Browse entries in the PDBbind-CN Database
HEADER 4USI_COMPLEX COMPND 4USI_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 55 SER ILE GLN CYS ASP LEU SER ALA PHE PRO GLY VAL LYS SEQRES 2 A 55 PHE PHE ARG ILE GLU ALA ILE PHE ARG PRO TRP ARG LEU SEQRES 3 A 55 PRO PHE VAL ILE ASP THR LEU SER LYS TYR GLY ILE ARG SEQRES 4 A 55 GLY LEU THR ASN THR PRO VAL LYS GLY VAL GLY VAL GLN SEQRES 5 A 55 GLY GLY SER SEQRES 1 A 60 GLU PHE GLY PRO SER ASN LEU VAL ASP LYS GLU LYS LEU SEQRES 2 A 60 ASP ILE VAL VAL SER ARG ALA GLN VAL ASP ALA VAL VAL SEQRES 3 A 60 ARG LEU VAL ALA ALA SER ALA TYR THR GLY GLU ILE GLY SEQRES 4 A 60 ASP GLY LYS ILE PHE VAL HIS PRO VAL ALA GLU VAL VAL SEQRES 5 A 60 ARG ILE ARG THR ALA GLU THR GLY SEQRES 1 B 54 ILE GLN CYS ASP LEU SER ALA PHE PRO GLY VAL LYS PHE SEQRES 2 B 54 PHE ARG ILE GLU ALA ILE PHE ARG PRO TRP ARG LEU PRO SEQRES 3 B 54 PHE VAL ILE ASP THR LEU SER LYS TYR GLY ILE ARG GLY SEQRES 4 B 54 LEU THR ASN THR PRO VAL LYS GLY VAL GLY VAL GLN GLY SEQRES 5 B 54 GLY SER SEQRES 1 B 57 PHE GLY PRO SER ASN LEU VAL ASP LYS GLU LYS LEU ASP SEQRES 2 B 57 ILE VAL VAL SER ARG ALA GLN VAL ASP ALA VAL VAL ARG SEQRES 3 B 57 LEU VAL ALA ALA SER ALA TYR THR GLY GLU ILE GLY ASP SEQRES 4 B 57 GLY LYS ILE PHE VAL HIS PRO VAL ALA GLU VAL VAL ARG SEQRES 5 B 57 ILE ARG THR ALA GLU SEQRES 1 C 48 GLN CYS ASP LEU SER ALA PHE PRO GLY VAL LYS PHE PHE SEQRES 2 C 48 ARG ILE GLU ALA ILE PHE ARG PRO TRP ARG LEU PRO PHE SEQRES 3 C 48 VAL ILE ASP THR LEU SER LYS TYR GLY ILE ARG GLY LEU SEQRES 4 C 48 THR ASN THR PRO VAL LYS GLY VAL GLY SEQRES 1 C 61 GLU PHE GLY PRO SER ASN LEU VAL ASP LYS GLU LYS LEU SEQRES 2 C 61 ASP ILE VAL VAL SER ARG ALA GLN VAL ASP ALA VAL VAL SEQRES 3 C 61 ARG LEU VAL ALA ALA SER ALA TYR THR GLY GLU ILE GLY SEQRES 4 C 61 ASP GLY LYS ILE PHE VAL HIS PRO VAL ALA GLU VAL VAL SEQRES 5 C 61 ARG ILE ARG THR ALA GLU THR GLY LEU HET MG A 1 1 HET MG A 2 1 HET AKG A 623 14 ATOM 1 N SER A 5 27.485 4.282 -1.116 1.00 41.83 N ATOM 2 CA SER A 5 26.831 3.260 -0.258 1.00 39.72 C ATOM 3 C SER A 5 26.353 3.880 1.076 1.00 34.14 C ATOM 4 O SER A 5 27.071 4.651 1.722 1.00 32.81 O ATOM 5 CB SER A 5 27.788 2.087 0.030 1.00 64.47 C ATOM 6 OG SER A 5 27.680 1.078 -0.969 1.00 55.42 O ATOM 7 HG SER A 5 28.304 0.339 -0.759 1.00 0.00 H ATOM 8 HN3 SER A 5 28.308 4.677 -0.617 1.00 0.00 H ATOM 9 HN2 SER A 5 26.807 5.043 -1.325 1.00 0.00 H ATOM 10 HN1 SER A 5 27.796 3.840 -2.004 1.00 0.00 H ATOM 11 N ILE A 6 25.141 3.545 1.460 1.00 30.06 N ATOM 12 CA ILE A 6 24.539 3.963 2.748 1.00 25.41 C ATOM 13 C ILE A 6 25.459 3.562 3.907 1.00 25.90 C ATOM 14 O ILE A 6 25.809 2.370 4.028 1.00 33.28 O ATOM 15 CB ILE A 6 23.155 3.296 3.012 1.00 27.26 C ATOM 16 CG1 ILE A 6 21.996 4.118 2.441 1.00 21.83 C ATOM 17 CG2 ILE A 6 22.879 3.126 4.516 1.00 21.74 C ATOM 18 CD1 ILE A 6 22.265 5.601 2.366 1.00 22.81 C ATOM 19 H ILE A 6 24.572 2.952 0.823 1.00 0.00 H ATOM 20 N GLN A 7 25.790 4.517 4.770 1.00 25.01 N ATOM 21 CA GLN A 7 26.586 4.241 5.961 1.00 25.51 C ATOM 22 C GLN A 7 25.866 4.870 7.131 1.00 21.32 C ATOM 23 O GLN A 7 25.700 6.093 7.229 1.00 35.76 O ATOM 24 CB GLN A 7 27.959 4.804 5.829 1.00 29.61 C ATOM 25 CG GLN A 7 28.805 4.008 4.880 1.00 43.64 C ATOM 26 CD GLN A 7 30.161 4.662 4.696 1.00 52.54 C ATOM 27 OE1 GLN A 7 30.304 5.620 3.925 1.00 74.97 O ATOM 28 NE2 GLN A 7 31.163 4.162 5.422 1.00 56.37 N ATOM 29 HE22 GLN A 7 30.994 3.355 6.056 1.00 0.00 H ATOM 30 HE21 GLN A 7 32.113 4.579 5.353 1.00 0.00 H ATOM 31 H GLN A 7 25.472 5.491 4.591 1.00 0.00 H ATOM 32 N CYS A 8 25.369 3.998 7.978 1.00 20.59 N ATOM 33 CA CYS A 8 24.625 4.410 9.125 1.00 18.30 C ATOM 34 C CYS A 8 25.532 4.746 10.297 1.00 21.39 C ATOM 35 O CYS A 8 26.499 4.023 10.585 1.00 18.79 O ATOM 36 CB CYS A 8 23.741 3.305 9.549 1.00 15.93 C ATOM 37 SG CYS A 8 22.478 2.874 8.414 1.00 21.36 S ATOM 38 H CYS A 8 25.521 2.983 7.809 1.00 0.00 H ATOM 39 N ASP A 9 25.287 5.921 10.871 1.00 17.39 N ATOM 40 CA ASP A 9 26.037 6.414 12.006 1.00 16.65 C ATOM 41 C ASP A 9 25.578 5.827 13.305 1.00 16.13 C ATOM 42 O ASP A 9 24.564 6.205 13.873 1.00 15.52 O ATOM 43 CB ASP A 9 25.942 7.951 12.073 1.00 17.02 C ATOM 44 CG ASP A 9 26.764 8.518 13.178 1.00 21.01 C ATOM 45 OD1 ASP A 9 27.616 7.739 13.796 1.00 21.59 O ATOM 46 OD2 ASP A 9 26.794 9.820 13.301 1.00 24.96 O ATOM 47 H ASP A 9 24.522 6.512 10.487 1.00 0.00 H ATOM 48 N LEU A 10 26.321 4.832 13.825 1.00 16.55 N ATOM 49 CA LEU A 10 25.941 4.176 15.130 1.00 16.29 C ATOM 50 C LEU A 10 26.874 4.608 16.234 1.00 17.34 C ATOM 51 O LEU A 10 26.881 3.972 17.324 1.00 17.48 O ATOM 52 CB LEU A 10 25.974 2.654 15.019 1.00 16.13 C ATOM 53 CG LEU A 10 25.203 2.088 13.804 1.00 15.36 C ATOM 54 CD1 LEU A 10 25.253 0.546 13.864 1.00 18.13 C ATOM 55 CD2 LEU A 10 23.811 2.613 13.816 1.00 14.35 C ATOM 56 H LEU A 10 27.171 4.510 13.319 1.00 0.00 H ATOM 57 N SER A 11 27.528 5.695 16.000 1.00 18.09 N ATOM 58 CA SER A 11 28.596 6.105 16.960 1.00 19.38 C ATOM 59 C SER A 11 28.064 6.550 18.291 1.00 19.35 C ATOM 60 O SER A 11 28.805 6.448 19.264 1.00 20.31 O ATOM 61 CB SER A 11 29.429 7.198 16.390 1.00 20.38 C ATOM 62 OG SER A 11 28.718 8.404 16.132 1.00 20.07 O ATOM 63 HG SER A 11 27.991 8.225 15.484 1.00 0.00 H ATOM 64 H SER A 11 27.316 6.273 15.162 1.00 0.00 H ATOM 65 N ALA A 12 26.851 7.001 18.425 1.00 18.46 N ATOM 66 CA ALA A 12 26.312 7.451 19.684 1.00 18.57 C ATOM 67 C ALA A 12 25.823 6.220 20.461 1.00 18.08 C ATOM 68 O ALA A 12 25.336 6.393 21.609 1.00 18.22 O ATOM 69 CB ALA A 12 25.172 8.485 19.496 1.00 18.02 C ATOM 70 H ALA A 12 26.241 7.039 17.584 1.00 0.00 H ATOM 71 N PHE A 13 26.026 4.998 19.989 1.00 17.77 N ATOM 72 CA PHE A 13 25.557 3.788 20.671 1.00 17.44 C ATOM 73 C PHE A 13 26.694 2.741 20.833 1.00 18.31 C ATOM 74 O PHE A 13 26.563 1.597 20.460 1.00 18.00 O ATOM 75 CB PHE A 13 24.344 3.191 19.842 1.00 16.15 C ATOM 76 CG PHE A 13 23.219 4.173 19.653 1.00 15.46 C ATOM 77 CD1 PHE A 13 22.299 4.338 20.591 1.00 21.78 C ATOM 78 CD2 PHE A 13 23.219 5.020 18.558 1.00 15.27 C ATOM 79 CE1 PHE A 13 21.284 5.314 20.367 1.00 14.82 C ATOM 80 CE2 PHE A 13 22.280 6.017 18.422 1.00 25.23 C ATOM 81 CZ PHE A 13 21.350 6.129 19.345 1.00 17.41 C ATOM 82 H PHE A 13 26.542 4.893 19.092 1.00 0.00 H ATOM 83 N PRO A 14 27.774 3.156 21.530 1.00 19.57 N ATOM 84 CA PRO A 14 28.863 2.266 21.721 1.00 20.60 C ATOM 85 C PRO A 14 28.470 1.120 22.624 1.00 20.61 C ATOM 86 O PRO A 14 27.785 1.340 23.597 1.00 20.45 O ATOM 87 CB PRO A 14 29.876 3.155 22.354 1.00 21.95 C ATOM 88 CG PRO A 14 29.120 4.143 23.166 1.00 21.71 C ATOM 89 CD PRO A 14 27.943 4.428 22.194 1.00 20.19 C ATOM 90 N GLY A 15 28.921 -0.073 22.288 1.00 20.95 N ATOM 91 CA GLY A 15 28.640 -1.282 23.037 1.00 21.17 C ATOM 92 C GLY A 15 27.303 -1.942 22.720 1.00 19.90 C ATOM 93 O GLY A 15 27.038 -2.977 23.228 1.00 20.13 O ATOM 94 H GLY A 15 29.513 -0.151 21.436 1.00 0.00 H ATOM 95 N VAL A 16 26.441 -1.303 21.927 1.00 18.69 N ATOM 96 CA VAL A 16 25.152 -1.887 21.565 1.00 17.59 C ATOM 97 C VAL A 16 25.373 -2.956 20.526 1.00 17.57 C ATOM 98 O VAL A 16 26.011 -2.691 19.541 1.00 17.67 O ATOM 99 CB VAL A 16 24.231 -0.767 21.092 1.00 16.55 C ATOM 100 CG1 VAL A 16 22.887 -1.306 20.697 1.00 15.56 C ATOM 101 CG2 VAL A 16 23.999 0.187 22.302 1.00 16.83 C ATOM 102 H VAL A 16 26.693 -0.364 21.557 1.00 0.00 H ATOM 103 N LYS A 17 24.851 -4.153 20.740 1.00 17.58 N ATOM 104 CA LYS A 17 25.142 -5.296 19.921 1.00 17.89 C ATOM 105 C LYS A 17 24.080 -5.523 18.814 1.00 16.82 C ATOM 106 O LYS A 17 24.421 -6.169 17.850 1.00 17.06 O ATOM 107 CB LYS A 17 25.248 -6.505 20.813 1.00 18.80 C ATOM 108 CG LYS A 17 26.413 -6.419 21.756 1.00 21.57 C ATOM 109 CD LYS A 17 26.444 -7.790 22.424 1.00 25.33 C ATOM 110 CE LYS A 17 27.361 -7.956 23.606 1.00 46.36 C ATOM 111 NZ LYS A 17 27.010 -9.255 24.276 1.00 52.70 N ATOM 112 HZ1 LYS A 17 26.018 -9.226 24.588 1.00 0.00 H ATOM 113 HZ2 LYS A 17 27.140 -10.037 23.603 1.00 0.00 H ATOM 114 HZ3 LYS A 17 27.629 -9.397 25.099 1.00 0.00 H ATOM 115 H LYS A 17 24.198 -4.272 21.541 1.00 0.00 H ATOM 116 N PHE A 18 22.882 -5.019 19.054 1.00 15.89 N ATOM 117 CA PHE A 18 21.735 -5.346 18.194 1.00 15.04 C ATOM 118 C PHE A 18 21.036 -4.030 17.930 1.00 14.14 C ATOM 119 O PHE A 18 20.943 -3.122 18.720 1.00 14.07 O ATOM 120 CB PHE A 18 20.798 -6.303 18.914 1.00 15.11 C ATOM 121 CG PHE A 18 21.345 -7.656 19.164 1.00 18.84 C ATOM 122 CD1 PHE A 18 21.482 -8.564 18.131 1.00 22.65 C ATOM 123 CD2 PHE A 18 21.737 -8.028 20.438 1.00 31.07 C ATOM 124 CE1 PHE A 18 22.015 -9.831 18.373 1.00 44.12 C ATOM 125 CE2 PHE A 18 22.279 -9.287 20.695 1.00 36.76 C ATOM 126 CZ PHE A 18 22.425 -10.189 19.649 1.00 41.83 C ATOM 127 H PHE A 18 22.748 -4.381 19.864 1.00 0.00 H ATOM 128 N PHE A 19 20.513 -3.898 16.681 1.00 13.51 N ATOM 129 CA PHE A 19 19.722 -2.730 16.257 1.00 12.74 C ATOM 130 C PHE A 19 18.492 -3.211 15.532 1.00 12.18 C ATOM 131 O PHE A 19 18.495 -4.248 14.822 1.00 12.35 O ATOM 132 CB PHE A 19 20.537 -1.827 15.332 1.00 12.79 C ATOM 133 CG PHE A 19 21.698 -1.142 16.030 1.00 13.45 C ATOM 134 CD1 PHE A 19 22.906 -1.789 16.278 1.00 14.33 C ATOM 135 CD2 PHE A 19 21.554 0.152 16.473 1.00 13.33 C ATOM 136 CE1 PHE A 19 23.892 -1.176 17.051 1.00 15.07 C ATOM 137 CE2 PHE A 19 22.585 0.784 17.234 1.00 14.09 C ATOM 138 CZ PHE A 19 23.751 0.120 17.498 1.00 14.95 C ATOM 139 H PHE A 19 20.680 -4.659 15.992 1.00 0.00 H ATOM 140 N ARG A 20 17.453 -2.396 15.633 1.00 11.63 N ATOM 141 CA ARG A 20 16.191 -2.639 14.924 1.00 11.17 C ATOM 142 C ARG A 20 16.093 -1.722 13.737 1.00 10.83 C ATOM 143 O ARG A 20 16.197 -0.544 13.860 1.00 10.73 O ATOM 144 CB ARG A 20 15.040 -2.284 15.814 1.00 10.99 C ATOM 145 CG ARG A 20 13.604 -2.523 15.323 1.00 10.70 C ATOM 146 CD ARG A 20 12.564 -2.353 16.370 1.00 11.96 C ATOM 147 NE ARG A 20 12.533 -1.027 16.977 1.00 11.82 N ATOM 148 CZ ARG A 20 11.673 -0.056 16.658 1.00 13.95 C ATOM 149 NH1 ARG A 20 10.842 -0.155 15.647 1.00 14.81 N ATOM 150 NH2 ARG A 20 11.685 1.078 17.336 1.00 14.13 N ATOM 151 HE ARG A 20 13.235 -0.822 17.716 1.00 0.00 H ATOM 152 HH12 ARG A 20 10.188 0.625 15.433 1.00 0.00 H ATOM 153 HH11 ARG A 20 10.837 -1.013 15.060 1.00 0.00 H ATOM 154 HH22 ARG A 20 11.017 1.837 17.092 1.00 0.00 H ATOM 155 HH21 ARG A 20 12.362 1.211 18.114 1.00 0.00 H ATOM 156 H ARG A 20 17.534 -1.553 16.237 1.00 0.00 H ATOM 157 N ILE A 21 15.978 -2.383 12.587 1.00 10.82 N ATOM 158 CA ILE A 21 15.730 -1.753 11.290 1.00 10.61 C ATOM 159 C ILE A 21 14.210 -1.645 11.085 1.00 10.29 C ATOM 160 O ILE A 21 13.524 -2.650 11.092 1.00 10.36 O ATOM 161 CB ILE A 21 16.441 -2.547 10.213 1.00 10.97 C ATOM 162 CG1 ILE A 21 17.909 -2.712 10.518 1.00 11.57 C ATOM 163 CG2 ILE A 21 16.284 -1.788 8.919 1.00 10.89 C ATOM 164 CD1 ILE A 21 18.575 -1.510 11.120 1.00 21.89 C ATOM 165 H ILE A 21 16.071 -3.419 12.612 1.00 0.00 H ATOM 166 N GLU A 22 13.745 -0.416 11.093 1.00 10.08 N ATOM 167 CA GLU A 22 12.321 -0.211 10.842 1.00 9.94 C ATOM 168 C GLU A 22 12.199 0.468 9.486 1.00 9.96 C ATOM 169 O GLU A 22 12.539 1.617 9.328 1.00 10.00 O ATOM 170 CB GLU A 22 11.766 0.672 11.957 1.00 9.90 C ATOM 171 CG GLU A 22 10.299 0.998 11.881 1.00 9.94 C ATOM 172 CD GLU A 22 9.874 2.087 12.815 1.00 10.55 C ATOM 173 OE1 GLU A 22 10.614 2.977 13.235 1.00 12.06 O ATOM 174 OE2 GLU A 22 8.625 2.006 13.095 1.00 16.60 O ATOM 175 H GLU A 22 14.376 0.391 11.274 1.00 0.00 H ATOM 176 N ALA A 23 11.601 -0.288 8.589 1.00 10.05 N ATOM 177 CA ALA A 23 11.467 0.180 7.201 1.00 10.22 C ATOM 178 C ALA A 23 10.001 0.397 6.913 1.00 10.31 C ATOM 179 O ALA A 23 9.209 -0.500 7.110 1.00 10.39 O ATOM 180 CB ALA A 23 12.132 -0.754 6.197 1.00 10.49 C ATOM 181 H ALA A 23 11.223 -1.217 8.862 1.00 0.00 H ATOM 182 N ILE A 24 9.716 1.594 6.421 1.00 10.44 N ATOM 183 CA ILE A 24 8.261 1.911 6.073 1.00 10.72 C ATOM 184 C ILE A 24 8.284 2.290 4.565 1.00 11.11 C ATOM 185 O ILE A 24 8.915 3.261 4.215 1.00 11.56 O ATOM 186 CB ILE A 24 7.729 3.084 6.872 1.00 10.79 C ATOM 187 CG1 ILE A 24 7.785 2.694 8.374 1.00 11.31 C ATOM 188 CG2 ILE A 24 6.334 3.488 6.459 1.00 11.82 C ATOM 189 CD1 ILE A 24 7.646 3.854 9.327 1.00 13.34 C ATOM 190 H ILE A 24 10.464 2.301 6.275 1.00 0.00 H ATOM 191 N PHE A 25 7.490 1.599 3.731 1.00 11.46 N ATOM 192 CA PHE A 25 7.596 1.730 2.302 1.00 11.93 C ATOM 193 C PHE A 25 6.238 1.370 1.644 1.00 12.49 C ATOM 194 O PHE A 25 5.272 1.102 2.258 1.00 12.55 O ATOM 195 CB PHE A 25 8.801 0.872 1.858 1.00 11.86 C ATOM 196 CG PHE A 25 8.712 -0.574 2.202 1.00 11.80 C ATOM 197 CD1 PHE A 25 7.860 -1.504 1.647 1.00 12.24 C ATOM 198 CD2 PHE A 25 9.402 -0.956 3.272 1.00 11.37 C ATOM 199 CE1 PHE A 25 7.753 -2.760 2.111 1.00 12.29 C ATOM 200 CE2 PHE A 25 9.304 -2.247 3.804 1.00 12.25 C ATOM 201 CZ PHE A 25 8.491 -3.159 3.199 1.00 11.86 C ATOM 202 H PHE A 25 6.780 0.952 4.129 1.00 0.00 H ATOM 203 N ARG A 26 6.268 1.388 0.289 1.00 13.06 N ATOM 204 CA ARG A 26 4.992 1.241 -0.465 1.00 13.81 C ATOM 205 C ARG A 26 4.480 -0.171 -0.299 1.00 13.92 C ATOM 206 O ARG A 26 5.198 -1.142 -0.421 1.00 13.80 O ATOM 207 CB ARG A 26 5.284 1.529 -1.966 1.00 14.49 C ATOM 208 CG ARG A 26 5.768 2.926 -2.275 1.00 14.63 C ATOM 209 CD ARG A 26 6.148 3.089 -3.691 1.00 15.37 C ATOM 210 NE ARG A 26 6.841 4.357 -3.903 1.00 15.53 N ATOM 211 CZ ARG A 26 6.233 5.524 -4.024 1.00 16.05 C ATOM 212 NH1 ARG A 26 4.901 5.589 -3.934 1.00 16.44 N ATOM 213 NH2 ARG A 26 6.957 6.608 -4.181 1.00 16.29 N ATOM 214 HE ARG A 26 7.879 4.340 -3.963 1.00 0.00 H ATOM 215 HH12 ARG A 26 4.418 6.505 -4.028 1.00 0.00 H ATOM 216 HH11 ARG A 26 4.348 4.724 -3.769 1.00 0.00 H ATOM 217 HH22 ARG A 26 6.493 7.534 -4.278 1.00 0.00 H ATOM 218 HH21 ARG A 26 7.994 6.541 -4.209 1.00 0.00 H ATOM 219 H ARG A 26 7.169 1.503 -0.217 1.00 0.00 H ATOM 220 N PRO A 27 3.153 -0.317 -0.108 1.00 14.38 N ATOM 221 CA PRO A 27 2.731 -1.665 0.217 1.00 14.55 C ATOM 222 C PRO A 27 2.990 -2.707 -0.858 1.00 15.10 C ATOM 223 O PRO A 27 3.342 -3.843 -0.584 1.00 15.06 O ATOM 224 CB PRO A 27 1.213 -1.494 0.495 1.00 15.18 C ATOM 225 CG PRO A 27 1.104 -0.060 0.990 1.00 14.93 C ATOM 226 CD PRO A 27 2.140 0.730 0.225 1.00 14.70 C ATOM 227 N TRP A 28 2.850 -2.253 -2.088 1.00 15.74 N ATOM 228 CA TRP A 28 3.114 -3.130 -3.246 1.00 16.45 C ATOM 229 C TRP A 28 4.526 -3.628 -3.438 1.00 16.12 C ATOM 230 O TRP A 28 4.757 -4.640 -4.080 1.00 16.72 O ATOM 231 CB TRP A 28 2.520 -2.522 -4.561 1.00 17.43 C ATOM 232 CG TRP A 28 3.006 -1.192 -4.926 1.00 17.26 C ATOM 233 CD1 TRP A 28 2.529 0.019 -4.525 1.00 17.13 C ATOM 234 CD2 TRP A 28 4.102 -0.888 -5.773 1.00 17.36 C ATOM 235 NE1 TRP A 28 3.244 1.046 -5.064 1.00 17.16 N ATOM 236 CE2 TRP A 28 4.237 0.521 -5.834 1.00 17.28 C ATOM 237 CE3 TRP A 28 4.943 -1.660 -6.518 1.00 17.68 C ATOM 238 CZ2 TRP A 28 5.186 1.159 -6.671 1.00 17.56 C ATOM 239 CZ3 TRP A 28 5.889 -1.029 -7.319 1.00 17.92 C ATOM 240 CH2 TRP A 28 5.993 0.357 -7.377 1.00 17.85 C ATOM 241 HE1 TRP A 28 3.062 2.059 -4.913 1.00 0.00 H ATOM 242 H TRP A 28 2.551 -1.269 -2.244 1.00 0.00 H ATOM 243 N ARG A 29 5.437 -2.990 -2.777 1.00 15.27 N ATOM 244 CA ARG A 29 6.820 -3.530 -2.705 1.00 14.98 C ATOM 245 C ARG A 29 7.113 -4.535 -1.629 1.00 14.59 C ATOM 246 O ARG A 29 8.215 -5.029 -1.522 1.00 14.49 O ATOM 247 CB ARG A 29 7.818 -2.398 -2.726 1.00 14.55 C ATOM 248 CG ARG A 29 8.102 -1.820 -4.086 1.00 15.24 C ATOM 249 CD ARG A 29 8.878 -2.778 -4.972 1.00 15.89 C ATOM 250 NE ARG A 29 9.102 -2.305 -6.368 1.00 16.77 N ATOM 251 CZ ARG A 29 10.004 -1.416 -6.712 1.00 16.82 C ATOM 252 NH1 ARG A 29 10.952 -1.008 -5.925 1.00 16.73 N ATOM 253 NH2 ARG A 29 10.022 -0.937 -7.909 1.00 17.70 N ATOM 254 HE ARG A 29 8.504 -2.706 -7.119 1.00 0.00 H ATOM 255 HH12 ARG A 29 11.637 -0.300 -6.259 1.00 0.00 H ATOM 256 HH11 ARG A 29 11.027 -1.389 -4.960 1.00 0.00 H ATOM 257 HH22 ARG A 29 10.739 -0.233 -8.177 1.00 0.00 H ATOM 258 HH21 ARG A 29 9.320 -1.255 -8.607 1.00 0.00 H ATOM 259 H ARG A 29 5.201 -2.099 -2.296 1.00 0.00 H ATOM 260 N LEU A 30 6.155 -4.820 -0.757 1.00 14.45 N ATOM 261 CA LEU A 30 6.495 -5.744 0.338 1.00 14.15 C ATOM 262 C LEU A 30 7.035 -7.083 -0.179 1.00 14.82 C ATOM 263 O LEU A 30 7.983 -7.578 0.365 1.00 14.62 O ATOM 264 CB LEU A 30 5.268 -5.967 1.227 1.00 14.20 C ATOM 265 CG LEU A 30 5.440 -6.910 2.382 1.00 14.22 C ATOM 266 CD1 LEU A 30 6.402 -6.402 3.367 1.00 13.24 C ATOM 267 CD2 LEU A 30 4.057 -7.058 2.974 1.00 18.40 C ATOM 268 H LEU A 30 5.204 -4.408 -0.843 1.00 0.00 H ATOM 269 N PRO A 31 6.470 -7.657 -1.287 1.00 15.77 N ATOM 270 CA PRO A 31 6.999 -8.985 -1.651 1.00 16.53 C ATOM 271 C PRO A 31 8.441 -8.908 -2.109 1.00 16.50 C ATOM 272 O PRO A 31 9.248 -9.809 -1.872 1.00 16.81 O ATOM 273 CB PRO A 31 6.091 -9.466 -2.820 1.00 17.68 C ATOM 274 CG PRO A 31 4.872 -8.676 -2.660 1.00 17.50 C ATOM 275 CD PRO A 31 5.219 -7.357 -2.009 1.00 16.37 C ATOM 276 N PHE A 32 8.769 -7.827 -2.813 1.00 16.31 N ATOM 277 CA PHE A 32 10.165 -7.608 -3.253 1.00 16.37 C ATOM 278 C PHE A 32 11.147 -7.460 -2.105 1.00 15.61 C ATOM 279 O PHE A 32 12.209 -8.063 -2.078 1.00 15.95 O ATOM 280 CB PHE A 32 10.205 -6.356 -4.190 1.00 16.40 C ATOM 281 CG PHE A 32 11.449 -6.166 -5.009 1.00 16.88 C ATOM 282 CD1 PHE A 32 12.678 -6.774 -4.738 1.00 17.04 C ATOM 283 CD2 PHE A 32 11.343 -5.286 -6.042 1.00 17.27 C ATOM 284 CE1 PHE A 32 13.741 -6.515 -5.572 1.00 17.66 C ATOM 285 CE2 PHE A 32 12.396 -5.023 -6.857 1.00 17.86 C ATOM 286 CZ PHE A 32 13.593 -5.644 -6.643 1.00 18.07 C ATOM 287 H PHE A 32 8.037 -7.129 -3.056 1.00 0.00 H ATOM 288 N VAL A 33 10.784 -6.629 -1.149 1.00 14.71 N ATOM 289 CA VAL A 33 11.600 -6.414 0.023 1.00 14.04 C ATOM 290 C VAL A 33 11.785 -7.719 0.770 1.00 14.30 C ATOM 291 O VAL A 33 12.904 -8.064 1.162 1.00 14.40 O ATOM 292 CB VAL A 33 11.030 -5.292 0.915 1.00 13.19 C ATOM 293 CG1 VAL A 33 11.905 -5.233 2.129 1.00 12.69 C ATOM 294 CG2 VAL A 33 10.956 -3.979 0.149 1.00 13.12 C ATOM 295 H VAL A 33 9.885 -6.114 -1.241 1.00 0.00 H ATOM 296 N ILE A 34 10.718 -8.442 1.006 1.00 14.54 N ATOM 297 CA ILE A 34 10.846 -9.718 1.695 1.00 14.98 C ATOM 298 C ILE A 34 11.713 -10.729 0.919 1.00 15.98 C ATOM 299 O ILE A 34 12.578 -11.434 1.518 1.00 16.28 O ATOM 300 CB ILE A 34 9.450 -10.291 2.019 1.00 15.25 C ATOM 301 CG1 ILE A 34 8.753 -9.484 3.114 1.00 17.65 C ATOM 302 CG2 ILE A 34 9.517 -11.786 2.347 1.00 16.85 C ATOM 303 CD1 ILE A 34 7.279 -9.699 3.188 1.00 23.41 C ATOM 304 H ILE A 34 9.782 -8.105 0.702 1.00 0.00 H ATOM 305 N ASP A 35 11.539 -10.768 -0.404 1.00 16.62 N ATOM 306 CA ASP A 35 12.381 -11.722 -1.173 1.00 17.75 C ATOM 307 C ASP A 35 13.860 -11.363 -1.041 1.00 17.63 C ATOM 308 O ASP A 35 14.780 -12.250 -0.917 1.00 18.41 O ATOM 309 CB ASP A 35 12.015 -11.723 -2.622 1.00 18.53 C ATOM 310 CG ASP A 35 12.660 -12.868 -3.370 1.00 22.14 C ATOM 311 OD1 ASP A 35 12.574 -14.031 -2.906 1.00 22.41 O ATOM 312 OD2 ASP A 35 13.248 -12.626 -4.449 1.00 23.23 O ATOM 313 H ASP A 35 10.843 -10.156 -0.877 1.00 0.00 H ATOM 314 N THR A 36 14.151 -10.076 -1.098 1.00 16.85 N ATOM 315 CA THR A 36 15.532 -9.650 -1.023 1.00 16.87 C ATOM 316 C THR A 36 16.155 -10.037 0.359 1.00 16.60 C ATOM 317 O THR A 36 17.284 -10.587 0.464 1.00 17.30 O ATOM 318 CB THR A 36 15.620 -8.148 -1.260 1.00 16.16 C ATOM 319 OG1 THR A 36 15.046 -7.814 -2.511 1.00 16.91 O ATOM 320 CG2 THR A 36 17.043 -7.649 -1.112 1.00 18.89 C ATOM 321 HG1 THR A 36 15.110 -6.836 -2.652 1.00 0.00 H ATOM 322 H THR A 36 13.392 -9.372 -1.196 1.00 0.00 H ATOM 323 N LEU A 37 15.411 -9.808 1.439 1.00 15.76 N ATOM 324 CA LEU A 37 15.824 -10.222 2.778 1.00 15.60 C ATOM 325 C LEU A 37 15.960 -11.738 2.957 1.00 16.62 C ATOM 326 O LEU A 37 16.931 -12.197 3.507 1.00 17.09 O ATOM 327 CB LEU A 37 14.915 -9.594 3.855 1.00 14.60 C ATOM 328 CG LEU A 37 15.023 -8.096 3.830 1.00 13.79 C ATOM 329 CD1 LEU A 37 13.858 -7.586 4.681 1.00 15.68 C ATOM 330 CD2 LEU A 37 16.328 -7.634 4.460 1.00 16.02 C ATOM 331 H LEU A 37 14.502 -9.316 1.325 1.00 0.00 H ATOM 332 N SER A 38 14.975 -12.478 2.456 1.00 17.10 N ATOM 333 CA SER A 38 15.012 -13.946 2.468 1.00 18.30 C ATOM 334 C SER A 38 16.262 -14.471 1.761 1.00 19.40 C ATOM 335 O SER A 38 16.966 -15.382 2.257 1.00 22.54 O ATOM 336 CB SER A 38 13.746 -14.549 1.822 1.00 18.81 C ATOM 337 OG SER A 38 13.938 -15.893 1.432 1.00 20.26 O ATOM 338 HG SER A 38 13.105 -16.239 1.024 1.00 0.00 H ATOM 339 H SER A 38 14.150 -12.000 2.041 1.00 0.00 H ATOM 340 N LYS A 39 16.562 -13.914 0.577 1.00 20.16 N ATOM 341 CA LYS A 39 17.727 -14.365 -0.167 1.00 22.45 C ATOM 342 C LYS A 39 19.047 -14.115 0.528 1.00 21.02 C ATOM 343 O LYS A 39 19.956 -14.922 0.392 1.00 25.13 O ATOM 344 CB LYS A 39 17.750 -13.721 -1.544 1.00 22.05 C ATOM 345 CG LYS A 39 16.796 -14.500 -2.421 1.00 28.30 C ATOM 346 CD LYS A 39 16.552 -13.907 -3.782 1.00 46.26 C ATOM 347 CE LYS A 39 15.594 -14.834 -4.509 1.00 48.89 C ATOM 348 NZ LYS A 39 15.174 -14.294 -5.823 1.00 51.08 N ATOM 349 HZ1 LYS A 39 14.696 -13.381 -5.684 1.00 0.00 H ATOM 350 HZ2 LYS A 39 16.011 -14.160 -6.425 1.00 0.00 H ATOM 351 HZ3 LYS A 39 14.521 -14.963 -6.279 1.00 0.00 H ATOM 352 H LYS A 39 15.960 -13.159 0.191 1.00 0.00 H ATOM 353 N TYR A 40 19.124 -12.988 1.243 1.00 19.51 N ATOM 354 CA TYR A 40 20.295 -12.561 2.018 1.00 20.48 C ATOM 355 C TYR A 40 20.496 -13.496 3.234 1.00 21.14 C ATOM 356 O TYR A 40 21.584 -13.620 3.767 1.00 29.58 O ATOM 357 CB TYR A 40 20.090 -11.116 2.447 1.00 21.31 C ATOM 358 CG TYR A 40 21.027 -10.620 3.551 1.00 22.05 C ATOM 359 CD1 TYR A 40 22.315 -10.178 3.266 1.00 34.89 C ATOM 360 CD2 TYR A 40 20.576 -10.560 4.896 1.00 21.59 C ATOM 361 CE1 TYR A 40 23.149 -9.711 4.278 1.00 29.66 C ATOM 362 CE2 TYR A 40 21.406 -10.101 5.917 1.00 30.21 C ATOM 363 CZ TYR A 40 22.696 -9.665 5.600 1.00 27.15 C ATOM 364 OH TYR A 40 23.579 -9.195 6.596 1.00 33.69 O ATOM 365 HH TYR A 40 24.438 -8.934 6.178 1.00 0.00 H ATOM 366 H TYR A 40 18.290 -12.366 1.251 1.00 0.00 H ATOM 367 N GLY A 41 19.398 -14.104 3.692 1.00 21.04 N ATOM 368 CA GLY A 41 19.408 -15.053 4.773 1.00 20.89 C ATOM 369 C GLY A 41 18.919 -14.455 6.064 1.00 19.03 C ATOM 370 O GLY A 41 19.272 -14.944 7.118 1.00 19.65 O ATOM 371 H GLY A 41 18.487 -13.879 3.243 1.00 0.00 H ATOM 372 N ILE A 42 18.059 -13.458 5.988 1.00 17.81 N ATOM 373 CA ILE A 42 17.599 -12.751 7.143 1.00 16.81 C ATOM 374 C ILE A 42 17.047 -13.782 8.112 1.00 24.86 C ATOM 375 O ILE A 42 16.471 -14.797 7.755 1.00 26.20 O ATOM 376 CB ILE A 42 16.606 -11.670 6.784 1.00 17.71 C ATOM 377 CG1 ILE A 42 16.553 -10.614 7.834 1.00 17.57 C ATOM 378 CG2 ILE A 42 15.228 -12.302 6.533 1.00 19.96 C ATOM 379 CD1 ILE A 42 17.781 -9.723 7.904 1.00 22.40 C ATOM 380 H ILE A 42 17.702 -13.175 5.053 1.00 0.00 H ATOM 381 N ARG A 43 17.330 -13.541 9.374 1.00 22.03 N ATOM 382 CA ARG A 43 17.019 -14.499 10.456 1.00 29.88 C ATOM 383 C ARG A 43 15.707 -14.155 11.197 1.00 19.03 C ATOM 384 O ARG A 43 15.353 -14.800 12.196 1.00 23.72 O ATOM 385 CB ARG A 43 18.191 -14.577 11.457 1.00 31.92 C ATOM 386 CG ARG A 43 19.535 -15.003 10.871 1.00 42.79 C ATOM 387 CD ARG A 43 19.861 -16.449 11.186 1.00 45.19 C ATOM 388 NE ARG A 43 21.251 -16.767 10.852 1.00 73.04 N ATOM 389 CZ ARG A 43 21.722 -16.949 9.613 1.00 81.53 C ATOM 390 NH1 ARG A 43 20.921 -16.850 8.544 1.00 80.21 N ATOM 391 NH2 ARG A 43 23.011 -17.241 9.436 1.00 61.91 N ATOM 392 HE ARG A 43 21.924 -16.858 11.639 1.00 0.00 H ATOM 393 HH12 ARG A 43 21.307 -16.995 7.589 1.00 0.00 H ATOM 394 HH11 ARG A 43 19.913 -16.628 8.669 1.00 0.00 H ATOM 395 HH22 ARG A 43 23.385 -17.384 8.476 1.00 0.00 H ATOM 396 HH21 ARG A 43 23.643 -17.326 10.258 1.00 0.00 H ATOM 397 H ARG A 43 17.790 -12.641 9.620 1.00 0.00 H ATOM 398 N GLY A 44 14.939 -13.201 10.701 1.00 17.66 N ATOM 399 CA GLY A 44 13.563 -12.960 11.182 1.00 18.06 C ATOM 400 C GLY A 44 13.233 -11.490 10.962 1.00 14.34 C ATOM 401 O GLY A 44 14.107 -10.599 10.730 1.00 17.82 O ATOM 402 H GLY A 44 15.317 -12.597 9.944 1.00 0.00 H ATOM 403 N LEU A 45 11.938 -11.259 11.079 1.00 14.68 N ATOM 404 CA LEU A 45 11.294 -9.928 10.796 1.00 16.91 C ATOM 405 C LEU A 45 9.870 -9.928 11.184 1.00 13.99 C ATOM 406 O LEU A 45 9.214 -10.977 11.295 1.00 16.94 O ATOM 407 CB LEU A 45 11.445 -9.487 9.362 1.00 17.27 C ATOM 408 CG LEU A 45 11.159 -10.419 8.175 1.00 13.67 C ATOM 409 CD1 LEU A 45 9.700 -10.679 8.082 1.00 19.33 C ATOM 410 CD2 LEU A 45 11.754 -9.909 6.895 1.00 18.16 C ATOM 411 H LEU A 45 11.327 -12.043 11.385 1.00 0.00 H ATOM 412 N THR A 46 9.362 -8.694 11.360 1.00 