C ATOM 1630 CE1 TYR A 143 3.187 9.529 48.124 1.00 36.47 C ATOM 1631 CE2 TYR A 143 4.716 10.567 49.640 1.00 37.09 C ATOM 1632 CZ TYR A 143 3.451 10.467 49.108 1.00 37.06 C ATOM 1633 OH TYR A 143 2.470 11.319 49.580 1.00 37.42 O ATOM 1634 HA TYR A 143 7.780 9.434 46.725 1.00 0.00 H ATOM 1635 HB3 TYR A 143 7.381 7.771 48.505 1.00 0.00 H ATOM 1636 HB2 TYR A 143 6.239 6.902 47.453 1.00 0.00 H ATOM 1637 HD2 TYR A 143 6.730 9.820 49.617 1.00 0.00 H ATOM 1638 HE2 TYR A 143 4.924 11.304 50.416 1.00 0.00 H ATOM 1639 HE1 TYR A 143 2.186 9.446 47.700 1.00 0.00 H ATOM 1640 HD1 TYR A 143 4.002 7.949 46.901 1.00 0.00 H ATOM 1641 HH TYR A 143 1.619 11.133 49.109 1.00 0.00 H ATOM 1642 H TYR A 143 6.062 7.911 44.790 1.00 0.00 H ATOM 1643 N ILE A 144 9.684 7.774 46.719 1.00 34.95 N ATOM 1644 CA ILE A 144 10.897 6.978 46.469 1.00 35.64 C ATOM 1645 C ILE A 144 11.233 6.079 47.681 1.00 36.43 C ATOM 1646 O ILE A 144 10.987 6.469 48.824 1.00 35.36 O ATOM 1647 CB ILE A 144 12.128 7.881 46.094 1.00 35.71 C ATOM 1648 CG1 ILE A 144 12.337 9.001 47.124 1.00 36.15 C ATOM 1649 CG2 ILE A 144 11.953 8.500 44.709 1.00 35.14 C ATOM 1650 CD1 ILE A 144 13.263 10.140 46.653 1.00 36.41 C ATOM 1651 HA ILE A 144 10.686 6.339 45.612 1.00 0.00 H ATOM 1652 HB ILE A 144 13.006 7.235 46.091 1.00 0.00 H ATOM 1653 HG12 ILE A 144 11.364 9.430 47.363 1.00 0.00 H ATOM 1654 HG13 ILE A 144 12.769 8.561 48.023 1.00 0.00 H ATOM 1655 HD11 ILE A 144 14.248 9.734 46.422 1.00 0.00 H ATOM 1656 HD12 ILE A 144 12.842 10.604 45.761 1.00 0.00 H ATOM 1657 HD13 ILE A 144 13.352 10.885 47.444 1.00 0.00 H ATOM 1658 HG21 ILE A 144 11.862 7.707 43.967 1.00 0.00 H ATOM 1659 HG22 ILE A 144 11.053 9.114 44.698 1.00 0.00 H ATOM 1660 HG23 ILE A 144 12.820 9.119 44.477 1.00 0.00 H ATOM 1661 H ILE A 144 9.703 8.474 47.488 1.00 0.00 H ATOM 1662 N TYR A 145 11.781 4.884 47.439 1.00 37.37 N ATOM 1663 CA TYR A 145 12.230 4.023 48.558 1.00 38.95 C ATOM 1664 C TYR A 145 13.632 4.375 49.038 1.00 39.15 C ATOM 1665 O TYR A 145 14.566 4.418 48.236 1.00 40.18 O ATOM 1666 CB TYR A 145 12.154 2.523 48.222 1.00 39.57 C ATOM 1667 CG TYR A 145 10.836 1.871 48.606 1.00 40.63 C ATOM 1668 CD1 TYR A 145 9.831 1.702 47.667 1.00 41.24 C ATOM 1669 CD2 TYR A 145 10.598 1.428 49.914 1.00 41.83 C ATOM 1670 CE1 TYR A 145 8.613 1.106 48.006 1.00 41.80 C ATOM 1671 CE2 TYR A 145 9.378 0.829 50.267 1.00 41.37 C ATOM 1672 CZ TYR A 145 8.392 0.675 49.302 1.00 41.68 C ATOM 1673 OH TYR A 145 7.182 0.085 49.605 1.00 41.51 O ATOM 1674 HA TYR A 145 11.530 4.223 49.369 1.00 0.00 H ATOM 1675 HB3 TYR A 145 12.957 2.011 48.752 1.00 0.00 H ATOM 1676 HB2 TYR A 145 12.296 2.404 47.148 1.00 0.00 H ATOM 1677 HD2 TYR A 145 11.373 1.550 50.670 1.00 0.00 H ATOM 1678 HE2 TYR A 145 9.207 0.488 51.288 1.00 0.00 H ATOM 1679 HE1 TYR A 145 7.838 0.981 47.250 1.00 0.00 H ATOM 1680 HD1 TYR A 145 9.994 2.041 46.644 1.00 0.00 H ATOM 1681 HH TYR A 145 6.614 0.065 48.795 1.00 0.00 H ATOM 1682 H TYR A 145 11.893 4.556 46.458 1.00 0.00 H TER 1683 TYR A 145 ATOM 1684 N LYS A 150 9.891 5.188 52.614 1.00 45.36 N ATOM 1685 CA LYS A 150 9.039 5.706 51.546 1.00 45.46 C ATOM 1686 C LYS A 150 8.908 7.225 51.697 1.00 45.17 C ATOM 1687 O LYS A 150 8.045 7.714 52.431 1.00 45.69 O ATOM 1688 CB LYS A 150 7.672 4.991 51.561 1.00 45.45 C ATOM 1689 CG LYS A 150 6.703 5.292 50.396 1.00 46.53 C ATOM 1690 CD LYS A 150 7.051 4.548 49.084 1.00 47.74 C ATOM 1691 CE LYS A 150 5.786 4.058 48.341 1.00 48.37 C ATOM 1692 NZ LYS A 150 4.842 5.121 47.832 1.00 47.11 N ATOM 1693 HA LYS A 150 9.489 5.505 50.574 1.00 0.00 H ATOM 1694 HB2 LYS A 150 7.863 3.918 51.559 1.00 0.00 H ATOM 1695 HB3 LYS A 150 7.168 5.268 52.487 1.00 0.00 H ATOM 1696 HG2 LYS A 150 5.698 5.000 50.701 1.00 0.00 H ATOM 1697 HG3 LYS A 150 6.724 6.364 50.199 1.00 0.00 H ATOM 1698 HD2 LYS A 150 7.603 5.225 48.431 1.00 0.00 H ATOM 1699 HD3 LYS A 150 7.675 3.687 49.323 1.00 0.00 H ATOM 1700 HE2 LYS A 150 5.227 3.420 49.026 1.00 0.00 H ATOM 1701 HE3 LYS A 150 6.114 3.469 47.484 1.00 0.00 H ATOM 1702 HZ1 LYS A 150 4.497 5.689 48.632 1.00 0.00 H ATOM 1703 HZ2 LYS A 150 5.344 5.736 47.160 1.00 0.00 H ATOM 1704 HZ3 LYS A 150 4.037 4.668 47.355 1.00 0.00 H ATOM 1705 HN3 LYS A 150 9.464 5.412 53.536 1.00 0.00 H ATOM 1706 HN2 LYS A 150 10.831 5.628 52.550 1.00 0.00 H ATOM 1707 HN1 LYS A 150 9.982 4.157 52.514 1.00 0.00 H ATOM 1708 N ILE A 151 9.787 7.961 51.008 1.00 44.61 N ATOM 1709 CA ILE A 151 9.832 9.436 51.063 1.00 43.88 C ATOM 1710 C ILE A 151 9.246 10.097 49.803 1.00 43.27 C ATOM 1711 O ILE A 151 9.558 9.671 48.687 1.00 43.33 O ATOM 1712 CB ILE A 151 11.282 9.971 51.328 1.00 44.20 C ATOM 1713 CG1 ILE A 151 11.590 11.181 50.435 1.00 43.80 C ATOM 1714 CG2 ILE A 151 12.333 8.875 51.123 1.00 44.26 C ATOM 1715 CD1 ILE A 151 13.026 11.548 50.372 1.00 44.06 C ATOM 1716 HA ILE A 151 9.201 9.716 51.907 1.00 0.00 H ATOM 1717 HB ILE A 151 11.327 10.287 