Browse entries in the PDBbind-CN Database
HEADER 5H5R_COMPLEX COMPND 5H5R_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 44 SER ALA SER ARG ASP ASP TRP ARG ALA ALA ARG SER MET SEQRES 2 A 44 HIS GLU PHE SER ALA LYS ASP ILE ASP GLY HIS MET VAL SEQRES 3 A 44 ASN LEU ASP LYS TYR ARG GLY PHE VAL SER ILE VAL THR SEQRES 4 A 44 ASN VAL ALA SER GLN SEQRES 1 A 124 GLY LYS THR GLU VAL ASN TYR THR GLN LEU VAL ASP LEU SEQRES 2 A 124 HIS ALA ARG TYR ALA GLU ARG GLY LEU ARG ILE LEU ALA SEQRES 3 A 124 PHE PRO SER ASN GLN PHE GLY LYS GLN GLU PRO GLY SER SEQRES 4 A 124 ASN GLU GLU ILE LYS GLU PHE ALA ALA GLY TYR ASN VAL SEQRES 5 A 124 LYS PHE ASP MET PHE SER LYS ILE GLU VAL ASN GLY ASP SEQRES 6 A 124 ASP ALA HIS PRO LEU TRP LYS TRP MET LYS ILE GLN PRO SEQRES 7 A 124 LYS GLY LYS GLY ILE LEU GLY ASN ALA ILE LYS TRP ASN SEQRES 8 A 124 PHE THR LYS PHE LEU ILE ASP LYS ASN GLY VAL VAL VAL SEQRES 9 A 124 LYS ARG TYR GLY PRO MET GLU GLU PRO LEU VAL ILE GLU SEQRES 10 A 124 LYS ASP LEU PRO HIS TYR PHE HET ACE A 347 237 ATOM 1 N SER A 29 36.879 -0.415 28.279 1.00 28.48 N ATOM 2 CA SER A 29 37.736 0.685 28.838 1.00 28.57 C ATOM 3 C SER A 29 39.234 0.550 28.456 1.00 27.35 C ATOM 4 O SER A 29 39.775 1.453 27.819 1.00 27.15 O ATOM 5 CB SER A 29 37.531 0.809 30.354 1.00 29.86 C ATOM 6 OG SER A 29 36.144 0.899 30.660 1.00 30.94 O ATOM 7 HG SER A 29 36.028 0.978 31.640 1.00 0.00 H ATOM 8 HN3 SER A 29 37.214 -1.331 28.640 1.00 0.00 H ATOM 9 HN2 SER A 29 36.940 -0.407 27.241 1.00 0.00 H ATOM 10 HN1 SER A 29 35.892 -0.266 28.570 1.00 0.00 H ATOM 11 N ALA A 30 39.894 -0.551 28.834 1.00 25.49 N ATOM 12 CA ALA A 30 41.220 -0.912 28.264 1.00 24.58 C ATOM 13 C ALA A 30 41.087 -1.341 26.797 1.00 22.93 C ATOM 14 O ALA A 30 42.044 -1.269 26.030 1.00 23.23 O ATOM 15 CB ALA A 30 41.896 -2.021 29.068 1.00 25.00 C ATOM 16 H ALA A 30 39.467 -1.174 29.549 1.00 0.00 H ATOM 17 N SER A 31 39.901 -1.803 26.419 1.00 20.94 N ATOM 18 CA SER A 31 39.612 -2.152 25.028 1.00 19.16 C ATOM 19 C SER A 31 39.252 -0.930 24.187 1.00 16.84 C ATOM 20 O SER A 31 38.860 0.131 24.692 1.00 16.67 O ATOM 21 CB SER A 31 38.496 -3.177 24.951 1.00 19.79 C ATOM 22 OG SER A 31 37.288 -2.605 25.402 1.00 20.92 O ATOM 23 HG SER A 31 37.059 -1.828 24.832 1.00 0.00 H ATOM 24 H SER A 31 39.155 -1.920 27.134 1.00 0.00 H ATOM 25 N ARG A 32 39.405 -1.103 22.882 1.00 14.76 N ATOM 26 CA ARG A 32 39.009 -0.067 21.947 1.00 13.18 C ATOM 27 C ARG A 32 37.500 0.145 22.070 1.00 12.36 C ATOM 28 O ARG A 32 36.713 -0.817 22.024 1.00 12.45 O ATOM 29 CB ARG A 32 39.354 -0.451 20.521 1.00 12.43 C ATOM 30 CG ARG A 32 39.234 0.723 19.582 1.00 11.84 C ATOM 31 CD ARG A 32 39.465 0.356 18.135 1.00 11.34 C ATOM 32 NE ARG A 32 39.315 1.569 17.347 1.00 11.03 N ATOM 33 CZ ARG A 32 39.292 1.637 16.018 1.00 10.87 C ATOM 34 NH1 ARG A 32 39.456 0.549 15.285 1.00 10.90 N ATOM 35 NH2 ARG A 32 39.104 2.807 15.435 1.00 10.78 N ATOM 36 HE ARG A 32 39.217 2.463 17.869 1.00 0.00 H ATOM 37 HH12 ARG A 32 39.436 0.613 14.247 1.00 0.00 H ATOM 38 HH11 ARG A 32 39.605 -0.371 15.746 1.00 0.00 H ATOM 39 HH22 ARG A 32 39.084 2.874 14.397 1.00 0.00 H ATOM 40 HH21 ARG A 32 38.976 3.662 16.014 1.00 0.00 H ATOM 41 H ARG A 32 39.813 -1.990 22.525 1.00 0.00 H ATOM 42 N ASP A 33 37.100 1.399 22.218 1.00 11.86 N ATOM 43 CA ASP A 33 35.679 1.706 22.381 1.00 11.71 C ATOM 44 C ASP A 33 35.230 2.921 21.565 1.00 11.02 C ATOM 45 O ASP A 33 34.384 3.706 21.988 1.00 10.86 O ATOM 46 CB ASP A 33 35.270 1.772 23.870 1.00 12.59 C ATOM 47 CG ASP A 33 35.938 2.885 24.622 1.00 13.52 C ATOM 48 OD1 ASP A 33 36.720 3.665 24.042 1.00 14.01 O ATOM 49 OD2 ASP A 33 35.668 2.996 25.847 1.00 15.13 O ATOM 50 H ASP A 33 37.799 2.169 22.218 1.00 0.00 H ATOM 51 N ASP A 34 35.761 3.028 20.342 1.00 10.73 N ATOM 52 CA ASP A 34 35.258 4.005 19.379 1.00 10.59 C ATOM 53 C ASP A 34 33.814 3.742 18.981 1.00 9.80 C ATOM 54 O ASP A 34 33.166 4.655 18.462 1.00 9.66 O ATOM 55 CB ASP A 34 36.169 4.056 18.148 1.00 11.28 C ATOM 56 CG ASP A 34 37.469 4.743 18.450 1.00 12.22 C ATOM 57 OD1 ASP A 34 37.421 5.846 19.030 1.00 13.20 O ATOM 58 OD2 ASP A 34 38.530 4.191 18.134 1.00 12.96 O ATOM 59 H ASP A 34 36.547 2.404 20.071 1.00 0.00 H ATOM 60 N TRP A 35 33.284 2.534 19.240 1.00 9.26 N ATOM 61 CA TRP A 35 31.849 2.292 19.077 1.00 8.91 C ATOM 62 C TRP A 35 30.994 3.265 19.903 1.00 9.03 C ATOM 63 O TRP A 35 29.852 3.500 19.543 1.00 8.97 O ATOM 64 CB TRP A 35 31.465 0.831 19.425 1.00 8.54 C ATOM 65 CG TRP A 35 31.876 0.404 20.783 1.00 8.64 C ATOM 66 CD1 TRP A 35 32.991 -0.291 21.093 1.00 8.82 C ATOM 67 CD2 TRP A 35 31.223 0.698 22.020 1.00 8.68 C ATOM 68 NE1 TRP A 35 33.086 -0.459 22.448 1.00 8.97 N ATOM 69 CE2 TRP A 35 31.999 0.134 23.039 1.00 8.93 C ATOM 70 CE3 TRP A 35 30.026 1.338 22.363 1.00 8.59 C ATOM 71 CZ2 TRP A 35 31.658 0.244 24.384 1.00 9.14 C ATOM 72 CZ3 TRP A 35 29.664 1.409 23.693 1.00 8.83 C ATOM 73 CH2 TRP A 35 30.490 0.883 24.693 1.00 9.11 C ATOM 74 HE1 TRP A 35 33.854 -0.953 22.946 1.00 0.00 H ATOM 75 H TRP A 35 33.901 1.761 19.560 1.00 0.00 H ATOM 76 N ARG A 36 31.535 3.822 20.992 1.00 9.63 N ATOM 77 CA ARG A 36 30.775 4.765 21.794 1.00 10.18 C ATOM 78 C ARG A 36 30.357 6.003 21.016 1.00 10.12 C ATOM 79 O ARG A 36 29.327 6.599 21.342 1.00 10.78 O ATOM 80 CB ARG A 36 31.557 5.227 23.020 1.00 11.18 C ATOM 81 CG ARG A 36 31.890 4.120 24.008 1.00 12.04 C ATOM 82 CD ARG A 36 32.693 4.673 25.165 1.00 13.61 C ATOM 83 NE ARG A 36 31.876 5.647 25.876 1.00 15.44 N ATOM 84 CZ ARG A 36 30.987 5.373 26.830 1.00 16.79 C ATOM 85 NH1 ARG A 36 30.823 4.139 27.314 1.00 17.59 N ATOM 86 NH2 ARG A 36 30.277 6.383 27.338 1.00 17.99 N ATOM 87 HE ARG A 36 31.997 6.646 25.616 1.00 0.00 H ATOM 88 HH12 ARG A 36 30.119 3.962 28.059 1.00 0.00 H ATOM 89 HH11 ARG A 36 31.399 3.355 26.946 1.00 0.00 H ATOM 90 HH22 ARG A 36 29.575 6.202 28.084 1.00 0.00 H ATOM 91 HH21 ARG A 36 30.426 7.351 26.988 1.00 0.00 H ATOM 92 H ARG A 36 32.508 3.578 21.267 1.00 0.00 H ATOM 93 N ALA A 37 31.132 6.387 20.004 1.00 10.06 N ATOM 94 CA ALA A 37 30.867 7.613 19.237 1.00 10.22 C ATOM 95 C ALA A 37 29.934 7.406 18.058 1.00 10.11 C ATOM 96 O ALA A 37 29.581 8.384 17.404 1.00 10.92 O ATOM 97 CB ALA A 37 32.163 8.242 18.771 1.00 10.65 C ATOM 98 H ALA A 37 31.952 5.801 19.748 1.00 0.00 H ATOM 99 N ALA A 38 29.503 6.176 17.768 1.00 9.56 N ATOM 100 CA ALA A 38 28.474 5.996 16.747 1.00 9.23 C ATOM 101 C ALA A 38 27.234 6.790 17.146 1.00 9.37 C ATOM 102 O ALA A 38 26.947 6.968 18.331 1.00 9.24 O ATOM 103 CB ALA A 38 28.136 4.525 16.580 1.00 8.84 C ATOM 104 H ALA A 38 29.897 5.352 18.265 1.00 0.00 H ATOM 105 N ARG A 39 26.517 7.282 16.149 1.00 9.81 N ATOM 106 CA ARG A 39 25.338 8.130 16.372 1.00 9.99 C ATOM 107 C ARG A 39 24.015 7.460 15.952 1.00 9.65 C ATOM 108 O ARG A 39 22.938 8.025 16.132 1.00 9.98 O ATOM 109 CB ARG A 39 25.532 9.474 15.669 1.00 10.64 C ATOM 110 CG ARG A 39 26.785 10.227 16.104 1.00 11.08 C ATOM 111 CD ARG A 39 26.797 10.573 17.578 1.00 11.22 C ATOM 112 NE ARG A 39 28.136 11.058 17.871 1.00 11.50 N ATOM 113 CZ ARG A 39 28.772 10.892 19.018 1.00 11.68 C ATOM 114 NH1 ARG A 39 28.188 10.305 20.061 1.00 11.58 N ATOM 115 NH2 ARG A 39 29.997 11.318 