12.52 N ATOM 413 CA THR A 46 7.956 -8.489 11.737 1.00 12.61 C ATOM 414 C THR A 46 7.235 -7.447 10.865 1.00 12.23 C ATOM 415 O THR A 46 7.834 -6.413 10.636 1.00 11.67 O ATOM 416 CB THR A 46 7.924 -8.070 13.246 1.00 12.49 C ATOM 417 OG1 THR A 46 8.548 -9.066 14.056 1.00 13.59 O ATOM 418 CG2 THR A 46 6.550 -7.961 13.756 1.00 13.59 C ATOM 419 HG1 THR A 46 8.518 -8.784 15.005 1.00 0.00 H ATOM 420 H THR A 46 9.978 -7.867 11.226 1.00 0.00 H ATOM 421 N ASN A 47 6.025 -7.685 10.392 1.00 12.66 N ATOM 422 CA ASN A 47 5.366 -6.811 9.445 1.00 12.51 C ATOM 423 C ASN A 47 4.081 -6.292 10.060 1.00 12.73 C ATOM 424 O ASN A 47 3.381 -7.074 10.695 1.00 13.32 O ATOM 425 CB ASN A 47 4.999 -7.698 8.254 1.00 13.14 C ATOM 426 CG ASN A 47 4.112 -7.006 7.185 1.00 13.30 C ATOM 427 OD1 ASN A 47 3.101 -7.555 6.730 1.00 14.60 O ATOM 428 ND2 ASN A 47 4.463 -5.792 6.846 1.00 12.74 N ATOM 429 HD22 ASN A 47 5.321 -5.366 7.252 1.00 0.00 H ATOM 430 HD21 ASN A 47 3.884 -5.253 6.171 1.00 0.00 H ATOM 431 H ASN A 47 5.524 -8.538 10.714 1.00 0.00 H ATOM 432 N THR A 48 3.888 -4.963 9.919 1.00 12.35 N ATOM 433 CA THR A 48 2.730 -4.285 10.431 1.00 13.29 C ATOM 434 C THR A 48 2.245 -3.325 9.295 1.00 12.71 C ATOM 435 O THR A 48 3.056 -2.596 8.766 1.00 12.22 O ATOM 436 CB THR A 48 3.079 -3.417 11.677 1.00 12.42 C ATOM 437 OG1 THR A 48 3.691 -4.154 12.760 1.00 17.79 O ATOM 438 CG2 THR A 48 1.806 -2.801 12.299 1.00 21.30 C ATOM 439 HG1 THR A 48 3.882 -3.537 13.511 1.00 0.00 H ATOM 440 H THR A 48 4.609 -4.406 9.418 1.00 0.00 H ATOM 441 N PRO A 49 0.974 -3.276 8.952 1.00 13.41 N ATOM 442 CA PRO A 49 0.405 -2.188 8.135 1.00 13.64 C ATOM 443 C PRO A 49 0.271 -0.869 8.899 1.00 13.51 C ATOM 444 O PRO A 49 -0.145 -0.888 10.063 1.00 14.82 O ATOM 445 CB PRO A 49 -0.939 -2.722 7.632 1.00 17.53 C ATOM 446 CG PRO A 49 -1.264 -3.819 8.582 1.00 25.08 C ATOM 447 CD PRO A 49 -0.052 -4.245 9.353 1.00 19.62 C ATOM 448 N VAL A 50 0.689 0.234 8.313 1.00 13.26 N ATOM 449 CA VAL A 50 0.635 1.530 8.988 1.00 13.28 C ATOM 450 C VAL A 50 0.128 2.567 7.978 1.00 13.79 C ATOM 451 O VAL A 50 -0.156 2.264 6.786 1.00 14.10 O ATOM 452 CB VAL A 50 2.034 1.934 9.554 1.00 12.48 C ATOM 453 CG1 VAL A 50 2.509 0.931 10.613 1.00 12.14 C ATOM 454 CG2 VAL A 50 3.044 2.115 8.535 1.00 12.61 C ATOM 455 H VAL A 50 1.067 0.182 7.346 1.00 0.00 H ATOM 456 N LYS A 51 -0.112 3.745 8.444 1.00 14.09 N ATOM 457 CA LYS A 51 -0.407 4.919 7.649 1.00 14.64 C ATOM 458 C LYS A 51 0.384 6.107 7.945 1.00 14.44 C ATOM 459 O LYS A 51 0.656 6.283 9.156 1.00 14.22 O ATOM 460 CB LYS A 51 -1.886 5.418 7.715 1.00 21.93 C ATOM 461 CG LYS A 51 -2.944 4.555 8.333 1.00 27.17 C ATOM 462 CD LYS A 51 -4.338 4.904 7.805 1.00 26.97 C ATOM 463 H LYS A 51 -0.092 3.862 9.477 1.00 0.00 H ATOM 464 N GLY A 52 0.747 7.004 7.081 1.00 14.64 N ATOM 465 CA GLY A 52 1.621 8.080 7.461 1.00 14.51 C ATOM 466 C GLY A 52 1.785 9.214 6.518 1.00 15.10 C ATOM 467 O GLY A 52 1.155 9.169 5.457 1.00 15.65 O ATOM 468 H GLY A 52 0.402 6.944 6.102 1.00 0.00 H ATOM 469 N VAL A 53 2.538 10.246 6.903 1.00 15.18 N ATOM 470 CA VAL A 53 2.976 11.276 5.972 1.00 15.72 C ATOM 471 C VAL A 53 4.464 11.462 6.216 1.00 15.11 C ATOM 472 O VAL A 53 4.965 11.166 7.305 1.00 14.55 O ATOM 473 CB VAL A 53 2.263 12.615 6.063 1.00 16.95 C ATOM 474 CG1 VAL A 53 0.762 12.483 5.832 1.00 17.78 C ATOM 475 CG2 VAL A 53 2.482 13.282 7.390 1.00 17.10 C ATOM 476 H VAL A 53 2.821 10.317 7.901 1.00 0.00 H ATOM 477 N GLY A 54 5.186 11.957 5.221 1.00 15.35 N ATOM 478 CA GLY A 54 6.495 12.464 5.320 1.00 15.23 C ATOM 479 C GLY A 54 6.494 13.971 5.173 1.00 16.34 C ATOM 480 O GLY A 54 5.556 14.710 5.563 1.00 17.14 O ATOM 481 H GLY A 54 4.744 11.972 4.280 1.00 0.00 H ATOM 482 N VAL A 55 7.544 14.485 4.510 1.00 16.62 N ATOM 483 CA VAL A 55 7.745 15.936 4.413 1.00 19.97 C ATOM 484 C VAL A 55 6.706 16.671 3.580 1.00 23.44 C ATOM 485 O VAL A 55 6.432 17.871 3.793 1.00 24.70 O ATOM 486 CB VAL A 55 9.241 16.322 4.039 1.00 21.52 C ATOM 487 CG1 VAL A 55 10.233 15.692 4.969 1.00 21.10 C ATOM 488 CG2 VAL A 55 9.580 16.003 2.587 1.00 22.56 C ATOM 489 H VAL A 55 8.226 13.843 4.058 1.00 0.00 H ATOM 490 N GLN A 56 6.086 15.984 2.600 1.00 18.86 N ATOM 491 CA GLN A 56 5.135 16.591 1.729 1.00 20.05 C ATOM 492 C GLN A 56 3.720 16.619 2.271 1.00 20.48 C ATOM 493 O GLN A 56 2.851 17.231 1.670 1.00 26.65 O ATOM 494 CB GLN A 56 5.156 15.948 0.342 1.00 20.04 C ATOM 495 CG GLN A 56 6.477 16.124 -0.419 1.00 20.09 C ATOM 496 CD GLN A 56 7.445 15.012 -0.203 1.00 18.78 C ATOM 497 OE1 GLN A 56 7.121 14.033 0.460 1.00 18.28 O ATOM 498 NE2 GLN A 56 8.686 15.201 -0.610 1.00 18.86 N ATOM 499 HE22 GLN A 56 8.927 16.043 -1.171 1.00 0.00 H ATOM 500 HE21 GLN A 56 9.423 14.508 -0.370 1.00 0.00 H ATOM 501 H GLN A 56 6.309 14.976 2.475 1.00 0.00 H ATOM 502 N GLY A 57 3.482 15.937 3.412 1.00 19.60 N ATOM 503 CA GLY A 57 2.164 16.106 4.103 1.00 25.93 C ATOM 504 C GLY A 57 1.006 15.354 3.457 1.00 23.61 C ATOM 505 O GLY A 57 -0.161 15.721 3.584 1.00 33.12 O ATOM 506 H GLY A 57 4.205 15.302 3.806 1.00 0.00 H ATOM 507 N GLY A 58 1.352 14.247 2.835 1.00 22.71 N ATOM 508 CA GLY A 58 0.394 13.240 2.409 1.00 25.01 C ATOM 509 C GLY A 58 -0.125 13.466 1.016 1.00 38.73 C ATOM 510 O GLY A 58 0.466 14.229 0.238 1.00 33.57 O ATOM 511 H GLY A 58 2.360 14.085 2.639 1.00 0.00 H ATOM 512 N SER A 59 -1.244 12.792 0.714 1.00 29.37 N ATOM 513 CA SER A 59 -1.897 12.916 -0.596 1.00 29.21 C ATOM 514 C SER A 59 -0.995 13.235 -1.804 1.00 70.26 C ATOM 515 O SER A 59 0.023 12.582 -2.048 1.00 61.70 O ATOM 516 CB SER A 59 -2.958 14.003 -0.502 1.00 50.30 C ATOM 517 OG SER A 59 -3.990 13.544 0.348 1.00 39.17 O ATOM 518 HG SER A 59 -4.690 14.240 0.421 1.00 0.00 H ATOM 519 H SER A 59 -1.662 12.163 1.429 1.00 0.00 H TER 520 SER A 59 ATOM 521 N GLU A 67 -1.023 22.044 4.791 1.00 59.61 N ATOM 522 CA GLU A 67 -1.641 21.301 5.892 1.00 54.01 C ATOM 523 C GLU A 67 -2.062 19.869 5.459 1.00 55.23 C ATOM 524 O GLU A 67 -2.047 19.504 4.242 1.00 39.08 O ATOM 525 CB GLU A 67 -2.852 22.079 6.453 1.00 47.18 C ATOM 526 HN3 GLU A 67 -1.701 22.126 4.006 1.00 0.00 H ATOM 527 HN2 GLU A 67 -0.174 21.538 4.466 1.00 0.00 H ATOM 528 HN1 GLU A 67 -0.757 22.994 5.121 1.00 0.00 H ATOM 529 N PHE A 68 -2.432 19.059 6.457 1.00 41.86 N ATOM 530 CA PHE A 68 -3.020 17.725 6.211 1.00 32.86 C ATOM 531 C PHE A 68 -3.913 17.292 7.387 1.00 43.06 C ATOM 532 O PHE A 68 -3.875 17.877 8.472 1.00 29.26 O ATOM 533 CB PHE A 68 -1.948 16.681 5.901 1.00 29.88 C ATOM 534 CG PHE A 68 -0.997 16.456 7.027 1.00 26.05 C ATOM 535 CD1 PHE A 68 0.133 17.257 7.140 1.00 26.24 C ATOM 536 CD2 PHE A 68 -1.172 15.418 7.931 1.00 29.24 C ATOM 537 CE1 PHE A 68 1.062 17.042 8.116 1.00 24.25 C ATOM 538 CE2 PHE A 68 -0.266 15.220 8.977 1.00 28.43 C ATOM 539 CZ PHE A 68 0.870 16.040 9.089 1.00 22.92 C ATOM 540 H PHE A 68 -2.302 19.378 7.438 1.00 0.00 H ATOM 541 N GLY A 69 -4.739 16.287 7.122 1.00 29.02 N ATOM 542 CA GLY A 69 -5.654 15.685 8.100 1.00 29.28 C ATOM 543 C GLY A 69 -5.545 14.182 7.940 1.00 27.03 C ATOM 544 O GLY A 69 -4.746 13.666 7.139 1.00 27.69 O ATOM 545 H GLY A 69 -4.738 15.900 6.157 1.00 0.00 H ATOM 546 N PRO A 70 -6.336 13.445 8.744 1.00 31.21 N ATOM 547 CA PRO A 70 -6.202 11.953 8.726 1.00 29.86 C ATOM 548 C PRO A 70 -6.453 11.318 7.323 1.00 24.74 C ATOM 549 O PRO A 70 -5.865 10.260 7.025 1.00 25.95 O ATOM 550 CB PRO A 70 -7.245 11.514 9.770 1.00 41.12 C ATOM 551 CG PRO A 70 -7.319 12.687 10.678 1.00 29.02 C ATOM 552 CD PRO A 70 -7.298 13.885 9.770 1.00 28.37 C ATOM 553 N SER A 71 -7.335 11.958 6.548 1.00 26.61 N ATOM 554 CA SER A 71 -7.652 11.570 5.151 1.00 29.73 C ATOM 555 C SER A 71 -6.467 11.661 4.209 1.00 41.18 C ATOM 556 O SER A 71 -6.457 11.010 3.168 1.00 29.96 O ATOM 557 CB SER A 71 -8.849 12.370 4.631 1.00 33.28 C ATOM 558 OG SER A 71 -8.499 13.599 3.991 1.00 48.77 O ATOM 559 HG SER A 71 -8.018 14.179 4.633 1.00 0.00 H ATOM 560 H SER A 71 -7.830 12.780 6.950 1.00 0.00 H ATOM 561 N ASN A 72 -5.414 12.384 4.594 1.00 24.98 N ATOM 562 CA ASN A 72 -4.278 12.533 3.736 1.00 23.35 C ATOM 563 C ASN A 72 -3.241 11.574 4.103 1.00 20.52 C ATOM 564 O ASN A 72 -2.222 11.508 3.425 1.00 19.90 O ATOM 565 CB ASN A 72 -3.691 13.961 3.737 1.00 24.71 C ATOM 566 CG ASN A 72 -4.650 14.975 3.317 1.00 28.46 C ATOM 567 OD1 ASN A 72 -4.988 15.120 2.109 1.00 32.52 O ATOM 568 ND2 ASN A 72 -5.200 15.674 4.236 1.00 27.03 N ATOM 569 HD22 ASN A 72 -4.914 15.547 5.228 1.00 0.00 H ATOM 570 HD21 ASN A 72 -5.933 16.370 3.992 1.00 0.00 H ATOM 571 H ASN A 72 -5.419 12.844 5.527 1.00 0.00 H ATOM 572 N LEU A 73 -3.378 10.842 5.242 1.00 19.90 N ATOM 573 CA LEU A 73 -2.372 9.839 5.560 1.00 18.43 C ATOM 574 C LEU A 73 -2.380 8.729 4.487 1.00 18.11 C ATOM 575 O LEU A 73 -3.433 8.394 3.967 1.00 18.95 O ATOM 576 CB LEU A 73 -2.526 9.227 6.951 1.00 18.15 C ATOM 577 CG LEU A 73 -1.903 10.049 8.127 1.00 19.80 C ATOM 578 CD1 LEU A 73 -2.355 11.482 8.183 1.00 22.87 C ATOM 579 CD2 LEU A 73 -2.148 9.324 9.431 1.00 27.94 C ATOM 580 H LEU A 73 -4.188 10.997 5.875 1.00 0.00 H ATOM 581 N VAL A 74 -1.223 8.232 4.129 1.00 17.10 N ATOM 582 CA VAL A 74 -1.017 7.279 2.998 1.00 16.88 C ATOM 583 C VAL A 74 -0.669 5.900 3.539 1.00 15.98 C ATOM 584 O VAL A 74 0.165 5.796 4.470 1.00 15.13 O ATOM 585 CB VAL A 74 0.171 7.724 2.216 1.00 16.53 C ATOM 586 CG1 VAL A 74 0.369 6.768 1.049 1.00 16.47 C ATOM 587 CG2 VAL A 74 -0.059 9.092 1.616 1.00 19.14 C ATOM 588 H VAL A 74 -0.385 8.522 4.673 1.00 0.00 H ATOM 589 N ASP A 75 -1.302 4.815 3.138 1.00 16.24 N ATOM 590 CA ASP A 75 -1.011 3.434 3.506 1.00 15.62 C ATOM 591 C ASP A 75 0.397 3.055 3.151 1.00 14.74 C ATOM 592 O ASP A 75 0.799 3.284 2.010 1.00 14.93 O ATOM 593 CB ASP A 75 -2.003 2.474 2.783 1.00 16.86 C ATOM 594 CG ASP A 75 -3.400 2.591 3.297 1.00 21.68 C ATOM 595 OD1 ASP A 75 -3.659 3.109 4.405 1.00 25.37 O ATOM 596 OD2 ASP A 75 -4.281 2.119 2.576 1.00 29.13 O ATOM 597 H ASP A 75 -2.099 4.960 2.486 1.00 0.00 H ATOM 598 N LYS A 76 1.101 2.447 4.116 1.00 13.95 N ATOM 599 CA LYS A 76 2.431 1.980 3.964 1.00 13.23 C ATOM 600 C LYS A 76 2.526 0.600 4.635 1.00 12.93 C ATOM 601 O LYS A 76 1.727 0.265 5.434 1.00 14.12 O ATOM 602 CB LYS A 76 3.423 2.962 4.627 1.00 12.68 C ATOM 603 CG LYS A 76 3.405 4.335 4.044 1.00 13.10 C ATOM 604 CD LYS A 76 3.972 4.418 2.643 1.00 15.05 C ATOM 605 CE LYS A 76 3.907 5.801 2.008 1.00 17.22 C ATOM 606 NZ LYS A 76 4.065 5.995 0.558 1.00 17.54 N ATOM 607 HZ1 LYS A 76 4.998 5.644 0.262 1.00 0.00 H ATOM 608 HZ2 LYS A 76 3.320 5.470 0.056 1.00 0.00 H ATOM 609 HZ3 LYS A 76 3.988 7.008 0.335 1.00 0.00 H ATOM 610 H LYS A 76 0.641 2.308 5.038 1.00 0.00 H ATOM 611 N GLU A 77 3.543 -0.156 4.284 1.00 12.57 N ATOM 612 CA GLU A 77 3.913 -1.386 4.944 1.00 12.33 C ATOM 613 C GLU A 77 5.169 -1.137 5.755 1.00 11.64 C ATOM 614 O GLU A 77 6.055 -0.409 5.328 1.00 11.40 O ATOM 615 CB GLU A 77 4.097 -2.566 4.010 1.00 12.68 C ATOM 616 CG GLU A 77 2.784 -3.035 3.505 1.00 14.30 C ATOM 617 CD GLU A 77 1.887 -3.804 4.449 1.00 14.78 C ATOM 618 OE1 GLU A 77 2.332 -4.196 5.546 1.00 14.57 O ATOM 619 OE2 GLU A 77 0.699 -4.066 4.126 1.00 20.75 O ATOM 620 H GLU A 77 4.120 0.153 3.476 1.00 0.00 H ATOM 621 N LYS A 78 5.152 -1.705 6.998 1.00 11.47 N ATOM 622 CA LYS A 78 6.354 -1.575 7.820 1.00 10.95 C ATOM 623 C LYS A 78 6.901 -2.937 8.100 1.00 11.00 C ATOM 624 O LYS A 78 6.187 -3.889 8.335 1.00 11.38 O ATOM 625 CB LYS A 78 6.043 -0.899 9.094 1.00 11.08 C ATOM 626 CG LYS A 78 7.228 -0.792 10.024 1.00 11.54 C ATOM 627 CD LYS A 78 6.805 -1.070 11.434 1.00 10.96 C ATOM 628 CE LYS A 78 6.095 0.183 11.849 1.00 11.91 C ATOM 629 NZ LYS A 78 5.796 0.386 13.307 1.00 19.01 N ATOM 630 HZ1 LYS A 78 5.191 -0.389 13.647 1.00 0.00 H ATOM 631 HZ2 LYS A 78 6.686 0.393 13.844 1.00 0.00 H ATOM 632 HZ3 LYS A 78 5.305 1.293 13.436 1.00 0.00 H ATOM 633 H LYS A 78 4.314 -2.212 7.347 1.00 0.00 H ATOM 634 N LEU A 79 8.233 -3.019 8.091 1.00 10.75 N ATOM 635 CA LEU A 79 9.006 -4.183 8.541 1.00 11.14 C ATOM 636 C LEU A 79 9.928 -3.739 9.639 1.00 10.56 C ATOM 637 O LEU A 79 10.650 -2.710 9.512 1.00 10.30 O ATOM 638 CB LEU A 79 9.880 -4.804 7.457 1.00 11.11 C ATOM 639 CG LEU A 79 9.166 -5.513 6.378 1.00 12.94 C ATOM 640 CD1 LEU A 79 10.158 -5.877 5.276 1.00 13.64 C ATOM 641 CD2 LEU A 79 8.485 -6.801 6.854 1.00 13.60 C ATOM 642 H LEU A 79 8.763 -2.197 7.739 1.00 0.00 H ATOM 643 N ASP A 80 10.010 -4.580 10.689 1.00 10.75 N ATOM 644 CA ASP A 80 11.008 -4.365 11.741 1.00 10.65 C ATOM 645 C ASP A 80 11.869 -5.609 11.732 1.00 11.07 C ATOM 646 O ASP A 80 11.399 -6.740 11.713 1.00 11.51 O ATOM 647 CB ASP A 80 10.352 -4.112 13.067 1.00 10.67 C ATOM 648 CG ASP A 80 9.576 -2.812 13.078 1.00 10.42 C ATOM 649 OD1 ASP A 80 8.407 -2.863 12.638 1.00 14.69 O ATOM 650 OD2 ASP A 80 10.062 -1.732 13.507 1.00 10.29 O ATOM 651 H ASP A 80 9.359 -5.389 10.753 1.00 0.00 H ATOM 652 N ILE A 81 13.153 -5.374 11.724 1.00 11.08 N ATOM 653 CA ILE A 81 14.213 -6.406 11.425 1.00 11.63 C ATOM 654 C ILE A 81 15.311 -6.139 12.489 1.00 11.77 C ATOM 655 O ILE A 81 15.975 -5.142 12.375 1.00 11.56 O ATOM 656 CB ILE A 81 14.781 -6.353 9.995 1.00 11.75 C ATOM 657 CG1 ILE A 81 13.623 -6.072 8.946 1.00 11.93 C ATOM 658 CG2 ILE A 81 15.540 -7.612 9.710 1.00 15.59 C ATOM 659 CD1 ILE A 81 14.008 -5.267 7.770 1.00 14.98 C ATOM 660 H ILE A 81 13.468 -4.406 11.939 1.00 0.00 H ATOM 661 N VAL A 82 15.386 -7.028 13.472 1.00 12.24 N ATOM 662 CA VAL A 82 16.471 -6.854 14.493 1.00 12.56 C ATOM 663 C VAL A 82 17.653 -7.653 14.022 1.00 13.28 C ATOM 664 O VAL A 82 17.534 -8.826 13.750 1.00 13.83 O ATOM 665 CB VAL A 82 16.043 -7.263 15.860 1.00 12.85 C ATOM 666 CG1 VAL A 82 17.198 -7.144 16.835 1.00 13.35 C ATOM 667 CG2 VAL A 82 14.907 -6.420 16.245 1.00 12.28 C ATOM 668 H VAL A 82 14.714 -7.820 13.532 1.00 0.00 H ATOM 669 N VAL A 83 18.784 -6.969 13.865 1.00 13.38 N ATOM 670 CA VAL A 83 20.009 -7.546 13.355 1.00 14.18 C ATOM 671 C VAL A 83 21.240 -7.224 14.236 1.00 14.77 C ATOM 672 O VAL A 83 21.162 -6.286 15.055 1.00 14.41 O ATOM 673 CB VAL A 83 20.333 -7.070 11.900 1.00 14.05 C ATOM 674 CG1 VAL A 83 19.191 -7.433 11.010 1.00 13.67 C ATOM 675 CG2 VAL A 83 20.580 -5.604 11.846 1.00 13.55 C ATOM 676 H VAL A 83 18.787 -5.962 14.124 1.00 0.00 H ATOM 677 N SER A 84 22.291 -7.947 14.047 1.00 15.74 N ATOM 678 CA SER A 84 23.522 -7.563 14.714 1.00 16.44 C ATOM 679 C SER A 84 24.071 -6.269 14.185 1.00 16.16 C ATOM 680 O SER A 84 23.829 -5.871 13.050 1.00 15.72 O ATOM 681 CB SER A 84 24.507 -8.646 14.505 1.00 17.71 C ATOM 682 OG SER A 84 25.076 -8.585 13.158 1.00 19.97 O ATOM 683 HG SER A 84 25.731 -9.319 13.044 1.00 0.00 H ATOM 684 H SER A 84 22.258 -8.785 13.432 1.00 0.00 H ATOM 685 N ARG A 85 24.872 -5.556 14.989 1.00 16.57 N ATOM 686 CA ARG A 85 25.494 -4.315 14.601 1.00 16.56 C ATOM 687 C ARG A 85 26.222 -4.455 13.273 1.00 17.07 C ATOM 688 O ARG A 85 26.138 -3.556 12.429 1.00 16.68 O ATOM 689 CB ARG A 85 26.474 -3.921 15.725 1.00 17.41 C ATOM 690 CG ARG A 85 27.245 -2.682 15.498 1.00 17.71 C ATOM 691 CD ARG A 85 28.125 -2.434 16.783 1.00 18.71 C ATOM 692 NE ARG A 85 28.650 -1.081 16.762 1.00 18.96 N ATOM 693 CZ ARG A 85 28.178 -0.064 17.438 1.00 18.55 C ATOM 694 NH1 ARG A 85 27.387 -0.294 18.471 1.00 18.12 N ATOM 695 NH2 ARG A 85 28.721 1.138 17.301 1.00 22.81 N ATOM 696 HE ARG A 85 29.476 -0.903 16.155 1.00 0.00 H ATOM 697 HH12 ARG A 85 27.003 0.502 19.019 1.00 0.00 H ATOM 698 HH11 ARG A 85 27.148 -1.271 18.736 1.00 0.00 H ATOM 699 HH22 ARG A 85 28.343 1.944 17.840 1.00 0.00 H ATOM 700 HH21 ARG A 85 29.524 1.275 16.655 1.00 0.00 H ATOM 701 H ARG A 85 25.055 -5.918 15.946 1.00 0.00 H ATOM 702 N ALA A 86 26.960 -5.547 13.095 1.00 18.10 N ATOM 703 CA ALA A 86 27.793 -5.702 11.913 1.00 18.89 C ATOM 704 C ALA A 86 26.937 -5.777 10.626 1.00 18.16 C ATOM 705 O ALA A 86 27.509 -5.574 9.567 1.00 18.67 O ATOM 706 CB ALA A 86 28.628 -6.948 12.033 1.00 20.25 C ATOM 707 H ALA A 86 26.941 -6.301 13.811 1.00 0.00 H ATOM 708 N GLN A 87 25.666 -6.137 10.722 1.00 17.22 N ATOM 709 CA GLN A 87 24.764 -6.323 9.565 1.00 16.66 C ATOM 710 C GLN A 87 23.957 -5.129 9.286 1.00 15.60 C ATOM 711 O GLN A 87 23.257 -5.092 8.252 1.00 15.22 O ATOM 712 CB GLN A 87 23.812 -7.463 9.836 1.00 16.47 C ATOM 713 CG GLN A 87 24.434 -8.820 9.945 1.00 17.88 C ATOM 714 CD GLN A 87 23.352 -9.788 10.446 1.00 29.84 C ATOM 715 OE1 GLN A 87 22.706 -9.616 11.549 1.00 35.74 O ATOM 716 NE2 GLN A 87 23.057 -10.763 9.599 1.00 38.62 N ATOM 717 HE22 GLN A 87 23.601 -10.870 8.719 1.00 0.00 H ATOM 718 HE21 GLN A 87 22.281 -11.422 9.814 1.00 0.00 H ATOM 719 H GLN A 87 25.277 -6.299 11.673 1.00 0.00 H ATOM 720 N VAL A 88 23.913 -4.104 10.098 1.00 15.15 N ATOM 721 CA VAL A 88 23.114 -2.915 9.836 1.00 14.29 C ATOM 722 C VAL A 88 23.301 -2.349 8.442 1.00 14.43 C ATOM 723 O VAL A 88 22.276 -2.185 7.794 1.00 13.82 O ATOM 724 CB VAL A 88 23.304 -1.858 10.964 1.00 14.14 C ATOM 725 CG1 VAL A 88 22.522 -0.596 10.684 1.00 13.45 C ATOM 726 CG2 VAL A 88 22.856 -2.450 12.292 1.00 13.96 C ATOM 727 H VAL A 88 24.475 -4.140 10.972 1.00 0.00 H ATOM 728 N ASP A 89 24.384 -1.887 8.057 1.00 15.16 N ATOM 729 CA ASP A 89 24.560 -1.264 6.803 1.00 15.41 C ATOM 730 C ASP A 89 24.096 -2.214 5.713 1.00 15.48 C ATOM 731 O ASP A 89 23.368 -1.752 4.805 1.00 15.12 O ATOM 732 CB ASP A 89 25.960 -0.824 6.565 1.00 16.50 C ATOM 733 CG ASP A 89 26.326 0.445 7.353 1.00 18.49 C ATOM 734 OD1 ASP A 89 25.400 1.055 7.912 1.00 22.87 O ATOM 735 OD2 ASP A 89 27.504 0.795 7.340 1.00 25.65 O ATOM 736 H ASP A 89 25.206 -1.962 8.690 1.00 0.00 H ATOM 737 N ALA A 90 24.456 -3.463 5.731 1.00 16.05 N ATOM 738 CA ALA A 90 24.066 -4.368 4.607 1.00 16.34 C ATOM 739 C ALA A 90 22.605 -4.421 4.552 1.00 15.36 C ATOM 740 O ALA A 90 22.035 -4.428 3.412 1.00 15.37 O ATOM 741 CB ALA A 90 24.584 -5.754 4.808 1.00 17.19 C ATOM 742 H ALA A 90 25.015 -3.832 6.527 1.00 0.00 H ATOM 743 N VAL A 91 21.880 -4.566 5.609 1.00 14.66 N ATOM 744 CA VAL A 91 20.453 -4.772 5.573 1.00 13.93 C ATOM 745 C VAL A 91 19.801 -3.478 5.213 1.00 13.29 C ATOM 746 O VAL A 91 18.796 -3.530 4.395 1.00 13.07 O ATOM 747 CB VAL A 91 19.968 -5.450 6.872 1.00 13.63 C ATOM 748 CG1 VAL A 91 18.458 -5.547 6.897 1.00 12.97 C ATOM 749 CG2 VAL A 91 20.572 -6.808 7.008 1.00 14.49 C ATOM 750 H VAL A 91 22.349 -4.533 6.536 1.00 0.00 H ATOM 751 N VAL A 92 20.121 -2.317 5.703 1.00 13.05 N ATOM 752 CA VAL A 92 19.539 -1.040 5.327 1.00 12.65 C ATOM 753 C VAL A 92 19.653 -0.874 3.819 1.00 13.12 C ATOM 754 O VAL A 92 18.715 -0.499 3.157 1.00 12.88 O ATOM 755 CB VAL A 92 20.237 0.113 6.103 1.00 12.69 C ATOM 756 CG1 VAL A 92 19.849 1.489 5.597 1.00 12.58 C ATOM 757 CG2 VAL A 92 19.926 -0.027 7.599 1.00 12.26 C ATOM 758 H VAL A 92 20.863 -2.301 6.432 1.00 0.00 H ATOM 759 N ARG A 93 20.791 -1.188 3.304 1.00 13.92 N ATOM 760 CA ARG A 93 21.104 -1.048 1.844 1.00 14.62 C ATOM 761 C ARG A 93 20.175 -1.975 1.100 1.00 14.59 C ATOM 762 O ARG A 93 19.580 -1.544 0.042 1.00 14.71 O ATOM 763 CB ARG A 93 22.548 -1.334 1.525 1.00 15.67 C ATOM 764 CG ARG A 93 23.498 -0.247 1.961 1.00 16.18 C ATOM 765 CD ARG A 93 24.926 -0.776 1.937 1.00 24.43 C ATOM 766 NE ARG A 93 25.841 0.114 2.633 1.00 29.45 N ATOM 767 CZ ARG A 93 27.087 -0.202 2.935 1.00 27.44 C ATOM 768 NH1 ARG A 93 27.536 -1.419 2.612 1.00 37.52 N ATOM 769 NH2 ARG A 93 27.890 0.691 3.566 1.00 27.53 N ATOM 770 HE ARG A 93 25.494 1.055 2.909 1.00 0.00 H ATOM 771 HH12 ARG A 93 28.514 -1.690 2.840 1.00 0.00 H ATOM 772 HH11 ARG A 93 26.907 -2.095 2.133 1.00 0.00 H ATOM 773 HH22 ARG A 93 28.870 0.434 3.800 1.00 0.00 H ATOM 774 HH21 ARG A 93 27.525 1.633 3.815 1.00 0.00 H ATOM 775 H ARG A 93 21.532 -1.558 3.934 1.00 0.00 H ATOM 776 N LEU A 94 20.013 -3.224 1.496 1.00 14.61 N ATOM 777 CA LEU A 94 19.122 -4.128 0.752 1.00 14.76 C ATOM 778 C LEU A 94 17.740 -3.610 0.764 1.00 14.03 C ATOM 779 O LEU A 94 16.998 -3.748 -0.256 1.00 14.28 O ATOM 780 CB LEU A 94 19.160 -5.558 1.369 1.00 15.54 C ATOM 781 CG LEU A 94 20.507 -6.254 1.136 1.00 17.87 C ATOM 782 CD1 LEU A 94 20.566 -7.460 2.119 1.00 21.91 C ATOM 783 CD2 LEU A 94 20.655 -6.606 -0.322 1.00 19.79 C ATOM 784 H LEU A 94 20.517 -3.570 2.337 1.00 0.00 H ATOM 785 N VAL A 95 17.193 -3.175 1.855 1.00 13.25 N ATOM 786 CA VAL A 95 15.815 -2.712 1.975 1.00 12.66 C ATOM 787 C VAL A 95 15.669 -1.442 1.230 1.00 12.70 C ATOM 788 O VAL A 95 14.684 -1.340 0.387 1.00 12.84 O ATOM 789 CB VAL A 95 15.447 -2.418 3.442 1.00 11.97 C ATOM 790 CG1 VAL A 95 14.062 -1.907 3.525 1.00 11.57 C ATOM 791 CG2 VAL A 95 15.466 -3.683 4.273 1.00 12.01 C ATOM 792 H VAL A 95 17.782 -3.154 2.712 1.00 0.00 H ATOM 793 N ALA A 96 16.597 -0.513 1.282 1.00 12.83 N ATOM 794 CA ALA A 96 16.485 0.685 0.470 1.00 13.08 C ATOM 795 C ALA A 96 16.484 0.396 -1.039 1.00 13.84 C ATOM 796 O ALA A 96 15.666 0.908 -1.805 1.00 14.01 O ATOM 797 CB ALA A 96 17.470 1.749 0.821 1.00 13.25 C ATOM 798 H ALA A 96 17.417 -0.637 1.909 1.00 0.00 H ATOM 799 N ALA A 97 17.282 -0.525 -1.427 1.00 14.37 N ATOM 800 CA ALA A 97 17.386 -0.836 -2.863 1.00 15.26 C ATOM 801 C ALA A 97 16.167 -1.517 -3.352 1.00 15.26 C ATOM 802 O ALA A 97 15.837 -1.289 -4.505 1.00 15.88 O ATOM 803 CB ALA A 97 18.691 -1.668 -3.124 1.00 16.06 C ATOM 804 H ALA A 97 17.853 -1.050 -0.734 1.00 0.00 H ATOM 805 N SER A 98 15.506 -2.360 -2.636 1.00 14.79 N ATOM 806 CA SER A 98 14.365 -3.103 -3.032 1.00 14.94 C ATOM 807 C SER A 98 13.133 -2.241 -2.997 1.00 14.54 C ATOM 808 O SER A 98 12.179 -2.447 -3.777 1.00 14.97 O ATOM 809 CB SER A 98 14.152 -4.324 -2.109 1.00 14.69 C ATOM 810 OG SER A 98 15.231 -5.250 -2.293 1.00 18.19 O ATOM 811 HG SER A 98 15.097 -6.033 -1.703 1.00 0.00 H ATOM 812 H SER A 98 15.845 -2.512 -1.665 1.00 0.00 H ATOM 813 N ALA A 99 13.053 -1.299 -2.085 1.00 13.84 N ATOM 814 CA ALA A 99 11.877 -0.474 -1.911 1.00 13.56 C ATOM 815 C ALA A 99 11.891 0.734 -2.882 1.00 14.06 C ATOM 816 O ALA A 99 10.834 1.360 -3.149 1.00 14.21 O ATOM 817 CB ALA A 99 11.804 0.024 -0.485 1.00 12.77 C ATOM 818 H ALA A 99 13.870 -1.139 -1.461 1.00 0.00 H ATOM 819 N TYR A 100 13.013 1.068 -3.431 1.00 14.48 N ATOM 820 CA TYR A 100 13.221 2.270 -4.270 1.00 15.08 C ATOM 821 C TYR A 100 12.425 2.253 -5.577 1.00 15.89 C ATOM 822 O TYR A 100 12.411 1.240 -6.313 1.00 16.39 O ATOM 823 CB TYR A 100 14.706 2.415 -4.618 1.00 15.56 C ATOM 824 CG TYR A 100 15.055 3.512 -5.560 1.00 16.40 C ATOM 825 CD1 TYR A 100 15.341 4.801 -5.128 1.00 16.38 C ATOM 826 CD2 TYR A 100 15.045 3.289 -6.863 1.00 17.33 C ATOM 827 CE1 TYR A 100 15.579 5.827 -5.985 1.00 17.28 C ATOM 828 CE2 TYR A 100 15.334 4.321 -7.775 1.00 20.74 C ATOM 829 CZ TYR A 100 15.638 5.583 -7.271 1.00 20.47 C ATOM 830 OH TYR A 100 15.803 6.503 -8.311 1.00 28.60 O ATOM 831 HH TYR A 100 16.018 7.392 -7.932 1.00 0.00 H ATOM 832 H TYR A 100 13.831 0.446 -3.271 1.00 0.00 H ATOM 833 N THR A 101 11.809 3.400 -5.826 1.00 16.15 N ATOM 834 CA THR A 101 11.269 3.649 -7.188 1.00 17.19 C ATOM 835 C THR A 101 11.783 4.910 -7.731 1.00 17.86 C ATOM 836 O THR A 101 11.774 4.998 -8.988 1.00 18.92 O ATOM 837 CB THR A 101 9.741 3.695 -7.231 1.00 17.28 C ATOM 838 OG1 THR A 101 9.231 4.911 -6.678 1.00 17.14 O ATOM 839 CG2 THR A 101 9.097 2.515 -6.537 1.00 17.19 C ATOM 840 HG1 THR A 101 9.519 4.989 -5.734 1.00 0.00 H ATOM 841 H THR A 101 11.705 4.116 -5.079 1.00 0.00 H ATOM 842 N GLY A 102 12.154 5.893 -6.921 1.00 17.49 N ATOM 843 CA GLY A 102 12.613 7.180 -7.395 1.00 18.29 C ATOM 844 C GLY A 102 11.567 8.284 -7.258 1.00 18.55 C ATOM 845 O GLY A 102 11.913 9.437 -7.476 1.00 19.24 O ATOM 846 H GLY A 102 12.113 5.730 -5.895 1.00 0.00 H ATOM 847 N GLU A 103 10.331 7.998 -6.815 1.00 18.66 N ATOM 848 CA GLU A 103 9.323 9.045 -6.578 1.00 19.66 C ATOM 849 C GLU A 103 9.097 9.297 -5.118 1.00 18.07 C ATOM 850 O GLU A 103 9.368 8.423 -4.308 1.00 16.62 O ATOM 851 CB GLU A 103 7.982 8.570 -7.150 1.00 18.90 C ATOM 852 CG GLU A 103 8.077 8.153 -8.620 1.00 22.95 C ATOM 853 CD GLU A 103 8.325 9.289 -9.614 1.00 36.90 C ATOM 854 OE1 GLU A 103 8.104 10.505 -9.361 1.00 34.00 O ATOM 855 OE2 GLU A 103 8.815 8.936 -10.678 1.00 32.03 O ATOM 856 H GLU A 103 10.078 7.006 -6.634 1.00 0.00 H ATOM 857 N ILE A 104 8.616 10.496 -4.781 1.00 18.05 N ATOM 858 CA ILE A 104 8.332 10.855 -3.426 1.00 17.44 C ATOM 859 C ILE A 104 7.403 9.828 -2.848 1.00 16.73 C ATOM 860 O ILE A 104 6.446 9.343 -3.497 1.00 18.02 O ATOM 861 CB ILE A 104 7.781 12.279 -3.223 1.00 24.39 C ATOM 