52.370 1.00 0.00 H ATOM 1718 HG12 ILE A 151 11.252 10.954 49.424 1.00 0.00 H ATOM 1719 HG13 ILE A 151 11.036 12.038 50.818 1.00 0.00 H ATOM 1720 HD11 ILE A 151 13.381 11.793 51.373 1.00 0.00 H ATOM 1721 HD12 ILE A 151 13.597 10.708 49.977 1.00 0.00 H ATOM 1722 HD13 ILE A 151 13.151 12.412 49.719 1.00 0.00 H ATOM 1723 HG21 ILE A 151 12.138 8.053 51.811 1.00 0.00 H ATOM 1724 HG22 ILE A 151 12.282 8.512 50.097 1.00 0.00 H ATOM 1725 HG23 ILE A 151 13.325 9.284 51.316 1.00 0.00 H ATOM 1726 H ILE A 151 10.474 7.469 50.402 1.00 0.00 H ATOM 1727 N PRO A 152 8.386 11.129 49.978 1.00 42.30 N ATOM 1728 CA PRO A 152 7.794 11.873 48.854 1.00 41.49 C ATOM 1729 C PRO A 152 8.798 12.416 47.866 1.00 40.51 C ATOM 1730 O PRO A 152 9.810 12.986 48.271 1.00 40.80 O ATOM 1731 CB PRO A 152 7.060 13.050 49.535 1.00 41.69 C ATOM 1732 CG PRO A 152 7.503 13.038 50.955 1.00 42.05 C ATOM 1733 CD PRO A 152 7.883 11.625 51.270 1.00 42.37 C ATOM 1734 HA PRO A 152 7.159 11.212 48.264 1.00 0.00 H ATOM 1735 HD3 PRO A 152 8.659 11.587 52.035 1.00 0.00 H ATOM 1736 HD2 PRO A 152 7.019 11.050 51.603 1.00 0.00 H ATOM 1737 HG3 PRO A 152 6.692 13.364 51.606 1.00 0.00 H ATOM 1738 HG2 PRO A 152 8.361 13.697 51.088 1.00 0.00 H ATOM 1739 HB2 PRO A 152 7.332 13.993 49.060 1.00 0.00 H ATOM 1740 HB3 PRO A 152 5.981 12.911 49.473 1.00 0.00 H ATOM 1741 N LEU A 153 8.519 12.227 46.579 1.00 38.93 N ATOM 1742 CA LEU A 153 9.252 12.920 45.544 1.00 37.69 C ATOM 1743 C LEU A 153 8.453 14.154 45.226 1.00 37.21 C ATOM 1744 O LEU A 153 7.320 14.066 44.756 1.00 37.45 O ATOM 1745 CB LEU A 153 9.417 12.077 44.273 1.00 37.73 C ATOM 1746 CG LEU A 153 10.140 12.825 43.141 1.00 37.45 C ATOM 1747 CD1 LEU A 153 11.607 13.038 43.499 1.00 36.71 C ATOM 1748 CD2 LEU A 153 10.007 12.122 41.793 1.00 36.90 C ATOM 1749 HA LEU A 153 10.259 13.146 45.894 1.00 0.00 H ATOM 1750 HB2 LEU A 153 9.991 11.184 44.521 1.00 0.00 H ATOM 1751 HB3 LEU A 153 8.428 11.785 43.920 1.00 0.00 H ATOM 1752 HG LEU A 153 9.654 13.795 43.036 1.00 0.00 H ATOM 1753 HD21 LEU A 153 10.437 11.123 41.862 1.00 0.00 H ATOM 1754 HD22 LEU A 153 8.953 12.048 41.526 1.00 0.00 H ATOM 1755 HD23 LEU A 153 10.537 12.695 41.032 1.00 0.00 H ATOM 1756 HD11 LEU A 153 11.675 13.626 44.414 1.00 0.00 H ATOM 1757 HD12 LEU A 153 12.087 12.071 43.650 1.00 0.00 H ATOM 1758 HD13 LEU A 153 12.104 13.569 42.687 1.00 0.00 H ATOM 1759 H LEU A 153 7.759 11.568 46.313 1.00 0.00 H ATOM 1760 N VAL A 154 9.046 15.307 45.497 1.00 36.30 N ATOM 1761 CA VAL A 154 8.395 16.580 45.257 1.00 35.63 C ATOM 1762 C VAL A 154 9.404 17.515 44.632 1.00 34.69 C ATOM 1763 O VAL A 154 10.405 17.859 45.246 1.00 35.52 O ATOM 1764 CB VAL A 154 7.845 17.210 46.573 1.00 35.68 C ATOM 1765 CG1 VAL A 154 7.179 18.549 46.297 1.00 35.76 C ATOM 1766 CG2 VAL A 154 6.862 16.271 47.247 1.00 35.56 C ATOM 1767 HA VAL A 154 7.545 16.419 44.594 1.00 0.00 H ATOM 1768 HB VAL A 154 8.689 17.374 47.243 1.00 0.00 H ATOM 1769 HG11 VAL A 154 7.907 19.232 45.859 1.00 0.00 H ATOM 1770 HG12 VAL A 154 6.350 18.405 45.604 1.00 0.00 H ATOM 1771 HG13 VAL A 154 6.804 18.966 47.232 1.00 0.00 H ATOM 1772 HG21 VAL A 154 6.028 16.076 46.573 1.00 0.00 H ATOM 1773 HG22 VAL A 154 7.363 15.333 47.487 1.00 0.00 H ATOM 1774 HG23 VAL A 154 6.491 16.731 48.163 1.00 0.00 H ATOM 1775 H VAL A 154 10.007 15.299 45.894 1.00 0.00 H ATOM 1776 N LEU A 155 9.159 17.915 43.399 1.00 33.31 N ATOM 1777 CA LEU A 155 9.949 18.979 42.819 1.00 32.15 C ATOM 1778 C LEU A 155 9.231 20.290 43.137 1.00 32.27 C ATOM 1779 O LEU A 155 7.995 20.328 43.231 1.00 31.63 O ATOM 1780 CB LEU A 155 10.103 18.787 41.314 1.00 31.74 C ATOM 1781 CG LEU A 155 10.538 17.396 40.828 1.00 30.26 C ATOM 1782 CD1 LEU A 155 10.702 17.410 39.314 1.00 29.78 C ATOM 1783 CD2 LEU A 155 11.830 16.942 41.489 1.00 27.98 C ATOM 1784 HA LEU A 155 10.956 18.983 43.235 1.00 0.00 H ATOM 1785 HB2 LEU A 155 9.140 19.010 40.854 1.00 0.00 H ATOM 1786 HB3 LEU A 155 10.846 19.504 40.965 1.00 0.00 H ATOM 1787 HG LEU A 155 9.760 16.685 41.108 1.00 0.00 H ATOM 1788 HD21 LEU A 155 12.625 17.650 41.254 1.00 0.00 H ATOM 1789 HD22 LEU A 155 11.688 16.898 42.569 1.00 0.00 H ATOM 1790 HD23 LEU A 155 12.100 15.954 41.116 1.00 0.00 H ATOM 1791 HD11 LEU A 155 9.752 17.675 38.849 1.00 0.00 H ATOM 1792 HD12 LEU A 155 11.460 18.143 39.039 1.00 0.00 H ATOM 1793 HD13 LEU A 155 11.011 16.421 38.974 1.00 0.00 H ATOM 1794 H LEU A 155 8.401 17.467 42.846 1.00 0.00 H ATOM 1795 N SER A 156 9.992 21.360 43.330 1.00 31.60 N ATOM 1796 CA SER A 156 9.357 22.656 43.551 1.00 31.43 C ATOM 1797 C SER A 156 9.987 23.735 42.709 1.00 31.15 C ATOM 1798 O SER A 156 9.279 24.505 42.063 1.00 31.94 O ATOM 1799 CB SER A 156 9.313 23.032 45.037 1.00 31.15 C ATOM 1800 OG SER A 156 10.588 22.937 45.644 1.00 32.73 O ATOM 1801 HA SER A 156 8.321 22.563 43.226 1.00 0.00 H ATOM 1802 HB2 SER A 156 8.627 22.359 45.551 1.00 0.00 H ATOM 1803 HB3 SER A 156 