19.117 1.00 11.92 N ATOM 116 HE ARG A 39 28.633 11.577 17.119 1.00 0.00 H ATOM 117 HH12 ARG A 39 28.712 10.187 20.952 1.00 0.00 H ATOM 118 HH11 ARG A 39 27.208 9.964 19.985 1.00 0.00 H ATOM 119 HH22 ARG A 39 30.518 11.199 20.009 1.00 0.00 H ATOM 120 HH21 ARG A 39 30.455 11.778 18.304 1.00 0.00 H ATOM 121 H ARG A 39 26.798 7.061 15.172 1.00 0.00 H ATOM 122 N SER A 40 24.093 6.252 15.407 1.00 9.03 N ATOM 123 CA SER A 40 22.914 5.553 14.901 1.00 8.85 C ATOM 124 C SER A 40 23.174 4.064 14.809 1.00 8.30 C ATOM 125 O SER A 40 24.307 3.651 14.500 1.00 8.12 O ATOM 126 CB SER A 40 22.605 6.077 13.504 1.00 9.17 C ATOM 127 OG SER A 40 21.547 5.406 12.873 1.00 9.39 O ATOM 128 HG SER A 40 20.725 5.506 13.415 1.00 0.00 H ATOM 129 H SER A 40 25.022 5.789 15.338 1.00 0.00 H ATOM 130 N MET A 41 22.123 3.266 15.033 1.00 8.15 N ATOM 131 CA MET A 41 22.180 1.839 14.764 1.00 7.70 C ATOM 132 C MET A 41 22.602 1.573 13.322 1.00 8.01 C ATOM 133 O MET A 41 23.252 0.563 13.035 1.00 7.91 O ATOM 134 CB MET A 41 20.811 1.220 15.044 1.00 7.33 C ATOM 135 CG MET A 41 20.691 -0.261 14.730 1.00 6.99 C ATOM 136 SD MET A 41 20.053 -0.650 13.085 1.00 6.87 S ATOM 137 CE MET A 41 18.304 -0.602 13.423 1.00 6.83 C ATOM 138 H MET A 41 21.245 3.677 15.409 1.00 0.00 H ATOM 139 N HIS A 42 22.232 2.487 12.424 1.00 8.32 N ATOM 140 CA HIS A 42 22.505 2.324 11.003 1.00 8.73 C ATOM 141 C HIS A 42 23.971 2.336 10.637 1.00 8.54 C ATOM 142 O HIS A 42 24.302 1.967 9.505 1.00 9.09 O ATOM 143 CB HIS A 42 21.815 3.437 10.221 1.00 9.50 C ATOM 144 CG HIS A 42 20.339 3.489 10.443 1.00 9.99 C ATOM 145 ND1 HIS A 42 19.613 4.639 10.246 1.00 10.83 N ATOM 146 CD2 HIS A 42 19.457 2.552 10.849 1.00 10.24 C ATOM 147 CE1 HIS A 42 18.353 4.414 10.534 1.00 11.06 C ATOM 148 NE2 HIS A 42 18.214 3.157 10.880 1.00 10.75 N ATOM 149 H HIS A 42 21.734 3.341 12.748 1.00 0.00 H ATOM 150 N GLU A 43 24.845 2.758 11.556 1.00 8.12 N ATOM 151 CA GLU A 43 26.277 2.743 11.278 1.00 8.19 C ATOM 152 C GLU A 43 26.888 1.352 11.355 1.00 7.69 C ATOM 153 O GLU A 43 27.987 1.147 10.835 1.00 7.63 O ATOM 154 CB GLU A 43 27.021 3.665 12.234 1.00 8.65 C ATOM 155 CG GLU A 43 26.649 5.122 12.046 1.00 9.23 C ATOM 156 CD GLU A 43 27.455 6.050 12.921 1.00 9.81 C ATOM 157 OE1 GLU A 43 28.642 5.762 13.180 1.00 10.60 O ATOM 158 OE2 GLU A 43 26.898 7.092 13.367 1.00 10.70 O ATOM 159 H GLU A 43 24.502 3.100 12.476 1.00 0.00 H ATOM 160 N PHE A 44 26.222 0.423 12.025 1.00 7.25 N ATOM 161 CA PHE A 44 26.817 -0.878 12.355 1.00 7.03 C ATOM 162 C PHE A 44 26.588 -1.903 11.249 1.00 7.04 C ATOM 163 O PHE A 44 25.792 -1.689 10.322 1.00 7.24 O ATOM 164 CB PHE A 44 26.252 -1.361 13.702 1.00 6.84 C ATOM 165 CG PHE A 44 26.730 -0.560 14.878 1.00 6.89 C ATOM 166 CD1 PHE A 44 26.036 0.580 15.293 1.00 6.98 C ATOM 167 CD2 PHE A 44 27.900 -0.898 15.539 1.00 7.02 C ATOM 168 CE1 PHE A 44 26.495 1.339 16.354 1.00 7.13 C ATOM 169 CE2 PHE A 44 28.340 -0.134 16.608 1.00 7.16 C ATOM 170 CZ PHE A 44 27.642 0.988 17.005 1.00 7.21 C ATOM 171 H PHE A 44 25.247 0.622 12.327 1.00 0.00 H ATOM 172 N SER A 45 27.305 -3.014 11.372 1.00 7.01 N ATOM 173 CA SER A 45 27.153 -4.186 10.502 1.00 7.25 C ATOM 174 C SER A 45 27.135 -5.430 11.368 1.00 7.15 C ATOM 175 O SER A 45 27.727 -5.448 12.453 1.00 7.16 O ATOM 176 CB SER A 45 28.313 -4.263 9.537 1.00 7.62 C ATOM 177 OG SER A 45 28.397 -3.090 8.768 1.00 8.21 O ATOM 178 HG SER A 45 28.529 -2.313 9.367 1.00 0.00 H ATOM 179 H SER A 45 28.016 -3.056 12.130 1.00 0.00 H ATOM 180 N ALA A 46 26.466 -6.480 10.889 1.00 7.13 N ATOM 181 CA ALA A 46 26.434 -7.750 11.601 1.00 7.25 C ATOM 182 C ALA A 46 26.218 -8.880 10.628 1.00 7.46 C ATOM 183 O ALA A 46 25.579 -8.713 9.582 1.00 7.83 O ATOM 184 CB ALA A 46 25.316 -7.737 12.641 1.00 7.38 C ATOM 185 H ALA A 46 25.956 -6.390 9.987 1.00 0.00 H ATOM 186 N LYS A 47 26.718 -10.059 10.975 1.00 7.59 N ATOM 187 CA LYS A 47 26.442 -11.227 10.151 1.00 8.03 C ATOM 188 C LYS A 47 25.041 -11.751 10.374 1.00 7.31 C ATOM 189 O LYS A 47 24.608 -11.939 11.528 1.00 6.93 O ATOM 190 CB LYS A 47 27.478 -12.337 10.378 1.00 9.24 C ATOM 191 CG LYS A 47 28.786 -12.052 9.666 1.00 10.56 C ATOM 192 CD LYS A 47 29.871 -13.097 9.790 1.00 12.07 C ATOM 193 CE LYS A 47 30.990 -12.724 8.838 1.00 13.32 C ATOM 194 NZ LYS A 47 32.109 -13.682 8.829 1.00 14.43 N ATOM 195 HZ1 LYS A 47 32.521 -13.741 9.782 1.00 0.00 H ATOM 196 HZ2 LYS A 47 31.759 -14.619 8.543 1.00 0.00 H ATOM 197 HZ3 LYS A 47 32.834 -13.360 8.156 1.00 0.00 H ATOM 198 H LYS A 47 27.303 -10.148 11.830 1.00 0.00 H ATOM 199 N ASP A 48 24.344 -12.012 9.278 1.00 7.14 N ATOM 200 CA ASP A 48 23.032 -12.640 9.353 1.00 7.27 C ATOM 201 C ASP A 48 23.179 -14.106 9.747 1.00 7.03 C ATOM 202 O ASP A 48 24.296 -14.631 9.894 1.00 6.92 O ATOM 203 CB ASP A 48 22.207 -12.428 8.055 1.00 7.78 C ATOM 204 CG ASP A 48 22.726 -13.182 6.853 1.00 8.31 C ATOM 205 OD1 ASP A 48 23.452 -14.183 6.972 1.00 8.34 O ATOM 206 OD2 ASP A 48 22.371 -12.724 5.717 1.00 10.08 O ATOM 207 H ASP A 48 24.740 -11.764 8.349 1.00 0.00 H ATOM 208 N ILE A 49 22.053 -14.793 9.913 1.00 7.10 N ATOM 209 CA ILE A 49 22.094 -16.151 10.462 1.00 7.70 C ATOM 210 C ILE A 49 22.747 -17.150 9.499 1.00 8.16 C ATOM 211 O ILE A 49 23.117 -18.237 9.915 1.00 8.42 O ATOM 212 CB ILE A 49 20.706 -16.599 10.926 1.00 7.89 C ATOM 213 CG1 ILE A 49 20.842 -17.740 11.963 1.00 8.16 C ATOM 214 CG2 ILE A 49 19.796 -16.894 9.732 1.00 8.08 C ATOM 215 CD1 ILE A 49 19.714 -17.801 12.951 1.00 8.36 C ATOM 216 H ILE A 49 21.141 -14.366 9.653 1.00 0.00 H ATOM 217 N ASP A 50 22.862 -16.791 8.217 1.00 8.60 N ATOM 218 CA ASP A 50 23.578 -17.591 7.220 1.00 9.63 C ATOM 219 C ASP A 50 25.047 -17.231 7.065 1.00 9.36 C ATOM 220 O ASP A 50 25.716 -17.758 6.177 1.00 9.84 O ATOM 221 CB ASP A 50 22.856 -17.472 5.870 1.00 11.01 C ATOM 222 CG ASP A 50 21.521 -18.214 5.843 1.00 12.27 C ATOM 223 OD1 ASP A 50 21.291 -19.070 6.691 1.00 13.85 O ATOM 224 OD2 ASP A 50 20.720 -17.991 4.927 1.00 15.43 O ATOM 225 H ASP A 50 22.421 -15.900 7.912 1.00 0.00 H ATOM 226 N GLY A 51 25.554 -16.346 7.905 1.00 8.68 N ATOM 227 CA GLY A 51 26.971 -15.982 7.910 1.00 8.91 C ATOM 228 C GLY A 51 27.345 -14.836 6.990 1.00 9.03 C ATOM 229 O GLY A 51 28.539 -14.555 6.824 1.00 9.65 O ATOM 230 H GLY A 51 24.920 -15.889 8.591 1.00 0.00 H ATOM 231 N HIS A 52 26.359 -14.166 6.390 1.00 9.03 N ATOM 232 CA HIS A 52 26.633 -13.097 5.421 1.00 9.82 C ATOM 233 C HIS A 52 26.596 -11.745 6.092 1.00 10.14 C ATOM 234 O HIS A 52 25.710 -11.460 6.899 1.00 9.24 O ATOM 235 CB HIS A 52 25.627 -13.179 4.276 1.00 10.25 C ATOM 236 CG HIS A 52 25.674 -14.488 3.561 1.00 10.96 C ATOM 237 ND1 HIS A 52 24.568 -15.294 3.404 1.00 11.42 N ATOM 238 CD2 HIS A 52 26.712 -15.157 3.021 1.00 11.74 C ATOM 239 CE1 HIS A 52 24.918 -16.385 2.749 1.00 11.81 C ATOM 240 NE2 HIS A 52 26.212 -16.334 2.522 1.00 12.25 N ATOM 241 H HIS A 52 25.372 -14.407 6.614 1.00 0.00 H ATOM 242 N MET A 53 27.548 -10.892 5.731 1.00 11.01 N ATOM 243 CA MET A 53 27.739 -9.599 6.382 1.00 11.85 C ATOM 244 C MET A 53 26.724 -8.567 5.875 1.00 11.50 C ATOM 245 O MET A 53 26.756 -8.221 4.694 1.00 12.17 O ATOM 246 CB MET A 53 29.199 -9.154 6.165 1.00 13.41 C ATOM 247 CG MET A 