862 CG1 ILE A 104 6.447 12.458 -3.911 1.00 20.96 C ATOM 863 CG2 ILE A 104 8.827 13.336 -3.564 1.00 25.08 C ATOM 864 CD1 ILE A 104 5.653 13.623 -3.273 1.00 30.12 C ATOM 865 H ILE A 104 8.441 11.195 -5.531 1.00 0.00 H ATOM 866 N GLY A 105 7.629 9.559 -1.585 1.00 15.84 N ATOM 867 CA GLY A 105 6.876 8.589 -0.851 1.00 15.19 C ATOM 868 C GLY A 105 7.453 7.206 -0.885 1.00 14.50 C ATOM 869 O GLY A 105 6.780 6.249 -0.479 1.00 14.16 O ATOM 870 H GLY A 105 8.389 10.073 -1.095 1.00 0.00 H ATOM 871 N ASP A 106 8.652 6.996 -1.312 1.00 14.41 N ATOM 872 CA ASP A 106 9.166 5.658 -1.419 1.00 13.98 C ATOM 873 C ASP A 106 9.445 5.041 -0.019 1.00 13.09 C ATOM 874 O ASP A 106 9.530 3.854 0.116 1.00 12.78 O ATOM 875 CB ASP A 106 10.600 5.712 -2.092 1.00 14.24 C ATOM 876 CG ASP A 106 10.619 5.569 -3.589 1.00 15.08 C ATOM 877 OD1 ASP A 106 9.584 5.251 -4.117 1.00 15.40 O ATOM 878 OD2 ASP A 106 11.696 5.710 -4.127 1.00 15.45 O ATOM 879 H ASP A 106 9.252 7.802 -1.581 1.00 0.00 H ATOM 880 N GLY A 107 9.610 5.858 0.988 1.00 12.84 N ATOM 881 CA GLY A 107 9.741 5.350 2.366 1.00 12.15 C ATOM 882 C GLY A 107 10.843 5.964 3.117 1.00 11.98 C ATOM 883 O GLY A 107 11.670 6.741 2.675 1.00 12.37 O ATOM 884 H GLY A 107 9.650 6.883 0.814 1.00 0.00 H ATOM 885 N LYS A 108 10.897 5.487 4.364 1.00 11.46 N ATOM 886 CA LYS A 108 11.973 5.854 5.269 1.00 11.32 C ATOM 887 C LYS A 108 12.368 4.629 6.070 1.00 10.85 C ATOM 888 O LYS A 108 11.583 3.730 6.308 1.00 10.61 O ATOM 889 CB LYS A 108 11.492 6.981 6.172 1.00 11.47 C ATOM 890 CG LYS A 108 12.638 7.768 6.772 1.00 11.67 C ATOM 891 CD LYS A 108 12.202 9.159 7.211 1.00 12.45 C ATOM 892 CE LYS A 108 11.881 10.072 6.054 1.00 12.85 C ATOM 893 NZ LYS A 108 11.428 11.449 6.483 1.00 13.62 N ATOM 894 HZ1 LYS A 108 10.569 11.365 7.063 1.00 0.00 H ATOM 895 HZ2 LYS A 108 12.180 11.902 7.040 1.00 0.00 H ATOM 896 HZ3 LYS A 108 11.224 12.024 5.641 1.00 0.00 H ATOM 897 H LYS A 108 10.153 4.839 4.694 1.00 0.00 H ATOM 898 N ILE A 109 13.648 4.637 6.459 1.00 10.88 N ATOM 899 CA ILE A 109 14.237 3.571 7.307 1.00 10.62 C ATOM 900 C ILE A 109 14.797 4.297 8.521 1.00 10.67 C ATOM 901 O ILE A 109 15.594 5.223 8.429 1.00 11.04 O ATOM 902 CB ILE A 109 15.331 2.784 6.595 1.00 10.85 C ATOM 903 CG1 ILE A 109 14.763 2.220 5.236 1.00 10.99 C ATOM 904 CG2 ILE A 109 15.942 1.655 7.425 1.00 10.77 C ATOM 905 CD1 ILE A 109 15.830 1.681 4.320 1.00 11.45 C ATOM 906 H ILE A 109 14.256 5.424 6.154 1.00 0.00 H ATOM 907 N PHE A 110 14.373 3.791 9.672 1.00 10.41 N ATOM 908 CA PHE A 110 14.841 4.240 11.009 1.00 10.52 C ATOM 909 C PHE A 110 15.590 3.060 11.572 1.00 10.50 C ATOM 910 O PHE A 110 15.167 1.959 11.585 1.00 11.97 O ATOM 911 CB PHE A 110 13.663 4.614 11.810 1.00 10.43 C ATOM 912 CG PHE A 110 12.803 5.669 11.198 1.00 10.60 C ATOM 913 CD1 PHE A 110 13.116 6.990 11.247 1.00 11.03 C ATOM 914 CD2 PHE A 110 11.590 5.304 10.602 1.00 15.16 C ATOM 915 CE1 PHE A 110 12.207 7.979 10.683 1.00 12.46 C ATOM 916 CE2 PHE A 110 10.726 6.274 10.056 1.00 16.22 C ATOM 917 CZ PHE A 110 11.026 7.604 10.215 1.00 12.29 C ATOM 918 H PHE A 110 13.666 3.029 9.636 1.00 0.00 H ATOM 919 N VAL A 111 16.764 3.369 12.143 1.00 10.86 N ATOM 920 CA VAL A 111 17.612 2.381 12.874 1.00 11.06 C ATOM 921 C VAL A 111 17.565 2.762 14.374 1.00 11.23 C ATOM 922 O VAL A 111 17.849 3.925 14.699 1.00 11.53 O ATOM 923 CB VAL A 111 19.011 2.335 12.318 1.00 11.56 C ATOM 924 CG1 VAL A 111 19.788 1.280 13.012 1.00 11.90 C ATOM 925 CG2 VAL A 111 19.046 2.118 10.845 1.00 11.54 C ATOM 926 H VAL A 111 17.102 4.350 12.073 1.00 0.00 H ATOM 927 N HIS A 112 17.221 1.771 15.212 1.00 11.17 N ATOM 928 CA HIS A 112 16.996 2.024 16.636 1.00 11.40 C ATOM 929 C HIS A 112 17.884 1.026 17.421 1.00 11.85 C ATOM 930 O HIS A 112 18.017 -0.112 17.065 1.00 11.84 O ATOM 931 CB HIS A 112 15.612 1.669 16.963 1.00 11.09 C ATOM 932 CG HIS A 112 14.553 2.327 16.121 1.00 10.74 C ATOM 933 ND1 HIS A 112 13.935 3.517 16.422 1.00 10.85 N ATOM 934 CD2 HIS A 112 13.979 1.884 14.978 1.00 10.40 C ATOM 935 CE1 HIS A 112 12.982 3.747 15.524 1.00 10.61 C ATOM 936 NE2 HIS A 112 13.006 2.780 14.657 1.00 10.33 N ATOM 937 H HIS A 112 17.112 0.805 14.842 1.00 0.00 H ATOM 938 N PRO A 113 18.406 1.449 18.625 1.00 12.39 N ATOM 939 CA PRO A 113 19.217 0.538 19.383 1.00 12.97 C ATOM 940 C PRO A 113 18.391 -0.488 20.138 1.00 12.96 C ATOM 941 O PRO A 113 17.233 -0.162 20.464 1.00 12.66 O ATOM 942 CB PRO A 113 19.896 1.475 20.424 1.00 13.65 C ATOM 943 CG PRO A 113 18.876 2.556 20.570 1.00 13.33 C ATOM 944 CD PRO A 113 18.300 2.802 19.155 1.00 12.61 C ATOM 945 N VAL A 114 18.871 -1.713 20.300 1.00 13.36 N ATOM 946 CA VAL A 114 18.147 -2.744 21.106 1.00 13.58 C ATOM 947 C VAL A 114 19.103 -3.156 22.175 1.00 14.52 C ATOM 948 O VAL A 114 20.253 -3.358 21.916 1.00 14.98 O ATOM 949 CB VAL A 114 17.794 -3.942 20.213 1.00 13.39 C ATOM 950 CG1 VAL A 114 17.163 -5.102 21.005 1.00 14.19 C ATOM 951 CG2 VAL A 114 16.902 -3.521 19.045 1.00 12.57 C ATOM 952 H VAL A 114 19.776 -1.964 19.854 1.00 0.00 H ATOM 953 N ALA A 115 18.598 -3.209 23.401 1.00 14.92 N ATOM 954 CA ALA A 115 19.429 -3.611 24.554 1.00 15.99 C ATOM 955 C ALA A 115 19.574 -5.104 24.645 1.00 16.56 C ATOM 956 O ALA A 115 20.675 -5.557 24.996 1.00 17.84 O ATOM 957 CB ALA A 115 18.840 -3.075 25.843 1.00 16.36 C ATOM 958 H ALA A 115 17.599 -2.963 23.553 1.00 0.00 H ATOM 959 N GLU A 116 18.522 -5.874 24.477 1.00 16.30 N ATOM 960 CA GLU A 116 18.556 -7.317 24.693 1.00 17.05 C ATOM 961 C GLU A 116 17.586 -8.042 23.763 1.00 16.53 C ATOM 962 O GLU A 116 16.544 -7.496 23.435 1.00 15.76 O ATOM 963 CB GLU A 116 18.220 -7.677 26.131 1.00 18.50 C ATOM 964 CG GLU A 116 18.575 -9.121 26.526 1.00 23.85 C ATOM 965 CD GLU A 116 20.030 -9.567 26.163 1.00 22.44 C ATOM 966 OE1 GLU A 116 20.377 -9.884 24.974 1.00 25.17 O ATOM 967 OE2 GLU A 116 20.841 -9.523 27.110 1.00 33.98 O ATOM 968 H GLU A 116 17.627 -5.436 24.177 1.00 0.00 H ATOM 969 N VAL A 117 17.914 -9.270 23.417 1.00 17.14 N ATOM 970 CA VAL A 117 17.088 -10.229 22.633 1.00 17.05 C ATOM 971 C VAL A 117 16.961 -11.521 23.454 1.00 18.28 C ATOM 972 O VAL A 117 17.971 -12.073 23.858 1.00 19.25 O ATOM 973 CB VAL A 117 17.673 -10.543 21.193 1.00 16.82 C ATOM 974 CG1 VAL A 117 16.728 -11.432 20.446 1.00 17.93 C ATOM 975 CG2 VAL A 117 17.961 -9.233 20.504 1.00 16.62 C ATOM 976 H VAL A 117 18.849 -9.605 23.724 1.00 0.00 H ATOM 977 N VAL A 118 15.734 -12.011 23.624 1.00 18.36 N ATOM 978 CA VAL A 118 15.435 -13.237 24.363 1.00 19.62 C ATOM 979 C VAL A 118 14.502 -14.173 23.557 1.00 19.76 C ATOM 980 O VAL A 118 13.495 -13.749 23.097 1.00 19.01 O ATOM 981 CB VAL A 118 14.747 -12.919 25.721 1.00 20.00 C ATOM 982 CG1 VAL A 118 14.457 -14.180 26.509 1.00 21.96 C ATOM 983 CG2 VAL A 118 15.606 -11.974 26.599 1.00 25.46 C ATOM 984 H VAL A 118 14.938 -11.489 23.205 1.00 0.00 H ATOM 985 N ARG A 119 14.923 -15.399 23.337 1.00 20.83 N ATOM 986 CA ARG A 119 14.150 -16.396 22.644 1.00 21.28 C ATOM 987 C ARG A 119 13.284 -17.047 23.709 1.00 22.33 C ATOM 988 O ARG A 119 13.766 -17.620 24.700 1.00 23.52 O ATOM 989 CB ARG A 119 15.064 -17.374 21.855 1.00 22.10 C ATOM 990 CG ARG A 119 14.344 -18.558 21.262 1.00 25.23 C ATOM 991 CD ARG A 119 15.267 -19.472 20.457 1.00 27.40 C ATOM 992 NE ARG A 119 15.644 -18.805 19.246 1.00 30.23 N ATOM 993 CZ ARG A 119 16.856 -18.367 18.901 1.00 33.55 C ATOM 994 NH1 ARG A 119 17.918 -18.581 19.691 1.00 40.32 N ATOM 995 NH2 ARG A 119 17.009 -17.761 17.718 1.00 28.07 N ATOM 996 HE ARG A 119 14.884 -18.643 18.555 1.00 0.00 H ATOM 997 HH12 ARG A 119 18.856 -18.233 19.407 1.00 0.00 H ATOM 998 HH11 ARG A 119 17.804 -19.095 20.588 1.00 0.00 H ATOM 999 HH22 ARG A 119 17.945 -17.412 17.430 1.00 0.00 H ATOM 1000 HH21 ARG A 119 16.192 -17.639 17.087 1.00 0.00 H ATOM 1001 H ARG A 119 15.867 -15.663 23.683 1.00 0.00 H ATOM 1002 N ILE A 120 11.975 -16.962 23.485 1.00 22.00 N ATOM 1003 CA ILE A 120 10.989 -17.441 24.468 1.00 22.99 C ATOM 1004 C ILE A 120 11.130 -18.919 24.697 1.00 24.70 C ATOM 1005 O ILE A 120 11.078 -19.360 25.841 1.00 25.87 O ATOM 1006 CB ILE A 120 9.538 -17.001 24.114 1.00 22.40 C ATOM 1007 CG1 ILE A 120 9.475 -15.454 24.217 1.00 20.98 C ATOM 1008 CG2 ILE A 120 8.476 -17.707 24.962 1.00 23.72 C ATOM 1009 CD1 ILE A 120 8.136 -14.801 23.837 1.00 20.37 C ATOM 1010 H ILE A 120 11.640 -16.546 22.593 1.00 0.00 H ATOM 1011 N ARG A 121 11.243 -19.718 23.659 1.00 25.05 N ATOM 1012 CA ARG A 121 11.230 -21.175 23.796 1.00 26.87 C ATOM 1013 C ARG A 121 12.348 -21.668 24.752 1.00 28.07 C ATOM 1014 O ARG A 121 12.190 -22.623 25.475 1.00 29.72 O ATOM 1015 CB ARG A 121 11.412 -21.828 22.412 1.00 27.01 C ATOM 1016 CG ARG A 121 11.501 -23.318 22.410 1.00 28.99 C ATOM 1017 CD ARG A 121 11.417 -23.921 21.031 1.00 29.23 C ATOM 1018 NE ARG A 121 12.458 -23.383 20.224 1.00 28.44 N ATOM 1019 CZ ARG A 121 13.727 -23.803 20.163 1.00 32.22 C ATOM 1020 NH1 ARG A 121 14.159 -24.877 20.815 1.00 33.31 N ATOM 1021 NH2 ARG A 121 14.553 -23.146 19.351 1.00 34.62 N ATOM 1022 HE ARG A 121 12.206 -22.577 19.617 1.00 0.00 H ATOM 1023 HH12 ARG A 121 15.155 -25.166 20.738 1.00 0.00 H ATOM 1024 HH11 ARG A 121 13.501 -25.428 21.402 1.00 0.00 H ATOM 1025 HH22 ARG A 121 15.548 -23.439 19.273 1.00 0.00 H ATOM 1026 HH21 ARG A 121 14.203 -22.340 18.795 1.00 0.00 H ATOM 1027 H ARG A 121 11.345 -19.302 22.711 1.00 0.00 H ATOM 1028 N THR A 122 13.479 -20.991 24.698 1.00 27.33 N ATOM 1029 CA THR A 122 14.675 -21.526 25.365 1.00 29.11 C ATOM 1030 C THR A 122 15.165 -20.678 26.499 1.00 33.56 C ATOM 1031 O THR A 122 16.073 -21.114 27.214 1.00 32.03 O ATOM 1032 CB THR A 122 15.841 -21.610 24.346 1.00 29.31 C ATOM 1033 OG1 THR A 122 16.105 -20.352 23.784 1.00 29.47 O ATOM 1034 CG2 THR A 122 15.555 -22.604 23.262 1.00 30.96 C ATOM 1035 HG1 THR A 122 16.851 -20.430 23.138 1.00 0.00 H ATOM 1036 H THR A 122 13.524 -20.086 24.188 1.00 0.00 H ATOM 1037 N ALA A 123 14.618 -19.491 26.690 1.00 32.31 N ATOM 1038 CA ALA A 123 15.267 -18.524 27.596 1.00 53.30 C ATOM 1039 C ALA A 123 16.686 -18.051 27.123 1.00 50.28 C ATOM 1040 O ALA A 123 17.420 -17.397 27.891 1.00 49.98 O ATOM 1041 CB ALA A 123 15.334 -19.090 29.023 1.00 47.12 C ATOM 1042 H ALA A 123 13.734 -19.239 26.204 1.00 0.00 H ATOM 1043 N GLU A 124 17.075 -18.373 25.883 1.00 40.14 N ATOM 1044 CA GLU A 124 18.385 -17.949 25.345 1.00 31.49 C ATOM 1045 C GLU A 124 18.398 -16.426 25.119 1.00 36.97 C ATOM 1046 O GLU A 124 17.478 -15.890 24.480 1.00 31.38 O ATOM 1047 CB GLU A 124 18.711 -18.630 24.009 1.00 43.55 C ATOM 1048 H GLU A 124 16.439 -18.936 25.283 1.00 0.00 H ATOM 1049 N THR A 125 19.436 -15.754 25.639 1.00 49.20 N ATOM 1050 CA THR A 125 19.616 -14.284 25.535 1.00 33.61 C ATOM 1051 C THR A 125 20.791 -13.882 24.587 1.00 48.94 C ATOM 1052 O THR A 125 21.517 -14.747 24.092 1.00 51.99 O ATOM 1053 CB THR A 125 19.769 -13.684 26.957 1.00 34.89 C ATOM 1054 OG1 THR A 125 20.971 -14.188 27.567 1.00 52.15 O ATOM 1055 CG2 THR A 125 18.606 -14.077 27.849 1.00 49.59 C ATOM 1056 HG1 THR A 125 21.066 -13.803 28.474 1.00 0.00 H ATOM 1057 H THR A 125 20.162 -16.298 26.148 1.00 0.00 H ATOM 1058 N GLY A 126 20.942 -12.585 24.282 1.00 51.19 N ATOM 1059 CA GLY A 126 22.119 -12.088 23.526 1.00 44.18 C ATOM 1060 C GLY A 126 22.210 -12.610 22.103 1.00 55.98 C ATOM 1061 O GLY A 126 21.213 -13.104 21.559 1.00 45.50 O ATOM 1062 H GLY A 126 20.213 -11.907 24.584 1.00 0.00 H TER 1063 GLY A 126 ATOM 1064 N ILE B 6 16.490 -15.905 33.185 1.00 48.09 N ATOM 1065 CA ILE B 6 16.920 -14.892 32.156 1.00 42.22 C ATOM 1066 C ILE B 6 17.578 -13.696 32.844 1.00 65.80 C ATOM 1067 O ILE B 6 17.014 -13.116 33.783 1.00 34.52 O ATOM 1068 CB ILE B 6 15.709 -14.470 31.255 1.00 42.45 C ATOM 1069 CG1 ILE B 6 15.455 -15.548 30.201 1.00 53.40 C ATOM 1070 CG2 ILE B 6 15.910 -13.101 30.584 1.00 27.99 C ATOM 1071 CD1 ILE B 6 13.994 -15.618 29.745 1.00 44.41 C ATOM 1072 HN3 ILE B 6 15.809 -15.467 33.837 1.00 0.00 H ATOM 1073 HN2 ILE B 6 17.322 -16.231 33.718 1.00 0.00 H ATOM 1074 HN1 ILE B 6 16.044 -16.714 32.708 1.00 0.00 H ATOM 1075 N GLN B 7 18.804 -13.379 32.425 1.00 42.89 N ATOM 1076 CA GLN B 7 19.447 -12.135 32.848 1.00 30.68 C ATOM 1077 C GLN B 7 19.665 -11.269 31.630 1.00 46.68 C ATOM 1078 O GLN B 7 20.099 -11.761 30.565 1.00 57.61 O ATOM 1079 CB GLN B 7 20.785 -12.389 33.538 1.00 31.79 C ATOM 1080 CG GLN B 7 20.653 -12.911 34.971 1.00 39.77 C ATOM 1081 CD GLN B 7 21.678 -13.992 35.375 1.00 72.25 C ATOM 1082 OE1 GLN B 7 22.733 -14.205 34.740 1.00 46.46 O ATOM 1083 NE2 GLN B 7 21.358 -14.684 36.460 1.00 56.97 N ATOM 1084 HE22 GLN B 7 20.472 -14.480 36.964 1.00 0.00 H ATOM 1085 HE21 GLN B 7 21.994 -15.431 36.807 1.00 0.00 H ATOM 1086 H GLN B 7 19.311 -14.026 31.788 1.00 0.00 H ATOM 1087 N CYS B 8 19.312 -9.991 31.791 1.00 40.76 N ATOM 1088 CA CYS B 8 19.291 -9.028 30.707 1.00 28.32 C ATOM 1089 C CYS B 8 20.461 -8.049 30.856 1.00 35.81 C ATOM 1090 O CYS B 8 20.635 -7.377 31.883 1.00 31.23 O ATOM 1091 CB CYS B 8 17.976 -8.252 30.676 1.00 30.22 C ATOM 1092 SG CYS B 8 16.559 -9.093 29.916 1.00 33.55 S ATOM 1093 H CYS B 8 19.038 -9.670 32.742 1.00 0.00 H ATOM 1094 N ASP B 9 21.234 -7.945 29.778 1.00 47.12 N ATOM 1095 CA ASP B 9 22.441 -7.135 29.772 1.00 39.37 C ATOM 1096 C ASP B 9 22.117 -5.691 29.392 1.00 28.04 C ATOM 1097 O ASP B 9 21.874 -5.401 28.191 1.00 32.22 O ATOM 1098 CB ASP B 9 23.418 -7.718 28.747 1.00 38.66 C ATOM 1099 CG ASP B 9 24.726 -6.950 28.712 1.00 64.92 C ATOM 1100 OD1 ASP B 9 24.857 -6.037 29.565 1.00 33.22 O ATOM 1101 OD2 ASP B 9 25.602 -7.230 27.848 1.00 54.44 O ATOM 1102 H ASP B 9 20.967 -8.459 28.914 1.00 0.00 H ATOM 1103 N LEU B 10 22.049 -4.791 30.391 1.00 27.66 N ATOM 1104 CA LEU B 10 21.737 -3.362 30.127 1.00 18.29 C ATOM 1105 C LEU B 10 22.950 -2.482 30.297 1.00 20.26 C ATOM 1106 O LEU B 10 22.816 -1.236 30.347 1.00 21.46 O ATOM 1107 CB LEU B 10 20.567 -2.848 31.051 1.00 18.07 C ATOM 1108 CG LEU B 10 19.368 -3.707 31.115 1.00 17.77 C ATOM 1109 CD1 LEU B 10 18.259 -3.139 31.996 1.00 22.85 C ATOM 1110 CD2 LEU B 10 18.742 -3.879 29.714 1.00 16.09 C ATOM 1111 H LEU B 10 22.218 -5.102 31.369 1.00 0.00 H ATOM 1112 N SER B 11 24.147 -3.076 30.385 1.00 25.00 N ATOM 1113 CA SER B 11 25.366 -2.312 30.594 1.00 23.87 C ATOM 1114 C SER B 11 25.723 -1.273 29.503 1.00 22.45 C ATOM 1115 O SER B 11 26.459 -0.308 29.800 1.00 22.74 O ATOM 1116 CB SER B 11 26.627 -3.232 30.777 1.00 26.85 C ATOM 1117 OG SER B 11 26.855 -3.976 29.580 1.00 30.23 O ATOM 1118 HG SER B 11 26.063 -4.537 29.386 1.00 0.00 H ATOM 1119 H SER B 11 24.206 -4.111 30.302 1.00 0.00 H ATOM 1120 N ALA B 12 25.170 -1.427 28.300 1.00 22.28 N ATOM 1121 CA ALA B 12 25.453 -0.462 27.246 1.00 23.38 C ATOM 1122 C ALA B 12 24.705 0.831 27.344 1.00 21.01 C ATOM 1123 O ALA B 12 24.765 1.644 26.410 1.00 23.37 O ATOM 1124 CB ALA B 12 25.233 -1.107 25.897 1.00 22.96 C ATOM 1125 H ALA B 12 24.539 -2.233 28.115 1.00 0.00 H ATOM 1126 N PHE B 13 23.762 0.899 28.322 1.00 18.83 N ATOM 1127 CA PHE B 13 22.876 2.016 28.491 1.00 18.09 C ATOM 1128 C PHE B 13 22.965 2.577 29.882 1.00 18.30 C ATOM 1129 O PHE B 13 21.960 2.639 30.577 1.00 17.57 O ATOM 1130 CB PHE B 13 21.469 1.521 28.241 1.00 17.47 C ATOM 1131 CG PHE B 13 21.315 0.934 26.908 1.00 19.31 C ATOM 1132 CD1 PHE B 13 21.100 1.753 25.801 1.00 18.09 C ATOM 1133 CD2 PHE B 13 21.510 -0.440 26.707 1.00 17.87 C ATOM 1134 CE1 PHE B 13 21.018 1.223 24.503 1.00 16.83 C ATOM 1135 CE2 PHE B 13 21.458 -0.930 25.399 1.00 17.72 C ATOM 1136 CZ PHE B 13 21.120 -0.134 24.353 1.00 16.88 C ATOM 1137 H PHE B 13 23.678 0.100 28.982 1.00 0.00 H ATOM 1138 N PRO B 14 24.163 3.035 30.215 1.00 19.42 N ATOM 1139 CA PRO B 14 24.236 3.581 31.560 1.00 20.29 C ATOM 1140 C PRO B 14 23.423 4.866 31.674 1.00 20.40 C ATOM 1141 O PRO B 14 23.276 5.633 30.708 1.00 22.53 O ATOM 1142 CB PRO B 14 25.744 3.781 31.748 1.00 26.72 C ATOM 1143 CG PRO B 14 26.240 4.017 30.358 1.00 31.94 C ATOM 1144 CD PRO B 14 25.469 3.051 29.536 1.00 22.61 C ATOM 1145 N GLY B 15 22.734 4.996 32.810 1.00 20.81 N ATOM 1146 CA GLY B 15 21.948 6.211 33.038 1.00 24.20 C ATOM 1147 C GLY B 15 20.570 6.206 32.378 1.00 18.00 C ATOM 1148 O GLY B 15 19.667 7.074 32.669 1.00 23.73 O ATOM 1149 H GLY B 15 22.755 4.242 33.526 1.00 0.00 H ATOM 1150 N VAL B 16 20.247 5.133 31.651 1.00 17.02 N ATOM 1151 CA VAL B 16 18.902 4.972 31.109 1.00 16.08 C ATOM 1152 C VAL B 16 18.003 4.389 32.213 1.00 15.66 C ATOM 1153 O VAL B 16 18.246 3.299 32.754 1.00 15.65 O ATOM 1154 CB VAL B 16 18.915 4.095 29.859 1.00 15.68 C ATOM 1155 CG1 VAL B 16 17.493 3.814 29.370 1.00 14.80 C ATOM 1156 CG2 VAL B 16 19.791 4.743 28.782 1.00 17.28 C ATOM 1157 H VAL B 16 20.964 4.402 31.469 1.00 0.00 H ATOM 1158 N LYS B 17 16.871 5.028 32.428 1.00 15.36 N ATOM 1159 CA LYS B 17 16.038 4.671 33.528 1.00 15.21 C ATOM 1160 C LYS B 17 14.827 3.833 33.201 1.00 14.41 C ATOM 1161 O LYS B 17 14.286 3.142 34.008 1.00 14.77 O ATOM 1162 CB LYS B 17 15.454 5.925 34.164 1.00 16.72 C ATOM 1163 CG LYS B 17 16.505 6.815 34.802 1.00 26.04 C ATOM 1164 CD LYS B 17 15.992 8.253 34.999 1.00 41.14 C ATOM 1165 CE LYS B 17 14.511 8.389 35.356 1.00 31.79 C ATOM 1166 NZ LYS B 17 14.224 7.871 36.704 1.00 43.28 N ATOM 1167 HZ1 LYS B 17 14.480 6.864 36.749 1.00 0.00 H ATOM 1168 HZ2 LYS B 17 14.780 8.403 37.404 1.00 0.00 H ATOM 1169 HZ3 LYS B 17 13.210 7.981 36.908 1.00 0.00 H ATOM 1170 H LYS B 17 16.583 5.798 31.791 1.00 0.00 H ATOM 1171 N PHE B 18 14.405 3.835 31.929 1.00 13.95 N ATOM 1172 CA PHE B 18 13.197 3.126 31.476 1.00 13.29 C ATOM 1173 C PHE B 18 13.574 2.275 30.279 1.00 12.95 C ATOM 1174 O PHE B 18 14.368 2.671 29.488 1.00 13.20 O ATOM 1175 CB PHE B 18 12.078 4.077 31.071 1.00 13.27 C ATOM 1176 CG PHE B 18 11.560 4.848 32.259 1.00 16.11 C ATOM 1177 CD1 PHE B 18 10.692 4.247 33.107 1.00 13.97 C ATOM 1178 CD2 PHE B 18 11.962 6.112 32.468 1.00 25.97 C ATOM 1179 CE1 PHE B 18 10.204 4.901 34.257 1.00 19.59 C ATOM 1180 CE2 PHE B 18 11.489 6.801 33.587 1.00 35.44 C ATOM 1181 CZ PHE B 18 10.607 6.186 34.470 1.00 24.49 C ATOM 1182 H PHE B 18 14.959 4.364 31.226 1.00 0.00 H ATOM 1183 N PHE B 19 12.898 1.124 30.175 1.00 12.47 N ATOM 1184 CA PHE B 19 13.031 0.248 28.972 1.00 12.21 C ATOM 1185 C PHE B 19 11.662 -0.233 28.592 1.00 11.72 C ATOM 1186 O PHE B 19 10.778 -0.468 29.390 1.00 11.57 O ATOM 1187 CB PHE B 19 13.977 -0.941 29.336 1.00 12.42 C ATOM 1188 CG PHE B 19 15.370 -0.532 29.577 1.00 13.06 C ATOM 1189 CD1 PHE B 19 15.803 0.000 30.835 1.00 13.49 C ATOM 1190 CD2 PHE B 19 16.329 -0.625 28.566 1.00 13.44 C ATOM 1191 CE1 PHE B 19 17.128 0.366 31.028 1.00 14.23 C ATOM 1192 CE2 PHE B 19 17.615 -0.220 28.743 1.00 14.18 C ATOM 1193 CZ PHE B 19 18.025 0.299 29.962 1.00 14.57 C ATOM 1194 H PHE B 19 12.267 0.833 30.949 1.00 0.00 H ATOM 1195 N ARG B 20 11.596 -0.489 27.275 1.00 11.62 N ATOM 1196 CA ARG B 20 10.390 -1.050 26.718 1.00 11.27 C ATOM 1197 C ARG B 20 10.626 -2.539 26.466 1.00 11.16 C ATOM 1198 O ARG B 20 11.637 -2.903 25.769 1.00 11.44 O ATOM 1199 CB ARG B 20 10.147 -0.386 25.395 1.00 11.41 C ATOM 1200 CG ARG B 20 8.956 -0.907 24.645 1.00 11.23 C ATOM 1201 CD ARG B 20 8.572 -0.116 23.438 1.00 13.27 C ATOM 1202 NE ARG B 20 9.673 0.056 22.493 1.00 12.80 N ATOM 1203 CZ ARG B 20 9.760 -0.563 21.322 1.00 13.72 C ATOM 1204 NH1 ARG B 20 8.890 -1.425 21.045 1.00 16.46 N ATOM 1205 NH2 ARG B 20 10.729 -0.259 20.446 1.00 16.62 N ATOM 1206 HE ARG B 20 10.440 0.707 22.755 1.00 0.00 H ATOM 1207 HH12 ARG B 20 8.928 -1.929 20.136 1.00 0.00 H ATOM 1208 HH11 ARG B 20 8.131 -1.635 21.724 1.00 0.00 H ATOM 1209 HH22 ARG B 20 10.780 -0.756 19.534 1.00 0.00 H ATOM 1210 HH21 ARG B 20 11.430 0.473 20.679 1.00 0.00 H ATOM 1211 H ARG B 20 12.410 -0.284 26.661 1.00 0.00 H ATOM 1212 N ILE B 21 9.777 -3.400 26.970 1.00 10.92 N ATOM 1213 CA ILE B 21 9.827 -4.804 26.728 1.00 10.91 C ATOM 1214 C ILE B 21 8.766 -5.040 25.623 1.00 10.75 C ATOM 1215 O ILE B 21 7.575 -4.752 25.828 1.00 10.59 O ATOM 1216 CB ILE B 21 9.456 -5.571 27.993 1.00 10.89 C ATOM 1217 CG1 ILE B 21 10.547 -5.334 29.053 1.00 11.22 C ATOM 1218 CG2 ILE B 21 9.291 -7.019 27.701 1.00 10.95 C ATOM 1219 CD1 ILE B 21 10.159 -5.850 30.435 1.00 12.24 C ATOM 1220 H ILE B 21 9.020 -3.037 27.584 1.00 0.00 H ATOM 1221 N GLU B 22 9.255 -5.620 24.533 1.00 10.96 N ATOM 1222 CA GLU B 22 8.368 -5.910 23.370 1.00 10.97 C ATOM 1223 C GLU B 22 8.398 -7.403 23.159 1.00 11.13 C ATOM 1224 O GLU B 22 9.452 -7.968 22.876 1.00 11.61 O ATOM 1225 CB GLU B 22 8.955 -5.219 22.165 1.00 11.31 C ATOM 1226 CG GLU B 22 8.215 -5.513 20.883 1.00 11.54 C ATOM 1227 CD GLU B 22 8.919 -4.953 19.673 1.00 12.07 C ATOM 1228 OE1 GLU B 22 10.161 -4.903 19.568 1.00 13.09 O ATOM 1229 OE2 GLU B 22 8.188 -4.565 18.696 1.00 17.98 O ATOM 1230 H GLU B 22 10.263 -5.873 24.490 1.00 0.00 H ATOM 1231 N ALA B 23 7.263 -8.064 23.341 1.00 10.99 N ATOM 1232 CA ALA B 23 7.185 -9.500 23.198 1.00 11.22 C ATOM 1233 C ALA B 23 6.278 -9.812 22.007 1.00 11.40 C ATOM 1234 O ALA B 23 5.141 -9.273 21.955 1.00 11.23 O ATOM 1235 CB ALA B 23 6.682 -10.067 24.499 1.00 11.74 C ATOM 1236 H ALA B 23 6.405 -7.534 23.594 1.00 0.00 H ATOM 1237 N ILE B 24 6.756 -10.717 21.203 1.00 11.87 N ATOM 1238 CA ILE B 24 6.031 -11.138 19.989 1.00 12.23 C ATOM 1239 C ILE B 24 5.828 -12.639 20.156 1.00 14.19 C ATOM 1240 O ILE B 24 6.862 -13.381 20.275 1.00 17.39 O ATOM 1241 CB ILE B 24 6.791 -10.808 18.693 1.00 12.75 C ATOM 1242 CG1 ILE B 24 7.093 -9.324 18.663 1.00 12.62 C ATOM 1243 CG2 ILE B 24 6.058 -11.330 17.498 1.00 14.18 C ATOM 1244 CD1 ILE B 24 7.904 -8.836 17.496 1.00 19.18 C ATOM 1245 H ILE B 24 7.673 -11.155 21.422 1.00 0.00 H ATOM 1246 N PHE B 25 4.593 -13.135 20.115 1.00 12.65 N ATOM 1247 CA PHE B 25 4.372 -14.511 20.534 1.00 12.95 C ATOM 1248 C PHE B 25 3.091 -15.045 19.871 1.00 13.23 C ATOM 1249 O PHE B 25 2.390 -14.390 19.089 1.00 13.26 O ATOM 1250 CB PHE B 25 4.361 -14.680 22.050 1.00 13.86 C ATOM 1251 CG PHE B 25 3.463 -13.721 22.745 1.00 12.05 C ATOM 1252 CD1 PHE B 25 2.083 -13.874 22.761 1.00 13.32 C ATOM 1253 CD2 PHE B 25 3.931 -12.587 23.325 1.00 16.53 C ATOM 1254 CE1 PHE B 25 1.221 -12.886 23.225 1.00 13.35 C ATOM 1255 CE2 PHE B 25 3.068 -11.663 23.900 1.00 15.98 C ATOM 1256 CZ PHE B 25 1.728 -11.821 23.884 1.00 15.29 C ATOM 1257 H PHE B 25 3.799 -12.548 19.789 1.00 0.00 H ATOM 1258 N ARG B 26 2.749 -16.255 20.252 1.00 13.59 N ATOM 1259 CA ARG B 26 1.604 -16.949 19.598 1.00 14.09 C ATOM 1260 C ARG B 26 0.299 -16.265 19.970 1.00 13.77 C ATOM 1261 O ARG B 26 0.086 -16.056 21.113 1.00 13.40 O ATOM 1262 CB ARG B 26 1.544 -18.373 20.048 1.00 14.62 C ATOM 1263 CG ARG B 26 2.672 -19.264 19.561 1.00 15.31 C ATOM 1264 CD ARG B 26 2.631 -20.593 20.295 1.00 17.54 C ATOM 1265 NE ARG B 26 3.876 -21.338 20.184 1.00 17.96 N ATOM 1266 CZ ARG B 26 4.303 -21.921 19.093 1.00 17.45 C ATOM 1267 NH1 ARG B 26 3.602 -21.948 17.952 1.00 17.76 N ATOM 1268 NH2 ARG B 26 5.478 -22.503 19.061 1.00 18.21 N ATOM 1269 HE ARG B 26 4.470 -21.413 21.034 1.00 0.00 H ATOM 1270 HH12 ARG B 26 3.990 -22.426 17.114 1.00 0.00 H ATOM 1271 HH11 ARG B 26 2.669 -21.491 17.904 1.00 0.00 H ATOM 1272 HH22 ARG B 26 5.807 -22.963 18.188 1.00 0.00 H ATOM 1273 HH21 ARG B 26 6.081 -22.504 19.908 1.00 0.00 H ATOM 1274 H ARG B 26 3.278 -16.729 21.011 1.00 0.00 H ATOM 1275 N PRO B 27 -0.646 -16.066 19.018 1.00 14.14 N ATOM 1276 CA PRO B 27 -1.849 -15.384 19.372 1.00 14.03 C ATOM 1277 C PRO B 27 -2.623 -16.088 20.494 1.00 14.12 C ATOM 1278 O PRO B 27 -3.184 -15.418 21.383 1.00 13.87 O ATOM 1279 CB PRO B 27 -2.705 -15.329 18.063 1.00 14.73 C ATOM 1280 CG PRO B 27 -1.628 -15.296 17.048 1.00 14.87 C ATOM 1281 CD PRO B 27 -0.499 -16.205 17.555 1.00 14.74 C ATOM 1282 N TRP B 28 -2.681 -17.393 20.514 1.00 14.60 N ATOM 1283 CA TRP B 28 -3.462 -18.055 21.522 1.00 14.84 C ATOM 1284 C TRP B 28 -2.957 -17.870 22.949 1.00 14.37 C ATOM 1285 O TRP B 28 -3.698 -18.064 23.928 1.00 14.56 O ATOM 1286 CB TRP B 28 -3.716 -19.528 21.240 1.00 15.62 C ATOM 1287 CG TRP B 28 -2.605 -20.468 21.538 1.00 15.76 C ATOM 1288 CD1 TRP B 28 -1.560 -20.748 20.777 1.00 15.91 C ATOM 1289 CD2 TRP B 28 -2.463 -21.259 22.732 1.00 15.96 C ATOM 1290 NE1 TRP B 28 -0.725 -21.684 21.363 1.00 16.24 N ATOM 1291 CE2 TRP B 28 -1.260 -22.028 22.572 1.00 16.27 C ATOM 1292 CE3 TRP B 28 -3.223 -21.423 23.903 1.00 16.08 C ATOM 1293 CZ2 TRP B 28 -0.882 -22.996 23.512 1.00 16.76 C ATOM 1294 CZ3 TRP