8.953 24.057 45.131 1.00 0.00 H ATOM 1804 HG SER A 156 10.920 22.007 45.569 1.00 0.00 H ATOM 1805 H SER A 156 11.029 21.276 43.324 1.00 0.00 H ATOM 1806 N ARG A 157 11.314 23.803 42.695 1.00 30.03 N ATOM 1807 CA ARG A 157 11.965 24.849 41.927 1.00 29.60 C ATOM 1808 C ARG A 157 13.272 24.379 41.297 1.00 28.44 C ATOM 1809 O ARG A 157 14.086 23.746 41.956 1.00 28.17 O ATOM 1810 CB ARG A 157 12.172 26.119 42.775 1.00 30.14 C ATOM 1811 CG ARG A 157 13.371 26.065 43.758 1.00 32.24 C ATOM 1812 CD ARG A 157 13.043 25.335 45.056 1.00 36.45 C ATOM 1813 NE ARG A 157 12.588 26.245 46.106 1.00 39.60 N ATOM 1814 CZ ARG A 157 11.961 25.863 47.215 1.00 42.04 C ATOM 1815 NH1 ARG A 157 11.707 24.576 47.441 1.00 42.00 N ATOM 1816 NH2 ARG A 157 11.595 26.772 48.112 1.00 43.63 N ATOM 1817 HA ARG A 157 11.295 25.101 41.105 1.00 0.00 H ATOM 1818 HB2 ARG A 157 12.329 26.957 42.096 1.00 0.00 H ATOM 1819 HB3 ARG A 157 11.266 26.289 43.356 1.00 0.00 H ATOM 1820 HG2 ARG A 157 14.199 25.551 43.269 1.00 0.00 H ATOM 1821 HG3 ARG A 157 13.670 27.085 43.999 1.00 0.00 H ATOM 1822 HD2 ARG A 157 13.938 24.818 45.403 1.00 0.00 H ATOM 1823 HD3 ARG A 157 12.257 24.606 44.859 1.00 0.00 H ATOM 1824 HE ARG A 157 12.767 27.261 45.977 1.00 0.00 H ATOM 1825 HH12 ARG A 157 11.216 24.288 48.311 1.00 0.00 H ATOM 1826 HH11 ARG A 157 11.999 23.859 46.747 1.00 0.00 H ATOM 1827 HH22 ARG A 157 11.105 26.477 48.980 1.00 0.00 H ATOM 1828 HH21 ARG A 157 11.799 27.778 47.946 1.00 0.00 H ATOM 1829 H ARG A 157 11.881 23.114 43.229 1.00 0.00 H ATOM 1830 N PRO A 158 13.464 24.697 40.012 1.00 28.13 N ATOM 1831 CA PRO A 158 14.727 24.437 39.324 1.00 27.78 C ATOM 1832 C PRO A 158 15.838 25.295 39.927 1.00 27.94 C ATOM 1833 O PRO A 158 15.577 26.430 40.355 1.00 27.30 O ATOM 1834 CB PRO A 158 14.445 24.893 37.889 1.00 27.72 C ATOM 1835 CG PRO A 158 13.304 25.819 37.983 1.00 27.77 C ATOM 1836 CD PRO A 158 12.475 25.354 39.133 1.00 28.10 C ATOM 1837 HA PRO A 158 15.049 23.398 39.395 1.00 0.00 H ATOM 1838 HD3 PRO A 158 11.999 26.194 39.638 1.00 0.00 H ATOM 1839 HD2 PRO A 158 11.711 24.648 38.806 1.00 0.00 H ATOM 1840 HG3 PRO A 158 12.720 25.793 37.063 1.00 0.00 H ATOM 1841 HG2 PRO A 158 13.657 26.835 38.159 1.00 0.00 H ATOM 1842 HB2 PRO A 158 15.315 25.402 37.474 1.00 0.00 H ATOM 1843 HB3 PRO A 158 14.191 24.039 37.261 1.00 0.00 H ATOM 1844 N LEU A 159 17.060 24.770 39.962 1.00 27.60 N ATOM 1845 CA LEU A 159 18.176 25.531 40.508 1.00 27.94 C ATOM 1846 C LEU A 159 18.496 26.723 39.600 1.00 29.42 C ATOM 1847 O LEU A 159 18.542 26.582 38.382 1.00 28.38 O ATOM 1848 CB LEU A 159 19.409 24.647 40.710 1.00 27.49 C ATOM 1849 CG LEU A 159 20.691 25.319 41.233 1.00 27.37 C ATOM 1850 CD1 LEU A 159 20.508 25.871 42.630 1.00 25.97 C ATOM 1851 CD2 LEU A 159 21.849 24.359 41.193 1.00 26.13 C ATOM 1852 HA LEU A 159 17.885 25.909 41.488 1.00 0.00 H ATOM 1853 HB2 LEU A 159 19.137 23.866 41.420 1.00 0.00 H ATOM 1854 HB3 LEU A 159 19.647 24.195 39.747 1.00 0.00 H ATOM 1855 HG LEU A 159 20.909 26.159 40.574 1.00 0.00 H ATOM 1856 HD21 LEU A 159 21.624 23.494 41.817 1.00 0.00 H ATOM 1857 HD22 LEU A 159 22.015 24.034 40.166 1.00 0.00 H ATOM 1858 HD23 LEU A 159 22.744 24.856 41.567 1.00 0.00 H ATOM 1859 HD11 LEU A 159 19.710 26.614 42.624 1.00 0.00 H ATOM 1860 HD12 LEU A 159 20.246 25.059 43.309 1.00 0.00 H ATOM 1861 HD13 LEU A 159 21.437 26.336 42.960 1.00 0.00 H ATOM 1862 H LEU A 159 17.220 23.809 39.597 1.00 0.00 H ATOM 1863 N SER A 160 18.683 27.894 40.206 1.00 31.38 N ATOM 1864 CA SER A 160 19.064 29.089 39.454 1.00 33.41 C ATOM 1865 C SER A 160 20.554 29.393 39.606 1.00 34.13 C ATOM 1866 O SER A 160 21.174 29.047 40.615 1.00 33.86 O ATOM 1867 CB SER A 160 18.207 30.292 39.868 1.00 33.46 C ATOM 1868 OG SER A 160 18.041 30.347 41.279 1.00 35.30 O ATOM 1869 HA SER A 160 18.878 28.891 38.398 1.00 0.00 H ATOM 1870 HB2 SER A 160 17.227 30.209 39.398 1.00 0.00 H ATOM 1871 HB3 SER A 160 18.694 31.208 39.531 1.00 0.00 H ATOM 1872 HG SER A 160 17.485 31.132 41.514 1.00 0.00 H ATOM 1873 H SER A 160 18.555 27.960 41.236 1.00 0.00 H ATOM 1874 N SER A 161 21.120 30.031 38.580 1.00 35.70 N ATOM 1875 CA SER A 161 22.497 30.518 38.613 1.00 36.85 C ATOM 1876 C SER A 161 22.518 31.743 39.527 1.00 37.78 C ATOM 1877 O SER A 161 21.479 32.380 39.720 1.00 38.65 O ATOM 1878 CB SER A 161 22.942 30.881 37.191 1.00 37.00 C ATOM 1879 OG SER A 161 24.250 30.412 36.922 1.00 36.91 O ATOM 1880 HA SER A 161 23.183 29.760 38.991 1.00 0.00 H ATOM 1881 HB2 SER A 161 22.924 31.965 37.080 1.00 0.00 H ATOM 1882 HB3 SER A 161 22.251 30.432 36.478 1.00 0.00 H ATOM 1883 HG SER A 161 24.506 30.662 35.999 1.00 0.00 H ATOM 1884 H SER A 161 20.557 30.188 37.720 1.00 0.00 H ATOM 1885 N ASN A 162 23.677 32.062 40.100 1.00 38.66 N ATOM 1886 CA ASN A 162 23.844 33.240 40.992 1.00 39.42 C ATOM 1887 C ASN A 162 24.133 32.852 42.448 1.00 39.16 C ATOM 1888 O ASN A 162 25.276 32.609 