53 29.981 -9.120 7.473 1.00 14.49 C ATOM 248 SD MET A 53 29.118 -7.850 8.366 1.00 16.80 S ATOM 249 CE MET A 53 29.011 -6.736 6.962 1.00 16.81 C ATOM 250 H MET A 53 28.184 -11.156 4.952 1.00 0.00 H ATOM 251 N VAL A 54 25.838 -8.106 6.774 1.00 10.66 N ATOM 252 CA VAL A 54 24.752 -7.166 6.481 1.00 10.58 C ATOM 253 C VAL A 54 25.075 -5.791 7.109 1.00 9.58 C ATOM 254 O VAL A 54 25.307 -5.667 8.312 1.00 9.21 O ATOM 255 CB VAL A 54 23.427 -7.688 7.074 1.00 11.11 C ATOM 256 CG1 VAL A 54 22.295 -6.688 6.887 1.00 11.34 C ATOM 257 CG2 VAL A 54 23.055 -9.024 6.431 1.00 11.59 C ATOM 258 H VAL A 54 25.930 -8.442 7.754 1.00 0.00 H ATOM 259 N ASN A 55 25.066 -4.743 6.287 1.00 9.48 N ATOM 260 CA ASN A 55 25.169 -3.367 6.786 1.00 9.47 C ATOM 261 C ASN A 55 23.794 -2.915 7.255 1.00 8.91 C ATOM 262 O ASN A 55 22.798 -2.992 6.519 1.00 9.21 O ATOM 263 CB ASN A 55 25.690 -2.437 5.703 1.00 10.25 C ATOM 264 CG ASN A 55 27.138 -2.699 5.364 1.00 10.98 C ATOM 265 OD1 ASN A 55 27.922 -3.234 6.153 1.00 11.11 O ATOM 266 ND2 ASN A 55 27.511 -2.280 4.162 1.00 12.23 N ATOM 267 HD22 ASN A 55 26.817 -1.834 3.528 1.00 0.00 H ATOM 268 HD21 ASN A 55 28.497 -2.397 3.853 1.00 0.00 H ATOM 269 H ASN A 55 24.984 -4.904 5.263 1.00 0.00 H ATOM 270 N LEU A 56 23.727 -2.423 8.492 1.00 8.36 N ATOM 271 CA LEU A 56 22.445 -2.088 9.105 1.00 8.32 C ATOM 272 C LEU A 56 21.905 -0.746 8.614 1.00 8.71 C ATOM 273 O LEU A 56 20.796 -0.359 8.992 1.00 8.54 O ATOM 274 CB LEU A 56 22.548 -2.128 10.626 1.00 8.01 C ATOM 275 CG LEU A 56 23.069 -3.457 11.190 1.00 7.98 C ATOM 276 CD1 LEU A 56 22.960 -3.425 12.695 1.00 7.96 C ATOM 277 CD2 LEU A 56 22.365 -4.703 10.660 1.00 8.13 C ATOM 278 H LEU A 56 24.604 -2.275 9.031 1.00 0.00 H ATOM 279 N ASP A 57 22.658 -0.050 7.752 1.00 9.34 N ATOM 280 CA ASP A 57 22.101 1.136 7.085 1.00 10.25 C ATOM 281 C ASP A 57 20.953 0.790 6.130 1.00 10.32 C ATOM 282 O ASP A 57 20.216 1.684 5.721 1.00 10.68 O ATOM 283 CB ASP A 57 23.173 2.023 6.438 1.00 11.29 C ATOM 284 CG ASP A 57 23.986 1.325 5.387 1.00 12.12 C ATOM 285 OD1 ASP A 57 23.646 0.225 4.948 1.00 13.11 O ATOM 286 OD2 ASP A 57 25.009 1.923 4.963 1.00 13.64 O ATOM 287 H ASP A 57 23.635 -0.348 7.555 1.00 0.00 H ATOM 288 N LYS A 58 20.761 -0.487 5.801 1.00 10.39 N ATOM 289 CA LYS A 58 19.514 -0.914 5.123 1.00 11.04 C ATOM 290 C LYS A 58 18.248 -0.537 5.901 1.00 10.58 C ATOM 291 O LYS A 58 17.175 -0.469 5.302 1.00 11.34 O ATOM 292 CB LYS A 58 19.506 -2.426 4.842 1.00 11.83 C ATOM 293 CG LYS A 58 19.375 -3.281 6.080 1.00 12.49 C ATOM 294 CD LYS A 58 19.600 -4.763 5.854 1.00 13.37 C ATOM 295 CE LYS A 58 18.339 -5.494 5.476 1.00 14.00 C ATOM 296 NZ LYS A 58 18.601 -6.940 5.244 1.00 14.37 N ATOM 297 HZ1 LYS A 58 19.290 -7.047 4.472 1.00 0.00 H ATOM 298 HZ2 LYS A 58 18.983 -7.366 6.113 1.00 0.00 H ATOM 299 HZ3 LYS A 58 17.713 -7.415 4.985 1.00 0.00 H ATOM 300 H LYS A 58 21.494 -1.191 6.022 1.00 0.00 H ATOM 301 N TYR A 59 18.358 -0.305 7.213 1.00 9.64 N ATOM 302 CA TYR A 59 17.210 0.041 8.047 1.00 9.41 C ATOM 303 C TYR A 59 16.924 1.542 8.128 1.00 9.68 C ATOM 304 O TYR A 59 16.019 1.950 8.840 1.00 9.40 O ATOM 305 CB TYR A 59 17.363 -0.582 9.453 1.00 8.89 C ATOM 306 CG TYR A 59 17.418 -2.093 9.399 1.00 8.61 C ATOM 307 CD1 TYR A 59 16.290 -2.836 9.081 1.00 8.69 C ATOM 308 CD2 TYR A 59 18.602 -2.781 9.647 1.00 8.57 C ATOM 309 CE1 TYR A 59 16.345 -4.206 8.976 1.00 8.68 C ATOM 310 CE2 TYR A 59 18.663 -4.159 9.568 1.00 8.52 C ATOM 311 CZ TYR A 59 17.529 -4.872 9.242 1.00 8.50 C ATOM 312 OH TYR A 59 17.603 -6.249 9.188 1.00 8.79 O ATOM 313 HH TYR A 59 16.717 -6.617 8.943 1.00 0.00 H ATOM 314 H TYR A 59 19.296 -0.373 7.656 1.00 0.00 H ATOM 315 N ARG A 60 17.678 2.368 7.393 1.00 10.59 N ATOM 316 CA ARG A 60 17.384 3.803 7.279 1.00 11.85 C ATOM 317 C ARG A 60 15.965 3.983 6.779 1.00 11.33 C ATOM 318 O ARG A 60 15.602 3.440 5.729 1.00 11.56 O ATOM 319 CB ARG A 60 18.357 4.499 6.301 1.00 13.94 C ATOM 320 CG ARG A 60 19.818 4.578 6.738 1.00 16.20 C ATOM 321 CD ARG A 60 20.393 5.983 6.684 1.00 18.49 C ATOM 322 NE ARG A 60 19.635 6.800 7.626 1.00 20.39 N ATOM 323 CZ ARG A 60 20.028 7.202 8.837 1.00 21.34 C ATOM 324 NH1 ARG A 60 19.166 7.899 9.567 1.00 22.01 N ATOM 325 NH2 ARG A 60 21.251 6.941 9.328 1.00 20.85 N ATOM 326 HE ARG A 60 18.687 7.101 7.321 1.00 0.00 H ATOM 327 HH12 ARG A 60 19.436 8.230 10.515 1.00 0.00 H ATOM 328 HH11 ARG A 60 18.221 8.115 9.191 1.00 0.00 H ATOM 329 HH22 ARG A 60 21.512 7.275 10.278 1.00 0.00 H ATOM 330 HH21 ARG A 60 21.937 6.405 8.758 1.00 0.00 H ATOM 331 H ARG A 60 18.499 1.981 6.886 1.00 0.00 H ATOM 332 N GLY A 61 15.160 4.723 7.535 1.00 10.85 N ATOM 333 CA GLY A 61 13.780 4.976 7.158 1.00 11.28 C ATOM 334 C GLY A 61 12.795 3.947 7.666 1.00 11.03 C ATOM 335 O GLY A 61 11.599 4.052 7.372 1.00 11.51 O ATOM 336 H GLY A 61 15.527 5.131 8.418 1.00 0.00 H ATOM 337 N PHE A 62 13.273 2.948 8.428 1.00 10.53 N ATOM 338 CA PHE A 62 12.435 1.857 8.951 1.00 10.67 C ATOM 339 C PHE A 62 12.494 1.781 10.461 1.00 10.13 C ATOM 340 O PHE A 62 13.576 1.628 11.044 1.00 12.09 O ATOM 341 CB PHE A 62 12.907 0.505 8.396 1.00 10.92 C ATOM 342 CG PHE A 62 12.749 0.394 6.909 1.00 11.65 C ATOM 343 CD1 PHE A 62 11.532 0.049 6.343 1.00 12.59 C ATOM 344 CD2 PHE A 62 13.812 0.695 6.062 1.00 12.27 C ATOM 345 CE1 PHE A 62 11.363 -0.010 4.966 1.00 13.30 C ATOM 346 CE2 PHE A 62 13.661 0.618 4.683 1.00 12.99 C ATOM 347 CZ PHE A 62 12.429 0.264 4.131 1.00 13.48 C ATOM 348 H PHE A 62 14.287 2.946 8.660 1.00 0.00 H ATOM 349 N VAL A 63 11.339 1.798 11.092 1.00 9.15 N ATOM 350 CA VAL A 63 11.260 1.622 12.543 1.00 8.35 C ATOM 351 C VAL A 63 11.709 0.197 12.856 1.00 7.90 C ATOM 352 O VAL A 63 11.264 -0.747 12.193 1.00 7.84 O ATOM 353 CB VAL A 63 9.831 1.864 13.048 1.00 8.37 C ATOM 354 CG1 VAL A 63 9.731 1.600 14.547 1.00 8.25 C ATOM 355 CG2 VAL A 63 9.414 3.299 12.755 1.00 8.77 C ATOM 356 H VAL A 63 10.464 1.939 10.548 1.00 0.00 H ATOM 357 N SER A 64 12.586 0.046 13.844 1.00 7.61 N ATOM 358 CA SER A 64 13.173 -1.284 14.094 1.00 7.55 C ATOM 359 C SER A 64 13.078 -1.676 15.550 1.00 7.14 C ATOM 360 O SER A 64 13.167 -0.832 16.445 1.00 7.54 O ATOM 361 CB SER A 64 14.632 -1.300 13.653 1.00 8.01 C ATOM 362 OG SER A 64 14.772 -1.024 12.274 1.00 9.53 O ATOM 363 HG SER A 64 14.399 -0.128 12.079 1.00 0.00 H ATOM 364 H SER A 64 12.856 0.858 14.435 1.00 0.00 H ATOM 365 N ILE A 65 12.902 -2.971 15.779 1.00 6.82 N ATOM 366 CA ILE A 65 13.043 -3.563 17.106 1.00 6.73 C ATOM 367 C ILE A 65 14.257 -4.464 17.051 1.00 6.35 C ATOM 368 O ILE A 65 14.335 -5.336 16.179 1.00 6.58 O ATOM 369 CB ILE A 65 11.811 -4.372 17.518 1.00 6.96 C ATOM 370 CG1 ILE A 65 10.594 -3.454 17.649 1.00 7.33 C ATOM 371 CG2 ILE A 65 12.071 -5.117 18.826 1.00 7.06 C ATOM 372 CD1 ILE A 65 9.288 -4.221 17.670 1.00 7.54 C ATOM 373 H ILE A 65 12.653 -3.589 14.981 1.00 0.00 H ATOM 374 N VAL A 66 15.217 -4.243 17.951 1.00 6.15 N ATOM 375 CA VAL A 66 16.389 -5.115 18.070 1.00 6.06 C ATOM 376 C VAL A 66 16.226 -5.917 19.345 1.00 5.85 C ATOM 377 O VAL A 66 15.981 -5.343 20.420 1.00 6.23 O ATOM 378 CB VAL A 66 17.680 -4.287 18.102 1.00 6.24 C ATOM 379 CG1 VAL A 66 18.856 -5.226 18.181 1.00 6.40 C ATOM 380 CG2 VAL