B 28 -2.886 -22.386 24.764 1.00 16.53 C ATOM 1295 CH2 TRP B 28 -1.693 -23.158 24.588 1.00 16.86 C ATOM 1296 HE1 TRP B 28 0.155 -22.059 20.955 1.00 0.00 H ATOM 1297 H TRP B 28 -2.164 -17.950 19.804 1.00 0.00 H ATOM 1298 N ARG B 29 -1.687 -17.448 23.077 1.00 13.86 N ATOM 1299 CA ARG B 29 -1.136 -17.200 24.403 1.00 13.51 C ATOM 1300 C ARG B 29 -1.400 -15.821 24.869 1.00 13.01 C ATOM 1301 O ARG B 29 -1.147 -15.534 26.052 1.00 12.84 O ATOM 1302 CB ARG B 29 0.354 -17.448 24.416 1.00 13.40 C ATOM 1303 CG ARG B 29 0.762 -18.898 24.178 1.00 14.10 C ATOM 1304 CD ARG B 29 0.142 -19.908 25.094 1.00 14.63 C ATOM 1305 NE ARG B 29 0.535 -19.721 26.510 1.00 14.49 N ATOM 1306 CZ ARG B 29 0.107 -20.486 27.531 1.00 15.03 C ATOM 1307 NH1 ARG B 29 -0.758 -21.469 27.282 1.00 15.68 N ATOM 1308 NH2 ARG B 29 0.578 -20.273 28.769 1.00 15.02 N ATOM 1309 HE ARG B 29 1.189 -18.943 26.731 1.00 0.00 H ATOM 1310 HH12 ARG B 29 -1.100 -22.070 28.059 1.00 0.00 H ATOM 1311 HH11 ARG B 29 -1.091 -21.635 26.311 1.00 0.00 H ATOM 1312 HH22 ARG B 29 0.248 -20.863 29.559 1.00 0.00 H ATOM 1313 HH21 ARG B 29 1.273 -19.518 28.938 1.00 0.00 H ATOM 1314 H ARG B 29 -1.099 -17.299 22.232 1.00 0.00 H ATOM 1315 N LEU B 30 -1.987 -14.931 24.128 1.00 12.93 N ATOM 1316 CA LEU B 30 -2.212 -13.552 24.545 1.00 12.62 C ATOM 1317 C LEU B 30 -3.009 -13.489 25.866 1.00 12.84 C ATOM 1318 O LEU B 30 -2.562 -12.821 26.751 1.00 12.57 O ATOM 1319 CB LEU B 30 -2.886 -12.713 23.418 1.00 12.80 C ATOM 1320 CG LEU B 30 -3.171 -11.251 23.769 1.00 12.68 C ATOM 1321 CD1 LEU B 30 -1.890 -10.472 24.046 1.00 12.10 C ATOM 1322 CD2 LEU B 30 -3.993 -10.632 22.619 1.00 13.15 C ATOM 1323 H LEU B 30 -2.315 -15.218 23.184 1.00 0.00 H ATOM 1324 N PRO B 31 -4.114 -14.180 26.008 1.00 13.42 N ATOM 1325 CA PRO B 31 -4.871 -14.068 27.251 1.00 13.80 C ATOM 1326 C PRO B 31 -4.033 -14.587 28.403 1.00 13.67 C ATOM 1327 O PRO B 31 -4.194 -14.053 29.532 1.00 13.81 O ATOM 1328 CB PRO B 31 -6.136 -14.890 26.994 1.00 14.58 C ATOM 1329 CG PRO B 31 -5.981 -15.448 25.652 1.00 16.49 C ATOM 1330 CD PRO B 31 -4.824 -14.934 24.922 1.00 13.91 C ATOM 1331 N PHE B 32 -3.162 -15.558 28.173 1.00 13.57 N ATOM 1332 CA PHE B 32 -2.303 -16.101 29.288 1.00 13.64 C ATOM 1333 C PHE B 32 -1.298 -15.082 29.711 1.00 13.11 C ATOM 1334 O PHE B 32 -1.099 -14.818 30.920 1.00 13.25 O ATOM 1335 CB PHE B 32 -1.683 -17.451 28.871 1.00 13.92 C ATOM 1336 CG PHE B 32 -2.676 -18.556 28.672 1.00 14.63 C ATOM 1337 CD1 PHE B 32 -3.305 -18.737 27.433 1.00 14.73 C ATOM 1338 CD2 PHE B 32 -2.936 -19.489 29.636 1.00 15.32 C ATOM 1339 CE1 PHE B 32 -4.279 -19.735 27.301 1.00 15.50 C ATOM 1340 CE2 PHE B 32 -3.785 -20.501 29.470 1.00 16.05 C ATOM 1341 CZ PHE B 32 -4.489 -20.611 28.323 1.00 16.13 C ATOM 1342 H PHE B 32 -3.069 -15.950 27.214 1.00 0.00 H ATOM 1343 N VAL B 33 -0.687 -14.418 28.810 1.00 12.60 N ATOM 1344 CA VAL B 33 0.348 -13.397 29.074 1.00 12.14 C ATOM 1345 C VAL B 33 -0.303 -12.228 29.753 1.00 12.13 C ATOM 1346 O VAL B 33 0.178 -11.727 30.778 1.00 12.15 O ATOM 1347 CB VAL B 33 1.092 -12.950 27.864 1.00 11.75 C ATOM 1348 CG1 VAL B 33 2.083 -11.864 28.124 1.00 12.31 C ATOM 1349 CG2 VAL B 33 1.693 -14.203 27.249 1.00 12.13 C ATOM 1350 H VAL B 33 -0.935 -14.609 27.818 1.00 0.00 H ATOM 1351 N ILE B 34 -1.419 -11.761 29.272 1.00 12.28 N ATOM 1352 CA ILE B 34 -2.075 -10.601 29.857 1.00 12.48 C ATOM 1353 C ILE B 34 -2.514 -10.953 31.258 1.00 13.02 C ATOM 1354 O ILE B 34 -2.298 -10.127 32.216 1.00 13.15 O ATOM 1355 CB ILE B 34 -3.313 -10.168 29.051 1.00 12.82 C ATOM 1356 CG1 ILE B 34 -2.909 -9.587 27.704 1.00 12.44 C ATOM 1357 CG2 ILE B 34 -4.260 -9.236 29.878 1.00 13.43 C ATOM 1358 CD1 ILE B 34 -4.029 -9.327 26.781 1.00 13.24 C ATOM 1359 H ILE B 34 -1.852 -12.228 28.450 1.00 0.00 H ATOM 1360 N ASP B 35 -3.053 -12.153 31.464 1.00 13.45 N ATOM 1361 CA ASP B 35 -3.497 -12.548 32.882 1.00 14.17 C ATOM 1362 C ASP B 35 -2.332 -12.579 33.838 1.00 14.07 C ATOM 1363 O ASP B 35 -2.433 -12.072 34.985 1.00 14.53 O ATOM 1364 CB ASP B 35 -4.308 -13.815 32.858 1.00 14.76 C ATOM 1365 CG ASP B 35 -5.020 -14.034 34.175 1.00 17.22 C ATOM 1366 OD1 ASP B 35 -5.912 -13.231 34.508 1.00 26.94 O ATOM 1367 OD2 ASP B 35 -4.727 -15.019 34.841 1.00 22.28 O ATOM 1368 H ASP B 35 -3.173 -12.817 30.673 1.00 0.00 H ATOM 1369 N THR B 36 -1.210 -13.118 33.439 1.00 13.64 N ATOM 1370 CA THR B 36 -0.064 -13.241 34.309 1.00 13.72 C ATOM 1371 C THR B 36 0.413 -11.832 34.595 1.00 13.42 C ATOM 1372 O THR B 36 0.733 -11.534 35.792 1.00 13.85 O ATOM 1373 CB THR B 36 1.037 -13.987 33.600 1.00 13.43 C ATOM 1374 OG1 THR B 36 0.649 -15.315 33.397 1.00 18.14 O ATOM 1375 CG2 THR B 36 2.172 -14.050 34.539 1.00 16.53 C ATOM 1376 HG1 THR B 36 0.471 -15.743 34.272 1.00 0.00 H ATOM 1377 H THR B 36 -1.140 -13.470 32.463 1.00 0.00 H ATOM 1378 N LEU B 37 0.507 -10.908 33.682 1.00 12.85 N ATOM 1379 CA LEU B 37 1.012 -9.579 33.942 1.00 12.67 C ATOM 1380 C LEU B 37 0.078 -8.774 34.792 1.00 13.22 C ATOM 1381 O LEU B 37 0.486 -8.089 35.746 1.00 13.52 O ATOM 1382 CB LEU B 37 1.278 -8.761 32.665 1.00 12.07 C ATOM 1383 CG LEU B 37 2.510 -9.167 31.838 1.00 13.61 C ATOM 1384 CD1 LEU B 37 2.374 -8.720 30.374 1.00 18.13 C ATOM 1385 CD2 LEU B 37 3.853 -8.862 32.508 1.00 16.44 C ATOM 1386 H LEU B 37 0.203 -11.139 32.715 1.00 0.00 H ATOM 1387 N SER B 38 -1.199 -8.895 34.569 1.00 13.56 N ATOM 1388 CA SER B 38 -2.212 -8.189 35.312 1.00 14.52 C ATOM 1389 C SER B 38 -2.220 -8.625 36.763 1.00 15.07 C ATOM 1390 O SER B 38 -2.215 -7.804 37.716 1.00 16.78 O ATOM 1391 CB SER B 38 -3.579 -8.181 34.679 1.00 17.24 C ATOM 1392 OG SER B 38 -3.490 -7.669 33.354 1.00 17.82 O ATOM 1393 HG SER B 38 -3.135 -6.745 33.382 1.00 0.00 H ATOM 1394 H SER B 38 -1.506 -9.538 33.811 1.00 0.00 H ATOM 1395 N LYS B 39 -2.137 -9.949 36.961 1.00 15.20 N ATOM 1396 CA LYS B 39 -2.053 -10.478 38.295 1.00 16.01 C ATOM 1397 C LYS B 39 -0.852 -10.122 39.080 1.00 16.03 C ATOM 1398 O LYS B 39 -0.883 -10.086 40.342 1.00 18.14 O ATOM 1399 CB LYS B 39 -2.194 -11.972 38.283 1.00 16.25 C ATOM 1400 CG LYS B 39 -3.665 -12.347 38.036 1.00 24.70 C ATOM 1401 CD LYS B 39 -3.974 -13.845 37.981 1.00 23.30 C ATOM 1402 CE LYS B 39 -5.473 -14.166 37.714 1.00 24.32 C ATOM 1403 NZ LYS B 39 -5.658 -15.596 37.333 1.00 27.52 N ATOM 1404 HZ1 LYS B 39 -5.116 -15.796 36.468 1.00 0.00 H ATOM 1405 HZ2 LYS B 39 -5.320 -16.206 38.105 1.00 0.00 H ATOM 1406 HZ3 LYS B 39 -6.667 -15.780 37.161 1.00 0.00 H ATOM 1407 H LYS B 39 -2.133 -10.595 36.146 1.00 0.00 H ATOM 1408 N TYR B 40 0.245 -9.991 38.455 1.00 15.26 N ATOM 1409 CA TYR B 40 1.494 -9.543 39.081 1.00 15.30 C ATOM 1410 C TYR B 40 1.535 -8.132 39.362 1.00 15.36 C ATOM 1411 O TYR B 40 2.513 -7.671 40.015 1.00 20.54 O ATOM 1412 CB TYR B 40 2.644 -9.617 38.115 1.00 14.47 C ATOM 1413 CG TYR B 40 4.004 -9.786 38.803 1.00 14.77 C ATOM 1414 CD1 TYR B 40 4.307 -10.950 39.458 1.00 15.42 C ATOM 1415 CD2 TYR B 40 5.002 -8.890 38.575 1.00 14.43 C ATOM 1416 CE1 TYR B 40 5.561 -11.134 40.016 1.00 15.85 C ATOM 1417 CE2 TYR B 40 6.272 -9.060 39.082 1.00 15.62 C ATOM 1418 CZ TYR B 40 6.559 -10.203 39.790 1.00 15.52 C ATOM 1419 OH TYR B 40 7.861 -10.446 40.222 1.00 16.03 O ATOM 1420 HH TYR B 40 7.890 -11.306 40.712 1.00 0.00 H ATOM 1421 H TYR B 40 0.259 -10.214 37.439 1.00 0.00 H ATOM 1422 N GLY B 41 0.583 -7.324 38.906 1.00 15.31 N ATOM 1423 CA GLY B 41 0.606 -5.866 39.019 1.00 15.43 C ATOM 1424 C GLY B 41 1.322 -4.998 38.018 1.00 14.65 C ATOM 1425 O GLY B 41 1.854 -3.860 38.256 1.00 16.48 O ATOM 1426 H GLY B 41 -0.236 -7.759 38.436 1.00 0.00 H ATOM 1427 N ILE B 42 1.454 -5.491 36.785 1.00 13.85 N ATOM 1428 CA ILE B 42 2.020 -4.748 35.734 1.00 13.33 C ATOM 1429 C ILE B 42 0.912 -4.161 34.872 1.00 14.76 C ATOM 1430 O ILE B 42 0.034 -4.955 34.470 1.00 21.03 O ATOM 1431 CB ILE B 42 2.981 -5.658 34.914 1.00 15.69 C ATOM 1432 CG1 ILE B 42 3.991 -6.357 35.781 1.00 17.02 C ATOM 1433 CG2 ILE B 42 3.540 -4.876 33.760 1.00 14.98 C ATOM 1434 CD1 ILE B 42 4.900 -5.382 36.496 1.00 15.02 C ATOM 1435 H ILE B 42 1.126 -6.460 36.595 1.00 0.00 H ATOM 1436 N ARG B 43 0.975 -2.871 34.616 1.00 13.35 N ATOM 1437 CA ARG B 43 -0.025 -2.129 33.836 1.00 13.61 C ATOM 1438 C ARG B 43 0.614 -1.454 32.669 1.00 13.12 C ATOM 1439 O ARG B 43 1.805 -1.531 32.473 1.00 14.50 O ATOM 1440 CB ARG B 43 -0.735 -1.149 34.711 1.00 14.59 C ATOM 1441 CG ARG B 43 -1.476 -1.813 35.832 1.00 15.93 C ATOM 1442 CD ARG B 43 -2.312 -0.840 36.581 1.00 16.46 C ATOM 1443 NE ARG B 43 -3.316 -1.502 37.432 1.00 21.82 N ATOM 1444 CZ ARG B 43 -4.199 -0.854 38.162 1.00 18.59 C ATOM 1445 NH1 ARG B 43 -4.230 0.481 38.202 1.00 23.24 N ATOM 1446 NH2 ARG B 43 -5.070 -1.511 38.843 1.00 21.91 N ATOM 1447 HE ARG B 43 -3.328 -2.542 37.457 1.00 0.00 H ATOM 1448 HH12 ARG B 43 -4.939 0.967 38.788 1.00 0.00 H ATOM 1449 HH11 ARG B 43 -3.545 1.034 37.648 1.00 0.00 H ATOM 1450 HH22 ARG B 43 -5.769 -1.003 39.421 1.00 0.00 H ATOM 1451 HH21 ARG B 43 -5.075 -2.551 38.816 1.00 0.00 H ATOM 1452 H ARG B 43 1.788 -2.341 34.991 1.00 0.00 H ATOM 1453 N GLY B 44 -0.182 -0.789 31.867 1.00 14.20 N ATOM 1454 CA GLY B 44 0.376 -0.138 30.657 1.00 13.31 C ATOM 1455 C GLY B 44 0.704 -1.015 29.458 1.00 12.45 C ATOM 1456 O GLY B 44 1.557 -0.644 28.675 1.00 16.17 O ATOM 1457 H GLY B 44 -1.198 -0.719 32.078 1.00 0.00 H ATOM 1458 N LEU B 45 0.150 -2.189 29.420 1.00 12.31 N ATOM 1459 CA LEU B 45 0.261 -3.117 28.320 1.00 12.41 C ATOM 1460 C LEU B 45 -0.415 -2.500 27.082 1.00 12.22 C ATOM 1461 O LEU B 45 -1.574 -2.073 27.110 1.00 12.87 O ATOM 1462 CB LEU B 45 -0.427 -4.415 28.596 1.00 12.14 C ATOM 1463 CG LEU B 45 0.308 -5.437 29.454 1.00 19.74 C ATOM 1464 CD1 LEU B 45 1.134 -4.878 30.568 1.00 15.67 C ATOM 1465 CD2 LEU B 45 -0.640 -6.489 29.934 1.00 17.87 C ATOM 1466 H LEU B 45 -0.415 -2.482 30.242 1.00 0.00 H ATOM 1467 N THR B 46 0.304 -2.557 25.925 1.00 11.91 N ATOM 1468 CA THR B 46 -0.220 -2.176 24.625 1.00 12.28 C ATOM 1469 C THR B 46 -0.055 -3.368 23.667 1.00 12.02 C ATOM 1470 O THR B 46 1.059 -3.893 23.569 1.00 11.56 O ATOM 1471 CB THR B 46 0.505 -0.953 24.069 1.00 12.44 C ATOM 1472 OG1 THR B 46 0.329 0.166 24.995 1.00 14.22 O ATOM 1473 CG2 THR B 46 -0.046 -0.558 22.700 1.00 13.01 C ATOM 1474 HG1 THR B 46 -0.636 0.364 25.092 1.00 0.00 H ATOM 1475 H THR B 46 1.287 -2.894 25.976 1.00 0.00 H ATOM 1476 N ASN B 47 -1.156 -3.749 23.020 1.00 12.46 N ATOM 1477 CA ASN B 47 -1.192 -4.917 22.147 1.00 12.40 C ATOM 1478 C ASN B 47 -1.370 -4.479 20.670 1.00 12.92 C ATOM 1479 O ASN B 47 -2.169 -3.596 20.376 1.00 13.57 O ATOM 1480 CB ASN B 47 -2.464 -5.743 22.536 1.00 12.74 C ATOM 1481 CG ASN B 47 -2.748 -6.881 21.611 1.00 12.90 C ATOM 1482 OD1 ASN B 47 -3.888 -7.055 21.278 1.00 14.45 O ATOM 1483 ND2 ASN B 47 -1.783 -7.663 21.230 1.00 12.77 N ATOM 1484 HD22 ASN B 47 -0.809 -7.476 21.542 1.00 0.00 H ATOM 1485 HD21 ASN B 47 -1.985 -8.476 20.613 1.00 0.00 H ATOM 1486 H ASN B 47 -2.025 -3.191 23.143 1.00 0.00 H ATOM 1487 N THR B 48 -0.575 -5.110 19.791 1.00 12.77 N ATOM 1488 CA THR B 48 -0.756 -4.867 18.308 1.00 13.42 C ATOM 1489 C THR B 48 -0.721 -6.254 17.712 1.00 13.46 C ATOM 1490 O THR B 48 0.200 -7.001 17.979 1.00 13.01 O ATOM 1491 CB THR B 48 0.564 -4.097 17.781 1.00 13.56 C ATOM 1492 OG1 THR B 48 0.802 -2.920 18.542 1.00 19.08 O ATOM 1493 CG2 THR B 48 0.470 -3.695 16.342 1.00 16.83 C ATOM 1494 HG1 THR B 48 1.614 -2.467 18.201 1.00 0.00 H ATOM 1495 H THR B 48 0.162 -5.763 20.127 1.00 0.00 H ATOM 1496 N PRO B 49 -1.665 -6.626 16.838 1.00 14.16 N ATOM 1497 CA PRO B 49 -1.457 -7.861 16.037 1.00 14.38 C ATOM 1498 C PRO B 49 -0.438 -7.595 14.903 1.00 14.70 C ATOM 1499 O PRO B 49 -0.435 -6.489 14.376 1.00 18.59 O ATOM 1500 CB PRO B 49 -2.839 -8.154 15.439 1.00 15.21 C ATOM 1501 CG PRO B 49 -3.386 -6.804 15.437 1.00 18.00 C ATOM 1502 CD PRO B 49 -3.054 -6.130 16.650 1.00 18.40 C ATOM 1503 N VAL B 50 0.444 -8.571 14.656 1.00 14.61 N ATOM 1504 CA VAL B 50 1.516 -8.428 13.641 1.00 15.04 C ATOM 1505 C VAL B 50 1.646 -9.759 12.918 1.00 15.58 C ATOM 1506 O VAL B 50 0.923 -10.742 13.207 1.00 15.59 O ATOM 1507 CB VAL B 50 2.898 -8.066 14.265 1.00 14.47 C ATOM 1508 CG1 VAL B 50 2.769 -6.734 15.035 1.00 14.02 C ATOM 1509 CG2 VAL B 50 3.368 -9.186 15.225 1.00 13.94 C ATOM 1510 H VAL B 50 0.375 -9.459 15.193 1.00 0.00 H ATOM 1511 N LYS B 51 2.481 -9.787 11.873 1.00 16.26 N ATOM 1512 CA LYS B 51 2.799 -10.991 11.137 1.00 18.72 C ATOM 1513 C LYS B 51 4.335 -11.173 11.066 1.00 19.30 C ATOM 1514 O LYS B 51 5.027 -10.145 11.024 1.00 19.63 O ATOM 1515 CB LYS B 51 2.193 -10.898 9.741 1.00 22.57 C ATOM 1516 CG LYS B 51 0.647 -10.846 9.760 1.00 29.83 C ATOM 1517 CD LYS B 51 0.059 -10.986 8.373 1.00 36.00 C ATOM 1518 CE LYS B 51 -1.421 -10.622 8.448 1.00 57.78 C ATOM 1519 NZ LYS B 51 -2.011 -10.275 7.124 1.00 89.17 N ATOM 1520 HZ1 LYS B 51 -1.507 -9.458 6.725 1.00 0.00 H ATOM 1521 HZ2 LYS B 51 -1.920 -11.088 6.482 1.00 0.00 H ATOM 1522 HZ3 LYS B 51 -3.016 -10.038 7.245 1.00 0.00 H ATOM 1523 H LYS B 51 2.925 -8.895 11.574 1.00 0.00 H ATOM 1524 N GLY B 52 4.893 -12.427 11.149 1.00 17.38 N ATOM 1525 CA GLY B 52 6.391 -12.539 11.218 1.00 17.61 C ATOM 1526 C GLY B 52 7.095 -13.831 10.853 1.00 20.31 C ATOM 1527 O GLY B 52 6.482 -14.815 10.564 1.00 22.98 O ATOM 1528 H GLY B 52 4.294 -13.277 11.164 1.00 0.00 H ATOM 1529 N VAL B 53 8.430 -13.798 10.803 1.00 20.26 N ATOM 1530 CA VAL B 53 9.224 -15.030 10.719 1.00 25.27 C ATOM 1531 C VAL B 53 10.404 -14.878 11.711 1.00 23.09 C ATOM 1532 O VAL B 53 10.816 -13.745 12.082 1.00 26.20 O ATOM 1533 CB VAL B 53 9.751 -15.372 9.323 1.00 24.24 C ATOM 1534 CG1 VAL B 53 8.600 -15.642 8.319 1.00 24.26 C ATOM 1535 CG2 VAL B 53 10.672 -14.282 8.762 1.00 24.43 C ATOM 1536 H VAL B 53 8.917 -12.879 10.824 1.00 0.00 H ATOM 1537 N GLY B 54 10.862 -16.040 12.194 1.00 21.58 N ATOM 1538 CA GLY B 54 12.099 -16.109 12.963 1.00 22.03 C ATOM 1539 C GLY B 54 13.093 -16.848 12.128 1.00 23.30 C ATOM 1540 O GLY B 54 13.078 -16.811 10.856 1.00 24.48 O ATOM 1541 H GLY B 54 10.324 -16.912 12.017 1.00 0.00 H ATOM 1542 N VAL B 55 13.993 -17.552 12.819 1.00 27.25 N ATOM 1543 CA VAL B 55 15.137 -18.179 12.161 1.00 28.99 C ATOM 1544 C VAL B 55 14.782 -19.357 11.248 1.00 31.77 C ATOM 1545 O VAL B 55 15.557 -19.746 10.344 1.00 34.51 O ATOM 1546 CB VAL B 55 16.213 -18.577 13.204 1.00 31.59 C ATOM 1547 CG1 VAL B 55 16.547 -17.382 14.083 1.00 30.03 C ATOM 1548 CG2 VAL B 55 15.779 -19.784 14.032 1.00 38.14 C ATOM 1549 H VAL B 55 13.877 -17.656 13.847 1.00 0.00 H ATOM 1550 N GLN B 56 13.580 -19.915 11.411 1.00 32.92 N ATOM 1551 CA GLN B 56 13.151 -21.003 10.515 1.00 37.85 C ATOM 1552 C GLN B 56 12.423 -20.532 9.233 1.00 30.16 C ATOM 1553 O GLN B 56 12.012 -21.363 8.412 1.00 30.29 O ATOM 1554 CB GLN B 56 12.292 -22.045 11.259 1.00 32.55 C ATOM 1555 CG GLN B 56 13.070 -22.781 12.363 1.00 36.99 C ATOM 1556 CD GLN B 56 13.016 -22.085 13.705 1.00 39.73 C ATOM 1557 OE1 GLN B 56 12.303 -21.097 13.885 1.00 26.86 O ATOM 1558 NE2 GLN B 56 13.764 -22.615 14.671 1.00 30.26 N ATOM 1559 HE22 GLN B 56 14.352 -23.450 14.475 1.00 0.00 H ATOM 1560 HE21 GLN B 56 13.761 -22.194 15.622 1.00 0.00 H ATOM 1561 H GLN B 56 12.949 -19.583 12.168 1.00 0.00 H ATOM 1562 N GLY B 57 12.220 -19.219 9.100 1.00 33.28 N ATOM 1563 CA GLY B 57 11.703 -18.668 7.840 1.00 31.19 C ATOM 1564 C GLY B 57 10.243 -19.026 7.564 1.00 29.87 C ATOM 1565 O GLY B 57 9.881 -19.259 6.408 1.00 30.09 O ATOM 1566 H GLY B 57 12.429 -18.581 9.894 1.00 0.00 H ATOM 1567 N GLY B 58 9.435 -19.078 8.634 1.00 34.03 N ATOM 1568 CA GLY B 58 7.954 -19.182 8.520 1.00 33.03 C ATOM 1569 C GLY B 58 7.264 -20.546 8.391 1.00 57.52 C ATOM 1570 O GLY B 58 7.838 -21.593 8.687 1.00 39.24 O ATOM 1571 H GLY B 58 9.861 -19.044 9.582 1.00 0.00 H ATOM 1572 N SER B 59 6.011 -20.516 7.932 1.00 43.05 N ATOM 1573 CA SER B 59 5.167 -21.709 7.879 1.00 58.40 C ATOM 1574 C SER B 59 5.282 -22.360 6.497 1.00 74.38 C ATOM 1575 O SER B 59 4.469 -23.205 6.123 1.00 76.50 O ATOM 1576 CB SER B 59 3.707 -21.340 8.199 1.00 66.56 C ATOM 1577 OG SER B 59 3.165 -20.447 7.226 1.00 56.52 O ATOM 1578 HG SER B 59 2.228 -20.232 7.463 1.00 0.00 H ATOM 1579 H SER B 59 5.621 -19.611 7.600 1.00 0.00 H TER 1580 SER B 59 ATOM 1581 N PHE B 68 11.836 -17.918 1.951 1.00 44.79 N ATOM 1582 CA PHE B 68 10.457 -17.550 2.349 1.00 37.16 C ATOM 1583 C PHE B 68 9.906 -16.289 1.662 1.00 41.07 C ATOM 1584 O PHE B 68 10.651 -15.457 1.170 1.00 35.67 O ATOM 1585 CB PHE B 68 10.327 -17.419 3.867 1.00 32.85 C ATOM 1586 CG PHE B 68 10.976 -16.204 4.437 1.00 30.49 C ATOM 1587 CD1 PHE B 68 12.307 -16.247 4.827 1.00 33.86 C ATOM 1588 CD2 PHE B 68 10.255 -15.030 4.654 1.00 29.75 C ATOM 1589 CE1 PHE B 68 12.924 -15.142 5.386 1.00 30.76 C ATOM 1590 CE2 PHE B 68 10.871 -13.920 5.210 1.00 31.43 C ATOM 1591 CZ PHE B 68 12.215 -13.980 5.581 1.00 28.56 C ATOM 1592 HN3 PHE B 68 12.483 -17.139 2.187 1.00 0.00 H ATOM 1593 HN2 PHE B 68 11.864 -18.096 0.927 1.00 0.00 H ATOM 1594 HN1 PHE B 68 12.125 -18.777 2.461 1.00 0.00 H ATOM 1595 N GLY B 69 8.580 -16.152 1.719 1.00 36.90 N ATOM 1596 CA GLY B 69 7.801 -15.161 0.951 1.00 32.20 C ATOM 1597 C GLY B 69 6.729 -14.656 1.916 1.00 32.50 C ATOM 1598 O GLY B 69 6.597 -15.173 3.000 1.00 30.09 O ATOM 1599 H GLY B 69 8.057 -16.791 2.351 1.00 0.00 H ATOM 1600 N PRO B 70 5.944 -13.649 1.518 1.00 31.38 N ATOM 1601 CA PRO B 70 4.896 -13.094 2.414 1.00 31.40 C ATOM 1602 C PRO B 70 3.826 -14.078 2.888 1.00 31.12 C ATOM 1603 O PRO B 70 3.259 -13.861 3.969 1.00 30.21 O ATOM 1604 CB PRO B 70 4.263 -11.982 1.555 1.00 35.79 C ATOM 1605 CG PRO B 70 5.365 -11.658 0.615 1.00 31.56 C ATOM 1606 CD PRO B 70 5.916 -12.981 0.213 1.00 30.60 C ATOM 1607 N SER B 71 3.590 -15.138 2.137 1.00 32.93 N ATOM 1608 CA SER B 71 2.606 -16.152 2.546 1.00 33.06 C ATOM 1609 C SER B 71 3.123 -17.077 3.651 1.00 34.80 C ATOM 1610 O SER B 71 2.328 -17.807 4.211 1.00 35.15 O ATOM 1611 CB SER B 71 2.127 -16.963 1.367 1.00 45.58 C ATOM 1612 OG SER B 71 3.206 -17.610 0.732 1.00 41.56 O ATOM 1613 HG SER B 71 2.868 -18.135 -0.037 1.00 0.00 H ATOM 1614 H SER B 71 4.108 -15.258 1.243 1.00 0.00 H ATOM 1615 N ASN B 72 4.428 -17.037 3.948 1.00 28.80 N ATOM 1616 CA ASN B 72 5.010 -17.821 5.023 1.00 30.22 C ATOM 1617 C ASN B 72 5.048 -17.052 6.302 1.00 26.45 C ATOM 1618 O ASN B 72 5.335 -17.625 7.323 1.00 29.63 O ATOM 1619 CB ASN B 72 6.455 -18.226 4.706 1.00 36.17 C ATOM 1620 CG ASN B 72 6.558 -19.079 3.480 1.00 35.27 C ATOM 1621 OD1 ASN B 72 6.048 -20.195 3.434 1.00 47.35 O ATOM 1622 ND2 ASN B 72 7.119 -18.536 2.446 1.00 35.50 N ATOM 1623 HD22 ASN B 72 7.541 -17.589 2.521 1.00 0.00 H ATOM 1624 HD21 ASN B 72 7.147 -19.048 1.541 1.00 0.00 H ATOM 1625 H ASN B 72 5.049 -16.420 3.387 1.00 0.00 H ATOM 1626 N LEU B 73 4.776 -15.748 6.294 1.00 24.91 N ATOM 1627 CA LEU B 73 4.671 -14.976 7.539 1.00 23.37 C ATOM 1628 C LEU B 73 3.531 -15.585 8.409 1.00 22.87 C ATOM 1629 O LEU B 73 2.474 -15.937 7.844 1.00 29.34 O ATOM 1630 CB LEU B 73 4.252 -13.535 7.181 1.00 32.18 C ATOM 1631 CG LEU B 73 5.212 -12.634 6.408 1.00 42.72 C ATOM 1632 CD1 LEU B 73 4.542 -11.302 6.087 1.00 41.58 C ATOM 1633 CD2 LEU B 73 6.461 -12.434 7.219 1.00 31.26 C ATOM 1634 H LEU B 73 4.635 -15.265 5.384 1.00 0.00 H ATOM 1635 N VAL B 74 3.777 -15.680 9.704 1.00 21.34 N ATOM 1636 CA VAL B 74 2.895 -16.324 10.690 1.00 20.24 C ATOM 1637 C VAL B 74 2.247 -15.184 11.530 1.00 19.83 C ATOM 1638 O VAL B 74 2.966 -14.296 11.982 1.00 20.66 O ATOM 1639 CB VAL B 74 3.789 -17.243 11.569 1.00 19.39 C ATOM 1640 CG1 VAL B 74 2.965 -17.977 12.595 1.00 20.27 C ATOM 1641 CG2 VAL B 74 4.503 -18.271 10.662 1.00 24.60 C ATOM 1642 H VAL B 74 4.665 -15.267 10.054 1.00 0.00 H ATOM 1643 N ASP B 75 0.870 -15.185 11.663 1.00 21.38 N ATOM 1644 CA ASP B 75 0.225 -14.224 12.677 1.00 16.74 C ATOM 1645 C ASP B 75 0.790 -14.419 14.015 1.00 15.86 C ATOM 1646 O ASP B 75 0.930 -15.546 14.513 1.00 17.22 O ATOM 1647 CB ASP B 75 -1.345 -14.349 12.762 1.00 21.82 C ATOM 1648 CG ASP B 75 -2.043 -14.111 11.475 1.00 27.51 C ATOM 1649 OD1 ASP B 75 -1.586 -13.286 10.686 1.00 28.77 O ATOM 1650 OD2 ASP B 75 -3.096 -14.733 11.333 1.00 32.60 O ATOM 1651 H ASP B 75 0.282 -15.823 11.089 1.00 0.00 H ATOM 1652 N LYS B 76 1.096 -13.288 14.643 1.00 15.14 N ATOM 1653 CA LYS B 76 1.586 -13.229 15.984 1.00 14.34 C ATOM 1654 C LYS B 76 0.880 -12.068 16.726 1.00 13.77 C ATOM 1655 O LYS B 76 0.292 -11.173 16.144 1.00 14.01 O ATOM 1656 CB LYS B 76 3.155 -13.090 16.145 1.00 16.96 C ATOM 1657 CG LYS B 76 3.933 -14.125 15.372 1.00 21.12 C ATOM 1658 CD LYS B 76 4.055 -15.410 16.208 1.00 18.78 C ATOM 1659 CE LYS B 76 4.934 -16.437 15.471 1.00 27.96 C ATOM 1660 NZ LYS B 76 4.690 -17.842 15.896 1.00 23.35 N ATOM 1661 HZ1 LYS B 76 4.888 -17.935 16.913 1.00 0.00 H ATOM 1662 HZ2 LYS B 76 3.697 -18.091 15.711 1.00 0.00 H ATOM 1663 HZ3 LYS B 76 5.314 -18.478 15.360 1.00 0.00 H ATOM 1664 H LYS B 76 0.971 -12.393 14.128 1.00 0.00 H ATOM 1665 N GLU B 77 1.010 -12.085 18.019 1.00 13.17 N ATOM 1666 CA GLU B 77 0.532 -10.985 18.856 1.00 12.73 C ATOM 1667 C GLU B 77 1.733 -10.350 19.442 1.00 12.25 C ATOM 1668 O GLU B 77 2.633 -11.044 19.902 1.00 12.12 O ATOM 1669 CB GLU B 77 -0.507 -11.510 19.873 1.00 12.67 C ATOM 1670 CG GLU B 77 -1.909 -11.818 19.352 1.00 13.27 C ATOM 1671 CD GLU B 77 -2.715 -10.607 18.865 1.00 13.60 C ATOM 1672 OE1 GLU B 77 -2.398 -9.451 19.032 1.00 13.84 O ATOM 1673 OE2 GLU B 77 -3.771 -10.894 18.238 1.00 18.86 O ATOM 1674 H GLU B 77 1.466 -12.903 18.471 1.00 0.00 H ATOM 1675 N LYS B 78 1.725 -9.033 19.548 1.00 12.09 N ATOM 1676 CA LYS B 78 2.834 -8.221 20.154 1.00 11.70 C ATOM 1677 C LYS B 78 2.263 -7.529 21.389 1.00 11.40 C ATOM 1678 O LYS B 78 1.102 -6.998 21.388 1.00 11.63 O ATOM 1679 CB LYS B 78 3.300 -7.244 19.136 1.00 11.98 C ATOM 1680 CG LYS B 78 4.514 -6.461 19.591 1.00 13.27 C ATOM 1681 CD LYS B 78 5.207 -5.937 18.358 1.00 19.10 C ATOM 1682 CE LYS B 78 4.720 -4.550 18.104 1.00 25.14 C ATOM 1683 NZ LYS B 78 5.579 -3.663 18.987 1.00 28.96 N ATOM 1684 HZ1 LYS B 78 5.452 -3.939 19.982 1.00 0.00 H ATOM 1685 HZ2 LYS B 78 6.578 -3.774 18.720 1.00 0.00 H ATOM 1686 HZ3 LYS B 78 5.294 -2.671 18.862 1.00 0.00 H ATOM 1687 H LYS B 78 0.893 -8.523 19.187 1.00 0.00 H ATOM 1688 N LEU B 79 3.052 -7.546 22.404 1.00 11.06 N ATOM 1689 CA LEU B 79 2.752 -6.768 23.591 1.00 10.89 C ATOM 1690 C LEU B 79 3.959 -5.889 23.963 1.00 10.72 C ATOM 1691 O LEU B 79 5.040 -6.370 23.976 1.00 10.80 O ATOM 1692 CB LEU B 79 2.562 -7.692 24.737 1.00 11.77 C ATOM 1693 CG LEU B 79 1.418 -7.557 25.652 1.00 18.80 C ATOM 1694 CD1 LEU B 79 0.062 -7.101 25.277 1.00 11.32 C ATOM 1695 CD2 LEU B 79 1.412 -8.835 26.559 1.00 17.37 C ATOM 1696 H LEU B 79 3.916 -8.125 22.374 1.00 0.00 H ATOM 1697 N ASP B 80 3.720 -4.633 24.227 1.00 10.80 N ATOM 1698 CA ASP B 80 4.790 -3.640 24.595 1.00 10.76 C ATOM 1699 C ASP B 80 4.414 -3.181 26.014 1.00 10.77 C ATOM 1700 O ASP B 80 3.253 -2.856 26.316 1.00 11.00 O ATOM 1701 CB ASP B 80 4.876 -2.469 23.644 1.00 11.06 C ATOM 1702 CG ASP B 80 5.461 -2.896 22.295 1.00 12.24 C ATOM 1703 OD1 ASP B 80 6.737 -2.868 22.256 1.00 16.11 O ATOM 1704 OD2 ASP B 80 4.671 -3.311 21.434 1.00 22.52 O ATOM 1705 H ASP B 80 2.736 -4.300 24.181 1.00 0.00 H ATOM 1706 N ILE B 81 5.448 -3.142 26.861 1.00 10.67 N ATOM 1707 CA ILE B 81 5.306 -2.679 28.225 1.00 10.81 C ATOM 1708 C ILE B 81 6.579 -1.855 28.533 1.00 10.91 C ATOM 1709 O ILE B 81 7.694 -2.320 28.420 1.00 11.49 O ATOM 1710 CB ILE B 81 5.273 -3.865 29.234 1.00 11.17 C ATOM 1711 CG1 ILE B 81 4.274 -4.968 28.787 1.00 17.88 C ATOM 1712 CG2 ILE B 81 4.997 -3.357 30.614 1.00 13.08 C ATOM 1713 CD1 ILE B 81 4.907 -6.252 28.282 1.00 24.37 C ATOM 1714 H ILE B 81 6.383 -3.454 26.529 1.00 0.00 H ATOM 1715 N VAL B 82 6.420 -0.682 29.113 1.00 11.22 N ATOM 1716 CA VAL B 82 7.476 0.122 29.582 1.00 11.43 C ATOM 1717 C VAL B 82 7.630 -0.051 31.109 1.00 11.66 C ATOM 1718 O VAL B 82 6.660 0.063 31.843 1.00 11.90 O ATOM 1719 CB VAL B 82 7.365 1.617 29.171 1.00 11.82 C ATOM 1720 CG1 VAL B 82 8.576 2.448 29.734 1.00 12.15 C ATOM 1721 CG2 VAL B 82 7.369 1.658 27.626 1.00 11.72 C ATOM 1722 H VAL B 82 5.450 -0.327 29.232 1.00 0.00 H ATOM 1723 N VAL B 83 8.858 -0.391 31.532 1.00 11.72 N ATOM 1724 CA VAL B 83 9.165 -0.653 32.993 1.00 12.09 C ATOM 1725 C VAL B 83 10.439 0.131 33.255 1.00 12.47 C ATOM 1726 O VAL B 83 11.176 0.567 32.434 1.00 12.43 O ATOM 1727 CB VAL B 83 