42.838 1.00 38.72 O ATOM 1889 CB ASN A 162 22.628 34.188 40.931 1.00 39.56 C ATOM 1890 CG ASN A 162 22.884 35.456 40.110 1.00 41.29 C ATOM 1891 OD1 ASN A 162 22.986 35.426 38.878 1.00 42.72 O ATOM 1892 ND2 ASN A 162 22.955 36.590 40.803 1.00 42.79 N ATOM 1893 HA ASN A 162 24.718 33.769 40.612 1.00 0.00 H ATOM 1894 HB2 ASN A 162 21.792 33.650 40.484 1.00 0.00 H ATOM 1895 HB3 ASN A 162 22.367 34.481 41.948 1.00 0.00 H ATOM 1896 HD22 ASN A 162 22.864 36.573 41.839 1.00 0.00 H ATOM 1897 HD21 ASN A 162 23.101 37.493 40.309 1.00 0.00 H ATOM 1898 H ASN A 162 24.504 31.459 39.915 1.00 0.00 H TER 1899 ASN A 162 HETATM 1900 CA CAS A 1 14.406 8.345 26.844 1.00 28.34 CA HETATM 1901 CA CAS A 2 8.878 17.478 26.885 1.00 24.13 CA HETATM 1902 O HOH 3 10.878 5.240 33.242 1.00 14.42 O HETATM 1903 O HOH 4 8.035 9.693 34.460 1.00 15.25 O HETATM 1904 O HOH 5 14.300 4.260 21.974 1.00 34.19 O HETATM 1905 O HOH 6 26.156 23.978 33.737 1.00 22.04 O HETATM 1906 O HOH 7 17.667 5.940 38.909 1.00 18.66 O HETATM 1907 O HOH 8 11.578 2.360 34.432 1.00 22.41 O HETATM 1908 O HOH 9 4.864 -1.793 38.087 1.00 19.72 O HETATM 1909 O HOH 10 3.400 4.252 29.889 1.00 30.55 O HETATM 1910 O HOH 11 11.896 3.144 45.024 1.00 30.73 O HETATM 1911 O HOH 12 25.869 17.455 33.058 1.00 32.73 O HETATM 1912 O HOH 13 13.443 0.250 37.995 1.00 29.86 O HETATM 1913 O HOH 14 23.523 26.306 45.319 1.00 27.75 O HETATM 1914 O HOH 15 9.787 -0.697 36.473 1.00 19.69 O HETATM 1915 O HOH 16 18.339 10.093 29.762 1.00 24.94 O HETATM 1916 O HOH 17 14.150 28.654 40.408 1.00 37.93 O HETATM 1917 O HOH 18 4.761 0.476 36.284 1.00 26.50 O HETATM 1918 O HOH 19 7.308 0.754 36.847 1.00 28.17 O HETATM 1919 O HOH 20 6.812 6.591 25.149 1.00 34.15 O HETATM 1920 O HOH 21 24.343 24.053 30.924 1.00 26.40 O HETATM 1921 O HOH 22 23.250 18.117 48.115 1.00 42.57 O HETATM 1922 O HOH 23 5.475 13.454 42.991 1.00 26.02 O HETATM 1923 O HOH 24 3.412 14.751 41.703 1.00 24.51 O HETATM 1924 O HOH 25 0.900 7.668 37.645 1.00 44.53 O HETATM 1925 O HOH 26 26.187 8.880 29.487 1.00 42.13 O HETATM 1926 O HOH 27 17.470 16.578 54.393 1.00 42.91 O HETATM 1927 O HOH 28 5.391 21.149 43.925 1.00 35.33 O HETATM 1928 O HOH 29 24.526 25.174 47.645 1.00 36.76 O HETATM 1929 O HOH 30 14.034 0.742 33.994 1.00 54.80 O HETATM 1930 O HOH 31 2.032 7.880 44.986 1.00 45.57 O HETATM 1931 O HOH 32 31.638 17.878 34.726 1.00 55.24 O HETATM 1932 O HOH 33 23.923 13.772 43.988 1.00 45.23 O HETATM 1933 O HOH 34 12.024 18.518 26.284 1.00 39.07 O HETATM 1934 O HOH 35 3.818 5.204 27.038 1.00 33.70 O HETATM 1935 O HOH 36 6.251 13.998 54.307 1.00 51.55 O HETATM 1936 O HOH 37 24.694 13.146 28.449 1.00 34.48 O HETATM 1937 O HOH 38 -1.578 14.742 42.690 1.00 44.04 O HETATM 1938 O HOH 39 30.668 12.365 40.766 1.00 39.07 O HETATM 1939 O HOH 40 17.259 28.785 26.527 1.00 38.58 O HETATM 1940 O HOH 41 34.297 20.203 36.596 1.00 47.55 O HETATM 1941 O HOH 42 17.282 5.845 28.208 1.00 35.52 O HETATM 1942 O HOH 43 23.246 14.104 49.290 1.00 42.54 O HETATM 1943 O HOH 44 0.611 6.407 35.240 1.00 39.45 O HETATM 1944 O HOH 45 11.404 15.551 47.332 1.00 54.61 O HETATM 1945 O HOH 46 16.198 27.071 45.099 1.00 54.22 O HETATM 1946 O HOH 47 22.186 0.714 33.709 1.00 43.75 O HETATM 1947 O HOH 48 6.631 22.780 34.422 1.00 27.26 O HETATM 1948 O HOH 49 18.548 28.453 35.702 1.00 46.52 O HETATM 1949 O HOH 50 4.492 11.164 25.142 1.00 38.28 O HETATM 1950 O HOH 51 19.962 24.641 30.001 1.00 35.41 O HETATM 1951 O HOH 52 20.097 33.110 37.051 1.00 40.85 O HETATM 1952 O HOH 53 17.116 8.384 52.699 1.00 46.34 O HETATM 1953 O HOH 54 18.340 24.836 37.057 1.00 35.82 O HETATM 1954 O HOH 55 27.684 10.928 38.796 1.00 28.63 O HETATM 1955 O HOH 56 14.655 3.448 44.991 1.00 25.21 O HETATM 1956 O HOH 57 22.735 4.453 44.765 1.00 31.69 O HETATM 1957 O HOH 58 3.026 0.828 45.519 1.00 37.33 O HETATM 1958 O HOH 59 17.540 1.685 45.441 1.00 50.80 O HETATM 1959 O HOH 60 13.821 0.421 43.006 1.00 46.94 O HETATM 1960 N SER A 61 31.507 13.280 47.474 1.00 0.24 N HETATM 1961 CA SER A 61 30.083 13.151 47.784 1.00 0.09 C HETATM 1962 C SER A 61 29.572 11.786 47.338 1.00 0.23 C HETATM 1963 O SER A 61 29.810 11.366 46.201 1.00 -0.39 O HETATM 1964 N SER A 61 28.881 11.089 48.238 1.00 -0.26 N HETATM 1965 CA SER A 61 28.196 9.861 47.874 1.00 0.16 C HETATM 1966 C SER A 61 27.000 10.241 46.998 1.00 0.21 C HETATM 1967 O SER A 61 26.202 11.111 47.366 1.00 -0.39 O HETATM 1968 N SER A 61 26.924 9.612 45.828 1.00 -0.26 N HETATM 1969 CA SER A 61 25.881 9.874 44.838 1.00 0.13 C HETATM 1970 C SER A 61 24.859 8.720 44.826 1.00 0.20 C HETATM 1971 O SER A 61 25.093 7.664 44.237 1.00 -0.39 O HETATM 1972 N SER A 61 23.726 8.949 45.475 1.00 -0.26 N HETATM 1973 CA SER A 61 22.714 7.908 45.676 1.00 0.13 C HETATM 1974 C SER A 61 21.620 7.928 44.611 1.00 0.20 C HETATM 1975 O SER A 61 21.029 8.972 44.337 1.00 -0.39 O HETATM 1976 N SER A 61 21.353 6.763 44.030 1.00 -0.26 N HETATM 1977 