A 66 17.783 -3.404 16.874 1.00 6.46 C ATOM 381 H VAL A 66 15.131 -3.426 18.588 1.00 0.00 H ATOM 382 N THR A 67 16.367 -7.248 19.239 1.00 5.68 N ATOM 383 CA THR A 67 16.139 -8.096 20.401 1.00 5.86 C ATOM 384 C THR A 67 17.112 -9.250 20.421 1.00 5.72 C ATOM 385 O THR A 67 17.552 -9.714 19.362 1.00 6.00 O ATOM 386 CB THR A 67 14.662 -8.577 20.432 1.00 6.12 C ATOM 387 OG1 THR A 67 14.397 -9.310 21.632 1.00 6.40 O ATOM 388 CG2 THR A 67 14.338 -9.449 19.250 1.00 6.31 C ATOM 389 HG1 THR A 67 14.562 -8.728 22.416 1.00 0.00 H ATOM 390 H THR A 67 16.638 -7.673 18.329 1.00 0.00 H ATOM 391 N ASN A 68 17.454 -9.714 21.617 1.00 5.76 N ATOM 392 CA ASN A 68 18.285 -10.913 21.773 1.00 5.75 C ATOM 393 C ASN A 68 17.377 -12.101 22.066 1.00 5.84 C ATOM 394 O ASN A 68 16.493 -11.996 22.926 1.00 6.21 O ATOM 395 CB ASN A 68 19.357 -10.747 22.861 1.00 5.92 C ATOM 396 CG ASN A 68 18.790 -10.434 24.243 1.00 6.01 C ATOM 397 OD1 ASN A 68 18.051 -9.473 24.415 1.00 6.12 O ATOM 398 ND2 ASN A 68 19.167 -11.234 25.239 1.00 6.30 N ATOM 399 HD22 ASN A 68 19.796 -12.040 25.049 1.00 0.00 H ATOM 400 HD21 ASN A 68 18.832 -11.053 26.207 1.00 0.00 H ATOM 401 H ASN A 68 17.124 -9.214 22.467 1.00 0.00 H ATOM 402 N VAL A 69 17.588 -13.212 21.356 1.00 5.88 N ATOM 403 CA VAL A 69 16.674 -14.334 21.430 1.00 6.02 C ATOM 404 C VAL A 69 17.375 -15.582 21.948 1.00 6.16 C ATOM 405 O VAL A 69 18.606 -15.676 21.982 1.00 6.17 O ATOM 406 CB VAL A 69 15.979 -14.600 20.070 1.00 6.13 C ATOM 407 CG1 VAL A 69 15.254 -13.351 19.620 1.00 6.18 C ATOM 408 CG2 VAL A 69 16.970 -15.077 19.007 1.00 6.15 C ATOM 409 H VAL A 69 18.423 -13.273 20.739 1.00 0.00 H ATOM 410 N ALA A 70 16.568 -16.547 22.368 1.00 6.54 N ATOM 411 CA ALA A 70 17.060 -17.871 22.779 1.00 6.84 C ATOM 412 C ALA A 70 15.892 -18.849 22.600 1.00 7.09 C ATOM 413 O ALA A 70 14.720 -18.464 22.702 1.00 7.20 O ATOM 414 CB ALA A 70 17.549 -17.875 24.218 1.00 7.26 C ATOM 415 H ALA A 70 15.546 -16.360 22.408 1.00 0.00 H ATOM 416 N SER A 71 16.229 -20.102 22.332 1.00 7.47 N ATOM 417 CA SER A 71 15.218 -21.129 22.032 1.00 8.03 C ATOM 418 C SER A 71 14.696 -21.896 23.236 1.00 8.63 C ATOM 419 O SER A 71 13.624 -22.480 23.130 1.00 8.89 O ATOM 420 CB SER A 71 15.789 -22.133 21.027 1.00 8.11 C ATOM 421 OG SER A 71 16.240 -21.496 19.853 1.00 8.19 O ATOM 422 HG SER A 71 16.951 -20.846 20.084 1.00 0.00 H ATOM 423 H SER A 71 17.235 -20.367 22.334 1.00 0.00 H ATOM 424 N GLN A 72 15.426 -21.917 24.351 1.00 9.09 N ATOM 425 CA GLN A 72 15.119 -22.829 25.473 1.00 9.94 C ATOM 426 C GLN A 72 14.767 -22.069 26.747 1.00 10.06 C ATOM 427 O GLN A 72 15.179 -22.433 27.838 1.00 10.92 O ATOM 428 CB GLN A 72 16.280 -23.811 25.697 1.00 10.61 C ATOM 429 CG GLN A 72 16.603 -24.619 24.455 1.00 11.05 C ATOM 430 CD GLN A 72 17.735 -25.610 24.637 1.00 11.78 C ATOM 431 OE1 GLN A 72 18.106 -26.294 23.695 1.00 12.61 O ATOM 432 NE2 GLN A 72 18.304 -25.656 25.818 1.00 12.30 N ATOM 433 HE22 GLN A 72 17.951 -25.053 26.589 1.00 0.00 H ATOM 434 HE21 GLN A 72 19.108 -26.295 25.983 1.00 0.00 H ATOM 435 H GLN A 72 16.237 -21.271 24.434 1.00 0.00 H TER 436 GLN A 72 ATOM 437 N GLY A 74 11.535 -20.310 29.122 1.00 10.83 N ATOM 438 CA GLY A 74 10.102 -20.471 29.357 1.00 11.26 C ATOM 439 C GLY A 74 9.222 -19.502 28.586 1.00 11.18 C ATOM 440 O GLY A 74 8.064 -19.812 28.268 1.00 12.16 O ATOM 441 HN3 GLY A 74 11.825 -19.351 29.401 1.00 0.00 H ATOM 442 HN2 GLY A 74 11.738 -20.455 28.112 1.00 0.00 H ATOM 443 HN1 GLY A 74 12.058 -21.010 29.686 1.00 0.00 H ATOM 444 N LYS A 75 9.750 -18.318 28.288 1.00 10.77 N ATOM 445 CA LYS A 75 9.037 -17.307 27.507 1.00 10.89 C ATOM 446 C LYS A 75 9.453 -17.242 26.034 1.00 9.49 C ATOM 447 O LYS A 75 9.082 -16.307 25.326 1.00 9.02 O ATOM 448 CB LYS A 75 9.193 -15.931 28.195 1.00 12.15 C ATOM 449 CG LYS A 75 8.700 -15.902 29.637 1.00 13.99 C ATOM 450 CD LYS A 75 7.261 -16.399 29.763 1.00 15.61 C ATOM 451 CE LYS A 75 6.793 -16.486 31.198 1.00 17.26 C ATOM 452 NZ LYS A 75 7.492 -17.588 31.918 1.00 18.44 N ATOM 453 HZ1 LYS A 75 7.291 -18.492 31.444 1.00 0.00 H ATOM 454 HZ2 LYS A 75 8.517 -17.411 31.910 1.00 0.00 H ATOM 455 HZ3 LYS A 75 7.154 -17.628 32.901 1.00 0.00 H ATOM 456 H LYS A 75 10.710 -18.102 28.624 1.00 0.00 H ATOM 457 N THR A 76 10.202 -18.238 25.546 1.00 8.69 N ATOM 458 CA THR A 76 10.536 -18.291 24.115 1.00 8.29 C ATOM 459 C THR A 76 9.283 -18.253 23.246 1.00 8.28 C ATOM 460 O THR A 76 9.216 -17.495 22.271 1.00 7.88 O ATOM 461 CB THR A 76 11.387 -19.524 23.826 1.00 7.97 C ATOM 462 OG1 THR A 76 12.665 -19.340 24.447 1.00 7.88 O ATOM 463 CG2 THR A 76 11.550 -19.780 22.325 1.00 7.78 C ATOM 464 HG1 THR A 76 13.098 -18.531 24.075 1.00 0.00 H ATOM 465 H THR A 76 10.551 -18.981 26.185 1.00 0.00 H ATOM 466 N GLU A 77 8.294 -19.057 23.608 1.00 8.93 N ATOM 467 CA GLU A 77 7.079 -19.140 22.809 1.00 9.69 C ATOM 468 C GLU A 77 6.339 -17.809 22.728 1.00 9.22 C ATOM 469 O GLU A 77 5.971 -17.359 21.650 1.00 8.93 O ATOM 470 CB GLU A 77 6.138 -20.202 23.364 1.00 11.24 C ATOM 471 CG GLU A 77 4.820 -20.297 22.594 1.00 12.95 C ATOM 472 CD GLU A 77 4.650 -21.612 21.938 1.00 15.20 C ATOM 473 OE1 GLU A 77 3.572 -22.203 22.124 1.00 18.55 O ATOM 474 OE2 GLU A 77 5.619 -22.050 21.278 1.00 16.86 O ATOM 475 H GLU A 77 8.386 -19.633 24.469 1.00 0.00 H ATOM 476 N VAL A 78 6.100 -17.186 23.862 1.00 9.09 N ATOM 477 CA VAL A 78 5.366 -15.923 23.847 1.00 9.31 C ATOM 478 C VAL A 78 6.143 -14.841 23.101 1.00 8.57 C ATOM 479 O VAL A 78 5.553 -14.052 22.344 1.00 8.50 O ATOM 480 CB VAL A 78 4.921 -15.459 25.252 1.00 10.09 C ATOM 481 CG1 VAL A 78 6.058 -15.104 26.164 1.00 10.42 C ATOM 482 CG2 VAL A 78 3.930 -14.301 25.134 1.00 10.65 C ATOM 483 H VAL A 78 6.431 -17.589 24.762 1.00 0.00 H ATOM 484 N ASN A 79 7.466 -14.795 23.289 1.00 8.03 N ATOM 485 CA ASN A 79 8.261 -13.790 22.584 1.00 7.78 C ATOM 486 C ASN A 79 8.287 -14.008 21.075 1.00 7.64 C ATOM 487 O ASN A 79 8.025 -13.073 20.319 1.00 7.53 O ATOM 488 CB ASN A 79 9.663 -13.658 23.167 1.00 7.94 C ATOM 489 CG ASN A 79 9.664 -12.819 24.406 1.00 8.33 C ATOM 490 OD1 ASN A 79 9.755 -11.590 24.321 1.00 8.81 O ATOM 491 ND2 ASN A 79 9.531 -13.441 25.552 1.00 8.67 N ATOM 492 HD22 ASN A 79 9.458 -14.478 25.575 1.00 0.00 H ATOM 493 HD21 ASN A 79 9.498 -12.897 26.438 1.00 0.00 H ATOM 494 H ASN A 79 7.927 -15.470 23.933 1.00 0.00 H ATOM 495 N TYR A 80 8.577 -15.230 20.621 1.00 7.40 N ATOM 496 CA TYR A 80 8.611 -15.448 19.171 1.00 7.38 C ATOM 497 C TYR A 80 7.238 -15.219 18.556 1.00 7.51 C ATOM 498 O TYR A 80 7.114 -14.576 17.509 1.00 7.48 O ATOM 499 CB TYR A 80 9.118 -16.832 18.800 1.00 7.49 C ATOM 500 CG TYR A 80 10.592 -16.896 18.515 1.00 7.36 C ATOM 501 CD1 TYR A 80 11.090 -16.532 17.258 1.00 7.49 C ATOM 502 CD2 TYR A 80 11.497 -17.355 19.472 1.00 7.46 C ATOM 503 CE1 TYR A 80 12.436 -16.592 16.986 1.00 7.55 C ATOM 504 CE2 TYR A 80 12.853 -17.444 19.199 1.00 7.38 C ATOM 505 CZ TYR A 80 13.313 -17.070 17.957 1.00 7.42 C ATOM 506 OH TYR A 80 14.645 -17.168 17.629 1.00 7.59 O ATOM 507 HH TYR A 80 14.934 -18.112 17.704 1.00 0.00 H ATOM 508 H TYR A 80 8.774 -16.009 21.281 1.00 0.00 H ATOM 509 N THR A 81 6.186 -15.737 19.194 1.00 7.79 N ATOM 510 CA THR A 81 4.868 -15.593 18.593 1.00 8.22 C ATOM 511 C THR A 81 4.460 -14.119 18.470 1.00 8.01 C ATOM 512 O THR A 81 3.893 -13.692 17.456 1.00 8.03 O ATOM 513 CB THR A 81 3.781 -16.394 19.319 1.00 9.11 C ATOM 514 OG1 THR A 81 3.690 -16.000 20.658 1.00 10.24 O ATOM 515 CG2 THR A 81 4.050 -17.838 19.291 1.00 9.39 C ATOM 516 HG1 THR A 81 4.558 -16.157 21.107 1.00 0.00 H ATOM 517 H THR A 81 6.305 -16.233 20.101 1.00 0.00 H ATOM 518 N GLN A 82 4.751 -13.337 19.507 1.00 7.86 N ATOM 519 CA GLN A 82 4.350 -11.930 19.487 1.00 7.95 C ATOM 520 C GLN A 82 5.252 -11.078 18.598 1.00 7.65 C ATOM 521 O GLN A 82 4.783 -10.097 18.015 1.00 7.68 O ATOM 522 CB GLN A 82 4.257 -11.383 20.899 1.00 8.23 C ATOM 523 CG GLN A 82 3.090 -11.982 21.666 1.00 8.68 C ATOM 524 CD GLN A 82 2.869 -11.290 22.996 1.00 9.18 C ATOM 525 OE1 GLN A 82 3.462 -10.268 23.288 1.00 9.48 O ATOM 526 NE2 GLN A 82 1.966 -11.836 23.791 1.00 9.96 N ATOM 527 HE22 GLN A 82 1.481 -12.710 23.504 1.00 0.00 H ATOM 528 HE21 GLN A 82 1.740 -11.391 24.704 1.00 0.00 H ATOM 529 H GLN A 82 5.261 -13.724 20.327 1.00 0.00 H ATOM 530 N LEU A 83 6.529 -11.433 18.471 1.00 7.52 N ATOM 531 CA LEU A 83 7.384 -10.738 17.506 1.00 7.39 C ATOM 532 C LEU A 83 6.898 -10.985 16.083 1.00 7.49 C ATOM 533 O LEU A 83 6.860 -10.066 15.246 1.00 7.30 O ATOM 534 CB LEU A 83 8.838 -11.176 17.658 1.00 7.38 C ATOM 535 CG LEU A 83 9.560 -10.672 18.922 1.00 7.55 C ATOM 536 CD1 LEU A 83 10.825 -11.468 19.143 1.00 7.62 C ATOM 537 CD2 LEU A 83 9.888 -9.183 18.882 1.00 7.61 C ATOM 538 H LEU A 83 6.918 -12.201 19.055 1.00 0.00 H ATOM 539 N VAL A 84 6.518 -12.231 15.803 1.00 7.56 N ATOM 540 CA VAL A 84 5.926 -12.574 14.510 1.00 7.91 C ATOM 541 C VAL A 84 4.633 -11.768 14.301 1.00 8.28 C ATOM 542 O VAL A 84 4.424 -11.211 13.221 1.00 8.51 O ATOM 543 CB VAL A 84 5.690 -14.097 14.388 1.00 8.09 C ATOM 544 CG1 VAL A 84 4.829 -14.435 13.183 1.00 8.54 C ATOM 545 CG2 VAL A 84 7.027 -14.806 14.250 1.00 7.85 C ATOM 546 H VAL A 84 6.645 -12.975 16.518 1.00 0.00 H ATOM 547 N ASP A 85 3.786 -11.688 15.324 1.00 8.61 N ATOM 548 CA ASP A 85 2.569 -10.860 15.246 1.00 9.15 C ATOM 549 C ASP A 85 2.900 -9.421 14.874 1.00 8.83 C ATOM 550 O ASP A 85 2.292 -8.851 13.961 1.00 9.01 O ATOM 551 CB ASP A 85 1.829 -10.817 16.579 1.00 10.10 C ATOM 552 CG ASP A 85 1.204 -12.127 16.980 1.00 11.03 C ATOM 553 OD1 ASP A 85 0.993 -13.018 16.140 1.00 12.16 O ATOM 554 OD2 ASP A 85 0.924 -12.224 18.195 1.00 12.30 O ATOM 555 H ASP A 85 3.986 -12.220 16.195 1.00 0.00 H ATOM 556 N LEU A 86 3.864 -8.821 15.562 1.00 8.61 N ATOM 557 CA LEU A 86 4.232 -7.449 15.262 1.00 8.67 C ATOM 558 C LEU A 86 4.712 -7.269 13.836 1.00 8.56 C ATOM 559 O LEU A 86 4.319 -6.319 13.143 1.00 8.74 O ATOM 560 CB LEU A 86 5.310 -6.951 16.222 1.00 8.74 C ATOM 561 CG LEU A 86 4.896 -6.690 17.674 1.00 9.18 C ATOM 562 CD1 LEU A 86 6.105 -6.249 18.463 1.00 9.34 C ATOM 563 CD2 LEU A 86 3.798 -5.640 17.750 1.00 9.45 C ATOM 564 H LEU A 86 4.358 -9.336 16.319 1.00 0.00 H ATOM 565 N HIS A 87 5.590 -8.159 13.393 1.00 8.49 N ATOM 566 CA HIS A 87 6.099 -8.064 12.033 1.00 8.86 C ATOM 567 C HIS A 87 4.998 -8.255 11.000 1.00 9.06 C ATOM 568 O HIS A 87 4.921 -7.508 10.012 1.00 9.18 O ATOM 569 CB HIS A 87 7.236 -9.052 11.835 1.00 9.10 C ATOM 570 CG HIS A 87 7.930 -8.896 10.528 1.00 9.71 C ATOM 571 ND1 HIS A 87 7.860 -9.854 9.554 1.00 10.75 N ATOM 572 CD2 HIS A 87 8.690 -7.902 10.023 1.00 10.22 C ATOM 573 CE1 HIS A 87 8.536 -9.453 8.492 1.00 10.82 C ATOM 574 NE2 HIS A 87 9.066 -8.281 8.761 1.00 10.47 N ATOM 575 H HIS A 87 5.915 -8.925 14.018 1.00 0.00 H ATOM 576 N ALA A 88 4.127 -9.222 11.227 1.00 9.32 N ATOM 577 CA ALA A 88 3.027 -9.468 10.295 1.00 10.04 C ATOM 578 C ALA A 88 2.118 -8.256 10.176 1.00 10.30 C ATOM 579 O ALA A 88 1.674 -7.901 9.081 1.00 10.88 O ATOM 580 CB ALA A 88 2.225 -10.699 10.689 1.00 10.31 C ATOM 581 H ALA A 88 4.224 -9.814 12.077 1.00 0.00 H ATOM 582 N ARG A 89 1.823 -7.636 11.305 1.00 10.08 N ATOM 583 CA ARG A 89 0.946 -6.465 11.339 1.00 10.45 C ATOM 584 C ARG A 89 1.575 -5.205 10.766 1.00 10.22 C ATOM 585 O ARG A 89 0.882 -4.419 10.107 1.00 10.86 O ATOM 586 CB ARG A 89 0.569 -6.153 12.778 1.00 10.81 C ATOM 587 CG ARG A 89 -0.283 -7.210 13.438 1.00 11.36 C ATOM 588 CD ARG A 89 -0.422 -6.922 14.909 1.00 11.86 C ATOM 589 NE ARG A 89 -1.219 -7.940 15.584 1.00 12.79 N ATOM 590 CZ ARG A 89 -1.686 -7.834 16.826 1.00 13.56 C ATOM 591 NH1 ARG A 89 -2.413 -8.809 17.337 1.00 14.97 N ATOM 592 NH2 ARG A 89 -1.445 -6.748 17.556 1.00 13.87 N ATOM 593 HE ARG A 89 -1.438 -8.810 15.058 1.00 0.00 H ATOM 594 HH12 ARG A 89 -2.780 -8.731 18.307 1.00 0.00 H ATOM 595 HH11 ARG A 89 -2.619 -9.656 16.770 1.00 0.00 H ATOM 596 HH22 ARG A 89 -1.817 -6.680 18.525 1.00 0.00 H ATOM 597 HH21 ARG A 89 -0.885 -5.967 17.158 1.00 0.00 H ATOM 598 H ARG A 89 2.226 -7.991 12.196 1.00 0.00 H ATOM 599 N TYR A 90 2.856 -4.979 11.037 1.00 9.66 N ATOM 600 CA TYR A 90 3.442 -3.651 10.797 1.00 9.65 C ATOM 601 C TYR A 90 4.569 -3.620 9.761 1.00 9.90 C ATOM 602 O TYR A 90 5.095 -2.555 9.463 1.00 9.59 O ATOM 603 CB TYR A 90 3.936 -3.059 12.120 1.00 9.38 C ATOM 604 CG TYR A 90 2.810 -2.781 13.071 1.00 9.50 C ATOM 605 CD1 TYR A 90 1.974 -1.688 12.877 1.00 9.75 C ATOM 606 CD2 TYR A 90 2.558 -3.606 14.162 1.00 9.37 C ATOM 607 CE1 TYR A 90 0.916 -1.434 13.732 1.00 10.03 C ATOM 608 CE2 TYR A 90 1.497 -3.355 15.021 1.00 9.78 C ATOM 609 CZ TYR A 90 0.681 -2.267 14.800 1.00 9.96 C ATOM 610 OH TYR A 90 -0.387 -2.001 15.637 1.00 10.40 O ATOM 611 HH TYR A 90 -1.013 -2.768 15.625 1.00 0.00 H ATOM 612 H TYR A 90 3.447 -5.744 11.420 1.00 0.00 H ATOM 613 N ALA A 91 4.959 -4.760 9.196 1.00 10.25 N ATOM 614 CA ALA A 91 6.017 -4.740 8.173 1.00 11.04 C ATOM 615 C ALA A 91 5.669 -3.782 7.040 1.00 11.88 C ATOM 616 O ALA A 91 6.533 -3.082 6.522 1.00 11.78 O ATOM 617 CB ALA A 91 6.300 -6.122 7.608 1.00 11.21 C ATOM 618 H ALA A 91 4.519 -5.660 9.476 1.00 0.00 H ATOM 619 N GLU A 92 4.387 -3.726 6.674 1.00 13.53 N ATOM 620 CA GLU A 92 3.907 -2.812 5.625 1.00 15.47 C ATOM 621 C GLU A 92 4.032 -1.319 5.994 1.00 15.54 C ATOM 622 O GLU A 92 4.110 -0.458 5.101 1.00 16.88 O ATOM 623 CB GLU A 92 2.447 -3.149 5.266 1.00 17.11 C ATOM 624 CG GLU A 92 1.412 -2.757 6.321 1.00 18.67 C ATOM 625 CD GLU A 92 0.088 -3.499 6.170 1.00 20.37 C ATOM 626 OE1 GLU A 92 -0.707 -3.138 5.280 1.00 22.77 O ATOM 627 OE2 GLU A 92 -0.146 -4.453 6.945 1.00 22.43 O ATOM 628 H GLU A 92 3.703 -4.350 7.147 1.00 0.00 H ATOM 629 N ARG A 93 4.009 -0.998 7.282 1.00 14.90 N ATOM 630 CA ARG A 93 4.294 0.375 7.773 1.00 14.99 C ATOM 631 C ARG A 93 5.790 0.686 7.801 1.00 14.41 C ATOM 632 O ARG A 93 6.162 1.845 7.997 1.00 15.90 O ATOM 633 CB ARG A 93 3.798 0.595 9.210 1.00 15.38 C ATOM 634 CG ARG A 93 2.313 0.436 9.467 1.00 15.92 C ATOM 635 CD ARG A 93 1.445 1.432 8.711 1.00 16.71 C ATOM 636 NE ARG A 93 1.795 2.850 8.857 1.00 17.16 N ATOM 637 CZ ARG A 93 1.443 3.643 9.871 1.00 17.48 C ATOM 638 NH1 ARG A 93 1.822 4.923 9.847 1.00 18.04 N ATOM 639 NH2 ARG A 93 0.724 3.195 10.901 1.00 17.50 N ATOM 640 HE ARG A 93 2.369 3.275 8.102 1.00 0.00 H ATOM 641 HH12 ARG A 93 1.558 5.558 10.627 1.00 0.00 H ATOM 642 HH11 ARG A 93 2.381 5.285 9.048 1.00 0.00 