9.370 -2.146 33.209 1.00 11.96 C ATOM 1728 CG1 VAL B 83 8.080 -2.900 32.807 1.00 12.70 C ATOM 1729 CG2 VAL B 83 10.585 -2.715 32.606 1.00 11.93 C ATOM 1730 H VAL B 83 9.624 -0.477 30.834 1.00 0.00 H ATOM 1731 N SER B 84 10.738 0.242 34.571 1.00 13.00 N ATOM 1732 CA SER B 84 12.059 0.779 34.951 1.00 13.50 C ATOM 1733 C SER B 84 13.147 -0.218 34.832 1.00 13.57 C ATOM 1734 O SER B 84 12.931 -1.408 34.715 1.00 13.34 O ATOM 1735 CB SER B 84 11.973 1.168 36.421 1.00 14.20 C ATOM 1736 OG SER B 84 12.069 -0.088 37.155 1.00 14.36 O ATOM 1737 HG SER B 84 12.019 0.094 38.127 1.00 0.00 H ATOM 1738 H SER B 84 10.052 -0.045 35.298 1.00 0.00 H ATOM 1739 N ARG B 85 14.386 0.287 34.777 1.00 14.03 N ATOM 1740 CA ARG B 85 15.514 -0.545 34.662 1.00 14.36 C ATOM 1741 C ARG B 85 15.537 -1.716 35.626 1.00 14.70 C ATOM 1742 O ARG B 85 15.834 -2.828 35.300 1.00 14.72 O ATOM 1743 CB ARG B 85 16.777 0.346 34.856 1.00 15.11 C ATOM 1744 CG ARG B 85 18.059 -0.389 34.759 1.00 15.72 C ATOM 1745 CD ARG B 85 19.236 0.593 35.029 1.00 17.62 C ATOM 1746 NE ARG B 85 20.472 0.084 34.581 1.00 19.59 N ATOM 1747 CZ ARG B 85 20.984 0.360 33.377 1.00 19.93 C ATOM 1748 NH1 ARG B 85 20.486 1.330 32.586 1.00 16.77 N ATOM 1749 NH2 ARG B 85 22.158 -0.232 33.066 1.00 21.62 N ATOM 1750 HE ARG B 85 21.012 -0.536 35.218 1.00 0.00 H ATOM 1751 HH12 ARG B 85 20.914 1.513 31.656 1.00 0.00 H ATOM 1752 HH11 ARG B 85 19.674 1.896 32.906 1.00 0.00 H ATOM 1753 HH22 ARG B 85 22.602 -0.053 32.143 1.00 0.00 H ATOM 1754 HH21 ARG B 85 22.618 -0.867 33.750 1.00 0.00 H ATOM 1755 H ARG B 85 14.517 1.318 34.820 1.00 0.00 H ATOM 1756 N ALA B 86 15.221 -1.420 36.895 1.00 15.15 N ATOM 1757 CA ALA B 86 15.209 -2.441 37.892 1.00 15.65 C ATOM 1758 C ALA B 86 14.206 -3.514 37.735 1.00 15.17 C ATOM 1759 O ALA B 86 14.333 -4.587 38.234 1.00 15.74 O ATOM 1760 CB ALA B 86 15.044 -1.773 39.290 1.00 16.39 C ATOM 1761 H ALA B 86 14.983 -0.441 37.154 1.00 0.00 H ATOM 1762 N GLN B 87 13.156 -3.245 36.990 1.00 14.37 N ATOM 1763 CA GLN B 87 12.058 -4.200 36.805 1.00 13.95 C ATOM 1764 C GLN B 87 12.219 -5.070 35.551 1.00 13.47 C ATOM 1765 O GLN B 87 11.396 -5.962 35.349 1.00 13.21 O ATOM 1766 CB GLN B 87 10.807 -3.368 36.675 1.00 13.55 C ATOM 1767 CG GLN B 87 10.457 -2.637 38.000 1.00 14.22 C ATOM 1768 CD GLN B 87 9.448 -1.526 37.870 1.00 14.11 C ATOM 1769 OE1 GLN B 87 9.106 -1.175 36.663 1.00 13.49 O ATOM 1770 NE2 GLN B 87 8.960 -0.933 38.974 1.00 14.81 N ATOM 1771 HE22 GLN B 87 9.267 -1.253 39.915 1.00 0.00 H ATOM 1772 HE21 GLN B 87 8.276 -0.155 38.887 1.00 0.00 H ATOM 1773 H GLN B 87 13.102 -2.322 36.515 1.00 0.00 H ATOM 1774 N VAL B 88 13.175 -4.736 34.729 1.00 13.44 N ATOM 1775 CA VAL B 88 13.256 -5.465 33.435 1.00 13.08 C ATOM 1776 C VAL B 88 13.325 -6.978 33.555 1.00 13.39 C ATOM 1777 O VAL B 88 12.515 -7.705 32.964 1.00 13.00 O ATOM 1778 CB VAL B 88 14.448 -4.996 32.636 1.00 13.31 C ATOM 1779 CG1 VAL B 88 14.629 -5.903 31.392 1.00 13.21 C ATOM 1780 CG2 VAL B 88 14.227 -3.595 32.151 1.00 12.96 C ATOM 1781 H VAL B 88 13.856 -3.987 34.970 1.00 0.00 H ATOM 1782 N ASP B 89 14.252 -7.460 34.356 1.00 14.20 N ATOM 1783 CA ASP B 89 14.443 -8.903 34.405 1.00 14.71 C ATOM 1784 C ASP B 89 13.173 -9.634 34.878 1.00 14.49 C ATOM 1785 O ASP B 89 12.689 -10.613 34.364 1.00 14.39 O ATOM 1786 CB ASP B 89 15.603 -9.248 35.286 1.00 17.01 C ATOM 1787 CG ASP B 89 16.965 -9.025 34.617 1.00 20.68 C ATOM 1788 OD1 ASP B 89 17.060 -8.916 33.360 1.00 27.47 O ATOM 1789 OD2 ASP B 89 17.966 -9.001 35.349 1.00 32.41 O ATOM 1790 H ASP B 89 14.834 -6.826 34.940 1.00 0.00 H ATOM 1791 N ALA B 90 12.557 -9.141 35.949 1.00 14.53 N ATOM 1792 CA ALA B 90 11.333 -9.763 36.353 1.00 14.42 C ATOM 1793 C ALA B 90 10.210 -9.795 35.382 1.00 13.61 C ATOM 1794 O ALA B 90 9.488 -10.833 35.246 1.00 13.65 O ATOM 1795 CB ALA B 90 10.898 -9.178 37.702 1.00 14.82 C ATOM 1796 H ALA B 90 12.950 -8.334 36.473 1.00 0.00 H ATOM 1797 N VAL B 91 10.012 -8.697 34.675 1.00 12.98 N ATOM 1798 CA VAL B 91 8.904 -8.617 33.735 1.00 12.34 C ATOM 1799 C VAL B 91 9.193 -9.487 32.485 1.00 12.19 C ATOM 1800 O VAL B 91 8.372 -10.231 32.046 1.00 12.06 O ATOM 1801 CB VAL B 91 8.507 -7.168 33.437 1.00 11.94 C ATOM 1802 CG1 VAL B 91 7.418 -7.133 32.431 1.00 11.47 C ATOM 1803 CG2 VAL B 91 8.101 -6.522 34.758 1.00 13.81 C ATOM 1804 H VAL B 91 10.652 -7.885 34.791 1.00 0.00 H ATOM 1805 N VAL B 92 10.424 -9.465 32.041 1.00 12.40 N ATOM 1806 CA VAL B 92 10.857 -10.361 30.954 1.00 12.54 C ATOM 1807 C VAL B 92 10.615 -11.816 31.316 1.00 13.02 C ATOM 1808 O VAL B 92 10.041 -12.575 30.551 1.00 12.94 O ATOM 1809 CB VAL B 92 12.319 -10.156 30.562 1.00 12.98 C ATOM 1810 CG1 VAL B 92 12.832 -11.296 29.719 1.00 13.49 C ATOM 1811 CG2 VAL B 92 12.488 -8.821 29.875 1.00 12.55 C ATOM 1812 H VAL B 92 11.108 -8.804 32.462 1.00 0.00 H ATOM 1813 N ARG B 93 10.964 -12.214 32.517 1.00 13.63 N ATOM 1814 CA ARG B 93 10.769 -13.574 32.933 1.00 14.26 C ATOM 1815 C ARG B 93 9.269 -13.950 32.935 1.00 13.89 C ATOM 1816 O ARG B 93 8.897 -15.092 32.588 1.00 14.20 O ATOM 1817 CB ARG B 93 11.375 -13.806 34.348 1.00 15.19 C ATOM 1818 CG ARG B 93 12.880 -13.775 34.335 1.00 18.07 C ATOM 1819 CD ARG B 93 13.453 -13.605 35.737 1.00 26.38 C ATOM 1820 NE ARG B 93 14.899 -13.378 35.685 1.00 23.65 N ATOM 1821 CZ ARG B 93 15.664 -12.881 36.675 1.00 31.13 C ATOM 1822 NH1 ARG B 93 15.098 -12.416 37.802 1.00 39.37 N ATOM 1823 NH2 ARG B 93 16.981 -12.753 36.477 1.00 47.17 N ATOM 1824 HE ARG B 93 15.382 -13.625 34.797 1.00 0.00 H ATOM 1825 HH12 ARG B 93 15.694 -12.033 38.564 1.00 0.00 H ATOM 1826 HH11 ARG B 93 14.064 -12.439 37.912 1.00 0.00 H ATOM 1827 HH22 ARG B 93 17.586 -12.371 37.232 1.00 0.00 H ATOM 1828 HH21 ARG B 93 17.400 -13.036 35.568 1.00 0.00 H ATOM 1829 H ARG B 93 11.389 -11.533 33.178 1.00 0.00 H ATOM 1830 N LEU B 94 8.470 -13.033 33.477 1.00 13.45 N ATOM 1831 CA LEU B 94 6.995 -13.248 33.528 1.00 13.23 C ATOM 1832 C LEU B 94 6.391 -13.516 32.169 1.00 12.78 C ATOM 1833 O LEU B 94 5.584 -14.426 31.909 1.00 12.95 O ATOM 1834 CB LEU B 94 6.194 -12.107 34.230 1.00 13.74 C ATOM 1835 CG LEU B 94 6.379 -12.054 35.694 1.00 20.54 C ATOM 1836 CD1 LEU B 94 5.754 -10.777 36.243 1.00 26.02 C ATOM 1837 CD2 LEU B 94 5.755 -13.269 36.356 1.00 18.68 C ATOM 1838 H LEU B 94 8.878 -12.160 33.868 1.00 0.00 H ATOM 1839 N VAL B 95 6.760 -12.615 31.253 1.00 12.26 N ATOM 1840 CA VAL B 95 6.319 -12.751 29.844 1.00 11.95 C ATOM 1841 C VAL B 95 6.807 -14.060 29.249 1.00 12.42 C ATOM 1842 O VAL B 95 6.028 -14.787 28.648 1.00 12.51 O ATOM 1843 CB VAL B 95 6.748 -11.551 28.991 1.00 11.50 C ATOM 1844 CG1 VAL B 95 6.424 -11.801 27.529 1.00 11.40 C ATOM 1845 CG2 VAL B 95 6.150 -10.247 29.514 1.00 11.18 C ATOM 1846 H VAL B 95 7.361 -11.813 31.531 1.00 0.00 H ATOM 1847 N ALA B 96 8.082 -14.320 29.378 1.00 12.86 N ATOM 1848 CA ALA B 96 8.593 -15.544 28.805 1.00 13.52 C ATOM 1849 C ALA B 96 7.867 -16.792 29.327 1.00 14.03 C ATOM 1850 O ALA B 96 7.504 -17.701 28.601 1.00 14.34 O ATOM 1851 CB ALA B 96 10.082 -15.632 28.924 1.00 14.14 C ATOM 1852 H ALA B 96 8.712 -13.663 29.880 1.00 0.00 H ATOM 1853 N ALA B 97 7.662 -16.847 30.621 1.00 14.23 N ATOM 1854 CA ALA B 97 7.082 -18.022 31.185 1.00 14.88 C ATOM 1855 C ALA B 97 5.635 -18.276 30.701 1.00 14.57 C ATOM 1856 O ALA B 97 5.239 -19.438 30.703 1.00 15.21 O ATOM 1857 CB ALA B 97 7.151 -17.976 32.751 1.00 15.33 C ATOM 1858 H ALA B 97 7.919 -16.043 31.229 1.00 0.00 H ATOM 1859 N SER B 98 4.883 -17.220 30.504 1.00 13.81 N ATOM 1860 CA SER B 98 3.483 -17.335 30.113 1.00 13.65 C ATOM 1861 C SER B 98 3.357 -17.531 28.625 1.00 13.49 C ATOM 1862 O SER B 98 2.299 -18.023 28.175 1.00 15.75 O ATOM 1863 CB SER B 98 2.590 -16.138 30.541 1.00 13.99 C ATOM 1864 OG SER B 98 3.145 -14.850 30.262 1.00 13.40 O ATOM 1865 HG SER B 98 4.006 -14.752 30.741 1.00 0.00 H ATOM 1866 H SER B 98 5.297 -16.274 30.630 1.00 0.00 H ATOM 1867 N ALA B 99 4.286 -17.014 27.815 1.00 13.22 N ATOM 1868 CA ALA B 99 4.226 -17.209 26.366 1.00 13.25 C ATOM 1869 C ALA B 99 4.740 -18.574 25.982 1.00 14.07 C ATOM 1870 O ALA B 99 4.443 -19.081 24.868 1.00 14.36 O ATOM 1871 CB ALA B 99 5.006 -16.173 25.661 1.00 12.85 C ATOM 1872 H ALA B 99 5.067 -16.462 28.223 1.00 0.00 H ATOM 1873 N TYR B 100 5.596 -19.180 26.766 1.00 14.61 N ATOM 1874 CA TYR B 100 6.240 -20.448 26.476 1.00 15.61 C ATOM 1875 C TYR B 100 5.253 -21.563 26.152 1.00 18.46 C ATOM 1876 O TYR B 100 4.243 -21.711 26.811 1.00 17.91 O ATOM 1877 CB TYR B 100 7.134 -20.813 27.687 1.00 16.21 C ATOM 1878 CG TYR B 100 7.640 -22.176 27.626 1.00 17.44 C ATOM 1879 CD1 TYR B 100 6.836 -23.262 28.110 1.00 18.26 C ATOM 1880 CD2 TYR B 100 8.899 -22.470 27.046 1.00 18.20 C ATOM 1881 CE1 TYR B 100 7.300 -24.568 28.037 1.00 20.01 C ATOM 1882 CE2 TYR B 100 9.382 -23.778 27.011 1.00 21.00 C ATOM 1883 CZ TYR B 100 8.588 -24.807 27.558 1.00 24.35 C ATOM 1884 OH TYR B 100 8.915 -26.126 27.481 1.00 27.01 O ATOM 1885 HH TYR B 100 8.217 -26.665 27.931 1.00 0.00 H ATOM 1886 H TYR B 100 5.833 -18.717 27.666 1.00 0.00 H ATOM 1887 N THR B 101 5.576 -22.350 25.140 1.00 16.85 N ATOM 1888 CA THR B 101 4.909 -23.623 24.922 1.00 17.70 C ATOM 1889 C THR B 101 5.864 -24.802 24.751 1.00 19.02 C ATOM 1890 O THR B 101 5.497 -25.934 24.896 1.00 19.93 O ATOM 1891 CB THR B 101 3.994 -23.650 23.692 1.00 17.60 C ATOM 1892 OG1 THR B 101 4.806 -23.796 22.513 1.00 18.10 O ATOM 1893 CG2 THR B 101 3.113 -22.486 23.662 1.00 16.54 C ATOM 1894 HG1 THR B 101 5.433 -23.032 22.449 1.00 0.00 H ATOM 1895 H THR B 101 6.326 -22.051 24.484 1.00 0.00 H ATOM 1896 N GLY B 102 7.126 -24.523 24.457 1.00 19.28 N ATOM 1897 CA GLY B 102 8.103 -25.574 24.286 1.00 20.73 C ATOM 1898 C GLY B 102 8.392 -25.895 22.837 1.00 21.39 C ATOM 1899 O GLY B 102 9.297 -26.662 22.575 1.00 22.72 O ATOM 1900 H GLY B 102 7.418 -23.531 24.348 1.00 0.00 H ATOM 1901 N GLU B 103 7.591 -25.364 21.906 1.00 20.66 N ATOM 1902 CA GLU B 103 7.770 -25.602 20.450 1.00 21.35 C ATOM 1903 C GLU B 103 8.369 -24.378 19.729 1.00 20.73 C ATOM 1904 O GLU B 103 8.269 -23.235 20.169 1.00 19.52 O ATOM 1905 CB GLU B 103 6.472 -25.981 19.810 1.00 23.63 C ATOM 1906 CG GLU B 103 5.638 -27.045 20.541 1.00 25.79 C ATOM 1907 CD GLU B 103 6.210 -28.452 20.495 1.00 42.36 C ATOM 1908 OE1 GLU B 103 7.076 -28.785 19.625 1.00 27.37 O ATOM 1909 OE2 GLU B 103 5.748 -29.256 21.337 1.00 70.21 O ATOM 1910 H GLU B 103 6.806 -24.756 22.216 1.00 0.00 H ATOM 1911 N ILE B 104 9.049 -24.669 18.586 1.00 21.78 N ATOM 1912 CA ILE B 104 9.673 -23.567 17.796 1.00 21.78 C ATOM 1913 C ILE B 104 8.594 -22.607 17.414 1.00 20.22 C ATOM 1914 O ILE B 104 7.461 -23.080 17.132 1.00 20.87 O ATOM 1915 CB ILE B 104 10.440 -24.067 16.550 1.00 28.79 C ATOM 1916 CG1 ILE B 104 9.487 -24.845 15.649 1.00 33.69 C ATOM 1917 CG2 ILE B 104 11.665 -24.862 16.993 1.00 26.13 C ATOM 1918 CD1 ILE B 104 9.871 -24.850 14.172 1.00 45.64 C ATOM 1919 H ILE B 104 9.133 -25.655 18.265 1.00 0.00 H ATOM 1920 N GLY B 105 8.883 -21.330 17.363 1.00 19.36 N ATOM 1921 CA GLY B 105 7.866 -20.328 17.044 1.00 18.79 C ATOM 1922 C GLY B 105 7.205 -19.683 18.205 1.00 17.09 C ATOM 1923 O GLY B 105 6.246 -18.891 18.148 1.00 17.07 O ATOM 1924 H GLY B 105 9.858 -21.022 17.554 1.00 0.00 H ATOM 1925 N ASP B 106 7.760 -19.940 19.409 1.00 17.00 N ATOM 1926 CA ASP B 106 7.188 -19.424 20.629 1.00 16.04 C ATOM 1927 C ASP B 106 7.254 -17.915 20.726 1.00 15.10 C ATOM 1928 O ASP B 106 6.474 -17.290 21.453 1.00 15.53 O ATOM 1929 CB ASP B 106 7.910 -20.002 21.867 1.00 16.38 C ATOM 1930 CG ASP B 106 7.236 -21.248 22.434 1.00 16.90 C ATOM 1931 OD1 ASP B 106 6.178 -21.664 21.856 1.00 16.97 O ATOM 1932 OD2 ASP B 106 7.746 -21.755 23.449 1.00 17.31 O ATOM 1933 H ASP B 106 8.620 -20.523 19.458 1.00 0.00 H ATOM 1934 N GLY B 107 8.265 -17.329 20.076 1.00 16.46 N ATOM 1935 CA GLY B 107 8.321 -15.895 20.272 1.00 15.22 C ATOM 1936 C GLY B 107 9.671 -15.384 20.652 1.00 14.62 C ATOM 1937 O GLY B 107 10.591 -16.160 20.969 1.00 15.36 O ATOM 1938 H GLY B 107 8.945 -17.852 19.487 1.00 0.00 H ATOM 1939 N LYS B 108 9.748 -14.091 20.570 1.00 14.06 N ATOM 1940 CA LYS B 108 10.948 -13.399 20.974 1.00 14.14 C ATOM 1941 C LYS B 108 10.568 -12.187 21.834 1.00 13.24 C ATOM 1942 O LYS B 108 9.501 -11.608 21.651 1.00 12.69 O ATOM 1943 CB LYS B 108 11.651 -12.976 19.717 1.00 14.71 C ATOM 1944 CG LYS B 108 13.081 -12.641 19.937 1.00 15.25 C ATOM 1945 CD LYS B 108 13.855 -12.799 18.629 1.00 16.30 C ATOM 1946 CE LYS B 108 14.179 -14.258 18.396 1.00 18.24 C ATOM 1947 NZ LYS B 108 14.850 -14.454 17.077 1.00 25.39 N ATOM 1948 HZ1 LYS B 108 14.220 -14.126 16.317 1.00 0.00 H ATOM 1949 HZ2 LYS B 108 15.735 -13.908 17.055 1.00 0.00 H ATOM 1950 HZ3 LYS B 108 15.061 -15.464 16.943 1.00 0.00 H ATOM 1951 H LYS B 108 8.937 -13.549 20.210 1.00 0.00 H ATOM 1952 N ILE B 109 11.454 -11.815 22.765 1.00 13.27 N ATOM 1953 CA ILE B 109 11.325 -10.614 23.532 1.00 12.65 C ATOM 1954 C ILE B 109 12.488 -9.740 23.240 1.00 12.96 C ATOM 1955 O ILE B 109 13.635 -10.170 23.293 1.00 13.67 O ATOM 1956 CB ILE B 109 11.238 -10.932 25.054 1.00 12.52 C ATOM 1957 CG1 ILE B 109 10.060 -11.911 25.325 1.00 12.37 C ATOM 1958 CG2 ILE B 109 11.153 -9.637 25.858 1.00 12.03 C ATOM 1959 CD1 ILE B 109 10.121 -12.514 26.736 1.00 12.57 C ATOM 1960 H ILE B 109 12.276 -12.428 22.940 1.00 0.00 H ATOM 1961 N PHE B 110 12.225 -8.472 22.977 1.00 12.56 N ATOM 1962 CA PHE B 110 13.223 -7.462 22.720 1.00 12.85 C ATOM 1963 C PHE B 110 13.094 -6.404 23.803 1.00 12.40 C ATOM 1964 O PHE B 110 12.027 -5.965 24.125 1.00 11.85 O ATOM 1965 CB PHE B 110 12.946 -6.838 21.334 1.00 12.97 C ATOM 1966 CG PHE B 110 13.022 -7.821 20.201 1.00 13.56 C ATOM 1967 CD1 PHE B 110 14.226 -8.276 19.722 1.00 14.47 C ATOM 1968 CD2 PHE B 110 11.822 -8.264 19.571 1.00 15.64 C ATOM 1969 CE1 PHE B 110 14.227 -9.194 18.647 1.00 15.16 C ATOM 1970 CE2 PHE B 110 11.924 -9.178 18.516 1.00 17.62 C ATOM 1971 CZ PHE B 110 13.092 -9.573 18.084 1.00 15.01 C ATOM 1972 H PHE B 110 11.227 -8.181 22.954 1.00 0.00 H ATOM 1973 N VAL B 111 14.242 -5.963 24.314 1.00 12.79 N ATOM 1974 CA VAL B 111 14.286 -4.876 25.286 1.00 12.56 C ATOM 1975 C VAL B 111 14.918 -3.653 24.693 1.00 12.85 C ATOM 1976 O VAL B 111 16.029 -3.782 24.182 1.00 13.53 O ATOM 1977 CB VAL B 111 15.110 -5.343 26.539 1.00 12.95 C ATOM 1978 CG1 VAL B 111 15.076 -4.229 27.635 1.00 12.80 C ATOM 1979 CG2 VAL B 111 14.425 -6.573 27.125 1.00 12.77 C ATOM 1980 H VAL B 111 15.133 -6.406 24.011 1.00 0.00 H ATOM 1981 N HIS B 112 14.294 -2.494 24.784 1.00 12.53 N ATOM 1982 CA HIS B 112 14.705 -1.270 24.129 1.00 12.86 C ATOM 1983 C HIS B 112 14.787 -0.122 25.065 1.00 12.87 C ATOM 1984 O HIS B 112 13.973 0.017 25.978 1.00 12.47 O ATOM 1985 CB HIS B 112 13.637 -0.860 23.053 1.00 12.66 C ATOM 1986 CG HIS B 112 13.187 -1.987 22.164 1.00 12.61 C ATOM 1987 ND1 HIS B 112 13.734 -2.192 20.922 1.00 13.18 N ATOM 1988 CD2 HIS B 112 12.143 -2.837 22.275 1.00 12.16 C ATOM 1989 CE1 HIS B 112 13.051 -3.155 20.312 1.00 13.08 C ATOM 1990 NE2 HIS B 112 12.079 -3.557 21.081 1.00 12.45 N ATOM 1991 H HIS B 112 13.438 -2.457 25.374 1.00 0.00 H ATOM 1992 N PRO B 113 15.902 0.662 24.925 1.00 13.50 N ATOM 1993 CA PRO B 113 15.973 1.817 25.851 1.00 13.62 C ATOM 1994 C PRO B 113 14.898 2.913 25.571 1.00 13.44 C ATOM 1995 O PRO B 113 14.526 3.194 24.380 1.00 13.54 O ATOM 1996 CB PRO B 113 17.387 2.390 25.539 1.00 14.47 C ATOM 1997 CG PRO B 113 17.520 2.100 24.036 1.00 14.71 C ATOM 1998 CD PRO B 113 16.952 0.698 23.872 1.00 14.21 C ATOM 1999 N VAL B 114 14.415 3.565 26.584 1.00 13.38 N ATOM 2000 CA VAL B 114 13.470 4.662 26.505 1.00 13.46 C ATOM 2001 C VAL B 114 14.021 5.901 27.152 1.00 14.08 C ATOM 2002 O VAL B 114 14.538 5.733 28.299 1.00 14.17 O ATOM 2003 CB VAL B 114 12.173 4.272 27.195 1.00 13.00 C ATOM 2004 CG1 VAL B 114 11.209 5.438 27.304 1.00 13.33 C ATOM 2005 CG2 VAL B 114 11.569 3.141 26.542 1.00 12.55 C ATOM 2006 H VAL B 114 14.732 3.277 27.532 1.00 0.00 H ATOM 2007 N ALA B 115 14.002 7.058 26.546 1.00 14.61 N ATOM 2008 CA ALA B 115 14.528 8.307 27.109 1.00 15.35 C ATOM 2009 C ALA B 115 13.617 8.898 28.115 1.00 15.46 C ATOM 2010 O ALA B 115 14.084 9.379 29.149 1.00 19.60 O ATOM 2011 CB ALA B 115 14.820 9.297 26.063 1.00 16.02 C ATOM 2012 H ALA B 115 13.583 7.097 25.595 1.00 0.00 H ATOM 2013 N GLU B 116 12.343 9.020 27.852 1.00 15.33 N ATOM 2014 CA GLU B 116 11.373 9.692 28.733 1.00 15.71 C ATOM 2015 C GLU B 116 9.962 9.080 28.704 1.00 16.25 C ATOM 2016 O GLU B 116 9.546 8.564 27.689 1.00 14.94 O ATOM 2017 CB GLU B 116 11.280 11.225 28.379 1.00 20.07 C ATOM 2018 H GLU B 116 11.990 8.616 26.961 1.00 0.00 H ATOM 2019 N VAL B 117 9.179 9.160 29.825 1.00 15.50 N ATOM 2020 CA VAL B 117 7.817 8.722 29.993 1.00 16.81 C ATOM 2021 C VAL B 117 6.970 9.976 30.387 1.00 16.48 C ATOM 2022 O VAL B 117 7.265 10.545 31.477 1.00 17.41 O ATOM 2023 CB VAL B 117 7.677 7.644 31.140 1.00 15.55 C ATOM 2024 CG1 VAL B 117 6.209 7.317 31.249 1.00 21.32 C ATOM 2025 CG2 VAL B 117 8.499 6.409 30.734 1.00 19.08 C ATOM 2026 H VAL B 117 9.624 9.591 30.660 1.00 0.00 H ATOM 2027 N VAL B 118 5.792 10.163 29.751 1.00 17.83 N ATOM 2028 CA VAL B 118 4.806 11.267 30.082 1.00 18.07 C ATOM 2029 C VAL B 118 3.366 10.758 30.128 1.00 18.24 C ATOM 2030 O VAL B 118 2.850 10.178 29.167 1.00 17.90 O ATOM 2031 CB VAL B 118 4.854 12.346 28.962 1.00 19.17 C ATOM 2032 CG1 VAL B 118 3.956 13.525 29.288 1.00 21.27 C ATOM 2033 CG2 VAL B 118 6.282 12.855 28.750 1.00 24.32 C ATOM 2034 H VAL B 118 5.545 9.506 28.983 1.00 0.00 H ATOM 2035 N ARG B 119 2.647 10.978 31.202 1.00 18.97 N ATOM 2036 CA ARG B 119 1.241 10.639 31.319 1.00 19.45 C ATOM 2037 C ARG B 119 0.439 11.835 30.845 1.00 20.90 C ATOM 2038 O ARG B 119 0.531 12.984 31.340 1.00 22.06 O ATOM 2039 CB ARG B 119 0.939 10.341 32.802 1.00 20.49 C ATOM 2040 CG ARG B 119 -0.428 9.688 32.988 1.00 26.32 C ATOM 2041 CD ARG B 119 -0.608 9.163 34.427 1.00 32.93 C ATOM 2042 NE ARG B 119 -0.547 10.221 35.427 1.00 38.07 N ATOM 2043 CZ ARG B 119 -0.525 10.004 36.749 1.00 63.63 C ATOM 2044 NH1 ARG B 119 -0.594 8.771 37.252 1.00 76.35 N ATOM 2045 NH2 ARG B 119 -0.437 11.026 37.585 1.00 46.67 N ATOM 2046 HE ARG B 119 -0.519 11.206 35.094 1.00 0.00 H ATOM 2047 HH12 ARG B 119 -0.575 8.628 38.282 1.00 0.00 H ATOM 2048 HH11 ARG B 119 -0.667 7.953 36.614 1.00 0.00 H ATOM 2049 HH22 ARG B 119 -0.420 10.858 38.611 1.00 0.00 H ATOM 2050 HH21 ARG B 119 -0.385 11.997 37.216 1.00 0.00 H ATOM 2051 H ARG B 119 3.112 11.422 32.019 1.00 0.00 H ATOM 2052 N ILE B 120 -0.347 11.609 29.780 1.00 21.00 N ATOM 2053 CA ILE B 120 -0.980 12.757 29.127 1.00 22.47 C ATOM 2054 C ILE B 120 -1.923 13.519 30.085 1.00 24.12 C ATOM 2055 O ILE B 120 -1.929 14.736 30.123 1.00 25.45 O ATOM 2056 CB ILE B 120 -1.748 12.209 27.859 1.00 22.36 C ATOM 2057 CG1 ILE B 120 -0.738 11.723 26.813 1.00 21.12 C ATOM 2058 CG2 ILE B 120 -2.757 13.194 27.239 1.00 24.15 C ATOM 2059 CD1 ILE B 120 -1.368 11.100 25.548 1.00 21.00 C ATOM 2060 H ILE B 120 -0.502 10.643 29.428 1.00 0.00 H ATOM 2061 N ARG B 121 -2.637 12.764 30.929 1.00 24.86 N ATOM 2062 CA ARG B 121 -3.664 13.370 31.784 1.00 31.56 C ATOM 2063 C ARG B 121 -3.062 14.417 32.775 1.00 30.42 C ATOM 2064 O ARG B 121 -3.750 15.378 33.182 1.00 35.37 O ATOM 2065 CB ARG B 121 -4.454 12.264 32.534 1.00 30.96 C ATOM 2066 CG ARG B 121 -5.512 12.866 33.479 1.00 46.61 C ATOM 2067 CD ARG B 121 -6.405 11.836 34.156 1.00 44.07 C ATOM 2068 NE ARG B 121 -5.657 10.792 34.855 1.00 47.38 N ATOM 2069 CZ ARG B 121 -5.035 10.944 36.030 1.00 60.21 C ATOM 2070 NH1 ARG B 121 -5.047 12.117 36.661 1.00 71.96 N ATOM 2071 NH2 ARG B 121 -4.380 9.915 36.569 1.00 55.46 N ATOM 2072 HE ARG B 121 -5.604 9.857 34.403 1.00 0.00 H ATOM 2073 HH12 ARG B 121 -4.560 12.221 37.574 1.00 0.00 H ATOM 2074 HH11 ARG B 121 -5.544 12.928 36.241 1.00 0.00 H ATOM 2075 HH22 ARG B 121 -3.895 10.028 37.482 1.00 0.00 H ATOM 2076 HH21 ARG B 121 -4.354 8.999 36.076 1.00 0.00 H ATOM 2077 H ARG B 121 -2.462 11.740 30.979 1.00 0.00 H ATOM 2078 N THR B 122 -1.773 14.207 33.111 1.00 28.18 N ATOM 2079 CA THR B 122 -1.040 15.058 34.096 1.00 32.69 C ATOM 2080 C THR B 122 0.267 15.729 33.565 1.00 37.87 C ATOM 2081 O THR B 122 1.035 16.290 34.353 1.00 46.85 O ATOM 2082 CB THR B 122 -0.689 14.203 35.347 1.00 32.10 C ATOM 2083 OG1 THR B 122 0.104 13.089 34.959 1.00 32.84 O ATOM 2084 CG2 THR B 122 -1.988 13.709 36.048 1.00 32.89 C ATOM 2085 HG1 THR B 122 0.325 12.548 35.758 1.00 0.00 H ATOM 2086 H THR B 122 -1.266 13.417 32.664 1.00 0.00 H ATOM 2087 N ALA B 123 0.500 15.709 32.247 1.00 38.58 N ATOM 2088 CA ALA B 123 1.663 16.418 31.626 1.00 45.26 C ATOM 2089 C ALA B 123 1.765 17.911 32.011 1.00 50.59 C ATOM 2090 O ALA B 123 0.750 18.619 32.035 1.00 71.28 O ATOM 2091 CB ALA B 123 1.607 16.263 30.102 1.00 38.77 C ATOM 2092 H ALA B 123 -0.151 15.181 31.631 1.00 0.00 H ATOM 2093 N GLU B 124 2.983 18.382 32.316 1.00 71.39 N ATOM 2094 CA GLU B 124 3.195 19.753 32.829 1.00 67.75 C ATOM 2095 C GLU B 124 3.135 20.783 31.708 1.00 63.66 C ATOM 2096 O GLU B 124 2.670 21.905 31.908 1.00 85.76 O ATOM 2097 CB GLU B 124 4.543 19.866 33.553 1.00 58.92 C ATOM 2098 H GLU B 124 3.808 17.761 32.187 1.00 0.00 H TER 2099 GLU B 124 ATOM 2100 N GLN C 7 10.325 19.947 30.033 1.00 51.71 N ATOM 2101 CA GLN C 7 11.794 19.930 29.722 1.00 65.41 C ATOM 2102 C GLN C 7 12.293 18.482 29.750 1.00 68.00 C ATOM 2103 O GLN C 7 12.708 17.976 30.782 1.00 53.23 O ATOM 2104 CB GLN C 7 12.583 20.812 30.701 1.00 50.41 C ATOM 2105 HN3 GLN C 7 10.167 19.539 30.977 1.00 0.00 H ATOM 2106 HN2 GLN C 7 9.815 19.386 29.321 1.00 0.00 H ATOM 2107 HN1 GLN C 7 9.980 20.928 30.016 1.00 0.00 H ATOM 2108 N CYS C 8 12.226 17.802 28.613 1.00 42.18 N ATOM 2109 CA CYS C 8 12.580 16.386 28.567 1.00 33.49 C ATOM 2110 C CYS C 8 14.075 16.197 28.834 1.00 41.61 C ATOM 2111 O CYS C 8 14.912 16.943 28.300 1.00 38.85 O ATOM 2112 CB CYS C 8 12.211 15.759 27.222 1.00 24.98 C ATOM 2113 SG CYS C 8 10.427 15.807 26.796 1.00 42.34 S ATOM 2114 H CYS C 8 11.918 18.283 27.744 1.00 0.00 H ATOM 2115 N ASP C 9 14.389 15.216 29.688 1.00 42.59 N ATOM 2116 CA ASP C 9 15.760 14.965 30.141 1.00 31.68 C ATOM 2117 C ASP C 9 16.361 13.937 29.166 1.00 32.88 C ATOM 2118 O ASP C 9 16.014 12.729 29.197 1.00 30.91 O ATOM 2119 CB ASP C 9 15.816 14.497 31.609 1.00 37.45 C ATOM 2120 CG ASP C 9 17.219 14.450 32.124 1.00 63.16 C ATOM 2121 OD1 ASP C 9 18.097 14.289 31.266 1.00 34.67 O ATOM 2122 OD2 ASP C 9 17.479 14.597 33.341 1.00 44.70 O ATOM 2123 H ASP C 9 13.627 14.605 30.046 1.00 0.00 H ATOM 2124 N LEU C 10 17.177 14.437 28.221 1.00 28.58 N ATOM 2125 CA LEU C 10 17.770 13.572 27.180 1.00 23.53 C ATOM 2126 C LEU C 10 19.235 13.372 27.419 1.00 29.72 C ATOM 2127 O LEU C 10 19.956 12.960 26.516 1.00 32.43 O ATOM 2128 CB LEU C 10 17.560 14.123 25.763 1.00 23.07 C ATOM 2129 CG LEU C 10 16.156 14.451 25.405 1.00 19.90 C ATOM 2130 CD1 LEU C 10 15.959 14.986 23.992 1.00 27.62 C ATOM 2131 CD2 LEU C 10 15.314 13.193 25.488 1.00 21.12 C ATOM 2132 H LEU C 10 17.395 15.454 28.223 1.00 0.00 H ATOM 2133 N SER C 11 19.672 13.658 28.632 1.00 33.19 N ATOM 2134 CA SER C 11 21.071 13.646 28.941 1.00 30.79 C ATOM 2135 C SER C 11 21.740 12.266 29.014 1.00 27.73 C ATOM 2136 O SER C 11 22.952 12.240 28.933 1.00 28.73 O ATOM 2137 CB SER C 11 21.373 14.428 30.219 1.00 44.69 C ATOM 2138 OG SER C 11 20.760 13.783 31.296 1.00 33.98 O ATOM 2139 HG SER C 11 19.782 13.749 31.146 1.00 0.00 H ATOM 2140 H SER C 11 18.987 13.897 29.378 1.00 0.00 H ATOM 2141 N ALA C 12 20.990 11.152 29.053 1.00 28.60 N ATOM 2142 CA ALA C 12 21.639 9.820 28.942 1.00 30.92 C ATOM 2143 C ALA C 12 21.890 9.460 27.502 1.00 24.82 C ATOM 2144 O ALA C 12 22.326 8.336 27.218 1.00 27.89 O ATOM 2145 CB ALA C 12 20.791 8.698 29.543 1.00 26.25 C ATOM 2146 H ALA C 12 19.958 11.222 29.161 1.00 0.00 H ATOM 2147 N PHE C 13 21.615 10.387 26.581 1.00 21.52 N ATOM 2148 CA PHE C 13 21.764 10.096 25.153 1.00 20.69 C ATOM 2149 C PHE C 13 22.695 11.114 24.459 1.00 21.43 C ATOM 2150 O PHE C 13 22.335 11.645 23.408 1.00 20.86 O ATOM 2151 CB PHE C 13 20.407 9.995 24.469 1.00 19.48 C ATOM 2152 CG PHE C 13 19.549 8.916 25.045 1.00 18.87 C ATOM 2153 CD1 PHE C 13 19.810 7.631 24.716 1.00 20.69 C ATOM 2154 CD2 PHE C 13 18.717 9.187 26.101 1.00 25.89 C ATOM 2155 CE1 PHE C 13 19.054 6.609 25.278 1.00 21.38 C ATOM 2156 CE2 PHE C 13 18.029 8.157 26.732 1.00 24.15 