CA SER A 61 20.290 6.628 43.034 1.00 0.15 C HETATM 1978 C SER A 61 19.009 6.076 43.636 1.00 0.21 C HETATM 1979 O SER A 61 19.040 5.343 44.628 1.00 -0.39 O HETATM 1980 N SER A 61 17.880 6.460 43.040 1.00 -0.26 N HETATM 1981 CA SER A 61 16.576 6.002 43.471 1.00 0.15 C HETATM 1982 C SER A 61 15.688 5.803 42.249 1.00 0.21 C HETATM 1983 O SER A 61 16.009 6.255 41.150 1.00 -0.39 O HETATM 1984 N SER A 61 14.585 5.094 42.444 1.00 -0.26 N HETATM 1985 CA SER A 61 13.568 4.982 41.419 1.00 0.16 C HETATM 1986 C SER A 61 12.258 5.453 42.038 1.00 0.21 C HETATM 1987 O SER A 61 12.135 5.506 43.277 1.00 -0.39 O HETATM 1988 N SER A 61 11.297 5.820 41.186 1.00 -0.26 N HETATM 1989 CA SER A 61 10.029 6.368 41.636 1.00 0.13 C HETATM 1990 C SER A 61 8.978 5.259 41.735 1.00 0.20 C HETATM 1991 O SER A 61 8.839 4.463 40.821 1.00 -0.39 O HETATM 1992 N SER A 61 8.246 5.209 42.848 1.00 -0.26 N HETATM 1993 CA SER A 61 7.058 4.355 42.922 1.00 0.13 C HETATM 1994 C SER A 61 5.876 5.148 42.421 1.00 0.20 C HETATM 1995 O SER A 61 5.470 6.131 43.037 1.00 -0.39 O HETATM 1996 N SER A 61 5.355 4.739 41.268 1.00 -0.26 N HETATM 1997 CA SER A 61 4.155 5.333 40.696 1.00 0.14 C HETATM 1998 C SER A 61 2.934 4.546 41.167 1.00 0.20 C HETATM 1999 O SER A 61 2.618 3.493 40.624 1.00 -0.39 O HETATM 2000 N SER A 61 2.275 5.047 42.208 1.00 -0.27 N HETATM 2001 CA SER A 61 1.078 4.406 42.751 1.00 0.12 C HETATM 2002 C SER A 61 0.077 5.438 43.265 1.00 0.06 C HETATM 2003 O SER A 61 0.299 6.655 43.143 1.00 -0.57 O HETATM 2004 OXT SER A 61 -0.971 5.079 43.842 1.00 -0.57 O HETATM 2005 CB SER A 61 1.455 3.435 43.874 1.00 0.08 C HETATM 2006 OG SER A 61 2.358 2.437 43.421 1.00 -0.39 O HETATM 2007 H79 SER A 61 2.570 1.854 44.140 1.00 0.21 H HETATM 2008 H77 SER A 61 0.542 2.948 44.246 1.00 0.06 H HETATM 2009 H78 SER A 61 1.928 4.000 44.691 1.00 0.06 H HETATM 2010 H76 SER A 61 0.599 3.834 41.943 1.00 0.07 H HETATM 2011 H75 SER A 61 2.609 5.889 42.633 1.00 0.19 H HETATM 2012 CB SER A 61 4.239 5.364 39.160 1.00 0.01 C HETATM 2013 CG SER A 61 5.360 6.215 38.629 1.00 -0.00 C HETATM 2014 ND1 SER A 61 6.583 5.694 38.261 1.00 -0.33 N HETATM 2015 CE1 SER A 61 7.359 6.668 37.810 1.00 0.09 C HETATM 2016 NE2 SER A 61 6.691 7.806 37.893 1.00 -0.28 N HETATM 2017 CD2 SER A 61 5.433 7.547 38.390 1.00 0.03 C HETATM 2018 H72 SER A 61 4.643 8.277 38.560 1.00 0.07 H HETATM 2019 H74 SER A 61 7.052 8.734 37.629 1.00 0.24 H HETATM 2020 H73 SER A 61 8.375 6.551 37.435 1.00 0.12 H HETATM 2021 H70 SER A 61 3.289 5.758 38.769 1.00 0.04 H HETATM 2022 H71 SER A 61 4.385 4.335 38.800 1.00 0.04 H HETATM 2023 H69 SER A 61 4.067 6.368 41.058 1.00 0.08 H HETATM 2024 H68 SER A 61 5.805 3.994 40.775 1.00 0.19 H HETATM 2025 CB SER A 61 6.778 3.795 44.348 1.00 -0.01 C HETATM 2026 CG1 SER A 61 5.656 2.745 44.301 1.00 -0.06 C HETATM 2027 H62 SER A 61 5.471 2.360 45.315 1.00 0.02 H HETATM 2028 H63 SER A 61 5.957 1.916 43.644 1.00 0.02 H HETATM 2029 H64 SER A 61 4.737 3.207 43.911 1.00 0.02 H HETATM 2030 CG2 SER A 61 8.030 3.221 44.955 1.00 -0.06 C HETATM 2031 H65 SER A 61 8.814 3.992 44.976 1.00 0.02 H HETATM 2032 H66 SER A 61 8.372 2.367 44.352 1.00 0.02 H HETATM 2033 H67 SER A 61 7.819 2.885 45.981 1.00 0.02 H HETATM 2034 H61 SER A 61 6.442 4.627 44.984 1.00 0.03 H HETATM 2035 H60 SER A 61 7.214 3.496 42.253 1.00 0.08 H HETATM 2036 H59 SER A 61 8.510 5.760 43.640 1.00 0.19 H HETATM 2037 CB SER A 61 9.504 7.481 40.660 1.00 -0.01 C HETATM 2038 CG1 SER A 61 8.285 8.159 41.230 1.00 -0.06 C HETATM 2039 H53 SER A 61 7.936 8.933 40.531 1.00 0.02 H HETATM 2040 H54 SER A 61 8.541 8.624 42.194 1.00 0.02 H HETATM 2041 H55 SER A 61 7.489 7.415 41.381 1.00 0.02 H HETATM 2042 CG2 SER A 61 10.575 8.520 40.400 1.00 -0.06 C HETATM 2043 H56 SER A 61 11.468 8.030 39.984 1.00 0.02 H HETATM 2044 H57 SER A 61 10.838 9.020 41.344 1.00 0.02 H HETATM 2045 H58 SER A 61 10.197 9.264 39.684 1.00 0.02 H HETATM 2046 H52 SER A 61 9.232 7.007 39.705 1.00 0.03 H HETATM 2047 H51 SER A 61 10.175 6.812 42.632 1.00 0.08 H HETATM 2048 H50 SER A 61 11.456 5.714 40.204 1.00 0.19 H HETATM 2049 CB SER A 61 13.452 3.536 40.834 1.00 0.09 C HETATM 2050 OG1 SER A 61 12.915 2.661 41.817 1.00 -0.39 O HETATM 2051 H46 SER A 61 12.847 1.785 41.456 1.00 0.21 H HETATM 2052 CG2 SER A 61 14.792 2.992 40.415 1.00 -0.03 C HETATM 2053 H47 SER A 61 14.665 1.977 40.011 1.00 0.03 H HETATM 2054 H48 SER A 61 15.463 2.959 41.286 1.00 0.03 H HETATM 2055 H49 SER A 61 15.227 3.643 39.642 1.00 0.03 H HETATM 2056 H45 SER A 61 12.784 3.561 39.960 1.00 0.06 H HETATM 2057 H44 SER A 61 13.830 5.656 40.590 1.00 0.08 H HETATM 2058 H43 SER A 61 14.452 4.626 43.318 1.00 0.19 H HETATM 2059 CB SER A 61 15.937 7.008 44.440 1.00 0.08 C HETATM 2060 OG SER A 61 16.805 7.304 45.519 1.00 -0.39 O HETATM 2061 H42 SER A 61 16.385 7.927 46.100 1.00 0.21 H HETATM 2062 H40 SER A 61 15.004 6.581 44.837 1.00 0.06 H HETATM 2063 H41 SER