H ATOM 643 HH22 ARG A 93 0.467 3.840 11.675 1.00 0.00 H ATOM 644 HH21 ARG A 93 0.421 2.201 10.930 1.00 0.00 H ATOM 645 H ARG A 93 3.782 -1.738 7.976 1.00 0.00 H ATOM 646 N GLY A 94 6.632 -0.326 7.637 1.00 12.82 N ATOM 647 CA GLY A 94 8.064 -0.169 7.746 1.00 11.82 C ATOM 648 C GLY A 94 8.683 -0.771 8.997 1.00 10.73 C ATOM 649 O GLY A 94 9.862 -0.525 9.247 1.00 11.40 O ATOM 650 H GLY A 94 6.247 -1.268 7.422 1.00 0.00 H ATOM 651 N LEU A 95 7.946 -1.568 9.777 1.00 9.56 N ATOM 652 CA LEU A 95 8.572 -2.219 10.929 1.00 8.46 C ATOM 653 C LEU A 95 9.507 -3.345 10.507 1.00 7.92 C ATOM 654 O LEU A 95 9.127 -4.212 9.722 1.00 7.97 O ATOM 655 CB LEU A 95 7.526 -2.800 11.881 1.00 8.50 C ATOM 656 CG LEU A 95 8.110 -3.371 13.189 1.00 8.40 C ATOM 657 CD1 LEU A 95 8.657 -2.257 14.064 1.00 8.69 C ATOM 658 CD2 LEU A 95 7.088 -4.182 13.942 1.00 8.56 C ATOM 659 H LEU A 95 6.939 -1.724 9.568 1.00 0.00 H ATOM 660 N ARG A 96 10.708 -3.308 11.074 1.00 7.34 N ATOM 661 CA ARG A 96 11.692 -4.372 10.895 1.00 7.26 C ATOM 662 C ARG A 96 12.087 -4.884 12.262 1.00 6.82 C ATOM 663 O ARG A 96 12.091 -4.135 13.242 1.00 6.97 O ATOM 664 CB ARG A 96 12.892 -3.842 10.113 1.00 7.78 C ATOM 665 CG ARG A 96 12.501 -3.291 8.737 1.00 8.41 C ATOM 666 CD ARG A 96 12.025 -4.380 7.812 1.00 8.92 C ATOM 667 NE ARG A 96 11.656 -3.910 6.475 1.00 9.71 N ATOM 668 CZ ARG A 96 10.432 -3.568 6.083 1.00 10.31 C ATOM 669 NH1 ARG A 96 9.391 -3.576 6.909 1.00 10.58 N ATOM 670 NH2 ARG A 96 10.243 -3.184 4.820 1.00 11.11 N ATOM 671 HE ARG A 96 12.418 -3.837 5.771 1.00 0.00 H ATOM 672 HH12 ARG A 96 8.450 -3.301 6.562 1.00 0.00 H ATOM 673 HH11 ARG A 96 9.517 -3.857 7.902 1.00 0.00 H ATOM 674 HH22 ARG A 96 9.293 -2.913 4.496 1.00 0.00 H ATOM 675 HH21 ARG A 96 11.046 -3.156 4.159 1.00 0.00 H ATOM 676 H ARG A 96 10.957 -2.491 11.667 1.00 0.00 H ATOM 677 N ILE A 97 12.421 -6.175 12.326 1.00 6.50 N ATOM 678 CA ILE A 97 12.849 -6.794 13.576 1.00 6.43 C ATOM 679 C ILE A 97 14.164 -7.485 13.315 1.00 6.16 C ATOM 680 O ILE A 97 14.280 -8.263 12.379 1.00 6.32 O ATOM 681 CB ILE A 97 11.781 -7.742 14.173 1.00 6.69 C ATOM 682 CG1 ILE A 97 10.457 -6.988 14.389 1.00 7.10 C ATOM 683 CG2 ILE A 97 12.295 -8.356 15.470 1.00 6.62 C ATOM 684 CD1 ILE A 97 9.346 -7.831 14.970 1.00 7.44 C ATOM 685 H ILE A 97 12.375 -6.754 11.463 1.00 0.00 H ATOM 686 N LEU A 98 15.166 -7.146 14.129 1.00 6.02 N ATOM 687 CA LEU A 98 16.509 -7.717 14.068 1.00 6.09 C ATOM 688 C LEU A 98 16.686 -8.578 15.316 1.00 5.95 C ATOM 689 O LEU A 98 16.697 -8.069 16.443 1.00 6.44 O ATOM 690 CB LEU A 98 17.585 -6.635 14.098 1.00 6.29 C ATOM 691 CG LEU A 98 17.703 -5.652 12.937 1.00 6.63 C ATOM 692 CD1 LEU A 98 16.567 -4.638 12.873 1.00 6.91 C ATOM 693 CD2 LEU A 98 19.023 -4.926 13.071 1.00 6.97 C ATOM 694 H LEU A 98 14.978 -6.427 14.856 1.00 0.00 H ATOM 695 N ALA A 99 16.766 -9.889 15.123 1.00 5.82 N ATOM 696 CA ALA A 99 16.843 -10.847 16.222 1.00 5.85 C ATOM 697 C ALA A 99 18.241 -11.442 16.270 1.00 5.79 C ATOM 698 O ALA A 99 18.707 -12.081 15.313 1.00 5.91 O ATOM 699 CB ALA A 99 15.796 -11.918 16.034 1.00 6.02 C ATOM 700 H ALA A 99 16.774 -10.249 14.147 1.00 0.00 H ATOM 701 N PHE A 100 18.900 -11.244 17.408 1.00 5.59 N ATOM 702 CA PHE A 100 20.245 -11.713 17.655 1.00 5.67 C ATOM 703 C PHE A 100 20.209 -12.844 18.662 1.00 5.58 C ATOM 704 O PHE A 100 19.958 -12.618 19.853 1.00 5.67 O ATOM 705 CB PHE A 100 21.101 -10.581 18.195 1.00 5.74 C ATOM 706 CG PHE A 100 21.447 -9.549 17.160 1.00 5.94 C ATOM 707 CD1 PHE A 100 20.640 -8.450 16.915 1.00 6.03 C ATOM 708 CD2 PHE A 100 22.609 -9.689 16.415 1.00 6.17 C ATOM 709 CE1 PHE A 100 20.986 -7.515 15.936 1.00 6.35 C ATOM 710 CE2 PHE A 100 22.963 -8.759 15.456 1.00 6.33 C ATOM 711 CZ PHE A 100 22.151 -7.672 15.211 1.00 6.40 C ATOM 712 H PHE A 100 18.419 -10.720 18.166 1.00 0.00 H ATOM 713 N PRO A 101 20.458 -14.094 18.240 1.00 5.65 N ATOM 714 CA PRO A 101 20.574 -15.169 19.208 1.00 5.90 C ATOM 715 C PRO A 101 21.765 -14.934 20.129 1.00 6.13 C ATOM 716 O PRO A 101 22.773 -14.383 19.712 1.00 6.30 O ATOM 717 CB PRO A 101 20.762 -16.419 18.338 1.00 5.96 C ATOM 718 CG PRO A 101 20.363 -16.021 16.958 1.00 5.87 C ATOM 719 CD PRO A 101 20.705 -14.558 16.870 1.00 5.69 C ATOM 720 N SER A 102 21.647 -15.376 21.379 1.00 6.33 N ATOM 721 CA SER A 102 22.781 -15.380 22.301 1.00 6.73 C ATOM 722 C SER A 102 22.619 -16.516 23.276 1.00 6.89 C ATOM 723 O SER A 102 21.508 -16.831 23.705 1.00 6.90 O ATOM 724 CB SER A 102 22.853 -14.059 23.064 1.00 6.96 C ATOM 725 OG SER A 102 23.981 -14.042 23.914 1.00 7.64 O ATOM 726 HG SER A 102 24.803 -14.147 23.372 1.00 0.00 H ATOM 727 H SER A 102 20.725 -15.727 21.708 1.00 0.00 H ATOM 728 N ASN A 103 23.748 -17.139 23.603 1.00 7.18 N ATOM 729 CA ASN A 103 23.798 -18.242 24.575 1.00 7.57 C ATOM 730 C ASN A 103 24.283 -17.801 25.943 1.00 8.07 C ATOM 731 O ASN A 103 24.661 -18.649 26.756 1.00 8.78 O ATOM 732 CB ASN A 103 24.712 -19.343 24.037 1.00 7.77 C ATOM 733 CG ASN A 103 24.443 -20.700 24.664 1.00 8.13 C ATOM 734 OD1 ASN A 103 23.329 -21.028 25.037 1.00 8.05 O ATOM 735 ND2 ASN A 103 25.480 -21.495 24.770 1.00 8.67 N ATOM 736 HD22 ASN A 103 26.414 -21.178 24.440 1.00 0.00 H ATOM 737 HD21 ASN A 103 25.369 -22.443 25.184 1.00 0.00 H ATOM 738 H ASN A 103 24.634 -16.833 23.152 1.00 0.00 H ATOM 739 N GLN A 104 24.262 -16.503 26.230 1.00 8.05 N ATOM 740 CA GLN A 104 24.792 -15.988 27.491 1.00 8.45 C ATOM 741 C GLN A 104 23.868 -16.117 28.704 1.00 8.59 C ATOM 742 O GLN A 104 24.299 -15.850 29.829 1.00 9.39 O ATOM 743 CB GLN A 104 25.223 -14.527 27.339 1.00 8.46 C ATOM 744 CG GLN A 104 26.505 -14.381 26.557 1.00 8.66 C ATOM 745 CD GLN A 104 27.030 -12.972 26.617 1.00 8.64 C ATOM 746 OE1 GLN A 104 26.366 -12.048 26.158 1.00 8.48 O ATOM 747 NE2 GLN A 104 28.216 -12.795 27.160 1.00 9.18 N ATOM 748 HE22 GLN A 104 28.742 -13.609 27.536 1.00 0.00 H ATOM 749 HE21 GLN A 104 28.627 -11.841 27.213 1.00 0.00 H ATOM 750 H GLN A 104 23.858 -15.838 25.540 1.00 0.00 H ATOM 751 N PHE A 105 22.625 -16.553 28.503 1.00 8.42 N ATOM 752 CA PHE A 105 21.606 -16.532 29.566 1.00 8.70 C ATOM 753 C PHE A 105 21.056 -17.930 29.760 1.00 8.97 C ATOM 754 O PHE A 105 20.165 -18.393 29.072 1.00 8.80 O ATOM 755 CB PHE A 105 20.524 -15.508 29.254 1.00 8.60 C ATOM 756 CG PHE A 105 21.091 -14.159 28.964 1.00 8.58 C ATOM 757 CD1 PHE A 105 21.586 -13.352 30.000 1.00 8.96 C ATOM 758 CD2 PHE A 105 21.226 -13.732 27.658 1.00 8.43 C ATOM 759 CE1 PHE A 105 22.147 -12.130 29.721 1.00 9.15 C ATOM 760 CE2 PHE A 105 21.812 -12.502 27.384 1.00 8.48 C ATOM 761 CZ PHE A 105 22.270 -11.721 28.407 1.00 8.93 C ATOM 762 H PHE A 105 22.366 -16.920 27.565 1.00 0.00 H ATOM 763 N GLY A 106 21.621 -18.609 30.747 1.00 9.47 N ATOM 764 CA GLY A 106 21.233 -19.966 31.103 1.00 10.01 C ATOM 765 C GLY A 106 21.605 -21.000 30.068 1.00 10.21 C ATOM 766 O GLY A 106 21.050 -22.087 30.088 1.00 10.49 O ATOM 767 H GLY A 106 22.378 -18.151 31.294 1.00 0.00 H ATOM 768 N LYS A 107 22.530 -20.676 29.156 1.00 10.38 N ATOM 769 CA LYS A 107 22.859 -21.567 28.043 1.00 10.81 C ATOM 770 C LYS A 107 21.596 -22.012 27.303 1.00 9.91 C ATOM 771 O LYS A 107 21.428 -23.168 26.940 1.00 9.79 O ATOM 772 