C ATOM 2157 CZ PHE C 13 18.173 6.890 26.256 1.00 18.72 C ATOM 2158 H PHE C 13 21.291 11.328 26.882 1.00 0.00 H ATOM 2159 N PRO C 14 23.909 11.247 24.944 1.00 22.76 N ATOM 2160 CA PRO C 14 24.769 12.226 24.330 1.00 23.64 C ATOM 2161 C PRO C 14 25.055 11.818 22.912 1.00 23.08 C ATOM 2162 O PRO C 14 25.299 10.647 22.591 1.00 23.46 O ATOM 2163 CB PRO C 14 25.989 12.238 25.206 1.00 26.49 C ATOM 2164 CG PRO C 14 25.993 10.924 25.906 1.00 28.14 C ATOM 2165 CD PRO C 14 24.557 10.574 26.079 1.00 23.70 C ATOM 2166 N GLY C 15 25.075 12.779 22.048 1.00 23.25 N ATOM 2167 CA GLY C 15 25.454 12.409 20.699 1.00 23.00 C ATOM 2168 C GLY C 15 24.320 11.969 19.841 1.00 21.53 C ATOM 2169 O GLY C 15 24.441 11.891 18.584 1.00 21.55 O ATOM 2170 H GLY C 15 24.834 13.758 22.305 1.00 0.00 H ATOM 2171 N VAL C 16 23.153 11.603 20.421 1.00 20.48 N ATOM 2172 CA VAL C 16 21.990 11.159 19.631 1.00 19.16 C ATOM 2173 C VAL C 16 21.250 12.370 19.017 1.00 19.00 C ATOM 2174 O VAL C 16 20.962 13.364 19.720 1.00 19.77 O ATOM 2175 CB VAL C 16 21.038 10.343 20.519 1.00 18.33 C ATOM 2176 CG1 VAL C 16 19.765 10.038 19.747 1.00 17.13 C ATOM 2177 CG2 VAL C 16 21.778 9.118 21.071 1.00 18.63 C ATOM 2178 H VAL C 16 23.074 11.636 21.457 1.00 0.00 H ATOM 2179 N LYS C 17 21.085 12.362 17.728 1.00 18.71 N ATOM 2180 CA LYS C 17 20.518 13.515 16.984 1.00 18.81 C ATOM 2181 C LYS C 17 19.009 13.541 16.821 1.00 17.73 C ATOM 2182 O LYS C 17 18.449 14.609 16.689 1.00 18.55 O ATOM 2183 CB LYS C 17 21.185 13.536 15.606 1.00 19.34 C ATOM 2184 CG LYS C 17 22.679 13.776 15.724 1.00 21.90 C ATOM 2185 CD LYS C 17 23.253 14.170 14.392 1.00 33.95 C ATOM 2186 CE LYS C 17 24.746 14.416 14.522 1.00 36.12 C ATOM 2187 NZ LYS C 17 25.468 13.725 13.428 1.00 36.89 N ATOM 2188 HZ1 LYS C 17 25.282 12.703 13.483 1.00 0.00 H ATOM 2189 HZ2 LYS C 17 25.138 14.090 12.512 1.00 0.00 H ATOM 2190 HZ3 LYS C 17 26.489 13.898 13.524 1.00 0.00 H ATOM 2191 H LYS C 17 21.362 11.513 17.195 1.00 0.00 H ATOM 2192 N PHE C 18 18.391 12.363 16.774 1.00 16.74 N ATOM 2193 CA PHE C 18 16.977 12.141 16.509 1.00 15.76 C ATOM 2194 C PHE C 18 16.366 11.335 17.611 1.00 15.14 C ATOM 2195 O PHE C 18 16.935 10.406 18.147 1.00 15.19 O ATOM 2196 CB PHE C 18 16.796 11.370 15.172 1.00 16.91 C ATOM 2197 CG PHE C 18 17.297 12.116 14.031 1.00 20.97 C ATOM 2198 CD1 PHE C 18 16.505 13.126 13.430 1.00 24.89 C ATOM 2199 CD2 PHE C 18 18.567 11.893 13.593 1.00 21.94 C ATOM 2200 CE1 PHE C 18 17.007 13.865 12.352 1.00 45.88 C ATOM 2201 CE2 PHE C 18 19.093 12.642 12.519 1.00 30.79 C ATOM 2202 CZ PHE C 18 18.307 13.616 11.914 1.00 42.13 C ATOM 2203 H PHE C 18 18.975 11.519 16.943 1.00 0.00 H ATOM 2204 N PHE C 19 15.097 11.675 17.810 1.00 14.61 N ATOM 2205 CA PHE C 19 14.302 10.993 18.823 1.00 14.11 C ATOM 2206 C PHE C 19 12.915 10.708 18.227 1.00 13.32 C ATOM 2207 O PHE C 19 12.437 11.491 17.405 1.00 13.30 O ATOM 2208 CB PHE C 19 14.179 11.822 20.128 1.00 14.59 C ATOM 2209 CG PHE C 19 15.491 11.933 20.863 1.00 15.48 C ATOM 2210 CD1 PHE C 19 16.422 12.884 20.522 1.00 16.29 C ATOM 2211 CD2 PHE C 19 15.750 11.058 21.899 1.00 15.64 C ATOM 2212 CE1 PHE C 19 17.633 12.943 21.247 1.00 17.25 C ATOM 2213 CE2 PHE C 19 16.953 11.082 22.566 1.00 16.56 C ATOM 2214 CZ PHE C 19 17.876 12.023 22.266 1.00 17.35 C ATOM 2215 H PHE C 19 14.669 12.432 17.240 1.00 0.00 H ATOM 2216 N ARG C 20 12.311 9.668 18.724 1.00 12.88 N ATOM 2217 CA ARG C 20 10.974 9.250 18.354 1.00 12.27 C ATOM 2218 C ARG C 20 10.039 9.525 19.479 1.00 12.25 C ATOM 2219 O ARG C 20 10.194 8.972 20.572 1.00 12.45 O ATOM 2220 CB ARG C 20 10.968 7.796 18.049 1.00 11.97 C ATOM 2221 CG ARG C 20 9.642 7.231 17.669 1.00 11.50 C ATOM 2222 CD ARG C 20 9.746 5.827 17.211 1.00 11.37 C ATOM 2223 NE ARG C 20 10.306 4.948 18.182 1.00 11.61 N ATOM 2224 CZ ARG C 20 9.665 4.078 18.974 1.00 11.64 C ATOM 2225 NH1 ARG C 20 8.381 4.001 18.930 1.00 11.84 N ATOM 2226 NH2 ARG C 20 10.355 3.236 19.709 1.00 13.54 N ATOM 2227 HE ARG C 20 11.340 4.986 18.289 1.00 0.00 H ATOM 2228 HH12 ARG C 20 7.879 3.327 19.543 1.00 0.00 H ATOM 2229 HH11 ARG C 20 7.845 4.613 18.282 1.00 0.00 H ATOM 2230 HH22 ARG C 20 9.862 2.559 20.325 1.00 0.00 H ATOM 2231 HH21 ARG C 20 11.394 3.247 19.675 1.00 0.00 H ATOM 2232 H ARG C 20 12.820 9.101 19.432 1.00 0.00 H ATOM 2233 N ILE C 21 9.001 10.289 19.209 1.00 12.09 N ATOM 2234 CA ILE C 21 7.904 10.597 20.104 1.00 12.10 C ATOM 2235 C ILE C 21 6.833 9.620 19.798 1.00 11.65 C ATOM 2236 O ILE C 21 6.330 9.614 18.684 1.00 11.36 O ATOM 2237 CB ILE C 21 7.473 12.044 20.016 1.00 12.36 C ATOM 2238 CG1 ILE C 21 8.600 12.986 20.418 1.00 13.51 C ATOM 2239 CG2 ILE C 21 6.281 12.227 20.870 1.00 12.41 C ATOM 2240 CD1 ILE C 21 8.440 14.385 19.926 1.00 20.34 C ATOM 2241 H ILE C 21 8.965 10.713 18.260 1.00 0.00 H ATOM 2242 N GLU C 22 6.444 8.800 20.707 1.00 11.71 N ATOM 2243 CA GLU C 22 5.433 7.794 20.568 1.00 11.48 C ATOM 2244 C GLU C 22 4.308 8.200 21.517 1.00 11.74 C ATOM 2245 O GLU C 22 4.470 8.254 22.741 1.00 12.21 O ATOM 2246 CB GLU C 22 5.939 6.414 21.013 1.00 11.61 C ATOM 2247 CG GLU C 22 4.860 5.343 20.880 1.00 11.55 C ATOM 2248 CD GLU C 22 5.340 3.994 21.429 1.00 13.41 C ATOM 2249 OE1 GLU C 22 6.273 3.961 22.300 1.00 14.15 O ATOM 2250 OE2 GLU C 22 4.863 2.944 20.988 1.00 17.89 O ATOM 2251 H GLU C 22 6.908 8.873 21.635 1.00 0.00 H ATOM 2252 N ALA C 23 3.076 8.427 20.986 1.00 11.58 N ATOM 2253 CA ALA C 23 1.882 8.777 21.816 1.00 11.92 C ATOM 2254 C ALA C 23 0.807 7.767 21.545 1.00 11.90 C ATOM 2255 O ALA C 23 0.537 7.436 20.351 1.00 11.57 O ATOM 2256 CB ALA C 23 1.425 10.159 21.457 1.00 11.95 C ATOM 2257 H ALA C 23 2.959 8.354 19.955 1.00 0.00 H ATOM 2258 N ILE C 24 0.202 7.274 22.542 1.00 12.36 N ATOM 2259 CA ILE C 24 -0.892 6.315 22.529 1.00 12.61 C ATOM 2260 C ILE C 24 -2.017 6.967 23.218 1.00 13.10 C ATOM 2261 O ILE C 24 -1.917 7.269 24.452 1.00 13.65 O ATOM 2262 CB ILE C 24 -0.464 4.970 23.159 1.00 12.96 C ATOM 2263 CG1 ILE C 24 0.807 4.421 22.429 1.00 13.55 C ATOM 2264 CG2 ILE C 24 -1.685 4.075 23.192 1.00 13.43 C ATOM 2265 CD1 ILE C 24 1.481 3.331 23.146 1.00 14.94 C ATOM 2266 H ILE C 24 0.524 7.591 23.479 1.00 0.00 H ATOM 2267 N PHE C 25 -3.167 7.156 22.588 1.00 13.12 N ATOM 2268 CA PHE C 25 -4.231 7.986 23.104 1.00 13.60 C ATOM 2269 C PHE C 25 -5.613 7.575 22.558 1.00 13.89 C ATOM 2270 O PHE C 25 -5.700 6.612 21.758 1.00 13.73 O ATOM 2271 CB PHE C 25 -3.903 9.466 22.817 1.00 13.35 C ATOM 2272 CG PHE C 25 -3.609 9.740 21.360 1.00 12.75 C ATOM 2273 CD1 PHE C 25 -4.624 9.858 20.412 1.00 12.78 C ATOM 2274 CD2 PHE C 25 -2.333 9.899 20.900 1.00 12.30 C ATOM 2275 CE1 PHE C 25 -4.306 10.123 19.086 1.00 12.41 C ATOM 2276 CE2 PHE C 25 -2.064 10.161 19.574 1.00 11.93 C ATOM 2277 CZ PHE C 25 -3.060 10.242 18.657 1.00 12.00 C ATOM 2278 H PHE C 25 -3.311 6.682 21.674 1.00 0.00 H ATOM 2279 N ARG C 26 -6.671 8.213 23.062 1.00 14.47 N ATOM 2280 CA ARG C 26 -8.023 7.900 22.649 1.00 14.93 C ATOM 2281 C ARG C 26 -8.163 8.136 21.111 1.00 14.43 C ATOM 2282 O ARG C 26 -7.885 9.200 20.685 1.00 14.11 O ATOM 2283 CB ARG C 26 -9.009 8.765 23.444 1.00 15.68 C ATOM 2284 CG ARG C 26 -8.944 8.538 24.948 1.00 16.40 C ATOM 2285 CD ARG C 26 -9.695 9.639 25.617 1.00 17.07 C ATOM 2286 NE ARG C 26 -9.460 9.691 27.070 1.00 17.84 N ATOM 2287 CZ ARG C 26 -10.067 8.942 27.985 1.00 26.84 C ATOM 2288 NH1 ARG C 26 -10.973 7.982 27.695 1.00 22.12 N ATOM 2289 NH2 ARG C 26 -9.801 9.188 29.262 1.00 24.94 N ATOM 2290 HE ARG C 26 -8.755 10.376 27.411 1.00 0.00 H ATOM 2291 HH12 ARG C 26 -11.411 7.432 28.461 1.00 0.00 H ATOM 2292 HH11 ARG C 26 -11.232 7.794 26.706 1.00 0.00 H ATOM 2293 HH22 ARG C 26 -10.257 8.623 30.006 1.00 0.00 H ATOM 2294 HH21 ARG C 26 -9.137 9.946 29.518 1.00 0.00 H ATOM 2295 H ARG C 26 -6.520 8.957 23.773 1.00 0.00 H ATOM 2296 N PRO C 27 -8.817 7.174 20.452 1.00 14.67 N ATOM 2297 CA PRO C 27 -8.976 7.380 18.980 1.00 14.38 C ATOM 2298 C PRO C 27 -9.720 8.626 18.557 1.00 14.60 C ATOM 2299 O PRO C 27 -9.345 9.181 17.545 1.00 14.25 O ATOM 2300 CB PRO C 27 -9.763 6.118 18.567 1.00 14.93 C ATOM 2301 CG PRO C 27 -9.184 5.063 19.531 1.00 15.01 C ATOM 2302 CD PRO C 27 -9.206 5.830 20.833 1.00 15.21 C ATOM 2303 N TRP C 28 -10.690 9.085 19.300 1.00 15.24 N ATOM 2304 CA TRP C 28 -11.425 10.256 18.877 1.00 15.55 C ATOM 2305 C TRP C 28 -10.605 11.529 18.834 1.00 15.11 C ATOM 2306 O TRP C 28 -10.988 12.529 18.256 1.00 15.33 O ATOM 2307 CB TRP C 28 -12.735 10.406 19.723 1.00 16.51 C ATOM 2308 CG TRP C 28 -12.682 11.128 21.000 1.00 17.19 C ATOM 2309 CD1 TRP C 28 -12.514 10.618 22.280 1.00 19.77 C ATOM 2310 CD2 TRP C 28 -12.982 12.520 21.183 1.00 17.59 C ATOM 2311 NE1 TRP C 28 -12.542 11.626 23.175 1.00 26.05 N ATOM 2312 CE2 TRP C 28 -12.880 12.795 22.529 1.00 18.52 C ATOM 2313 CE3 TRP C 28 -13.290 13.562 20.291 1.00 18.46 C ATOM 2314 CZ2 TRP C 28 -13.132 14.061 23.054 1.00 21.89 C ATOM 2315 CZ3 TRP C 28 -13.571 14.804 20.787 1.00 19.02 C ATOM 2316 CH2 TRP C 28 -13.485 15.054 22.158 1.00 20.56 C ATOM 2317 HE1 TRP C 28 -12.341 11.535 24.191 1.00 0.00 H ATOM 2318 H TRP C 28 -10.933 8.610 20.193 1.00 0.00 H ATOM 2319 N ARG C 29 -9.456 11.493 19.530 1.00 14.63 N ATOM 2320 CA ARG C 29 -8.557 12.659 19.554 1.00 14.33 C ATOM 2321 C ARG C 29 -7.600 12.708 18.347 1.00 13.75 C ATOM 2322 O ARG C 29 -6.962 13.719 18.103 1.00 13.66 O ATOM 2323 CB ARG C 29 -7.700 12.687 20.835 1.00 14.26 C ATOM 2324 CG ARG C 29 -8.480 12.584 22.144 1.00 14.97 C ATOM 2325 CD ARG C 29 -9.428 13.767 22.260 1.00 15.60 C ATOM 2326 NE ARG C 29 -8.786 15.105 22.153 1.00 15.54 N ATOM 2327 CZ ARG C 29 -9.340 16.261 21.795 1.00 15.95 C ATOM 2328 NH1 ARG C 29 -10.637 16.295 21.527 1.00 18.71 N ATOM 2329 NH2 ARG C 29 -8.705 17.386 21.775 1.00 16.03 N ATOM 2330 HE ARG C 29 -7.774 15.142 22.388 1.00 0.00 H ATOM 2331 HH12 ARG C 29 -11.087 17.190 21.246 1.00 0.00 H ATOM 2332 HH11 ARG C 29 -11.206 15.427 21.598 1.00 0.00 H ATOM 2333 HH22 ARG C 29 -9.196 18.255 21.485 1.00 0.00 H ATOM 2334 HH21 ARG C 29 -7.702 17.422 22.049 1.00 0.00 H ATOM 2335 H ARG C 29 -9.199 10.634 20.057 1.00 0.00 H ATOM 2336 N LEU C 30 -7.580 11.629 17.546 1.00 13.52 N ATOM 2337 CA LEU C 30 -6.651 11.612 16.410 1.00 13.10 C ATOM 2338 C LEU C 30 -6.743 12.806 15.487 1.00 13.35 C ATOM 2339 O LEU C 30 -5.718 13.360 15.144 1.00 13.13 O ATOM 2340 CB LEU C 30 -6.662 10.273 15.707 1.00 12.99 C ATOM 2341 CG LEU C 30 -5.639 10.110 14.590 1.00 12.65 C ATOM 2342 CD1 LEU C 30 -4.217 10.153 15.129 1.00 12.15 C ATOM 2343 CD2 LEU C 30 -5.938 8.801 13.859 1.00 13.75 C ATOM 2344 H LEU C 30 -8.210 10.822 17.728 1.00 0.00 H ATOM 2345 N PRO C 31 -7.964 13.129 14.977 1.00 13.93 N ATOM 2346 CA PRO C 31 -8.008 14.283 14.052 1.00 14.31 C ATOM 2347 C PRO C 31 -7.404 15.541 14.659 1.00 14.35 C ATOM 2348 O PRO C 31 -6.723 16.283 13.920 1.00 14.47 O ATOM 2349 CB PRO C 31 -9.475 14.476 13.756 1.00 15.05 C ATOM 2350 CG PRO C 31 -10.031 13.114 14.042 1.00 14.99 C ATOM 2351 CD PRO C 31 -9.284 12.518 15.162 1.00 14.40 C ATOM 2352 N PHE C 32 -7.642 15.803 15.938 1.00 14.41 N ATOM 2353 CA PHE C 32 -7.184 17.031 16.546 1.00 14.65 C ATOM 2354 C PHE C 32 -5.670 17.023 16.746 1.00 14.17 C ATOM 2355 O PHE C 32 -5.031 18.054 16.532 1.00 14.44 O ATOM 2356 CB PHE C 32 -7.872 17.369 17.799 1.00 15.03 C ATOM 2357 CG PHE C 32 -7.493 18.698 18.314 1.00 15.47 C ATOM 2358 CD1 PHE C 32 -7.749 19.913 17.654 1.00 16.09 C ATOM 2359 CD2 PHE C 32 -6.860 18.773 19.534 1.00 15.43 C ATOM 2360 CE1 PHE C 32 -7.386 21.139 18.252 1.00 16.64 C ATOM 2361 CE2 PHE C 32 -6.465 19.967 20.078 1.00 15.96 C ATOM 2362 CZ PHE C 32 -6.718 21.162 19.430 1.00 17.39 C ATOM 2363 H PHE C 32 -8.167 15.113 16.512 1.00 0.00 H ATOM 2364 N VAL C 33 -5.147 15.858 17.119 1.00 13.61 N ATOM 2365 CA VAL C 33 -3.696 15.739 17.289 1.00 13.22 C ATOM 2366 C VAL C 33 -2.996 15.986 15.924 1.00 13.19 C ATOM 2367 O VAL C 33 -2.059 16.743 15.825 1.00 13.35 O ATOM 2368 CB VAL C 33 -3.317 14.376 17.875 1.00 12.75 C ATOM 2369 CG1 VAL C 33 -1.848 14.203 17.913 1.00 12.43 C ATOM 2370 CG2 VAL C 33 -3.941 14.185 19.268 1.00 13.00 C ATOM 2371 H VAL C 33 -5.763 15.038 17.289 1.00 0.00 H ATOM 2372 N ILE C 34 -3.561 15.364 14.882 1.00 13.16 N ATOM 2373 CA ILE C 34 -2.994 15.509 13.567 1.00 13.29 C ATOM 2374 C ILE C 34 -3.089 16.958 13.095 1.00 13.99 C ATOM 2375 O ILE C 34 -2.064 17.520 12.562 1.00 14.23 O ATOM 2376 CB ILE C 34 -3.658 14.463 12.585 1.00 13.28 C ATOM 2377 CG1 ILE C 34 -2.934 13.116 12.738 1.00 12.69 C ATOM 2378 CG2 ILE C 34 -3.688 14.981 11.161 1.00 13.86 C ATOM 2379 CD1 ILE C 34 -3.642 11.930 12.116 1.00 12.73 C ATOM 2380 H ILE C 34 -4.408 14.777 15.022 1.00 0.00 H ATOM 2381 N ASP C 35 -4.250 17.580 13.317 1.00 14.45 N ATOM 2382 CA ASP C 35 -4.442 18.955 12.929 1.00 15.25 C ATOM 2383 C ASP C 35 -3.383 19.857 13.608 1.00 15.39 C ATOM 2384 O ASP C 35 -2.801 20.701 12.983 1.00 15.96 O ATOM 2385 CB ASP C 35 -5.887 19.462 13.195 1.00 15.78 C ATOM 2386 CG ASP C 35 -6.103 20.821 12.658 1.00 18.80 C ATOM 2387 OD1 ASP C 35 -6.024 20.946 11.429 1.00 23.32 O ATOM 2388 OD2 ASP C 35 -6.281 21.821 13.396 1.00 26.96 O ATOM 2389 H ASP C 35 -5.027 17.064 13.777 1.00 0.00 H ATOM 2390 N THR C 36 -3.244 19.678 14.919 1.00 15.04 N ATOM 2391 CA THR C 36 -2.282 20.476 15.665 1.00 15.29 C ATOM 2392 C THR C 36 -0.837 20.357 15.144 1.00 15.18 C ATOM 2393 O THR C 36 -0.190 21.371 14.938 1.00 15.84 O ATOM 2394 CB THR C 36 -2.442 20.073 17.147 1.00 15.00 C ATOM 2395 OG1 THR C 36 -3.727 20.448 17.613 1.00 15.39 O ATOM 2396 CG2 THR C 36 -1.360 20.686 17.964 1.00 15.29 C ATOM 2397 HG1 THR C 36 -4.419 19.990 17.073 1.00 0.00 H ATOM 2398 H THR C 36 -3.823 18.968 15.411 1.00 0.00 H ATOM 2399 N LEU C 37 -0.415 19.111 14.933 1.00 14.46 N ATOM 2400 CA LEU C 37 0.925 18.873 14.413 1.00 14.38 C ATOM 2401 C LEU C 37 1.088 19.404 12.965 1.00 14.99 C ATOM 2402 O LEU C 37 2.130 19.996 12.699 1.00 15.48 O ATOM 2403 CB LEU C 37 1.262 17.403 14.465 1.00 13.59 C ATOM 2404 CG LEU C 37 1.347 16.794 15.840 1.00 13.16 C ATOM 2405 CD1 LEU C 37 1.308 15.261 15.675 1.00 14.11 C ATOM 2406 CD2 LEU C 37 2.554 17.275 16.512 1.00 13.85 C ATOM 2407 H LEU C 37 -1.043 18.308 15.140 1.00 0.00 H ATOM 2408 N SER C 38 0.104 19.185 12.122 1.00 15.09 N ATOM 2409 CA SER C 38 0.110 19.737 10.752 1.00 15.89 C ATOM 2410 C SER C 38 0.277 21.258 10.808 1.00 16.87 C ATOM 2411 O SER C 38 1.085 21.869 10.080 1.00 17.64 O ATOM 2412 CB SER C 38 -1.260 19.448 10.099 1.00 16.29 C ATOM 2413 OG SER C 38 -1.329 20.141 8.900 1.00 21.24 O ATOM 2414 HG SER C 38 -2.203 19.966 8.469 1.00 0.00 H ATOM 2415 H SER C 38 -0.703 18.606 12.429 1.00 0.00 H ATOM 2416 N LYS C 39 -0.533 21.934 11.636 1.00 17.04 N ATOM 2417 CA LYS C 39 -0.508 23.408 11.674 1.00 18.13 C ATOM 2418 C LYS C 39 0.799 23.928 12.222 1.00 18.41 C ATOM 2419 O LYS C 39 1.362 24.947 11.758 1.00 19.47 O ATOM 2420 CB LYS C 39 -1.700 23.966 12.456 1.00 18.32 C ATOM 2421 CG LYS C 39 -2.928 23.700 11.658 1.00 22.91 C ATOM 2422 CD LYS C 39 -4.131 24.285 12.336 1.00 25.05 C ATOM 2423 CE LYS C 39 -5.325 24.321 11.369 1.00 30.48 C ATOM 2424 NZ LYS C 39 -6.515 24.405 12.256 1.00 37.25 N ATOM 2425 HZ1 LYS C 39 -6.542 23.572 12.878 1.00 0.00 H ATOM 2426 HZ2 LYS C 39 -6.455 25.268 12.833 1.00 0.00 H ATOM 2427 HZ3 LYS C 39 -7.377 24.434 11.675 1.00 0.00 H ATOM 2428 H LYS C 39 -1.185 21.414 12.257 1.00 0.00 H ATOM 2429 N TYR C 40 1.331 23.189 13.164 1.00 17.58 N ATOM 2430 CA TYR C 40 2.591 23.610 13.692 1.00 17.92 C ATOM 2431 C TYR C 40 3.781 23.401 12.713 1.00 18.19 C ATOM 2432 O TYR C 40 4.793 24.123 12.838 1.00 19.97 O ATOM 2433 CB TYR C 40 2.736 22.925 15.052 1.00 17.14 C ATOM 2434 CG TYR C 40 3.991 23.206 15.756 1.00 18.29 C ATOM 2435 CD1 TYR C 40 4.143 24.369 16.475 1.00 19.93 C ATOM 2436 CD2 TYR C 40 5.072 22.347 15.631 1.00 17.89 C ATOM 2437 CE1 TYR C 40 5.393 24.662 17.099 1.00 20.12 C ATOM 2438 CE2 TYR C 40 6.299 22.610 16.277 1.00 21.58 C ATOM 2439 CZ TYR C 40 6.423 23.760 16.967 1.00 19.19 C ATOM 2440 OH TYR C 40 7.642 23.963 17.582 1.00 35.77 O ATOM 2441 HH TYR C 40 7.629 24.831 18.059 1.00 0.00 H ATOM 2442 H TYR C 40 0.856 22.332 13.513 1.00 0.00 H ATOM 2443 N GLY C 41 3.630 22.420 11.798 1.00 18.88 N ATOM 2444 CA GLY C 41 4.585 22.169 10.672 1.00 18.46 C ATOM 2445 C GLY C 41 5.425 20.907 10.696 1.00 18.20 C ATOM 2446 O GLY C 41 6.525 20.836 10.170 1.00 20.99 O ATOM 2447 H GLY C 41 2.799 21.800 11.880 1.00 0.00 H ATOM 2448 N ILE C 42 4.897 19.869 11.369 1.00 17.87 N ATOM 2449 CA ILE C 42 5.536 18.581 11.470 1.00 18.42 C ATOM 2450 C ILE C 42 5.947 17.966 10.166 1.00 19.43 C ATOM 2451 O ILE C 42 5.191 18.083 9.244 1.00 24.30 O ATOM 2452 CB ILE C 42 4.595 17.620 12.168 1.00 19.75 C ATOM 2453 CG1 ILE C 42 5.327 16.586 12.934 1.00 20.70 C ATOM 2454 CG2 ILE C 42 3.608 16.971 11.231 1.00 26.28 C ATOM 2455 CD1 ILE C 42 6.044 17.210 14.104 1.00 23.89 C ATOM 2456 H ILE C 42 3.980 20.003 11.841 1.00 0.00 H ATOM 2457 N ARG C 43 7.119 17.355 10.118 1.00 20.26 N ATOM 2458 CA ARG C 43 7.795 16.919 8.872 1.00 28.17 C ATOM 2459 C ARG C 43 7.553 15.413 8.605 1.00 17.09 C ATOM 2460 O ARG C 43 8.054 14.885 7.619 1.00 19.53 O ATOM 2461 CB ARG C 43 9.319 17.152 9.023 1.00 29.16 C ATOM 2462 CG ARG C 43 9.717 18.559 9.477 1.00 38.83 C ATOM 2463 CD ARG C 43 10.191 19.416 8.340 1.00 39.06 C ATOM 2464 NE ARG C 43 11.283 18.739 7.635 1.00 48.85 N ATOM 2465 CZ ARG C 43 11.628 18.984 6.379 1.00 43.60 C ATOM 2466 NH1 ARG C 43 10.970 19.895 5.682 1.00 51.81 N ATOM 2467 NH2 ARG C 43 12.624 18.298 5.822 1.00 41.15 N ATOM 2468 HE ARG C 43 11.823 18.018 8.155 1.00 0.00 H ATOM 2469 HH12 ARG C 43 11.238 20.089 4.696 1.00 0.00 H ATOM 2470 HH11 ARG C 43 10.184 20.417 6.120 1.00 0.00 H ATOM 2471 HH22 ARG C 43 12.898 18.487 4.837 1.00 0.00 H ATOM 2472 HH21 ARG C 43 13.128 17.573 6.372 1.00 0.00 H ATOM 2473 H ARG C 43 7.602 17.167 11.020 1.00 0.00 H ATOM 2474 N GLY C 44 6.702 14.754 9.408 1.00 14.51 N ATOM 2475 CA GLY C 44 6.426 13.376 9.246 1.00 13.73 C ATOM 2476 C GLY C 44 5.847 12.700 10.453 1.00 12.91 C ATOM 2477 O GLY C 44 6.066 13.178 11.548 1.00 12.77 O ATOM 2478 H GLY C 44 6.230 15.274 10.175 1.00 0.00 H ATOM 2479 N LEU C 45 4.970 11.719 10.244 1.00 12.55 N ATOM 2480 CA LEU C 45 4.471 10.891 11.371 1.00 11.92 C ATOM 2481 C LEU C 45 3.971 9.548 10.849 1.00 11.75 C ATOM 2482 O LEU C 45 3.583 9.458 9.630 1.00 12.14 O ATOM 2483 CB LEU C 45 3.493 11.633 12.160 1.00 11.85 C ATOM 2484 CG LEU C 45 2.370 12.327 11.490 1.00 12.21 C ATOM 2485 CD1 LEU C 45 1.307 11.402 10.917 1.00 12.32 C ATOM 2486 CD2 LEU C 45 1.630 13.412 12.310 1.00 15.41 C ATOM 2487 H LEU C 45 4.631 11.531 9.279 1.00 0.00 H ATOM 2488 N THR C 46 3.784 8.560 11.692 1.00 11.35 N ATOM 2489 CA THR C 46 3.225 7.283 11.343 1.00 11.31 C ATOM 2490 C THR C 46 2.141 6.912 12.315 1.00 11.12 C ATOM 2491 O THR C 46 2.378 7.028 13.542 1.00 10.90 O ATOM 2492 CB THR C 46 4.354 6.233 11.386 1.00 11.23 C ATOM 2493 OG1 THR C 46 5.331 6.614 10.394 1.00 11.56 O ATOM 2494 CG2 THR C 46 3.765 4.865 11.083 1.00 11.31 C ATOM 2495 HG1 THR C 46 6.073 5.959 10.395 1.00 0.00 H ATOM 2496 H THR C 46 4.060 8.712 12.683 1.00 0.00 H ATOM 2497 N ASN C 47 1.005 6.465 11.851 1.00 11.33 N ATOM 2498 CA ASN C 47 -0.139 6.077 12.630 1.00 11.35 C ATOM 2499 C ASN C 47 -0.311 4.576 12.628 1.00 11.48 C ATOM 2500 O ASN C 47 -0.395 4.007 11.498 1.00 11.80 O ATOM 2501 CB ASN C 47 -1.312 6.861 12.131 1.00 11.67 C ATOM 2502 CG ASN C 47 -2.643 6.477 12.725 1.00 11.89 C ATOM 2503 OD1 ASN C 47 -3.619 6.363 12.041 1.00 12.32 O ATOM 2504 ND2 ASN C 47 -2.725 6.382 14.027 1.00 11.73 N ATOM 2505 HD22 ASN C 47 -1.870 6.483 14.611 1.00 0.00 H ATOM 2506 HD21 ASN C 47 -3.645 6.206 14.479 1.00 0.00 H ATOM 2507 H ASN C 47 0.920 6.382 10.818 1.00 0.00 H ATOM 2508 N THR C 48 -0.676 3.955 13.748 1.00 11.49 N ATOM 2509 CA THR C 48 -0.899 2.524 13.897 1.00 11.79 C ATOM 2510 C THR C 48 -2.137 2.443 14.828 1.00 12.10 C ATOM 2511 O THR C 48 -2.040 3.031 15.894 1.00 11.94 O ATOM 2512 CB THR C 48 0.295 1.785 14.614 1.00 15.28 C ATOM 2513 OG1 THR C 48 1.527 2.043 13.904 1.00 20.14 O ATOM 2514 CG2 THR C 48 0.092 0.241 14.559 1.00 18.29 C ATOM 2515 HG1 THR C 48 2.272 1.577 14.359 1.00 0.00 H ATOM 2516 H THR C 48 -0.814 4.546 14.593 1.00 0.00 H ATOM 2517 N PRO C 49 -3.130 1.640 14.613 1.00 12.64 N ATOM 2518 CA PRO C 49 -4.093 1.419 15.611 1.00 13.06 C ATOM 2519 C PRO C 49 -3.543 0.351 16.569 1.00 13.27 C ATOM 2520 O PRO C 49 -3.004 -0.651 16.153 1.00 13.42 O ATOM 2521 CB PRO C 49 -5.328 0.876 14.868 1.00 13.76 C ATOM 2522 CG PRO C 49 -4.720 0.211 13.661 1.00 13.79 C ATOM 2523 CD PRO C 49 -3.427 0.891 13.340 1.00 14.26 C ATOM 2524 N VAL C 50 -3.790 0.499 17.901 1.00 13.49 N ATOM 2525 CA VAL C 50 -3.330 -0.528 18.851 1.00 13.90 C ATOM 2526 C VAL C 50 -4.438 -0.692 19.900 1.00 14.71 C ATOM 2527 O VAL C 50 -5.528 -0.112 19.822 1.00 14.92 O ATOM 2528 CB VAL C 50 -1.996 -0.108 19.575 1.00 13.44 C ATOM 2529 CG1 VAL C 50 -0.932 0.180 18.532 1.00 12.76 C ATOM 2530 CG2 VAL C 50 -2.212 1.115 20.437 1.00 13.32 C ATOM 2531 H VAL C 50 -4.302 1.336 18.246 1.00 0.00 H ATOM 2532 N LYS C 51 -4.198 -1.584 20.840 1.00 15.33 N ATOM 2533 CA LYS C 51 -5.190 -1.887 21.900 1.00 16.35 C ATOM 2534 C LYS C 51 -4.513 -1.766 23.265 1.00 16.61 C ATOM 2535 O LYS C 51 -3.482 -2.352 23.475 1.00 16.59 O ATOM 2536 CB LYS C 51 -5.792 -3.287 21.780 1.00 17.38 C ATOM 2537 CG LYS C 51 -6.402 -3.560 20.353 1.00 19.68 C ATOM 2538 CD LYS C 51 -7.681 -4.347 20.394 1.00 40.60 C ATOM 2539 CE LYS C 51 -8.209 -4.633 18.981 1.00 36.51 C ATOM 2540 NZ LYS C 51 -7.317 -5.616 18.258 1.00 64.44 N ATOM 2541 HZ1 LYS C 51 -6.358 -5.221 18.183 1.00 0.00 H ATOM 2542 HZ2 LYS C 51 -7.285 -6.509 18.790 1.00 0.00 H ATOM 2543 HZ3 LYS C 51 -7.697 -5.791 17.306 1.00 0.00 H ATOM 2544 H LYS C 51 -3.289 -2.089 20.838 1.00 0.00 H ATOM 2545 N GLY C 52 -5.154 -1.011 24.133 1.00 16.98 N ATOM 2546 CA GLY C 52 -4.687 -0.981 25.545 1.00 17.59 C ATOM 2547 C GLY C 52 -5.366 -2.069 26.252 1.00 18.95 C ATOM 2548 O GLY C 52 -6.445 -2.453 25.987 1.00 19.54 O ATOM 2549 H GLY C 52 -5.974 -0.445 23.836 1.00 0.00 H ATOM 2550 N VAL C 53 -4.695 -2.641 27.233 1.00 19.67 N ATOM 2551 CA VAL C 53 -5.312 -3.580 28.098 1.00 22.00 C ATOM 2552 C VAL C 53 -5.821 -2.810 29.316 1.00 31.49 C ATOM 2553 O VAL C 53 -5.003 -2.240 30.065 1.00 27.93 O ATOM 2554 CB VAL C 53 -4.263 -4.610 28.558 1.00 26.53 C ATOM 2555 CG1 VAL C 53 -4.904 -5.643 29.402 1.00 28.47 C ATOM 2556 CG2 VAL C 53 -3.537 -5.190 27.324 1.00 29.33 C ATOM 2557 H VAL C 53 -3.694 -2.399 27.375 1.00 0.00 H ATOM 2558 N GLY C 54 -7.139 -2.734 29.498 1.00 31.93 N ATOM 2559 CA GLY C 54 -7.699 -1.916 30.568 1.00 44.45 C ATOM 2560 C GLY C 54 -7.368 -2.421 31.956 1.00 56.82 C ATOM 2561 O GLY C 54 -8.028 -3.318 32.470 1.00 45.73 O ATOM 2562 H GLY C 54 -7.776 -3.264 28.870 1.00 0.00 H TER 2563 GLY C 54 ATOM 2564 N GLU C 67 -8.604 -19.598 36.685 1.00 54.01 N ATOM 2565 CA GLU C 67 -9.241 -18.806 35.634 1.00 50.62 C ATOM 2566 C GLU C 67 -8.631 -17.434 35.487 1.00 51.97 C ATOM 2567 O GLU C 67 -8.004 -16.912 36.403 1.00 53.67 O ATOM 2568 CB GLU C 67 -10.738 -18.625 35.876 1.00 54.29 C ATOM 2569 HN3 GLU C 67 -8.702 -19.106 37.596 1.00 0.00 H ATOM 2570 HN2 GLU C 67 -7.595 -19.720 36.463 1.00 0.00 H ATOM 2571 HN1 GLU C 67 -9.063 -20.530 36.741 1.00 0.00 H ATOM 2572 N PHE C 68 -8.837 -16.842 34.318 1.00 49.00 N ATOM 2573 CA PHE C 68 -8.335 -15.511 34.037 1.00 45.99 C ATOM 2574 C PHE C 68 -9.137 -14.405 34.734 1.00 44.72 C ATOM 2575 O PHE C 68 -10.366 -14.431 34.756 1.00 48.81 O ATOM 2576 CB PHE C 68 -8.358 -15.213 32.527 1.00 43.40 C ATOM 2577 CG PHE C 68 -7.535 -16.169 31.692 1.00 47.60 C ATOM 2578 CD1 PHE C 68 -6.327 -16.699 32.164 1.00 43.24 C ATOM 2579 CD2 PHE C 68 -7.950 -16.493 30.408 1.00 51.37 C ATOM 2580 CE1 PHE C 68 -5.589 -17.549 31.370 1.00 43.80 C ATOM 2581 CE2 PHE C 68 -7.206 -17.334 29.610 1.00 40.81 C ATOM 2582 CZ PHE C 68 -6.032 -17.855 30.089 1.00 40.80 C ATOM 2583 H PHE C 68 -9.373 -17.346 33.583 1.00 0.00 H ATOM 2584 N GLY C 69 -8.408 -13.404 35.239 1.00 45.10 N ATOM 2585 CA GLY C 69 -8.992 -12.157 35.740 1.00 48.46 C ATOM 2586 C GLY C 69 -9.668 -11.311 34.671 1.00 41.69 C ATOM 2587 O GLY C 69 -9.321 -11.417 33.476 1.00 45.26 O ATOM 2588 H GLY C 69 -7.375 -13.516 35.278 1.00 0.00 H ATOM 2589 N PRO C 70 -10.625 -10.447 35.093 1.00 54.91 N ATOM 2590 CA PRO C 70 -11.411 -9.660 34.125 1.00 67.35 C ATOM 2591 C PRO C 70 -10.557 -8.643 33.367 