A 61 15.712 7.937 43.896 1.00 0.06 H HETATM 2064 H39 SER A 61 16.691 5.039 43.990 1.00 0.08 H HETATM 2065 H38 SER A 61 17.936 7.089 42.265 1.00 0.19 H HETATM 2066 CB SER A 61 20.751 5.920 41.756 1.00 0.04 C HETATM 2067 CG SER A 61 21.656 6.806 40.926 1.00 -0.00 C HETATM 2068 CD1 SER A 61 23.012 6.934 41.238 1.00 -0.02 C HETATM 2069 CE1 SER A 61 23.845 7.755 40.503 1.00 0.01 C HETATM 2070 CZ SER A 61 23.332 8.488 39.445 1.00 0.17 C HETATM 2071 CE2 SER A 61 21.982 8.396 39.126 1.00 0.01 C HETATM 2072 CD2 SER A 61 21.154 7.552 39.860 1.00 -0.02 C HETATM 2073 H35 SER A 61 20.105 7.473 39.600 1.00 0.07 H HETATM 2074 H37 SER A 61 21.576 8.980 38.308 1.00 0.07 H HETATM 2075 OH SER A 61 24.105 9.238 38.820 1.00 -0.20 O HETATM 2076 P SER A 61 24.575 8.933 37.326 1.00 0.13 P HETATM 2077 O1P SER A 61 25.432 10.024 36.832 1.00 -0.67 O HETATM 2078 O2P SER A 61 23.349 8.781 36.397 1.00 -0.67 O HETATM 2079 O3P SER A 61 25.381 7.621 37.335 1.00 -0.67 O HETATM 2080 H36 SER A 61 24.897 7.826 40.753 1.00 0.07 H HETATM 2081 H34 SER A 61 23.419 6.377 42.074 1.00 0.07 H HETATM 2082 H32 SER A 61 19.868 5.651 41.158 1.00 0.06 H HETATM 2083 H33 SER A 61 21.299 5.007 42.031 1.00 0.06 H HETATM 2084 H31 SER A 61 20.045 7.654 42.721 1.00 0.08 H HETATM 2085 H30 SER A 61 21.892 5.959 44.280 1.00 0.19 H HETATM 2086 CB SER A 61 22.089 8.041 47.068 1.00 -0.00 C HETATM 2087 CG SER A 61 23.055 7.689 48.203 1.00 0.00 C HETATM 2088 CD SER A 61 22.503 8.043 49.573 1.00 0.04 C HETATM 2089 OE1 SER A 61 21.528 7.387 50.002 1.00 -0.57 O HETATM 2090 OE2 SER A 61 23.045 8.978 50.212 1.00 -0.57 O HETATM 2091 H28 SER A 61 23.995 8.240 48.049 1.00 0.04 H HETATM 2092 H29 SER A 61 23.255 6.608 48.173 1.00 0.04 H HETATM 2093 H26 SER A 61 21.221 7.367 47.127 1.00 0.03 H HETATM 2094 H27 SER A 61 21.756 9.081 47.203 1.00 0.03 H HETATM 2095 H25 SER A 61 23.221 6.934 45.617 1.00 0.08 H HETATM 2096 H24 SER A 61 23.556 9.864 45.840 1.00 0.19 H HETATM 2097 CB SER A 61 26.496 10.111 43.423 1.00 -0.01 C HETATM 2098 CG1 SER A 61 25.417 10.445 42.411 1.00 -0.06 C HETATM 2099 H18 SER A 61 25.877 10.607 41.425 1.00 0.02 H HETATM 2100 H19 SER A 61 24.890 11.358 42.724 1.00 0.02 H HETATM 2101 H20 SER A 61 24.701 9.612 42.350 1.00 0.02 H HETATM 2102 CG2 SER A 61 27.527 11.235 43.470 1.00 -0.06 C HETATM 2103 H21 SER A 61 28.306 10.987 44.205 1.00 0.02 H HETATM 2104 H22 SER A 61 27.033 12.174 43.762 1.00 0.02 H HETATM 2105 H23 SER A 61 27.985 11.355 42.477 1.00 0.02 H HETATM 2106 H17 SER A 61 26.999 9.186 43.104 1.00 0.03 H HETATM 2107 H16 SER A 61 25.353 10.793 45.133 1.00 0.08 H HETATM 2108 H15 SER A 61 27.617 8.924 45.615 1.00 0.19 H HETATM 2109 CB SER A 61 27.787 9.031 49.123 1.00 0.09 C HETATM 2110 OG1 SER A 61 28.918 8.270 49.567 1.00 -0.39 O HETATM 2111 H11 SER A 61 28.675 7.760 50.331 1.00 0.21 H HETATM 2112 CG2 SER A 61 26.653 8.063 48.814 1.00 -0.03 C HETATM 2113 H12 SER A 61 26.396 7.498 49.722 1.00 0.03 H HETATM 2114 H13 SER A 61 26.971 7.365 48.026 1.00 0.03 H HETATM 2115 H14 SER A 61 25.773 8.627 48.471 1.00 0.03 H HETATM 2116 H10 SER A 61 27.467 9.718 49.920 1.00 0.06 H HETATM 2117 H9 SER A 61 28.881 9.243 47.276 1.00 0.08 H HETATM 2118 H8 SER A 61 28.833 11.417 49.181 1.00 0.19 H HETATM 2119 CB SER A 61 29.262 14.240 47.080 1.00 0.10 C HETATM 2120 OG SER A 61 29.807 15.538 47.245 1.00 -0.39 O HETATM 2121 H7 SER A 61 29.261 16.169 46.791 1.00 0.21 H HETATM 2122 H5 SER A 61 28.243 14.233 47.493 1.00 0.06 H HETATM 2123 H6 SER A 61 29.224 14.010 46.005 1.00 0.06 H HETATM 2124 H4 SER A 61 29.949 13.249 48.871 1.00 0.11 H HETATM 2125 H1 SER A 61 31.835 14.185 47.773 1.00 0.20 H HETATM 2126 H2 SER A 61 31.645 13.184 46.480 1.00 0.20 H HETATM 2127 H3 SER A 61 32.022 12.560 47.956 1.00 0.20 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 1066 1080 1081 1082 1900 CONECT 1066 1067 CONECT 1080 1066 CONECT 1081 1066 CONECT 1082 1066 CONECT 1379 1394 1395 1396 1901 CONECT 1379 1380 CONECT 1394 1379 CONECT 1395 1379 CONECT 1396 1379 CONECT 1589 1590 1598 1599 1600 CONECT 1598 1589 CONECT 1599 1589 CONECT 1600 1589 CONECT 1684 1685 1705 1706 1707 CONECT 1705 1684 CONECT 1706 1684 CONECT 1707 1684 CONECT 1900 1066 CONECT 1901 1379 CONECT 1960 1961 2125 2126 2127 CONECT 1961 1960 1962 2119 2124 CONECT 1962 1961 1963 1964 CONECT 1963 1962 CONECT 1964 1962 1965 2118 CONECT 1965 1964 1966 2109 2117 CONECT 1966 1965 1967 1968 CONECT 1967 1966 CONECT 1968 1966 1969 2108 CONECT 1969 1968 1970 2097 2107 CONECT 1970 1969 1971 1972 CONECT 1971 1970 CONECT 1972 1970 1973 2096 CONECT 1973 1972 1974 2086 2095 CONECT 1974 1973 1975 1976 CONECT 1975 1974 CONECT 1976 1974 1977 2085 CONECT 1977 1976 1978 2066 2084 CONECT 1978 1977 1979 1980 CONECT 1979 1978 CONECT 1980 1978 1981 2065 CONECT 1981 1980 1982 2059 2064 CONECT 1982 1981 1983 1984 CONECT 1983 1982 CONECT 1984 1982 1985 2058 CONECT 1985 1984 1986 2049 2057 CONECT 