CB LYS A 107 23.759 -22.742 28.493 1.00 12.74 C ATOM 773 CG LYS A 107 25.120 -22.249 28.989 1.00 14.39 C ATOM 774 CD LYS A 107 26.198 -23.317 29.117 1.00 16.14 C ATOM 775 CE LYS A 107 27.570 -22.725 29.409 1.00 17.49 C ATOM 776 NZ LYS A 107 28.165 -21.839 28.367 1.00 18.22 N ATOM 777 HZ1 LYS A 107 28.275 -22.373 27.481 1.00 0.00 H ATOM 778 HZ2 LYS A 107 27.538 -21.025 28.207 1.00 0.00 H ATOM 779 HZ3 LYS A 107 29.096 -21.504 28.689 1.00 0.00 H ATOM 780 H LYS A 107 23.028 -19.767 29.241 1.00 0.00 H ATOM 781 N GLN A 108 20.719 -21.050 27.048 1.00 9.03 N ATOM 782 CA GLN A 108 19.419 -21.342 26.450 1.00 8.81 C ATOM 783 C GLN A 108 19.413 -21.220 24.924 1.00 8.26 C ATOM 784 O GLN A 108 18.360 -21.327 24.294 1.00 7.89 O ATOM 785 CB GLN A 108 18.328 -20.506 27.116 1.00 9.03 C ATOM 786 CG GLN A 108 18.066 -20.992 28.533 1.00 9.68 C ATOM 787 CD GLN A 108 17.122 -20.119 29.335 1.00 10.01 C ATOM 788 OE1 GLN A 108 16.740 -19.032 28.917 1.00 10.35 O ATOM 789 NE2 GLN A 108 16.731 -20.595 30.491 1.00 10.51 N ATOM 790 HE22 GLN A 108 17.075 -21.521 30.815 1.00 0.00 H ATOM 791 HE21 GLN A 108 16.077 -20.047 31.085 1.00 0.00 H ATOM 792 H GLN A 108 20.963 -20.066 27.279 1.00 0.00 H ATOM 793 N GLU A 109 20.587 -21.010 24.325 1.00 7.98 N ATOM 794 CA GLU A 109 20.721 -21.033 22.866 1.00 7.88 C ATOM 795 C GLU A 109 21.953 -21.860 22.480 1.00 8.25 C ATOM 796 O GLU A 109 22.913 -21.334 21.942 1.00 8.07 O ATOM 797 CB GLU A 109 20.820 -19.606 22.329 1.00 7.54 C ATOM 798 CG GLU A 109 20.670 -19.468 20.819 1.00 7.30 C ATOM 799 CD GLU A 109 19.228 -19.615 20.385 1.00 7.38 C ATOM 800 OE1 GLU A 109 18.644 -20.709 20.614 1.00 7.77 O ATOM 801 OE2 GLU A 109 18.682 -18.631 19.843 1.00 7.46 O ATOM 802 H GLU A 109 21.428 -20.825 24.908 1.00 0.00 H ATOM 803 N PRO A 110 21.934 -23.168 22.772 1.00 8.82 N ATOM 804 CA PRO A 110 23.121 -23.990 22.504 1.00 9.30 C ATOM 805 C PRO A 110 23.317 -24.388 21.041 1.00 9.31 C ATOM 806 O PRO A 110 24.356 -24.939 20.701 1.00 10.62 O ATOM 807 CB PRO A 110 22.838 -25.255 23.325 1.00 9.81 C ATOM 808 CG PRO A 110 21.356 -25.356 23.324 1.00 9.73 C ATOM 809 CD PRO A 110 20.885 -23.940 23.461 1.00 9.21 C ATOM 810 N GLY A 111 22.340 -24.161 20.189 1.00 8.94 N ATOM 811 CA GLY A 111 22.367 -24.647 18.827 1.00 8.83 C ATOM 812 C GLY A 111 23.262 -23.878 17.888 1.00 8.24 C ATOM 813 O GLY A 111 23.695 -22.740 18.161 1.00 8.37 O ATOM 814 H GLY A 111 21.517 -23.611 20.507 1.00 0.00 H ATOM 815 N SER A 112 23.541 -24.495 16.746 1.00 7.95 N ATOM 816 CA SER A 112 24.233 -23.790 15.671 1.00 7.75 C ATOM 817 C SER A 112 23.306 -22.755 15.055 1.00 7.39 C ATOM 818 O SER A 112 22.075 -22.794 15.233 1.00 7.22 O ATOM 819 CB SER A 112 24.653 -24.761 14.591 1.00 7.89 C ATOM 820 OG SER A 112 23.497 -25.261 13.944 1.00 7.85 O ATOM 821 HG SER A 112 22.995 -24.509 13.540 1.00 0.00 H ATOM 822 H SER A 112 23.264 -25.489 16.616 1.00 0.00 H ATOM 823 N ASN A 113 23.889 -21.845 14.292 1.00 7.41 N ATOM 824 CA ASN A 113 23.065 -20.875 13.567 1.00 7.48 C ATOM 825 C ASN A 113 22.034 -21.570 12.676 1.00 7.62 C ATOM 826 O ASN A 113 20.886 -21.116 12.600 1.00 7.19 O ATOM 827 CB ASN A 113 23.967 -19.917 12.778 1.00 7.74 C ATOM 828 CG ASN A 113 24.691 -18.933 13.695 1.00 7.89 C ATOM 829 OD1 ASN A 113 24.116 -18.422 14.631 1.00 7.91 O ATOM 830 ND2 ASN A 113 25.962 -18.684 13.441 1.00 8.58 N ATOM 831 HD22 ASN A 113 26.429 -19.138 12.630 1.00 0.00 H ATOM 832 HD21 ASN A 113 26.497 -18.034 14.052 1.00 0.00 H ATOM 833 H ASN A 113 24.925 -21.819 14.208 1.00 0.00 H ATOM 834 N GLU A 114 22.405 -22.656 12.000 1.00 8.19 N ATOM 835 CA GLU A 114 21.451 -23.376 11.156 1.00 8.66 C ATOM 836 C GLU A 114 20.298 -23.938 11.987 1.00 8.33 C ATOM 837 O GLU A 114 19.140 -23.869 11.576 1.00 8.06 O ATOM 838 CB GLU A 114 22.157 -24.476 10.365 1.00 9.66 C ATOM 839 CG GLU A 114 21.240 -25.472 9.674 1.00 10.67 C ATOM 840 CD GLU A 114 20.364 -24.849 8.616 1.00 11.21 C ATOM 841 OE1 GLU A 114 19.240 -25.387 8.437 1.00 11.99 O ATOM 842 OE2 GLU A 114 20.810 -23.887 7.958 1.00 11.98 O ATOM 843 H GLU A 114 23.385 -22.996 12.073 1.00 0.00 H ATOM 844 N GLU A 115 20.603 -24.497 13.156 1.00 7.88 N ATOM 845 CA GLU A 115 19.534 -25.008 14.026 1.00 7.79 C ATOM 846 C GLU A 115 18.612 -23.891 14.502 1.00 7.21 C ATOM 847 O GLU A 115 17.394 -24.071 14.576 1.00 7.21 O ATOM 848 CB GLU A 115 20.117 -25.707 15.247 1.00 8.07 C ATOM 849 CG GLU A 115 20.756 -27.046 14.932 1.00 8.72 C ATOM 850 CD GLU A 115 21.305 -27.695 16.180 1.00 9.35 C ATOM 851 OE1 GLU A 115 22.201 -27.120 16.809 1.00 9.15 O ATOM 852 OE2 GLU A 115 20.829 -28.793 16.545 1.00 11.15 O ATOM 853 H GLU A 115 21.597 -24.572 13.453 1.00 0.00 H ATOM 854 N ILE A 116 19.189 -22.738 14.838 1.00 6.94 N ATOM 855 CA ILE A 116 18.392 -21.600 15.302 1.00 6.81 C ATOM 856 C ILE A 116 17.489 -21.079 14.167 1.00 6.87 C ATOM 857 O ILE A 116 16.316 -20.744 14.400 1.00 6.84 O ATOM 858 CB ILE A 116 19.297 -20.490 15.850 1.00 6.63 C ATOM 859 CG1 ILE A 116 20.093 -20.997 17.061 1.00 6.87 C ATOM 860 CG2 ILE A 116 18.469 -19.275 16.268 1.00 6.42 C ATOM 861 CD1 ILE A 116 21.336 -20.202 17.340 1.00 6.85 C ATOM 862 H ILE A 116 20.223 -22.644 14.770 1.00 0.00 H ATOM 863 N LYS A 117 18.016 -21.053 12.940 1.00 7.11 N ATOM 864 CA LYS A 117 17.223 -20.678 11.781 1.00 7.60 C ATOM 865 C LYS A 117 16.002 -21.582 11.653 1.00 7.66 C ATOM 866 O LYS A 117 14.865 -21.112 11.432 1.00 7.63 O ATOM 867 CB LYS A 117 18.094 -20.759 10.529 1.00 8.23 C ATOM 868 CG LYS A 117 17.341 -20.479 9.236 1.00 9.18 C ATOM 869 CD LYS A 117 18.256 -20.403 8.036 1.00 10.14 C ATOM 870 CE LYS A 117 18.925 -21.701 7.737 1.00 11.47 C ATOM 871 NZ LYS A 117 19.827 -21.519 6.587 1.00 12.07 N ATOM 872 HZ1 LYS A 117 19.276 -21.208 5.761 1.00 0.00 H ATOM 873 HZ2 LYS A 117 20.542 -20.800 6.819 1.00 0.00 H ATOM 874 HZ3 LYS A 117 20.298 -22.421 6.371 1.00 0.00 H ATOM 875 H LYS A 117 19.016 -21.307 12.811 1.00 0.00 H ATOM 876 N GLU A 118 16.227 -22.899 11.764 1.00 7.93 N ATOM 877 CA GLU A 118 15.125 -23.858 11.674 1.00 8.57 C ATOM 878 C GLU A 118 14.109 -23.677 12.798 1.00 7.92 C ATOM 879 O GLU A 118 12.901 -23.821 12.588 1.00 8.06 O ATOM 880 CB GLU A 118 15.661 -25.289 11.643 1.00 10.05 C ATOM 881 CG GLU A 118 16.436 -25.601 10.375 1.00 11.74 C ATOM 882 CD GLU A 118 16.850 -27.050 10.261 1.00 13.97 C ATOM 883 OE1 GLU A 118 16.190 -27.923 10.880 1.00 16.76 O ATOM 884 OE2 GLU A 118 17.840 -27.330 9.531 1.00 16.07 O ATOM 885 H GLU A 118 17.196 -23.243 11.916 1.00 0.00 H ATOM 886 N PHE A 119 14.602 -23.364 13.995 1.00 7.35 N ATOM 887 CA PHE A 119 13.727 -23.098 15.146 1.00 7.28 C ATOM 888 C PHE A 119 12.824 -21.889 14.875 1.00 7.15 C ATOM 889 O PHE A 119 11.598 -21.930 15.063 1.00 7.15 O ATOM 890 CB PHE A 119 14.574 -22.900 16.411 1.00 7.19 C ATOM 891 CG PHE A 119 13.763 -22.756 17.647 1.00 7.32 C ATOM 892 CD1 PHE A 119 13.352 -23.875 18.360 1.00 7.69 C ATOM 893 CD2 PHE A 119 13.365 -21.496 18.099 1.00 7.19 C ATOM 894 CE1 PHE A 119 12.573 -23.748 19.498 1.00 7.94 C ATOM 895 CE2 PHE A 119 12.585 -21.367 19.223 1.00 7.44 C ATOM 896 CZ PHE A 119 12.202 -22.493 19.928 1.00 7.70 C ATOM 897 H PHE A 119 15.633 -23.306 14.119 1.00 0.00 H ATOM 898 N ALA A 120 13.428 -20.817 