1.00 61.59 C ATOM 2592 O PRO C 70 -10.080 -7.681 33.973 1.00 97.63 O ATOM 2593 CB PRO C 70 -12.479 -8.954 35.004 1.00 66.78 C ATOM 2594 CG PRO C 70 -12.450 -9.631 36.339 1.00 70.57 C ATOM 2595 CD PRO C 70 -11.078 -10.233 36.491 1.00 58.20 C ATOM 2596 N SER C 71 -10.359 -8.849 32.059 1.00 52.28 N ATOM 2597 CA SER C 71 -9.594 -7.897 31.226 1.00 57.00 C ATOM 2598 C SER C 71 -10.450 -7.359 30.072 1.00 45.45 C ATOM 2599 O SER C 71 -11.453 -7.957 29.665 1.00 61.73 O ATOM 2600 CB SER C 71 -8.256 -8.492 30.704 1.00 52.99 C ATOM 2601 OG SER C 71 -8.250 -8.787 29.310 1.00 59.03 O ATOM 2602 HG SER C 71 -7.369 -9.160 29.057 1.00 0.00 H ATOM 2603 H SER C 71 -10.755 -9.703 31.616 1.00 0.00 H ATOM 2604 N ASN C 72 -10.032 -6.216 29.555 1.00 31.82 N ATOM 2605 CA ASN C 72 -10.754 -5.595 28.454 1.00 34.20 C ATOM 2606 C ASN C 72 -9.763 -4.923 27.552 1.00 27.53 C ATOM 2607 O ASN C 72 -8.863 -4.226 28.040 1.00 28.25 O ATOM 2608 CB ASN C 72 -11.833 -4.613 28.970 1.00 52.64 C ATOM 2609 CG ASN C 72 -11.260 -3.461 29.804 1.00 63.62 C ATOM 2610 OD1 ASN C 72 -11.328 -2.297 29.401 1.00 73.59 O ATOM 2611 ND2 ASN C 72 -10.726 -3.776 30.975 1.00 60.83 N ATOM 2612 HD22 ASN C 72 -10.688 -4.770 31.279 1.00 0.00 H ATOM 2613 HD21 ASN C 72 -10.345 -3.029 31.591 1.00 0.00 H ATOM 2614 H ASN C 72 -9.181 -5.757 29.938 1.00 0.00 H ATOM 2615 N LEU C 73 -9.835 -5.171 26.239 1.00 25.40 N ATOM 2616 CA LEU C 73 -8.978 -4.533 25.309 1.00 21.97 C ATOM 2617 C LEU C 73 -9.653 -3.291 24.806 1.00 21.25 C ATOM 2618 O LEU C 73 -10.853 -3.399 24.506 1.00 22.00 O ATOM 2619 CB LEU C 73 -8.564 -5.441 24.121 1.00 23.59 C ATOM 2620 CG LEU C 73 -7.550 -6.572 24.519 1.00 26.36 C ATOM 2621 CD1 LEU C 73 -6.099 -6.056 24.643 1.00 29.09 C ATOM 2622 CD2 LEU C 73 -7.999 -7.291 25.777 1.00 36.63 C ATOM 2623 H LEU C 73 -10.540 -5.852 25.891 1.00 0.00 H ATOM 2624 N VAL C 74 -9.006 -2.160 24.821 1.00 20.12 N ATOM 2625 CA VAL C 74 -9.595 -0.873 24.522 1.00 19.59 C ATOM 2626 C VAL C 74 -8.820 -0.294 23.355 1.00 18.17 C ATOM 2627 O VAL C 74 -7.602 -0.129 23.386 1.00 17.40 O ATOM 2628 CB VAL C 74 -9.416 0.063 25.716 1.00 19.70 C ATOM 2629 CG1 VAL C 74 -9.823 1.496 25.392 1.00 19.07 C ATOM 2630 CG2 VAL C 74 -10.089 -0.555 26.930 1.00 21.28 C ATOM 2631 H VAL C 74 -7.995 -2.184 25.065 1.00 0.00 H ATOM 2632 N ASP C 75 -9.506 0.073 22.275 1.00 17.91 N ATOM 2633 CA ASP C 75 -8.806 0.641 21.131 1.00 16.76 C ATOM 2634 C ASP C 75 -8.193 1.958 21.443 1.00 15.98 C ATOM 2635 O ASP C 75 -8.741 2.773 22.142 1.00 16.27 O ATOM 2636 CB ASP C 75 -9.901 0.874 20.014 1.00 16.97 C ATOM 2637 CG ASP C 75 -10.542 -0.455 19.603 1.00 17.90 C ATOM 2638 OD1 ASP C 75 -9.845 -1.190 18.823 1.00 19.53 O ATOM 2639 OD2 ASP C 75 -11.583 -0.853 20.116 1.00 18.99 O ATOM 2640 H ASP C 75 -10.539 -0.045 22.248 1.00 0.00 H ATOM 2641 N LYS C 76 -6.960 2.134 20.876 1.00 15.07 N ATOM 2642 CA LYS C 76 -6.268 3.341 20.988 1.00 14.39 C ATOM 2643 C LYS C 76 -5.602 3.670 19.653 1.00 13.61 C ATOM 2644 O LYS C 76 -5.444 2.792 18.791 1.00 13.58 O ATOM 2645 CB LYS C 76 -5.119 3.183 22.048 1.00 14.32 C ATOM 2646 CG LYS C 76 -5.478 2.718 23.402 1.00 15.21 C ATOM 2647 CD LYS C 76 -6.000 3.849 24.120 1.00 16.39 C ATOM 2648 CE LYS C 76 -6.520 3.393 25.463 1.00 22.20 C ATOM 2649 NZ LYS C 76 -7.386 4.303 26.221 1.00 24.15 N ATOM 2650 HZ1 LYS C 76 -6.871 5.185 26.419 1.00 0.00 H ATOM 2651 HZ2 LYS C 76 -8.237 4.515 25.663 1.00 0.00 H ATOM 2652 HZ3 LYS C 76 -7.661 3.852 27.117 1.00 0.00 H ATOM 2653 H LYS C 76 -6.528 1.349 20.348 1.00 0.00 H ATOM 2654 N GLU C 77 -5.242 4.922 19.493 1.00 13.14 N ATOM 2655 CA GLU C 77 -4.439 5.321 18.278 1.00 12.53 C ATOM 2656 C GLU C 77 -3.055 5.621 18.696 1.00 12.10 C ATOM 2657 O GLU C 77 -2.909 6.210 19.779 1.00 12.22 O ATOM 2658 CB GLU C 77 -5.060 6.476 17.499 1.00 12.50 C ATOM 2659 CG GLU C 77 -6.354 6.116 16.751 1.00 13.00 C ATOM 2660 CD GLU C 77 -6.045 5.181 15.606 1.00 12.97 C ATOM 2661 OE1 GLU C 77 -4.980 5.070 15.158 1.00 14.91 O ATOM 2662 OE2 GLU C 77 -7.148 4.644 15.170 1.00 16.71 O ATOM 2663 H GLU C 77 -5.509 5.636 20.200 1.00 0.00 H ATOM 2664 N LYS C 78 -2.079 5.210 17.913 1.00 11.74 N ATOM 2665 CA LYS C 78 -0.626 5.419 18.180 1.00 11.42 C ATOM 2666 C LYS C 78 -0.059 6.287 17.096 1.00 11.11 C ATOM 2667 O LYS C 78 -0.410 6.070 15.895 1.00 11.13 O ATOM 2668 CB LYS C 78 0.114 4.096 18.255 1.00 11.46 C ATOM 2669 CG LYS C 78 1.622 4.243 18.410 1.00 11.42 C ATOM 2670 CD LYS C 78 2.148 3.011 19.003 1.00 15.25 C ATOM 2671 CE LYS C 78 2.375 2.068 17.898 1.00 24.59 C ATOM 2672 NZ LYS C 78 3.579 1.255 18.135 1.00 34.53 N ATOM 2673 HZ1 LYS C 78 4.407 1.879 18.216 1.00 0.00 H ATOM 2674 HZ2 LYS C 78 3.463 0.715 19.016 1.00 0.00 H ATOM 2675 HZ3 LYS C 78 3.715 0.599 17.340 1.00 0.00 H ATOM 2676 H LYS C 78 -2.341 4.702 17.044 1.00 0.00 H ATOM 2677 N LEU C 79 0.703 7.318 17.438 1.00 11.00 N ATOM 2678 CA LEU C 79 1.493 8.121 16.550 1.00 10.88 C ATOM 2679 C LEU C 79 2.948 7.970 16.939 1.00 10.81 C ATOM 2680 O LEU C 79 3.309 8.103 18.125 1.00 10.93 O ATOM 2681 CB LEU C 79 1.107 9.601 16.632 1.00 11.05 C ATOM 2682 CG LEU C 79 -0.114 9.979 15.942 1.00 11.22 C ATOM 2683 CD1 LEU C 79 -0.364 11.457 16.179 1.00 11.49 C ATOM 2684 CD2 LEU C 79 -0.068 9.861 14.439 1.00 11.28 C ATOM 2685 H LEU C 79 0.730 7.568 18.447 1.00 0.00 H ATOM 2686 N ASP C 80 3.778 7.724 15.953 1.00 10.74 N ATOM 2687 CA ASP C 80 5.250 7.754 16.107 1.00 10.79 C ATOM 2688 C ASP C 80 5.714 8.981 15.318 1.00 10.98 C ATOM 2689 O ASP C 80 5.376 9.116 14.104 1.00 11.06 O ATOM 2690 CB ASP C 80 5.854 6.535 15.516 1.00 10.79 C ATOM 2691 CG ASP C 80 5.818 5.335 16.470 1.00 17.90 C ATOM 2692 OD1 ASP C 80 6.305 5.400 17.638 1.00 14.72 O ATOM 2693 OD2 ASP C 80 5.202 4.304 16.016 1.00 30.53 O ATOM 2694 H ASP C 80 3.383 7.497 15.018 1.00 0.00 H ATOM 2695 N ILE C 81 6.514 9.865 15.838 1.00 11.22 N ATOM 2696 CA ILE C 81 6.880 11.111 15.223 1.00 11.59 C ATOM 2697 C ILE C 81 8.365 11.288 15.444 1.00 11.92 C ATOM 2698 O ILE C 81 8.804 11.451 16.614 1.00 12.07 O ATOM 2699 CB ILE C 81 6.158 12.335 15.817 1.00 11.81 C ATOM 2700 CG1 ILE C 81 4.629 12.092 16.014 1.00 11.55 C ATOM 2701 CG2 ILE C 81 6.433 13.565 15.064 1.00 12.32 C ATOM 2702 CD1 ILE C 81 3.917 12.703 17.132 1.00 11.93 C ATOM 2703 H ILE C 81 6.920 9.654 16.772 1.00 0.00 H ATOM 2704 N VAL C 82 9.200 11.117 14.461 1.00 12.15 N ATOM 2705 CA VAL C 82 10.640 11.269 14.599 1.00 12.60 C ATOM 2706 C VAL C 82 11.038 12.674 14.325 1.00 13.27 C ATOM 2707 O VAL C 82 10.699 13.215 13.282 1.00 13.54 O ATOM 2708 CB VAL C 82 11.340 10.274 13.683 1.00 12.64 C ATOM 2709 CG1 VAL C 82 12.850 10.469 13.787 1.00 13.24 C ATOM 2710 CG2 VAL C 82 10.987 8.851 14.025 1.00 12.12 C ATOM 2711 H VAL C 82 8.818 10.858 13.529 1.00 0.00 H ATOM 2712 N VAL C 83 11.745 13.300 15.281 1.00 13.71 N ATOM 2713 CA VAL C 83 12.077 14.690 15.250 1.00 14.49 C ATOM 2714 C VAL C 83 13.550 14.832 15.662 1.00 15.20 C ATOM 2715 O VAL C 83 14.164 13.950 16.250 1.00 15.04 O ATOM 2716 CB VAL C 83 11.171 15.579 16.101 1.00 14.52 C ATOM 2717 CG1 VAL C 83 9.743 15.440 15.621 1.00 16.98 C ATOM 2718 CG2 VAL C 83 11.319 15.288 17.571 1.00 14.45 C ATOM 2719 H VAL C 83 12.071 12.739 16.094 1.00 0.00 H ATOM 2720 N SER C 84 14.079 15.998 15.387 1.00 16.12 N ATOM 2721 CA SER C 84 15.398 16.317 15.838 1.00 17.00 C ATOM 2722 C SER C 84 15.314 16.613 17.343 1.00 17.12 C ATOM 2723 O SER C 84 14.288 17.020 17.858 1.00 16.83 O ATOM 2724 CB SER C 84 15.955 17.491 15.071 1.00 18.45 C ATOM 2725 OG SER C 84 15.193 18.597 15.403 1.00 25.08 O ATOM 2726 HG SER C 84 15.533 19.389 14.915 1.00 0.00 H ATOM 2727 H SER C 84 13.537 16.695 14.838 1.00 0.00 H ATOM 2728 N ARG C 85 16.444 16.429 18.044 1.00 17.73 N ATOM 2729 CA ARG C 85 16.563 16.765 19.494 1.00 18.19 C ATOM 2730 C ARG C 85 15.883 18.076 19.919 1.00 18.68 C ATOM 2731 O ARG C 85 15.101 18.158 20.888 1.00 18.47 O ATOM 2732 CB ARG C 85 18.054 16.753 19.877 1.00 19.23 C ATOM 2733 CG ARG C 85 18.462 16.829 21.326 1.00 20.18 C ATOM 2734 CD ARG C 85 19.996 16.599 21.443 1.00 23.58 C ATOM 2735 NE ARG C 85 20.224 16.209 22.794 1.00 32.48 N ATOM 2736 CZ ARG C 85 20.627 15.048 23.268 1.00 31.04 C ATOM 2737 NH1 ARG C 85 21.054 14.065 22.494 1.00 21.55 N ATOM 2738 NH2 ARG C 85 20.748 14.955 24.592 1.00 44.30 N ATOM 2739 HE ARG C 85 20.047 16.945 23.507 1.00 0.00 H ATOM 2740 HH12 ARG C 85 21.362 13.166 22.917 1.00 0.00 H ATOM 2741 HH11 ARG C 85 21.082 14.190 21.462 1.00 0.00 H ATOM 2742 HH22 ARG C 85 21.062 14.063 25.024 1.00 0.00 H ATOM 2743 HH21 ARG C 85 20.528 15.775 25.193 1.00 0.00 H ATOM 2744 H ARG C 85 17.273 16.035 17.555 1.00 0.00 H ATOM 2745 N ALA C 86 16.128 19.094 19.122 1.00 19.42 N ATOM 2746 CA ALA C 86 15.696 20.454 19.456 1.00 20.21 C ATOM 2747 C ALA C 86 14.195 20.620 19.465 1.00 19.43 C ATOM 2748 O ALA C 86 13.691 21.501 20.171 1.00 21.28 O ATOM 2749 CB ALA C 86 16.300 21.458 18.480 1.00 22.77 C ATOM 2750 H ALA C 86 16.641 18.929 18.233 1.00 0.00 H ATOM 2751 N GLN C 87 13.543 19.772 18.706 1.00 18.34 N ATOM 2752 CA GLN C 87 12.038 19.821 18.588 1.00 17.59 C ATOM 2753 C GLN C 87 11.292 18.930 19.586 1.00 16.76 C ATOM 2754 O GLN C 87 10.105 18.946 19.672 1.00 16.29 O ATOM 2755 CB GLN C 87 11.596 19.396 17.219 1.00 18.25 C ATOM 2756 CG GLN C 87 12.079 20.329 16.120 1.00 23.93 C ATOM 2757 CD GLN C 87 11.773 19.695 14.764 1.00 61.44 C ATOM 2758 OE1 GLN C 87 12.152 18.538 14.467 1.00 43.72 O ATOM 2759 NE2 GLN C 87 11.058 20.431 13.948 1.00 41.09 N ATOM 2760 HE22 GLN C 87 10.763 21.387 14.233 1.00 0.00 H ATOM 2761 HE21 GLN C 87 10.785 20.059 13.016 1.00 0.00 H ATOM 2762 H GLN C 87 14.073 19.052 18.175 1.00 0.00 H ATOM 2763 N VAL C 88 12.006 18.127 20.376 1.00 16.71 N ATOM 2764 CA VAL C 88 11.364 17.173 21.199 1.00 16.05 C ATOM 2765 C VAL C 88 10.402 17.831 22.186 1.00 16.32 C ATOM 2766 O VAL C 88 9.218 17.399 22.255 1.00 15.67 O ATOM 2767 CB VAL C 88 12.365 16.318 21.989 1.00 16.25 C ATOM 2768 CG1 VAL C 88 11.639 15.495 23.058 1.00 15.90 C ATOM 2769 CG2 VAL C 88 13.044 15.428 20.997 1.00 15.82 C ATOM 2770 H VAL C 88 13.043 18.203 20.387 1.00 0.00 H ATOM 2771 N ASP C 89 10.842 18.868 22.874 1.00 17.36 N ATOM 2772 CA ASP C 89 9.987 19.345 23.958 1.00 17.72 C ATOM 2773 C ASP C 89 8.733 19.953 23.318 1.00 17.40 C ATOM 2774 O ASP C 89 7.685 19.774 23.850 1.00 17.15 O ATOM 2775 CB ASP C 89 10.603 20.393 24.890 1.00 20.50 C ATOM 2776 CG ASP C 89 11.655 19.817 25.850 1.00 30.32 C ATOM 2777 OD1 ASP C 89 11.693 18.572 26.037 1.00 35.41 O ATOM 2778 OD2 ASP C 89 12.429 20.636 26.443 1.00 36.84 O ATOM 2779 H ASP C 89 11.752 19.322 22.655 1.00 0.00 H ATOM 2780 N ALA C 90 8.921 20.745 22.271 1.00 17.65 N ATOM 2781 CA ALA C 90 7.687 21.405 21.676 1.00 17.52 C ATOM 2782 C ALA C 90 6.697 20.398 21.188 1.00 16.41 C ATOM 2783 O ALA C 90 5.436 20.562 21.323 1.00 16.24 O ATOM 2784 CB ALA C 90 8.052 22.330 20.547 1.00 18.08 C ATOM 2785 H ALA C 90 9.869 20.907 21.875 1.00 0.00 H ATOM 2786 N VAL C 91 7.157 19.350 20.534 1.00 15.72 N ATOM 2787 CA VAL C 91 6.247 18.350 20.008 1.00 14.79 C ATOM 2788 C VAL C 91 5.568 17.527 21.091 1.00 14.44 C ATOM 2789 O VAL C 91 4.407 17.274 21.025 1.00 14.10 O ATOM 2790 CB VAL C 91 6.887 17.497 18.933 1.00 14.30 C ATOM 2791 CG1 VAL C 91 6.001 16.377 18.452 1.00 14.20 C ATOM 2792 CG2 VAL C 91 7.350 18.402 17.778 1.00 15.89 C ATOM 2793 H VAL C 91 8.182 19.239 20.394 1.00 0.00 H ATOM 2794 N VAL C 92 6.289 17.128 22.110 1.00 14.67 N ATOM 2795 CA VAL C 92 5.691 16.461 23.236 1.00 14.63 C ATOM 2796 C VAL C 92 4.577 17.364 23.845 1.00 15.11 C ATOM 2797 O VAL C 92 3.467 16.872 24.162 1.00 14.89 O ATOM 2798 CB VAL C 92 6.747 16.104 24.278 1.00 15.12 C ATOM 2799 CG1 VAL C 92 6.052 15.641 25.540 1.00 15.41 C ATOM 2800 CG2 VAL C 92 7.649 14.987 23.791 1.00 14.65 C ATOM 2801 H VAL C 92 7.315 17.297 22.105 1.00 0.00 H ATOM 2802 N ARG C 93 4.861 18.641 23.962 1.00 15.86 N ATOM 2803 CA ARG C 93 3.891 19.566 24.596 1.00 16.49 C ATOM 2804 C ARG C 93 2.613 19.663 23.764 1.00 16.03 C ATOM 2805 O ARG C 93 1.534 19.652 24.307 1.00 16.17 O ATOM 2806 CB ARG C 93 4.464 20.955 24.822 1.00 17.52 C ATOM 2807 CG ARG C 93 5.504 20.994 25.962 1.00 22.54 C ATOM 2808 CD ARG C 93 5.962 22.437 26.205 1.00 30.12 C ATOM 2809 NE ARG C 93 7.284 22.442 26.862 1.00 41.29 N ATOM 2810 CZ ARG C 93 8.412 22.913 26.334 1.00 49.12 C ATOM 2811 NH1 ARG C 93 8.436 23.454 25.103 1.00 51.08 N ATOM 2812 NH2 ARG C 93 9.526 22.857 27.059 1.00 66.74 N ATOM 2813 HE ARG C 93 7.339 22.043 27.821 1.00 0.00 H ATOM 2814 HH12 ARG C 93 9.329 23.815 24.711 1.00 0.00 H ATOM 2815 HH11 ARG C 93 7.562 23.511 24.543 1.00 0.00 H ATOM 2816 HH22 ARG C 93 10.419 23.219 26.668 1.00 0.00 H ATOM 2817 HH21 ARG C 93 9.503 22.452 28.016 1.00 0.00 H ATOM 2818 H ARG C 93 5.769 19.005 23.609 1.00 0.00 H ATOM 2819 N LEU C 94 2.767 19.685 22.463 1.00 15.60 N ATOM 2820 CA LEU C 94 1.600 19.823 21.593 1.00 15.33 C ATOM 2821 C LEU C 94 0.790 18.566 21.569 1.00 14.62 C ATOM 2822 O LEU C 94 -0.441 18.604 21.549 1.00 14.66 O ATOM 2823 CB LEU C 94 2.060 20.115 20.167 1.00 15.22 C ATOM 2824 CG LEU C 94 2.611 21.518 20.010 1.00 16.14 C ATOM 2825 CD1 LEU C 94 3.137 21.670 18.604 1.00 16.14 C ATOM 2826 CD2 LEU C 94 1.599 22.611 20.239 1.00 16.83 C ATOM 2827 H LEU C 94 3.718 19.604 22.050 1.00 0.00 H ATOM 2828 N VAL C 95 1.437 17.419 21.542 1.00 14.07 N ATOM 2829 CA VAL C 95 0.743 16.181 21.609 1.00 13.57 C ATOM 2830 C VAL C 95 0.022 15.993 22.907 1.00 13.95 C ATOM 2831 O VAL C 95 -1.140 15.596 22.919 1.00 13.91 O ATOM 2832 CB VAL C 95 1.642 14.962 21.316 1.00 13.02 C ATOM 2833 CG1 VAL C 95 0.897 13.658 21.490 1.00 13.93 C ATOM 2834 CG2 VAL C 95 2.261 15.092 19.966 1.00 12.75 C ATOM 2835 H VAL C 95 2.475 17.420 21.470 1.00 0.00 H ATOM 2836 N ALA C 96 0.680 16.314 24.011 1.00 14.49 N ATOM 2837 CA ALA C 96 0.042 16.188 25.318 1.00 15.08 C ATOM 2838 C ALA C 96 -1.229 17.062 25.362 1.00 15.52 C ATOM 2839 O ALA C 96 -2.338 16.601 25.796 1.00 15.71 O ATOM 2840 CB ALA C 96 0.962 16.556 26.401 1.00 15.78 C ATOM 2841 H ALA C 96 1.659 16.659 23.946 1.00 0.00 H ATOM 2842 N ALA C 97 -1.064 18.301 24.869 1.00 15.78 N ATOM 2843 CA ALA C 97 -2.224 19.210 24.948 1.00 16.34 C ATOM 2844 C ALA C 97 -3.392 18.836 24.061 1.00 15.93 C ATOM 2845 O ALA C 97 -4.537 19.087 24.428 1.00 16.41 O ATOM 2846 CB ALA C 97 -1.807 20.634 24.636 1.00 16.89 C ATOM 2847 H ALA C 97 -0.161 18.605 24.451 1.00 0.00 H ATOM 2848 N SER C 98 -3.079 18.187 22.943 1.00 15.16 N ATOM 2849 CA SER C 98 -4.145 17.848 22.009 1.00 14.91 C ATOM 2850 C SER C 98 -4.780 16.507 22.314 1.00 14.64 C ATOM 2851 O SER C 98 -5.928 16.317 22.041 1.00 14.80 O ATOM 2852 CB SER C 98 -3.619 17.905 20.588 1.00 14.46 C ATOM 2853 OG SER C 98 -2.412 17.184 20.460 1.00 13.94 O ATOM 2854 HG SER C 98 -1.731 17.572 21.065 1.00 0.00 H ATOM 2855 H SER C 98 -2.093 17.927 22.739 1.00 0.00 H ATOM 2856 N ALA C 99 -4.076 15.591 22.916 1.00 14.39 N ATOM 2857 CA ALA C 99 -4.603 14.292 23.300 1.00 14.33 C ATOM 2858 C ALA C 99 -5.272 14.249 24.637 1.00 15.10 C ATOM 2859 O ALA C 99 -6.155 13.412 24.913 1.00 17.37 O ATOM 2860 CB ALA C 99 -3.539 13.228 23.211 1.00 14.05 C ATOM 2861 H ALA C 99 -3.081 15.801 23.134 1.00 0.00 H ATOM 2862 N TYR C 100 -5.049 15.267 25.478 1.00 15.69 N ATOM 2863 CA TYR C 100 -5.693 15.494 26.832 1.00 17.44 C ATOM 2864 C TYR C 100 -7.246 15.538 26.794 1.00 17.28 C ATOM 2865 O TYR C 100 -7.881 16.235 25.968 1.00 23.07 O ATOM 2866 CB TYR C 100 -5.191 16.782 27.371 1.00 17.67 C ATOM 2867 CG TYR C 100 -5.752 17.133 28.761 1.00 21.33 C ATOM 2868 CD1 TYR C 100 -5.179 16.663 30.003 1.00 21.89 C ATOM 2869 CD2 TYR C 100 -6.910 17.912 28.835 1.00 26.82 C ATOM 2870 CE1 TYR C 100 -5.775 17.010 31.222 1.00 27.51 C ATOM 2871 CE2 TYR C 100 -7.464 18.258 30.033 1.00 27.89 C ATOM 2872 CZ TYR C 100 -6.884 17.806 31.225 1.00 23.59 C ATOM 2873 OH TYR C 100 -7.416 18.097 32.490 1.00 29.29 O ATOM 2874 HH TYR C 100 -6.851 17.681 33.188 1.00 0.00 H ATOM 2875 H TYR C 100 -4.358 15.980 25.169 1.00 0.00 H ATOM 2876 N THR C 101 -7.876 14.855 27.773 1.00 21.16 N ATOM 2877 CA THR C 101 -9.287 15.076 28.153 1.00 20.93 C ATOM 2878 C THR C 101 -9.416 15.373 29.611 1.00 28.75 C ATOM 2879 O THR C 101 -10.363 16.033 30.022 1.00 32.31 O ATOM 2880 CB THR C 101 -10.248 13.855 27.898 1.00 20.28 C ATOM 2881 OG1 THR C 101 -10.081 12.742 28.831 1.00 20.29 O ATOM 2882 CG2 THR C 101 -10.165 13.361 26.406 1.00 24.64 C ATOM 2883 HG1 THR C 101 -9.155 12.397 28.769 1.00 0.00 H ATOM 2884 H THR C 101 -7.337 14.131 28.290 1.00 0.00 H ATOM 2885 N GLY C 102 -8.500 14.850 30.418 1.00 21.88 N ATOM 2886 CA GLY C 102 -8.531 15.121 31.872 1.00 25.54 C ATOM 2887 C GLY C 102 -9.199 14.001 32.630 1.00 40.35 C ATOM 2888 O GLY C 102 -9.277 14.037 33.862 1.00 41.82 O ATOM 2889 H GLY C 102 -7.753 14.243 30.024 1.00 0.00 H ATOM 2890 N GLU C 103 -9.690 12.999 31.905 1.00 37.15 N ATOM 2891 CA GLU C 103 -10.211 11.805 32.549 1.00 36.59 C ATOM 2892 C GLU C 103 -9.176 10.716 32.471 1.00 27.79 C ATOM 2893 O GLU C 103 -8.285 10.681 31.599 1.00 26.64 O ATOM 2894 CB GLU C 103 -11.509 11.309 31.902 1.00 29.75 C ATOM 2895 CG GLU C 103 -12.579 12.383 31.801 1.00 32.94 C ATOM 2896 CD GLU C 103 -13.092 12.781 33.151 1.00 50.89 C ATOM 2897 OE1 GLU C 103 -13.039 11.925 34.071 1.00 54.82 O ATOM 2898 OE2 GLU C 103 -13.531 13.946 33.282 1.00 38.26 O ATOM 2899 H GLU C 103 -9.701 13.071 30.868 1.00 0.00 H ATOM 2900 N ILE C 104 -9.336 9.798 33.415 1.00 34.39 N ATOM 2901 CA ILE C 104 -8.557 8.606 33.443 1.00 28.91 C ATOM 2902 C ILE C 104 -8.714 7.830 32.136 1.00 27.04 C ATOM 2903 O ILE C 104 -9.823 7.669 31.587 1.00 29.25 O ATOM 2904 CB ILE C 104 -8.959 7.721 34.632 1.00 41.46 C ATOM 2905 CG1 ILE C 104 -8.578 8.435 35.951 1.00 40.15 C ATOM 2906 CG2 ILE C 104 -8.321 6.329 34.497 1.00 41.25 C ATOM 2907 CD1 ILE C 104 -9.581 8.231 37.091 1.00 55.56 C ATOM 2908 H ILE C 104 -10.050 9.953 34.155 1.00 0.00 H ATOM 2909 N GLY C 105 -7.589 7.373 31.623 1.00 27.55 N ATOM 2910 CA GLY C 105 -7.543 6.736 30.325 1.00 22.54 C ATOM 2911 C GLY C 105 -6.991 7.544 29.135 1.00 20.63 C ATOM 2912 O GLY C 105 -7.162 7.131 27.959 1.00 21.45 O ATOM 2913 H GLY C 105 -6.709 7.473 32.167 1.00 0.00 H ATOM 2914 N ASP C 106 -6.274 8.660 29.354 1.00 18.81 N ATOM 2915 CA ASP C 106 -5.848 9.547 28.232 1.00 17.68 C ATOM 2916 C ASP C 106 -4.629 9.054 27.492 1.00 16.59 C ATOM 2917 O ASP C 106 -4.359 9.470 26.359 1.00 19.25 O ATOM 2918 CB ASP C 106 -5.558 10.967 28.766 1.00 19.26 C ATOM 2919 CG ASP C 106 -6.750 11.871 28.867 1.00 19.50 C ATOM 2920 OD1 ASP C 106 -7.923 11.498 28.583 1.00 21.06 O ATOM 2921 OD2 ASP C 106 -6.535 13.012 29.424 1.00 21.06 O ATOM 2922 H ASP C 106 -6.010 8.911 30.328 1.00 0.00 H ATOM 2923 N GLY C 107 -3.895 8.120 28.107 1.00 16.39 N ATOM 2924 CA GLY C 107 -2.746 7.604 27.420 1.00 15.62 C ATOM 2925 C GLY C 107 -1.414 8.149 27.851 1.00 15.58 C ATOM 2926 O GLY C 107 -1.306 8.838 28.892 1.00 16.31 O ATOM 2927 H GLY C 107 -4.150 7.778 29.055 1.00 0.00 H ATOM 2928 N LYS C 108 -0.400 7.802 27.105 1.00 14.89 N ATOM 2929 CA LYS C 108 0.963 8.127 27.448 1.00 16.83 C ATOM 2930 C LYS C 108 1.743 8.507 26.272 1.00 14.09 C ATOM 2931 O LYS C 108 1.445 8.053 25.103 1.00 13.42 O ATOM 2932 CB LYS C 108 1.685 6.955 28.047 1.00 17.28 C ATOM 2933 CG LYS C 108 1.233 6.532 29.449 1.00 33.05 C ATOM 2934 CD LYS C 108 2.441 6.340 30.366 1.00 34.24 C ATOM 2935 CE LYS C 108 2.101 6.183 31.832 1.00 50.39 C ATOM 2936 NZ LYS C 108 1.070 5.135 32.049 1.00 63.93 N ATOM 2937 HZ1 LYS C 108 0.202 5.393 31.537 1.00 0.00 H ATOM 2938 HZ2 LYS C 108 1.424 4.223 31.695 1.00 0.00 H ATOM 2939 HZ3 LYS C 108 0.865 5.058 33.066 1.00 0.00 H ATOM 2940 H LYS C 108 -0.582 7.271 26.230 1.00 0.00 H ATOM 2941 N ILE C 109 2.794 9.246 26.536 1.00 14.23 N ATOM 2942 CA ILE C 109 3.803 9.677 25.557 1.00 13.68 C ATOM 2943 C ILE C 109 5.207 9.218 26.037 1.00 14.00 C ATOM 2944 O ILE C 109 5.581 9.311 27.153 1.00 14.75 O ATOM 2945 CB ILE C 109 3.903 11.225 25.397 1.00 13.95 C ATOM 2946 CG1 ILE C 109 2.547 11.790 24.844 1.00 13.58 C ATOM 2947 CG2 ILE C 109 4.946 11.539 24.327 1.00 14.74 C ATOM 2948 CD1 ILE C 109 2.511 13.300 24.867 1.00 15.90 C ATOM 2949 H ILE C 109 2.925 9.553 27.521 1.00 0.00 H ATOM 2950 N PHE C 110 5.871 8.572 25.123 1.00 13.48 N ATOM 2951 CA PHE C 110 7.251 8.142 25.326 1.00 13.73 C ATOM 2952 C PHE C 110 8.238 8.791 24.371 1.00 13.45 C ATOM 2953 O PHE C 110 7.825 9.069 23.237 1.00 12.87 O ATOM 2954 CB PHE C 110 7.269 6.635 25.077 1.00 13.55 C ATOM 2955 CG PHE C 110 6.360 5.877 25.979 1.00 14.00 C ATOM 2956 CD1 PHE C 110 6.628 5.655 27.251 1.00 14.88 C ATOM 2957 CD2 PHE C 110 5.170 5.412 25.477 1.00 13.94 C ATOM 2958 CE1 PHE C 110 5.753 4.989 28.176 1.00 15.72 C ATOM 2959 CE2 PHE C 110 4.288 4.678 26.351 1.00 18.12 C ATOM 2960 CZ PHE C 110 4.576 4.505 27.666 1.00 17.51 C ATOM 2961 H PHE C 110 5.404 8.355 24.220 1.00 0.00 H ATOM 2962 N VAL C 111 9.483 8.992 24.765 1.00 13.96 N ATOM 2963 CA VAL C 111 10.521 9.556 23.920 1.00 13.91 C ATOM 2964 C VAL C 111 11.549 8.483 23.821 1.00 14.02 C ATOM 2965 O VAL C 111 11.982 8.013 24.876 1.00 14.64 O ATOM 2966 CB VAL C 111 11.045 10.920 24.401 1.00 14.61 C ATOM 2967 CG1 VAL C 111 12.127 11.400 23.398 1.00 14.66 C ATOM 2968 CG2 VAL C 111 9.875 11.906 24.541 1.00 14.56 C ATOM 2969 H VAL C 111 9.735 8.730 25.739 1.00 0.00 H ATOM 2970 N HIS C 112 11.996 8.089 22.648 1.00 13.59 N ATOM 2971 CA HIS C 112 12.918 7.009 22.418 1.00 13.70 C ATOM 2972 C HIS C 112 14.060 7.544 21.569 1.00 13.90 C ATOM 2973 O HIS C 112 13.858 8.267 20.582 1.00 13.62 O ATOM 2974 CB HIS C 112 12.299 5.905 21.602 1.00 13.09 C ATOM 2975 CG HIS C 112 11.006 5.427 22.107 1.00 12.88 C ATOM 2976 ND1 HIS C 112 10.889 4.366 22.977 1.00 13.24 N ATOM 2977 CD2 HIS C 112 9.741 5.833 21.857 1.00 12.47 C ATOM 2978 CE1 HIS C 112 9.602 4.102 23.154 1.00 13.05 C ATOM 2979 NE2 HIS C 112 8.911 4.979 22.510 1.00 12.58 N ATOM 2980 H HIS C 112 11.652 8.604 21.813 1.00 0.00 H ATOM 2981 N PRO C 113 15.290 7.095 21.806 1.00 14.46 N ATOM 2982 CA PRO C 113 16.380 7.484 20.933 1.00 14.76 C ATOM 2983 C PRO C 113 16.328 6.764 19.557 1.00 14.25 C ATOM 2984 O PRO C 113 15.857 5.618 19.511 1.00 13.87 O ATOM 2985 CB PRO C 113 17.620 7.027 21.735 1.00 15.63 C ATOM 2986 CG PRO C 113 17.158 5.808 22.470 1.00 15.51 C ATOM 2987 CD PRO C 113 15.685 6.114 22.855 1.00 14.96 C ATOM 2988 N VAL C 114 16.803 7.444 18.513 1.00 14.40 N ATOM 2989 CA VAL C 114 16.919 6.825 17.161 1.00 14.17 C ATOM 2990 C VAL C 114 18.365 6.996 16.722 1.00 14.98 C ATOM 2991 O VAL C 114 18.945 8.045 16.918 1.00 15.58 O ATOM 2992 CB VAL C 114 15.917 7.583 16.233 1.00 13.74 C ATOM 2993 CG1 VAL C 114 16.019 7.102 14.778 1.00 13.72 C ATOM 2994 CG2 VAL C 114 14.455 7.460 16.652 1.00 13.06 C ATOM 2995 H VAL C 114 17.100 8.432 18.645 1.00 0.00 H ATOM 2996 N ALA C 115 18.969 5.932 16.211 1.00 15.12 N ATOM 2997 CA ALA C 115 20.288 5.989 15.745 1.00 15.95 C ATOM 2998 C ALA C 115 20.529 6.640 14.381 1.00 16.28 C ATOM 2999 O ALA C 115 21.447 7.398 14.176 1.00 17.12 O ATOM 3000 CB ALA C 115 20.850 4.575 15.783 1.00 16.10 C ATOM 3001 H ALA C 115 18.450 5.033 16.155 1.00 0.00 H ATOM 3002 N GLU C 116 19.634 6.299 13.431 1.00 15.72 N ATOM 3003 CA GLU C 116 19.824 6.797 12.036 1.00 16.19 C ATOM 3004 C GLU C 116 18.473 6.876 11.357 1.00 15.53 C ATOM 3005 O GLU C 116 17.556 6.165 11.666 1.00 14.79 O ATOM 3006 CB GLU C 116 20.752 5.887 11.284 1.00 16.77 C ATOM 3007 CG GLU C 116 21.173 6.443 9.940 1.00 17.59 C ATOM 3008 CD GLU C 116 21.895 7.803 10.029 1.00 18.46 C ATOM 3009 OE1 GLU C 116 21.153 8.853 10.161 1.00 19.41 O ATOM 3010 OE2 GLU C 116 23.175 7.752 10.020 1.00 19.43 O ATOM 3011 H GLU C 116 18.820 5.696 13.668 1.00 0.00 H ATOM 3012 N VAL C 117 18.412 7.818 10.416 1.00 16.01 N ATOM 3013 CA VAL C 117 17.210 8.008 9.536 1.00 15.67 C ATOM 3014 C VAL C 117 17.744 8.057 8.098 1.00 16.59 C ATOM 3015 O VAL C 117 18.702 8.726 7.793 1.00 17.52 O ATOM 3016 CB VAL C 117 16.566 9.330 9.842 1.00 15.61 C ATOM 3017 CG1 VAL C 117 15.312 9.542 8.927 1.00 15.40 C ATOM 3018 CG2 VAL C 117 16.271 9.461 11.358 1.00 15.02 C ATOM 3019 H VAL C 117 19.230 8.447 10.286 1.00 0.00 H ATOM 3020 N VAL C 118 17.115 7.236 7.265 1.00 16.41 N ATOM 3021 CA VAL C 118 17.442 7.118 5.852 1.00 17.33 C ATOM 3022 C VAL C 118 16.202 7.355 5.024 1.00 17.25 C ATOM 3023 O VAL C 118 15.237 6.645 5.138 1.00 16.54 O ATOM 3024 CB VAL C 118 17.930 5.719 5.571 1.00 17.43 C ATOM 3025 