1986 1985 1987 1988 CONECT 1987 1986 CONECT 1988 1986 1989 2048 CONECT 1989 1988 1990 2037 2047 CONECT 1990 1989 1991 1992 CONECT 1991 1990 CONECT 1992 1990 1993 2036 CONECT 1993 1992 1994 2025 2035 CONECT 1994 1993 1995 1996 CONECT 1995 1994 CONECT 1996 1994 1997 2024 CONECT 1997 1996 1998 2012 2023 CONECT 1998 1997 1999 2000 CONECT 1999 1998 CONECT 2000 1998 2001 2011 CONECT 2001 2000 2002 2005 2010 CONECT 2002 2001 2003 2004 CONECT 2003 2002 CONECT 2004 2002 CONECT 2005 2001 2006 2008 2009 CONECT 2006 2005 2007 CONECT 2007 2006 CONECT 2008 2005 CONECT 2009 2005 CONECT 2010 2001 CONECT 2011 2000 CONECT 2012 1997 2013 2021 2022 CONECT 2013 2012 2014 2017 CONECT 2014 2013 2015 CONECT 2015 2014 2016 2020 CONECT 2016 2015 2017 2019 CONECT 2017 2013 2016 2018 CONECT 2018 2017 CONECT 2019 2016 CONECT 2020 2015 CONECT 2021 2012 CONECT 2022 2012 CONECT 2023 1997 CONECT 2024 1996 CONECT 2025 1993 2026 2030 2034 CONECT 2026 2025 2027 2028 2029 CONECT 2027 2026 CONECT 2028 2026 CONECT 2029 2026 CONECT 2030 2025 2031 2032 2033 CONECT 2031 2030 CONECT 2032 2030 CONECT 2033 2030 CONECT 2034 2025 CONECT 2035 1993 CONECT 2036 1992 CONECT 2037 1989 2038 2042 2046 CONECT 2038 2037 2039 2040 2041 CONECT 2039 2038 CONECT 2040 2038 CONECT 2041 2038 CONECT 2042 2037 2043 2044 2045 CONECT 2043 2042 CONECT 2044 2042 CONECT 2045 2042 CONECT 2046 2037 CONECT 2047 1989 CONECT 2048 1988 CONECT 2049 1985 2050 2052 2056 CONECT 2050 2049 2051 CONECT 2051 2050 CONECT 2052 2049 2053 2054 2055 CONECT 2053 2052 CONECT 2054 2052 CONECT 2055 2052 CONECT 2056 2049 CONECT 2057 1985 CONECT 2058 1984 CONECT 2059 1981 2060 2062 2063 CONECT 2060 2059 2061 CONECT 2061 2060 CONECT 2062 2059 CONECT 2063 2059 CONECT 2064 1981 CONECT 2065 1980 CONECT 2066 1977 2067 2082 2083 CONECT 2067 2066 2068 2072 CONECT 2068 2067 2069 2081 CONECT 2069 2068 2070 2080 CONECT 2070 2069 2071 2075 CONECT 2071 2070 2072 2074 CONECT 2072 2067 2071 2073 CONECT 2073 2072 CONECT 2074 2071 CONECT 2075 2070 2076 CONECT 2076 2075 2077 2078 2079 CONECT 2077 2076 CONECT 2078 2076 CONECT 2079 2076 CONECT 2080 2069 CONECT 2081 2068 CONECT 2082 2066 CONECT 2083 2066 CONECT 2084 1977 CONECT 2085 1976 CONECT 2086 1973 2087 2093 2094 CONECT 2087 2086 2088 2091 2092 CONECT 2088 2087 2089 2090 CONECT 2089 2088 CONECT 2090 2088 CONECT 2091 2087 CONECT 2092 2087 CONECT 2093 2086 CONECT 2094 2086 CONECT 2095 1973 CONECT 2096 1972 CONECT 2097 1969 2098 2102 2106 CONECT 2098 2097 2099 2100 2101 CONECT 2099 2098 CONECT 2100 2098 CONECT 2101 2098 CONECT 2102 2097 2103 2104 2105 CONECT 2103 2102 CONECT 2104 2102 CONECT 2105 2102 CONECT 2106 2097 CONECT 2107 1969 CONECT 2108 1968 CONECT 2109 1965 2110 2112 2116 CONECT 2110 2109 2111 CONECT 2111 2110 CONECT 2112 2109 2113 2114 2115 CONECT 2113 2112 CONECT 2114 2112 CONECT 2115 2112 CONECT 2116 2109 CONECT 2117 1965 CONECT 2118 1964 CONECT 2119 1961 2120 2122 2123 CONECT 2120 2119 2121 CONECT 2121 2120 CONECT 2122 2119 CONECT 2123 2119 CONECT 2124 1961 CONECT 2125 1960 CONECT 2126 1960 CONECT 2127 1960 MASTER 0 0 0 0 0 0 0 0 2122 5 192 11 END
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2m3o
RCSB PDB
PDBbind
11-mer
2o9k
RCSB PDB
PDBbind
11-mer
2or9
RCSB PDB
PDBbind
11-mer
2qhr
RCSB PDB
PDBbind
11-mer
2r02
RCSB PDB
PDBbind
11-mer
2r05
RCSB PDB
PDBbind
11-mer
2w9r
RCSB PDB
PDBbind
11-mer
2wfj
RCSB PDB
PDBbind
11-mer
2x2c
RCSB PDB
PDBbind
11-mer
2z6w
RCSB PDB
PDBbind
11-mer
3asl
RCSB PDB
PDBbind
11-mer
3ax5
RCSB PDB
PDBbind
11-mer
3dpo
RCSB PDB
PDBbind
11-mer
3e8u
RCSB PDB
PDBbind
11-mer
3eov
RCSB PDB
PDBbind
11-mer
3eyf
RCSB PDB
PDBbind
11-mer
3gxz
RCSB PDB
PDBbind
11-mer
3i90
RCSB PDB
PDBbind
11-mer
3iiw
RCSB PDB
PDBbind
11-mer
3iiy
RCSB PDB
PDBbind
11-mer
3ij0
RCSB PDB
PDBbind
11-mer
3ij1
RCSB PDB
PDBbind
11-mer
3lgl
RCSB PDB
PDBbind
11-mer
3ll8
RCSB PDB
PDBbind
11-mer
3m53
RCSB PDB
PDBbind
11-mer
3m54
RCSB PDB
PDBbind
11-mer
3m55
RCSB PDB
PDBbind
11-mer
3m56
RCSB PDB
PDBbind
11-mer
3m57
RCSB PDB
PDBbind
11-mer
3m58
RCSB PDB
PDBbind
11-mer
3m59
RCSB PDB
PDBbind
11-mer
3m5a
RCSB PDB
PDBbind
11-mer
3me9
RCSB PDB
PDBbind
11-mer
3mea
RCSB PDB
PDBbind
11-mer
3met
RCSB PDB
PDBbind
11-mer
3oap
RCSB PDB
PDBbind
11-mer
3odi
RCSB PDB
PDBbind
11-mer
3odl
RCSB PDB
PDBbind
11-mer
3p4f
RCSB PDB
PDBbind
11-mer
3p9h
RCSB PDB
PDBbind
11-mer
3pqz
RCSB PDB
PDBbind
11-mer
3qzv
RCSB PDB
PDBbind
11-mer
3rbq
RCSB PDB
PDBbind
11-mer
3rl7
RCSB PDB
PDBbind
11-mer
3rl8
RCSB PDB
PDBbind
11-mer
3rwd
RCSB PDB
PDBbind
11-mer
3tg5
RCSB PDB
PDBbind
11-mer
3u0t
RCSB PDB
PDBbind
11-mer
3uvk
RCSB PDB
PDBbind
11-mer
3uvl
RCSB PDB
PDBbind
11-mer
3uvn
RCSB PDB
PDBbind
11-mer
3uvo
RCSB PDB
PDBbind
11-mer
3uvx
RCSB PDB
PDBbind
11-mer
3uw9
RCSB PDB
PDBbind
11-mer
3v2x
RCSB PDB
PDBbind
11-mer
3va4
RCSB PDB
PDBbind
11-mer
3zke
RCSB PDB
PDBbind
11-mer
3zkf
RCSB PDB
PDBbind
11-mer
4aa2
RCSB PDB
PDBbind
11-mer
4b8o
RCSB PDB
PDBbind
11-mer
4bd3
RCSB PDB
PDBbind
11-mer
4ds1
RCSB PDB
PDBbind
11-mer
4e9c
RCSB PDB
PDBbind
11-mer
4fgy
RCSB PDB
PDBbind
11-mer
4g69
RCSB PDB
PDBbind
11-mer
4ht6
RCSB PDB
PDBbind
11-mer
4htp
RCSB PDB
PDBbind
11-mer
4hyb
RCSB PDB
PDBbind
11-mer
4j7i
RCSB PDB
PDBbind
11-mer
4j8g
RCSB PDB
PDBbind
11-mer
4jjm
RCSB PDB
PDBbind
11-mer
4ln2
RCSB PDB
PDBbind
11-mer
4n7g
RCSB PDB
PDBbind
11-mer
4n7y
RCSB PDB
PDBbind
11-mer
4o3t
RCSB PDB
PDBbind
11-mer
4o62
RCSB PDB
PDBbind
11-mer
4pl6
RCSB PDB
PDBbind
11-mer
4pli
RCSB PDB
PDBbind
11-mer
4pr5
RCSB PDB
PDBbind
11-mer
4pra
RCSB PDB
PDBbind
11-mer
4prb
RCSB PDB
PDBbind
11-mer
4prd
RCSB PDB
PDBbind
11-mer
4pre
RCSB PDB
PDBbind
11-mer
4prh
RCSB PDB
PDBbind
11-mer
4pri
RCSB PDB
PDBbind
11-mer
4prn
RCSB PDB
PDBbind
11-mer
4prp
RCSB PDB
PDBbind
11-mer
4pxf
RCSB PDB
PDBbind
11-mer
4qc1
RCSB PDB
PDBbind
11-mer
4qyo
RCSB PDB
PDBbind
11-mer
4tk1
RCSB PDB
PDBbind
11-mer
4tk2
RCSB PDB
PDBbind
11-mer
4tk3
RCSB PDB
PDBbind
11-mer
4tk4
RCSB PDB
PDBbind
11-mer
4tmp
RCSB PDB
PDBbind
11-mer
4u68
RCSB PDB
PDBbind
11-mer
4u91
RCSB PDB
PDBbind
11-mer
4w5a
RCSB PDB
PDBbind
11-mer
4wph
RCSB PDB
PDBbind
11-mer
4x6s
RCSB PDB
PDBbind
11-mer
4xc2
RCSB PDB
PDBbind
11-mer
4yje
RCSB PDB
PDBbind
11-mer
4yk6
RCSB PDB
PDBbind
11-mer
4yv9
RCSB PDB
PDBbind
11-mer
4yy6
RCSB PDB
PDBbind
11-mer
4yyi
RCSB PDB
PDBbind
11-mer
4yym
RCSB PDB
PDBbind
11-mer
4yyn
RCSB PDB
PDBbind
11-mer
5a0e
RCSB PDB
PDBbind
11-mer
5agu
RCSB PDB
PDBbind
11-mer
5agv
RCSB PDB
PDBbind
11-mer
5ah2
RCSB PDB
PDBbind
11-mer
5awt
RCSB PDB
PDBbind
11-mer
5awu
RCSB PDB
PDBbind
11-mer
5b6c
RCSB PDB
PDBbind
11-mer
5c6v
RCSB PDB
PDBbind
11-mer
5c7e
RCSB PDB
PDBbind
11-mer
5c7f
RCSB PDB
PDBbind
11-mer
5csz
RCSB PDB
PDBbind
11-mer
5dah
RCSB PDB
PDBbind
11-mer
5ewz
RCSB PDB
PDBbind
11-mer
5ez0
RCSB PDB
PDBbind
11-mer
5hpm
RCSB PDB
PDBbind
11-mer
5ick
RCSB PDB
PDBbind
11-mer
5id0
RCSB PDB
PDBbind
11-mer
5igq
RCSB PDB
PDBbind
11-mer
5jin
RCSB PDB
PDBbind
11-mer
5jiy
RCSB PDB
PDBbind
11-mer
5jm4
RCSB PDB
PDBbind
11-mer
5kez
RCSB PDB
PDBbind
11-mer
5l3f
RCSB PDB
PDBbind
11-mer
5l3g
RCSB PDB
PDBbind
11-mer
5lgq
RCSB PDB
PDBbind
11-mer
5mlw
RCSB PDB
PDBbind
11-mer
5nne
RCSB PDB
PDBbind
11-mer
5svx
RCSB PDB
PDBbind
11-mer
5svy
RCSB PDB
PDBbind
11-mer
5tdr
RCSB PDB
PDBbind
11-mer
5tdw
RCSB PDB
PDBbind
11-mer
5tq1
RCSB PDB
PDBbind
11-mer
5tqs
RCSB PDB
PDBbind
11-mer
5vlk
RCSB PDB
PDBbind
11-mer
5xhz
RCSB PDB
PDBbind
11-mer
5ygd
RCSB PDB
PDBbind
11-mer
6au5
RCSB PDB
PDBbind
11-mer
6axj
RCSB PDB
PDBbind
11-mer
6axp
RCSB PDB
PDBbind
11-mer
6ayn
RCSB PDB
PDBbind
11-mer
6azk
RCSB PDB
PDBbind
11-mer
6azl
RCSB PDB
PDBbind
11-mer
6ct7
RCSB PDB
PDBbind
11-mer
6g0q
RCSB PDB
PDBbind
11-mer
6qzr
RCSB PDB
PDBbind
11-mer
6qtw
RCSB PDB
PDBbind
11-mer
6qs1
RCSB PDB
PDBbind
11-mer
6om2
RCSB PDB
PDBbind
11-mer
6i5n
RCSB PDB
PDBbind
11-mer
6i5j
RCSB PDB
PDBbind
11-mer
6i4x
RCSB PDB
PDBbind
11-mer
6hks
RCSB PDB
PDBbind
11-mer
6gy5
RCSB PDB
PDBbind
11-mer
6g8q
RCSB PDB
PDBbind
11-mer
6g8p
RCSB PDB
PDBbind
11-mer
6g8l
RCSB PDB
PDBbind
11-mer
6g8k
RCSB PDB
PDBbind
11-mer
6g8j
RCSB PDB
PDBbind
11-mer
6g8i
RCSB PDB
PDBbind
11-mer
6g6x
RCSB PDB
PDBbind
11-mer
Entry Information
PDB ID
2hmh
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Suppressor of cytokine signaling 3(SOCS3)
Ligand Name
11-mer
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=70nM
Release Year
2006
Protein/NA Sequence
Check fasta file
Primary Reference
(2006) Structure Vol. 14: pp. 1285-1292
Ligand Properties
Formula
C
5
2
H
8
4
N
1
3
O
2
3
P
Molecular Weight
1290.270
Exact Mass
1289.550
No. of atoms
173
No. of bonds
174
Polar Surface Area
606.58
LOGP Value
-5.68 (
Computed with XLOGP3
)
-4.75 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 17
No. of Hydrogen Bond Acceptors: 23
No. of Rotatable Bonds: 50
No. of Nitrogen and Oxygen Atoms: 36
No. of Rings: 2
Canonical SMILES
OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)Cc1c[nH]cn1)C(C)C)C(C)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CO)[NH3+])CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O
InChI String
InChI=1S/C52H84N13O23P/c1-22(2)37(62-50(81)40(25(7)69)64-42(73)30(53)18-66)47(78)56-31(13-14-36(71)72)43(74)57-32(15-27-9-11-29(12-10-27)88-89(85,86)87)44(75)59-34(19-67)46(77)65-41(26(8)70)51(82)63-39(24(5)6)49(80)61-38(23(3)4)48(79)58-33(16-28-17-54-21-55-28)45(76)60-35(20-68)52(83)84/h9-12,17,21-26,30-35,37-41,66-70,85-87,89H,13-16,18-20,53H2,1-8H3,(H,54,55)(H,56,78)(H,57,74)(H,58,79)(H,59,75)(H,60,76)(H,61,80)(H,62,81)(H,63,82)(H,64,73)(H,65,77)(H,71,72)(H,83,84)/p+1/t25-,26-,30+,31+,32+,33+,34+,35+,37+,38+,39+,40+,41+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O35718
Q00560
Entrez Gene ID
NCBI Entrez Gene ID:
12702
16195
ASD
Information of known allosteric effects of PDB entries
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