CG1 VAL C 118 18.243 5.577 4.088 1.00 18.52 C ATOM 3026 CG2 VAL C 118 19.204 5.458 6.375 1.00 17.65 C ATOM 3027 H VAL C 118 16.347 6.645 7.643 1.00 0.00 H ATOM 3028 N ARG C 119 16.357 8.293 4.078 1.00 18.24 N ATOM 3029 CA ARG C 119 15.239 8.525 3.132 1.00 18.45 C ATOM 3030 C ARG C 119 15.468 7.608 1.890 1.00 19.26 C ATOM 3031 O ARG C 119 16.512 7.663 1.264 1.00 20.32 O ATOM 3032 CB ARG C 119 15.215 9.984 2.648 1.00 19.34 C ATOM 3033 CG ARG C 119 14.115 10.285 1.641 1.00 19.78 C ATOM 3034 CD ARG C 119 14.090 11.769 1.328 1.00 20.69 C ATOM 3035 NE ARG C 119 13.466 12.485 2.410 1.00 22.91 N ATOM 3036 CZ ARG C 119 13.984 13.454 3.146 1.00 26.28 C ATOM 3037 NH1 ARG C 119 15.251 13.863 2.967 1.00 25.74 N ATOM 3038 NH2 ARG C 119 13.216 13.966 4.112 1.00 24.62 N ATOM 3039 HE ARG C 119 12.491 12.207 2.640 1.00 0.00 H ATOM 3040 HH12 ARG C 119 15.639 14.627 3.557 1.00 0.00 H ATOM 3041 HH11 ARG C 119 15.844 13.416 2.239 1.00 0.00 H ATOM 3042 HH22 ARG C 119 13.581 14.730 4.716 1.00 0.00 H ATOM 3043 HH21 ARG C 119 12.254 13.601 4.260 1.00 0.00 H ATOM 3044 H ARG C 119 17.237 8.843 4.010 1.00 0.00 H ATOM 3045 N ILE C 120 14.516 6.688 1.677 1.00 18.77 N ATOM 3046 CA ILE C 120 14.714 5.671 0.565 1.00 19.59 C ATOM 3047 C ILE C 120 14.919 6.306 -0.838 1.00 21.14 C ATOM 3048 O ILE C 120 15.783 5.873 -1.510 1.00 22.09 O ATOM 3049 CB ILE C 120 13.580 4.625 0.571 1.00 18.96 C ATOM 3050 CG1 ILE C 120 13.776 3.796 1.880 1.00 17.83 C ATOM 3051 CG2 ILE C 120 13.621 3.749 -0.723 1.00 20.06 C ATOM 3052 CD1 ILE C 120 12.691 2.817 2.119 1.00 17.21 C ATOM 3053 H ILE C 120 13.657 6.671 2.263 1.00 0.00 H ATOM 3054 N ARG C 121 14.155 7.328 -1.137 1.00 21.38 N ATOM 3055 CA ARG C 121 14.204 7.872 -2.537 1.00 23.04 C ATOM 3056 C ARG C 121 15.602 8.351 -2.839 1.00 24.17 C ATOM 3057 O ARG C 121 16.078 8.215 -3.964 1.00 25.65 O ATOM 3058 CB ARG C 121 13.183 8.978 -2.679 1.00 23.15 C ATOM 3059 CG ARG C 121 13.259 9.716 -4.030 1.00 25.02 C ATOM 3060 CD ARG C 121 12.097 10.678 -4.193 1.00 25.18 C ATOM 3061 NE ARG C 121 12.117 11.743 -3.176 1.00 24.47 N ATOM 3062 CZ ARG C 121 12.816 12.861 -3.220 1.00 25.37 C ATOM 3063 NH1 ARG C 121 13.646 13.119 -4.228 1.00 27.09 N ATOM 3064 NH2 ARG C 121 12.757 13.660 -2.135 1.00 24.55 N ATOM 3065 HE ARG C 121 11.519 11.599 -2.337 1.00 0.00 H ATOM 3066 HH12 ARG C 121 14.187 14.007 -4.242 1.00 0.00 H ATOM 3067 HH11 ARG C 121 13.753 12.433 -5.002 1.00 0.00 H ATOM 3068 HH22 ARG C 121 13.289 14.553 -2.118 1.00 0.00 H ATOM 3069 HH21 ARG C 121 12.179 13.383 -1.316 1.00 0.00 H ATOM 3070 H ARG C 121 13.530 7.752 -0.422 1.00 0.00 H ATOM 3071 N THR C 122 16.273 8.950 -1.880 1.00 23.69 N ATOM 3072 CA THR C 122 17.532 9.628 -2.089 1.00 24.88 C ATOM 3073 C THR C 122 18.764 9.004 -1.474 1.00 24.71 C ATOM 3074 O THR C 122 19.844 9.454 -1.734 1.00 25.87 O ATOM 3075 CB THR C 122 17.428 11.091 -1.564 1.00 24.95 C ATOM 3076 OG1 THR C 122 17.246 11.036 -0.149 1.00 23.38 O ATOM 3077 CG2 THR C 122 16.289 11.877 -2.317 1.00 25.51 C ATOM 3078 HG1 THR C 122 17.177 11.956 0.210 1.00 0.00 H ATOM 3079 H THR C 122 15.876 8.935 -0.919 1.00 0.00 H ATOM 3080 N ALA C 123 18.612 7.933 -0.697 1.00 23.41 N ATOM 3081 CA ALA C 123 19.722 7.414 0.132 1.00 26.07 C ATOM 3082 C ALA C 123 20.303 8.466 1.164 1.00 31.19 C ATOM 3083 O ALA C 123 21.364 8.273 1.778 1.00 34.89 O ATOM 3084 CB ALA C 123 20.834 6.841 -0.727 1.00 32.28 C ATOM 3085 H ALA C 123 17.691 7.450 -0.672 1.00 0.00 H ATOM 3086 N GLU C 124 19.622 9.587 1.350 1.00 26.01 N ATOM 3087 CA GLU C 124 20.115 10.624 2.247 1.00 27.16 C ATOM 3088 C GLU C 124 19.948 10.085 3.686 1.00 23.61 C ATOM 3089 O GLU C 124 18.904 9.539 4.034 1.00 25.70 O ATOM 3090 CB GLU C 124 19.258 11.902 2.124 1.00 30.21 C ATOM 3091 CG GLU C 124 19.613 12.781 0.942 1.00 29.04 C ATOM 3092 CD GLU C 124 18.527 13.845 0.754 1.00 47.08 C ATOM 3093 OE1 GLU C 124 17.326 13.489 0.733 1.00 26.81 O ATOM 3094 OE2 GLU C 124 18.850 15.049 0.666 1.00 45.26 O ATOM 3095 H GLU C 124 18.722 9.729 0.848 1.00 0.00 H ATOM 3096 N THR C 125 20.984 10.260 4.520 1.00 26.46 N ATOM 3097 CA THR C 125 20.854 9.861 5.945 1.00 23.75 C ATOM 3098 C THR C 125 20.975 11.102 6.849 1.00 33.49 C ATOM 3099 O THR C 125 21.494 12.141 6.424 1.00 29.24 O ATOM 3100 CB THR C 125 22.021 8.902 6.305 1.00 30.36 C ATOM 3101 OG1 THR C 125 23.262 9.642 6.335 1.00 36.88 O ATOM 3102 CG2 THR C 125 22.175 7.790 5.240 1.00 41.99 C ATOM 3103 HG1 THR C 125 24.005 9.029 6.565 1.00 0.00 H ATOM 3104 H THR C 125 21.873 10.672 4.171 1.00 0.00 H ATOM 3105 N GLY C 126 20.552 10.996 8.107 1.00 35.33 N ATOM 3106 CA GLY C 126 21.000 12.010 9.081 1.00 30.70 C ATOM 3107 C GLY C 126 20.172 13.268 8.919 1.00 24.25 C ATOM 3108 O GLY C 126 18.939 13.151 8.621 1.00 29.77 O ATOM 3109 H GLY C 126 19.923 10.220 8.395 1.00 0.00 H ATOM 3110 N LEU C 127 20.811 14.451 9.089 1.00 35.44 N ATOM 3111 CA LEU C 127 20.206 15.787 8.777 1.00 46.39 C ATOM 3112 C LEU C 127 19.089 16.214 9.741 1.00 31.36 C ATOM 3113 O LEU C 127 18.032 16.677 9.296 1.00 90.93 O ATOM 3114 CB LEU C 127 19.649 15.858 7.338 1.00 34.73 C ATOM 3115 H LEU C 127 21.783 14.431 9.459 1.00 0.00 H TER 3116 LEU C 127 HETATM 3117 MG MG A 1 7.388 12.122 1.303 1.00 16.03 MG HETATM 3118 MG MG A 2 11.224 -19.535 14.927 1.00 24.58 MG HETATM 3119 O HOH 3 25.470 7.056 3.675 1.00 37.19 O HETATM 3120 O HOH 4 23.416 1.855 -0.677 1.00 28.25 O HETATM 3121 O HOH 5 28.281 2.726 8.867 1.00 28.98 O HETATM 3122 O HOH 6 28.537 1.365 12.004 1.00 41.01 O HETATM 3123 O HOH 7 28.857 3.724 13.011 1.00 23.54 O HETATM 3124 O HOH 8 26.743 7.658 25.284 1.00 29.66 O HETATM 3125 O HOH 9 24.676 7.293 16.414 1.00 15.99 O HETATM 3126 O HOH 10 24.699 10.347 16.073 1.00 34.74 O HETATM 3127 O HOH 11 28.690 4.044 27.261 1.00 28.52 O HETATM 3128 O HOH 12 29.671 3.314 18.874 1.00 17.06 O HETATM 3129 O HOH 13 29.033 -5.339 18.588 1.00 33.39 O HETATM 3130 O HOH 14 30.749 4.714 15.005 1.00 32.43 O HETATM 3131 O HOH 15 30.094 7.519 21.530 1.00 16.60 O HETATM 3132 O HOH 16 7.433 0.052 17.760 1.00 30.94 O HETATM 3133 O HOH 17 23.398 4.714 23.841 1.00 35.13 O HETATM 3134 O HOH 18 25.023 8.289 23.520 1.00 23.87 O HETATM 3135 O HOH 19 25.660 2.891 24.385 1.00 20.85 O HETATM 3136 O HOH 20 28.495 0.785 26.216 1.00 22.73 O HETATM 3137 O HOH 21 2.696 -8.975 0.349 1.00 34.04 O HETATM 3138 O HOH 22 28.598 -4.517 24.787 1.00 41.49 O HETATM 3139 O HOH 23 22.732 -4.601 22.471 1.00 25.33 O HETATM 3140 O HOH 24 26.810 -7.542 17.703 1.00 21.99 O HETATM 3141 O HOH 25 17.383 -7.076 -5.749 1.00 25.91 O HETATM 3142 O HOH 26 9.775 -2.277 18.284 1.00 19.02 O HETATM 3143 O HOH 27 14.586 -0.559 19.156 1.00 14.36 O HETATM 3144 O HOH 28 9.472 2.545 16.137 1.00 18.03 O HETATM 3145 O HOH 29 13.066 1.812 19.947 1.00 18.44 O HETATM 3146 O HOH 30 10.207 5.477 13.805 1.00 23.92 O HETATM 3147 O HOH 31 6.627 3.793 13.344 1.00 27.70 O HETATM 3148 O HOH 32 -3.383 0.226 7.116 1.00 28.65 O HETATM 3149 O HOH 33 -4.299 -1.514 10.533 1.00 33.91 O HETATM 3150 O HOH 34 -4.434 -2.434 6.820 1.00 36.35 O HETATM 3151 O HOH 35 8.732 1.839 -1.587 1.00 10.64 O HETATM 3152 O HOH 36 6.552 4.910 -7.435 1.00 20.85 O HETATM 3153 O HOH 37 2.566 3.876 -4.196 1.00 22.56 O HETATM 3154 O HOH 38 3.487 8.121 -4.157 1.00 27.69 O HETATM 3155 O HOH 39 1.864 -6.243 -0.193 1.00 29.59 O HETATM 3156 O HOH 40 2.840 -6.383 -5.054 1.00 21.55 O HETATM 3157 O HOH 41 -9.417 16.450 7.662 1.00 40.54 O HETATM 3158 O HOH 42 8.491 -12.523 -1.742 1.00 20.87 O HETATM 3159 O HOH 43 -2.215 -1.249 1.102 1.00 37.48 O HETATM 3160 O HOH 44 -3.495 -3.831 5.012 1.00 33.74 O HETATM 3161 O HOH 45 10.296 -14.471 -1.472 1.00 20.47 O HETATM 3162 O HOH 46 28.542 -9.879 14.305 1.00 32.89 O HETATM 3163 O HOH 47 27.790 -7.136 6.180 1.00 37.19 O HETATM 3164 O HOH 48 19.391 -10.416 -1.301 1.00 27.67 O HETATM 3165 O HOH 49 15.463 -9.298 -4.711 1.00 19.05 O HETATM 3166 O HOH 50 24.799 -7.499 1.031 1.00 36.82 O HETATM 3167 O HOH 51 23.572 -4.339 -1.306 1.00 31.06 O HETATM 3168 O HOH 52 16.396 -16.384 5.613 1.00 34.75 O HETATM 3169 O HOH 53 17.232 -12.831 -7.248 1.00 30.98 O HETATM 3170 O HOH 54 22.900 -13.355 6.235 1.00 45.13 O HETATM 3171 O HOH 55 14.189 -16.237 8.440 1.00 35.68 O HETATM 3172 O HOH 56 19.100 -11.547 10.367 1.00 26.79 O HETATM 3173 O HOH 57 16.206 -13.622 14.667 1.00 25.32 O HETATM 3174 O HOH 58 16.902 -10.327 11.289 1.00 20.93 O HETATM 3175 O HOH 59 6.459 -4.256 12.027 1.00 15.55 O HETATM 3176 O HOH 60 10.561 -6.501 15.634 1.00 24.81 O HETATM 3177 O HOH 61 0.828 -7.664 9.459 1.00 28.66 O HETATM 3178 O HOH 62 0.707 -6.834 5.355 1.00 26.21 O HETATM 3179 O HOH 63 10.349 -19.460 30.952 1.00 38.00 O HETATM 3180 O HOH 64 4.153 -2.515 15.058 1.00 25.64 O HETATM 3181 O HOH 65 5.614 -4.669 14.644 1.00 36.74 O HETATM 3182 O HOH 66 -3.057 0.739 9.399 1.00 32.38 O HETATM 3183 O HOH 67 -1.948 -2.135 11.627 1.00 33.55 O HETATM 3184 O HOH 68 -1.305 0.008 5.332 1.00 19.22 O HETATM 3185 O HOH 69 4.746 9.387 2.907 1.00 15.73 O HETATM 3186 O HOH 70 4.235 16.740 6.525 1.00 27.17 O HETATM 3187 O HOH 71 7.717 19.268 5.969 1.00 38.41 O HETATM 3188 O HOH 72 9.221 17.333 -2.139 1.00 43.64 O HETATM 3189 O HOH 73 -5.999 18.609 9.982 1.00 24.36 O HETATM 3190 O HOH 74 -4.202 21.381 9.396 1.00 32.83 O HETATM 3191 O HOH 75 -8.590 14.913 6.382 1.00 40.68 O HETATM 3192 O HOH 76 -5.806 7.950 5.060 1.00 36.60 O HETATM 3193 O HOH 77 -4.280 9.259 1.357 1.00 30.54 O HETATM 3194 O HOH 78 -3.198 5.370 0.970 1.00 23.41 O HETATM 3195 O HOH 79 -0.206 3.354 -0.402 1.00 24.41 O HETATM 3196 O HOH 80 2.633 3.996 -0.681 1.00 28.88 O HETATM 3197 O HOH 81 -0.658 -1.380 3.710 1.00 32.98 O HETATM 3198 O HOH 82 3.575 0.318 14.715 1.00 28.48 O HETATM 3199 O HOH 83 8.346 -5.159 16.123 1.00 25.04 O HETATM 3200 O HOH 84 26.639 -10.692 12.434 1.00 35.42 O HETATM 3201 O HOH 85 27.910 -7.387 15.261 1.00 16.33 O HETATM 3202 O HOH 86 26.809 -2.226 9.975 1.00 17.05 O HETATM 3203 O HOH 87 30.429 -0.468 14.523 1.00 32.73 O HETATM 3204 O HOH 88 31.299 3.068 16.878 1.00 20.16 O HETATM 3205 O HOH 89 26.762 -4.301 7.120 1.00 17.89 O HETATM 3206 O HOH 90 30.098 -5.088 8.892 1.00 31.09 O HETATM 3207 O HOH 91 29.438 -0.323 6.332 1.00 26.90 O HETATM 3208 O HOH 92 23.797 -4.982 1.196 1.00 19.49 O HETATM 3209 O HOH 93 21.001 0.784 -1.224 1.00 22.98 O HETATM 3210 O HOH 94 26.377 -3.626 1.585 1.00 32.03 O HETATM 3211 O HOH 95 17.259 3.728 -2.113 1.00 28.32 O HETATM 3212 O HOH 96 17.105 -4.594 -4.982 1.00 30.77 O HETATM 3213 O HOH 97 16.199 9.357 -6.270 1.00 34.05 O HETATM 3214 O HOH 98 12.261 2.883 -10.480 1.00 16.63 O HETATM 3215 O HOH 99 12.117 7.381 -10.967 1.00 29.50 O HETATM 3216 O HOH 100 14.033 11.033 -6.971 1.00 30.24 O HETATM 3217 O HOH 101 8.130 12.164 -7.181 1.00 22.97 O HETATM 3218 O HOH 102 4.978 10.047 -5.660 1.00 28.77 O HETATM 3219 O HOH 103 11.784 8.266 0.163 1.00 11.23 O HETATM 3220 O HOH 104 10.460 13.490 8.145 1.00 18.80 O HETATM 3221 O HOH 105 13.161 12.353 8.316 1.00 33.01 O HETATM 3222 O HOH 106 13.212 4.570 18.742 1.00 11.70 O HETATM 3223 O HOH 107 23.111 -6.311 24.412 1.00 35.62 O HETATM 3224 O HOH 108 18.525 -14.927 22.078 1.00 29.85 O HETATM 3225 O HOH 109 16.242 -21.231 16.903 1.00 37.14 O HETATM 3226 O HOH 110 18.276 -20.455 21.964 1.00 35.55 O HETATM 3227 O HOH 111 18.866 -20.406 16.281 1.00 43.49 O HETATM 3228 O HOH 112 10.957 -18.999 20.946 1.00 14.76 O HETATM 3229 O HOH 113 12.068 -19.392 28.563 1.00 43.08 O HETATM 3230 O HOH 114 12.801 -25.114 25.550 1.00 35.18 O HETATM 3231 O HOH 115 16.763 -26.389 21.346 1.00 41.99 O HETATM 3232 O HOH 116 13.850 -26.206 23.129 1.00 33.76 O HETATM 3233 O HOH 117 16.922 -24.330 26.807 1.00 27.81 O HETATM 3234 O HOH 118 22.249 -16.831 25.678 1.00 41.32 O HETATM 3235 O HOH 119 19.179 -14.173 19.576 1.00 42.22 O HETATM 3236 O HOH 120 12.370 15.187 0.707 1.00 31.09 O HETATM 3237 O HOH 121 7.701 5.990 12.603 1.00 22.38 O HETATM 3238 O HOH 122 8.390 14.714 12.387 1.00 14.09 O HETATM 3239 O HOH 123 22.708 -5.130 33.107 1.00 31.55 O HETATM 3240 O HOH 124 23.569 -3.476 27.175 1.00 29.69 O HETATM 3241 O HOH 125 23.574 5.573 27.853 1.00 32.52 O HETATM 3242 O HOH 126 -0.232 -23.193 17.559 1.00 36.26 O HETATM 3243 O HOH 127 -3.567 -21.665 17.798 1.00 35.87 O HETATM 3244 O HOH 128 -6.882 -12.638 23.009 1.00 35.61 O HETATM 3245 O HOH 129 22.812 3.276 35.062 1.00 38.02 O HETATM 3246 O HOH 130 19.537 9.934 33.795 1.00 42.96 O HETATM 3247 O HOH 131 -7.515 -20.923 22.556 1.00 25.90 O HETATM 3248 O HOH 132 -8.154 -18.491 25.976 1.00 26.14 O HETATM 3249 O HOH 133 20.085 4.444 35.355 1.00 38.33 O HETATM 3250 O HOH 134 15.567 6.658 30.587 1.00 23.48 O HETATM 3251 O HOH 135 14.996 3.599 36.730 1.00 18.18 O HETATM 3252 O HOH 136 13.854 5.870 37.871 1.00 36.81 O HETATM 3253 O HOH 137 7.670 1.905 20.855 1.00 20.05 O HETATM 3254 O HOH 138 12.052 1.982 22.984 1.00 16.09 O HETATM 3255 O HOH 139 2.003 1.424 35.159 1.00 30.09 O HETATM 3256 O HOH 140 3.125 2.556 30.307 1.00 30.91 O HETATM 3257 O HOH 141 -4.887 -1.353 33.949 1.00 40.13 O HETATM 3258 O HOH 142 5.220 0.636 24.609 1.00 23.44 O HETATM 3259 O HOH 143 -7.264 -10.230 20.573 1.00 31.17 O HETATM 3260 O HOH 144 11.914 -5.444 17.722 1.00 23.04 O HETATM 3261 O HOH 145 -4.577 -5.224 8.717 1.00 36.86 O HETATM 3262 O HOH 146 13.500 -19.743 5.001 1.00 46.62 O HETATM 3263 O HOH 147 4.153 -18.046 22.246 1.00 14.01 O HETATM 3264 O HOH 148 3.196 -24.757 20.471 1.00 17.34 O HETATM 3265 O HOH 149 0.591 -20.572 17.416 1.00 24.95 O HETATM 3266 O HOH 150 4.245 -23.405 15.580 1.00 30.98 O HETATM 3267 O HOH 151 -2.097 -19.111 18.008 1.00 18.86 O HETATM 3268 O HOH 152 -5.693 -14.227 21.422 1.00 26.97 O HETATM 3269 O HOH 153 -6.369 -18.679 23.902 1.00 17.02 O HETATM 3270 O HOH 154 0.637 -23.644 19.964 1.00 20.35 O HETATM 3271 O HOH 155 -0.326 -22.608 30.044 1.00 19.98 O HETATM 3272 O HOH 156 0.824 -18.641 32.005 1.00 21.67 O HETATM 3273 O HOH 157 3.575 -21.247 29.580 1.00 17.22 O HETATM 3274 O HOH 158 -6.608 -12.661 30.003 1.00 18.23 O HETATM 3275 O HOH 159 -6.546 -11.522 25.282 1.00 33.55 O HETATM 3276 O HOH 160 -1.696 -17.209 32.442 1.00 17.35 O HETATM 3277 O HOH 161 -4.621 -14.074 14.940 1.00 30.82 O HETATM 3278 O HOH 162 -6.925 -11.441 32.359 1.00 33.42 O HETATM 3279 O HOH 163 -3.130 -17.099 34.677 1.00 25.58 O HETATM 3280 O HOH 164 17.724 0.968 38.746 1.00 30.17 O HETATM 3281 O HOH 165 18.478 -3.187 39.917 1.00 30.97 O HETATM 3282 O HOH 166 1.040 -13.314 37.912 1.00 19.22 O HETATM 3283 O HOH 167 -0.349 -16.707 35.695 1.00 31.93 O HETATM 3284 O HOH 168 -2.230 -4.914 37.182 1.00 31.38 O HETATM 3285 O HOH 169 -6.223 -8.699 32.726 1.00 33.03 O HETATM 3286 O HOH 170 -2.325 -5.094 33.165 1.00 17.87 O HETATM 3287 O HOH 171 -2.951 -10.935 41.886 1.00 30.37 O HETATM 3288 O HOH 172 3.101 -1.208 35.599 1.00 14.05 O HETATM 3289 O HOH 173 3.867 -0.105 31.053 1.00 33.88 O HETATM 3290 O HOH 174 -6.150 0.723 40.625 1.00 36.79 O HETATM 3291 O HOH 175 -2.635 2.649 36.922 1.00 30.57 O HETATM 3292 O HOH 176 -2.341 -2.897 31.278 1.00 17.60 O HETATM 3293 O HOH 177 -2.813 0.463 31.773 1.00 27.59 O HETATM 3294 O HOH 178 1.253 2.321 28.251 1.00 39.66 O HETATM 3295 O HOH 179 2.875 0.194 26.222 1.00 24.96 O HETATM 3296 O HOH 180 3.855 0.657 28.705 1.00 29.13 O HETATM 3297 O HOH 181 -2.937 -0.501 28.908 1.00 23.57 O HETATM 3298 O HOH 182 -1.707 1.236 26.383 1.00 33.52 O HETATM 3299 O HOH 183 2.246 -3.463 20.993 1.00 16.07 O HETATM 3300 O HOH 184 -5.222 -8.640 19.599 1.00 21.57 O HETATM 3301 O HOH 185 2.758 -1.347 17.645 1.00 27.88 O HETATM 3302 O HOH 186 -1.105 -7.537 11.318 1.00 40.28 O HETATM 3303 O HOH 187 -1.356 -5.125 12.411 1.00 27.98 O HETATM 3304 O HOH 188 -1.896 -11.520 14.118 1.00 27.52 O HETATM 3305 O HOH 189 -2.341 -9.994 11.951 1.00 32.41 O HETATM 3306 O HOH 190 -1.761 -7.016 7.009 1.00 43.16 O HETATM 3307 O HOH 191 8.107 -17.125 13.983 1.00 24.87 O HETATM 3308 O HOH 192 14.952 -18.449 6.800 1.00 37.25 O HETATM 3309 O HOH 193 1.572 -18.267 7.058 1.00 33.04 O HETATM 3310 O HOH 194 1.285 -14.872 5.958 1.00 41.57 O HETATM 3311 O HOH 195 -0.946 -17.295 10.701 1.00 33.86 O HETATM 3312 O HOH 196 -0.223 -17.899 14.187 1.00 25.29 O HETATM 3313 O HOH 197 1.885 -18.448 16.191 1.00 23.97 O HETATM 3314 O HOH 198 5.531 -16.658 17.808 1.00 32.35 O HETATM 3315 O HOH 199 -5.643 -12.511 19.461 1.00 30.94 O HETATM 3316 O HOH 200 -3.169 -12.290 15.710 1.00 31.36 O HETATM 3317 O HOH 201 2.509 -0.496 20.691 1.00 30.44 O HETATM 3318 O HOH 202 5.437 -1.264 34.299 1.00 17.86 O HETATM 3319 O HOH 203 12.207 0.496 39.838 1.00 13.73 O HETATM 3320 O HOH 204 15.173 1.319 38.089 1.00 15.61 O HETATM 3321 O HOH 205 16.336 -5.632 35.652 1.00 16.60 O HETATM 3322 O HOH 206 13.745 -7.280 37.854 1.00 14.08 O HETATM 3323 O HOH 207 16.769 -4.912 39.880 1.00 38.85 O HETATM 3324 O HOH 208 18.684 -1.497 38.162 1.00 27.78 O HETATM 3325 O HOH 209 6.838 0.212 36.226 1.00 12.07 O HETATM 3326 O HOH 210 9.511 -12.594 37.568 1.00 19.65 O HETATM 3327 O HOH 211 10.851 -17.260 32.528 1.00 25.43 O HETATM 3328 O HOH 212 15.416 -9.134 38.866 1.00 35.10 O HETATM 3329 O HOH 213 4.769 -16.121 34.047 1.00 29.45 O HETATM 3330 O HOH 214 6.826 -21.808 31.725 1.00 34.81 O HETATM 3331 O HOH 215 3.325 -18.134 33.959 1.00 31.01 O HETATM 3332 O HOH 216 6.407 -27.822 27.435 1.00 34.47 O HETATM 3333 O HOH 217 10.451 -28.518 20.896 1.00 36.42 O HETATM 3334 O HOH 218 9.590 -27.487 18.199 1.00 36.25 O HETATM 3335 O HOH 219 6.076 -25.361 16.118 1.00 32.85 O HETATM 3336 O HOH 220 15.034 3.198 21.283 1.00 24.56 O HETATM 3337 O HOH 221 10.950 10.294 31.994 1.00 27.42 O HETATM 3338 O HOH 222 4.038 12.236 33.358 1.00 33.25 O HETATM 3339 O HOH 223 3.218 14.281 32.716 1.00 37.01 O HETATM 3340 O HOH 224 -0.510 6.750 38.888 1.00 37.98 O HETATM 3341 O HOH 225 -3.031 9.949 30.827 1.00 19.99 O HETATM 3342 O HOH 226 -2.373 18.087 33.348 1.00 47.05 O HETATM 3343 O HOH 227 14.005 17.948 25.627 1.00 39.44 O HETATM 3344 O HOH 228 28.061 9.844 29.606 1.00 35.94 O HETATM 3345 O HOH 229 27.834 13.334 28.503 1.00 36.25 O HETATM 3346 O HOH 230 18.115 11.119 29.445 1.00 34.53 O HETATM 3347 O HOH 231 15.767 14.829 35.481 1.00 49.77 O HETATM 3348 O HOH 232 25.605 11.267 29.794 1.00 43.12 O HETATM 3349 O HOH 233 24.497 15.436 22.428 1.00 35.42 O HETATM 3350 O HOH 234 20.740 10.024 16.269 1.00 26.72 O HETATM 3351 O HOH 235 19.742 17.074 16.662 1.00 29.21 O HETATM 3352 O HOH 236 6.789 2.093 16.512 1.00 34.41 O HETATM 3353 O HOH 237 -6.571 2.554 10.914 1.00 36.99 O HETATM 3354 O HOH 238 6.721 2.727 24.659 1.00 18.47 O HETATM 3355 O HOH 239 4.356 0.495 22.105 1.00 40.91 O HETATM 3356 O HOH 240 -6.269 10.540 24.904 1.00 12.59 O HETATM 3357 O HOH 241 -11.229 5.303 25.896 1.00 18.41 O HETATM 3358 O HOH 242 -12.235 7.512 24.398 1.00 34.06 O HETATM 3359 O HOH 243 -9.124 5.455 27.727 1.00 25.42 O HETATM 3360 O HOH 244 -9.683 8.432 14.908 1.00 23.38 O HETATM 3361 O HOH 245 -13.254 12.505 16.410 1.00 18.16 O HETATM 3362 O HOH 246 -10.175 14.978 17.360 1.00 19.75 O HETATM 3363 O HOH 247 -12.704 11.167 25.940 1.00 31.16 O HETATM 3364 O HOH 248 -7.186 18.303 24.215 1.00 21.00 O HETATM 3365 O HOH 249 -7.203 16.587 11.313 1.00 23.46 O HETATM 3366 O HOH 250 18.006 21.267 15.407 1.00 35.43 O HETATM 3367 O HOH 251 3.139 20.323 8.575 1.00 37.36 O HETATM 3368 O HOH 252 0.395 23.103 26.545 1.00 34.89 O HETATM 3369 O HOH 253 5.233 26.815 13.667 1.00 31.90 O HETATM 3370 O HOH 254 7.587 23.662 12.955 1.00 31.85 O HETATM 3371 O HOH 255 7.825 22.701 8.917 1.00 36.00 O HETATM 3372 O HOH 256 8.945 17.419 12.164 1.00 24.90 O HETATM 3373 O HOH 257 13.974 16.030 6.314 1.00 39.58 O HETATM 3374 O HOH 258 2.611 4.382 14.768 1.00 13.67 O HETATM 3375 O HOH 259 -3.122 3.054 10.698 1.00 22.14 O HETATM 3376 O HOH 260 -6.253 5.329 12.157 1.00 31.05 O HETATM 3377 O HOH 261 -4.934 3.745 12.619 1.00 28.46 O HETATM 3378 O HOH 262 -4.780 -2.924 16.354 1.00 35.46 O HETATM 3379 O HOH 263 -2.991 -2.848 14.800 1.00 42.55 O HETATM 3380 O HOH 264 -7.462 -0.413 17.607 1.00 20.23 O HETATM 3381 O HOH 265 -6.901 -20.900 37.651 1.00 32.54 O HETATM 3382 O HOH 266 -11.054 -8.106 25.512 1.00 38.94 O HETATM 3383 O HOH 267 -11.969 -4.868 22.143 1.00 29.22 O HETATM 3384 O HOH 268 -9.127 4.756 24.131 1.00 13.90 O HETATM 3385 O HOH 269 -10.369 -3.078 16.959 1.00 32.51 O HETATM 3386 O HOH 270 -12.925 -3.122 20.254 1.00 24.31 O HETATM 3387 O HOH 271 -8.009 2.389 17.154 1.00 21.30 O HETATM 3388 O HOH 272 -9.454 5.845 14.736 1.00 22.85 O HETATM 3389 O HOH 273 15.270 21.346 15.069 1.00 45.30 O HETATM 3390 O HOH 274 18.316 19.269 17.255 1.00 22.11 O HETATM 3391 O HOH 275 13.652 19.652 22.948 1.00 22.27 O HETATM 3392 O HOH 276 18.552 20.371 21.538 1.00 30.39 O HETATM 3393 O HOH 277 11.409 21.956 21.326 1.00 20.69 O HETATM 3394 O HOH 278 4.708 23.333 22.132 1.00 23.10 O HETATM 3395 O HOH 279 1.180 20.239 27.037 1.00 22.50 O HETATM 3396 O HOH 280 -12.469 11.588 28.147 1.00 28.29 O HETATM 3397 O HOH 281 -11.426 10.169 35.355 1.00 43.47 O HETATM 3398 O HOH 282 -4.120 6.370 30.299 1.00 27.33 O HETATM 3399 O HOH 283 -0.397 6.346 34.025 1.00 43.73 O HETATM 3400 O HOH 284 22.400 10.567 11.867 1.00 32.49 O HETATM 3401 O HOH 285 24.530 9.415 8.776 1.00 27.39 O HETATM 3402 O HOH 286 22.790 12.317 3.467 1.00 36.89 O HETATM 3403 O HOH 287 18.360 13.615 5.727 1.00 32.26 O HETATM 3404 C1 AKG A 288 4.667 12.430 1.968 1.00 0.12 C HETATM 3405 O1 AKG A 288 5.769 12.691 2.441 1.00 -0.55 O HETATM 3406 O2 AKG A 288 3.534 12.679 2.653 1.00 -0.55 O HETATM 3407 C2 AKG A 288 4.628 11.857 0.723 1.00 0.17 C HETATM 3408 O5 AKG A 288 5.730 11.582 0.173 1.00 -0.36 O HETATM 3409 C3 AKG A 288 3.261 11.524 0.121 1.00 0.04 C HETATM 3410 C4 AKG A 288 3.312 10.584 -1.120 1.00 0.02 C HETATM 3411 C5 AKG A 288 3.288 9.095 -0.704 1.00 0.04 C HETATM 3412 O3 AKG A 288 3.460 8.714 0.431 1.00 -0.57 O HETATM 3413 O4 AKG A 288 2.979 8.156 -1.484 1.00 -0.57 O HETATM 3414 H AKG A 288 4.237 10.783 -1.682 1.00 0.05 H HETATM 3415 H AKG A 288 2.442 10.790 -1.761 1.00 0.05 H HETATM 3416 H AKG A 288 2.780 12.466 -0.181 1.00 0.05 H HETATM 3417 H AKG A 288 2.654 11.035 0.897 1.00 0.05 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 497 496 3117 CONECT 521 522 526 527 528 CONECT 526 521 CONECT 527 521 CONECT 528 521 CONECT 1064 1065 1072 1073 1074 CONECT 1072 1064 CONECT 1073 1064 CONECT 1074 1064 CONECT 1557 1556 3118 CONECT 1581 1582 1592 1593 1594 CONECT 1592 1581 CONECT 1593 1581 CONECT 1594 1581 CONECT 2100 2101 2105 2106 2107 CONECT 2105 2100 CONECT 2106 2100 CONECT 2107 2100 CONECT 2564 2565 2569 2570 2571 CONECT 2569 2564 CONECT 2570 2564 CONECT 2571 2564 CONECT 3117 497 CONECT 3118 1557 CONECT 3404 3405 3406 3407 CONECT 3405 3404 CONECT 3406 3404 CONECT 3407 3404 3408 3409 CONECT 3408 3407 CONECT 3409 3407 3410 3416 3417 CONECT 3410 3409 3411 3414 3415 CONECT 3411 3410 3412 3413 CONECT 3412 3411 CONECT 3413 3411 CONECT 3414 3410 CONECT 3415 3410 CONECT 3416 3409 CONECT 3417 3409 MASTER 0 0 0 0 0 0 0 0 3411 6 42 29 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 4usi
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4usj
RCSB PDB
PDBbind
154aa, >4USJ_2|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
2xzw
RCSB PDB
PDBbind
AKG
3hww
RCSB PDB
PDBbind
AKG
3ouj
RCSB PDB
PDBbind
AKG
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RCSB PDB
PDBbind
AKG
4oct
RCSB PDB
PDBbind
AKG
4qkd
RCSB PDB
PDBbind
AKG
4y5s
RCSB PDB
PDBbind
AKG
5c3p
RCSB PDB
PDBbind
AKG
5c5t
RCSB PDB
PDBbind
AKG
5hv0
RCSB PDB
PDBbind
AKG
6f4n
RCSB PDB
PDBbind
AKG
6gdy
RCSB PDB
PDBbind
AKG
Entry Information
PDB ID
4usi
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
NITROGEN REGULATORY PROTEIN PII
Ligand Name
AKG
EC.Number
E.C.-.-.-.-
Resolution
1.45(Å)
Affinity (Kd/Ki/IC50)
Kd=38.9uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Cell(Cambridge,Mass.) Vol. 159: pp. 1188-1199
Ligand Properties
Formula
C
5
H
6
O
5
Molecular Weight
146.098
Exact Mass
146.022
No. of atoms
16
No. of bonds
15
Polar Surface Area
91.67
LOGP Value
1.43 (
Computed with XLOGP3
)
-0.50 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 0
Canonical SMILES
OC(=O)CCC(=O)C(=O)O
InChI String
InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
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):
A8JI83
Entrez Gene ID
NCBI Entrez Gene ID:
5729212
ASD
Information of known allosteric effects of PDB entries
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