14.388 1.00 6.88 N ATOM 899 CA ALA A 120 12.673 -19.626 14.022 1.00 6.94 C ATOM 900 C ALA A 120 11.668 -19.906 12.918 1.00 7.24 C ATOM 901 O ALA A 120 10.529 -19.397 12.959 1.00 7.33 O ATOM 902 CB ALA A 120 13.634 -18.529 13.616 1.00 6.81 C ATOM 903 H ALA A 120 14.461 -20.825 14.264 1.00 0.00 H ATOM 904 N ALA A 121 12.047 -20.724 11.945 1.00 7.59 N ATOM 905 CA ALA A 121 11.121 -21.094 10.874 1.00 8.19 C ATOM 906 C ALA A 121 9.888 -21.789 11.413 1.00 8.51 C ATOM 907 O ALA A 121 8.784 -21.647 10.870 1.00 8.75 O ATOM 908 CB ALA A 121 11.800 -21.944 9.811 1.00 8.59 C ATOM 909 H ALA A 121 13.014 -21.107 11.943 1.00 0.00 H ATOM 910 N GLY A 122 10.031 -22.543 12.496 1.00 8.60 N ATOM 911 CA GLY A 122 8.880 -23.204 13.117 1.00 9.07 C ATOM 912 C GLY A 122 7.829 -22.247 13.641 1.00 9.28 C ATOM 913 O GLY A 122 6.669 -22.620 13.754 1.00 10.40 O ATOM 914 H GLY A 122 10.976 -22.667 12.911 1.00 0.00 H ATOM 915 N TYR A 123 8.240 -21.026 13.977 1.00 9.02 N ATOM 916 CA TYR A 123 7.325 -19.955 14.392 1.00 9.26 C ATOM 917 C TYR A 123 6.893 -19.074 13.226 1.00 9.22 C ATOM 918 O TYR A 123 6.246 -18.044 13.437 1.00 9.52 O ATOM 919 CB TYR A 123 7.994 -19.110 15.492 1.00 9.67 C ATOM 920 CG TYR A 123 7.968 -19.772 16.834 1.00 10.43 C ATOM 921 CD1 TYR A 123 6.837 -19.728 17.600 1.00 11.31 C ATOM 922 CD2 TYR A 123 9.097 -20.403 17.357 1.00 10.98 C ATOM 923 CE1 TYR A 123 6.796 -20.325 18.839 1.00 12.17 C ATOM 924 CE2 TYR A 123 9.069 -21.003 18.606 1.00 11.87 C ATOM 925 CZ TYR A 123 7.924 -20.988 19.330 1.00 12.25 C ATOM 926 OH TYR A 123 7.885 -21.591 20.569 1.00 14.20 O ATOM 927 HH TYR A 123 6.980 -21.487 20.957 1.00 0.00 H ATOM 928 H TYR A 123 9.259 -20.821 13.944 1.00 0.00 H ATOM 929 N ASN A 124 7.230 -19.459 12.000 1.00 9.23 N ATOM 930 CA ASN A 124 6.878 -18.681 10.813 1.00 9.55 C ATOM 931 C ASN A 124 7.493 -17.285 10.819 1.00 8.63 C ATOM 932 O ASN A 124 6.912 -16.323 10.306 1.00 8.71 O ATOM 933 CB ASN A 124 5.358 -18.671 10.598 1.00 10.91 C ATOM 934 CG ASN A 124 4.809 -20.078 10.457 1.00 12.40 C ATOM 935 OD1 ASN A 124 5.341 -20.867 9.691 1.00 14.28 O ATOM 936 ND2 ASN A 124 3.752 -20.394 11.175 1.00 13.65 N ATOM 937 HD22 ASN A 124 3.330 -19.692 11.815 1.00 0.00 H ATOM 938 HD21 ASN A 124 3.339 -21.346 11.102 1.00 0.00 H ATOM 939 H ASN A 124 7.763 -20.344 11.880 1.00 0.00 H ATOM 940 N VAL A 125 8.697 -17.179 11.365 1.00 7.81 N ATOM 941 CA VAL A 125 9.436 -15.933 11.369 1.00 7.37 C ATOM 942 C VAL A 125 9.764 -15.505 9.943 1.00 7.29 C ATOM 943 O VAL A 125 10.279 -16.287 9.143 1.00 7.39 O ATOM 944 CB VAL A 125 10.730 -16.106 12.185 1.00 6.93 C ATOM 945 CG1 VAL A 125 11.721 -14.974 11.954 1.00 6.73 C ATOM 946 CG2 VAL A 125 10.399 -16.222 13.662 1.00 6.89 C ATOM 947 H VAL A 125 9.125 -18.019 11.805 1.00 0.00 H ATOM 948 N LYS A 126 9.487 -14.232 9.648 1.00 7.36 N ATOM 949 CA LYS A 126 9.852 -13.619 8.358 1.00 7.83 C ATOM 950 C LYS A 126 10.680 -12.347 8.548 1.00 7.48 C ATOM 951 O LYS A 126 11.013 -11.698 7.555 1.00 7.91 O ATOM 952 CB LYS A 126 8.598 -13.332 7.532 1.00 8.62 C ATOM 953 CG LYS A 126 7.792 -14.590 7.249 1.00 9.65 C ATOM 954 CD LYS A 126 6.535 -14.340 6.420 1.00 11.09 C ATOM 955 CE LYS A 126 5.655 -15.578 6.387 1.00 12.49 C ATOM 956 NZ LYS A 126 4.386 -15.411 5.644 1.00 14.16 N ATOM 957 HZ1 LYS A 126 3.826 -14.653 6.083 1.00 0.00 H ATOM 958 HZ2 LYS A 126 4.594 -15.162 4.656 1.00 0.00 H ATOM 959 HZ3 LYS A 126 3.849 -16.301 5.672 1.00 0.00 H ATOM 960 H LYS A 126 8.995 -13.651 10.356 1.00 0.00 H ATOM 961 N PHE A 127 10.998 -12.000 9.782 1.00 7.06 N ATOM 962 CA PHE A 127 11.875 -10.890 10.083 1.00 6.86 C ATOM 963 C PHE A 127 13.341 -11.360 10.004 1.00 6.71 C ATOM 964 O PHE A 127 13.614 -12.459 9.519 1.00 7.12 O ATOM 965 CB PHE A 127 11.487 -10.225 11.413 1.00 6.81 C ATOM 966 CG PHE A 127 11.391 -11.132 12.617 1.00 6.73 C ATOM 967 CD1 PHE A 127 12.512 -11.529 13.317 1.00 6.61 C ATOM 968 CD2 PHE A 127 10.145 -11.510 13.090 1.00 6.82 C ATOM 969 CE1 PHE A 127 12.387 -12.316 14.463 1.00 6.72 C ATOM 970 CE2 PHE A 127 10.020 -12.292 14.218 1.00 7.02 C ATOM 971 CZ PHE A 127 11.142 -12.709 14.895 1.00 6.79 C ATOM 972 H PHE A 127 10.601 -12.549 10.571 1.00 0.00 H ATOM 973 N ASP A 128 14.288 -10.521 10.424 1.00 6.58 N ATOM 974 CA ASP A 128 15.696 -10.709 10.133 1.00 6.80 C ATOM 975 C ASP A 128 16.414 -11.379 11.277 1.00 6.56 C ATOM 976 O ASP A 128 16.531 -10.821 12.363 1.00 7.10 O ATOM 977 CB ASP A 128 16.297 -9.370 9.775 1.00 7.19 C ATOM 978 CG ASP A 128 15.616 -8.761 8.563 1.00 7.86 C ATOM 979 OD1 ASP A 128 15.288 -9.507 7.616 1.00 8.94 O ATOM 980 OD2 ASP A 128 15.382 -7.530 8.566 1.00 8.36 O ATOM 981 H ASP A 128 14.004 -9.694 10.986 1.00 0.00 H ATOM 982 N MET A 129 16.875 -12.605 11.011 1.00 6.44 N ATOM 983 CA MET A 129 17.629 -13.388 11.991 1.00 6.44 C ATOM 984 C MET A 129 19.115 -13.199 11.740 1.00 6.22 C ATOM 985 O MET A 129 19.574 -13.265 10.594 1.00 6.48 O ATOM 986 CB MET A 129 17.279 -14.869 11.890 1.00 6.80 C ATOM 987 CG MET A 129 15.850 -15.232 12.259 1.00 7.23 C ATOM 988 SD MET A 129 15.383 -14.983 13.977 1.00 7.61 S ATOM 989 CE MET A 129 16.505 -16.125 14.803 1.00 7.94 C ATOM 990 H MET A 129 16.691 -13.017 10.074 1.00 0.00 H ATOM 991 N PHE A 130 19.859 -13.001 12.822 1.00 6.06 N ATOM 992 CA PHE A 130 21.296 -12.797 12.782 1.00 6.16 C ATOM 993 C PHE A 130 22.046 -13.986 13.366 1.00 6.14 C ATOM 994 O PHE A 130 21.465 -14.821 14.063 1.00 6.33 O ATOM 995 CB PHE A 130 21.655 -11.460 13.453 1.00 6.23 C ATOM 996 CG PHE A 130 21.225 -10.281 12.623 1.00 6.55 C ATOM 997 CD1 PHE A 130 19.915 -9.819 12.658 1.00 6.71 C ATOM 998 CD2 PHE A 130 22.107 -9.686 11.744 1.00 6.86 C ATOM 999 CE1 PHE A 130 19.530 -8.759 11.845 1.00 6.99 C ATOM 1000 CE2 PHE A 130 21.721 -8.632 10.949 1.00 7.14 C ATOM 1001 CZ PHE A 130 20.426 -8.171 10.996 1.00 7.12 C ATOM 1002 H PHE A 130 19.387 -12.992 13.748 1.00 0.00 H ATOM 1003 N SER A 131 23.349 -14.052 13.077 1.00 6.16 N ATOM 1004 CA SER A 131 24.206 -15.050 13.723 1.00 6.42 C ATOM 1005 C SER A 131 24.309 -14.802 15.219 1.00 6.39 C ATOM 1006 O SER A 131 24.226 -13.672 15.704 1.00 6.27 O ATOM 1007 CB SER A 131 25.611 -15.038 13.143 1.00 6.73 C ATOM 1008 OG SER A 131 25.665 -15.662 11.884 1.00 7.25 O ATOM 1009 HG SER A 131 25.066 -15.187 11.255 1.00 0.00 H ATOM 1010 H SER A 131 23.758 -13.389 12.388 1.00 0.00 H ATOM 1011 N LYS A 132 24.485 -15.888 15.951 1.00 6.63 N ATOM 1012 CA LYS A 132 24.591 -15.838 17.404 1.00 6.95 C ATOM 1013 C LYS A 132 25.770 -14.979 17.817 1.00 7.00 C ATOM 1014 O LYS A 132 26.840 -15.072 17.223 1.00 7.13 O ATOM 1015 CB LYS A 132 24.759 -17.265 17.948 1.00 7.61 C ATOM 1016 CG LYS A 132 24.744 -17.396 19.471 1.00 8.25 C ATOM 1017 CD LYS A 132 25.377 -18.693 19.959 1.00 9.36 C ATOM 1018 CE LYS A 132 24.635 -19.890 19.426 1.00 9.59 C ATOM 1019 NZ LYS A 132 24.986 -21.205 20.027 1.00 9.45 N ATOM 1020 HZ1 LYS A 132 25.995 -21.399 19.868 1.00 0.00 H ATOM 1021 HZ2 LYS A 132 24.794 -21.180 21.049 1.00 0.00 H ATOM 1022 HZ3 LYS A 132 24.414 -21.951 19.583 1.00 0.00 H ATOM 1023 H LYS A 132 24.550 -16.810 15.474 1.00 0.00 H ATOM 1024 N ILE A 133 25.550 -14.173 18.855 1.00 6.88 N ATOM 1025 CA ILE A 133 26.556 -13.259 19.377 1.00 7.24 C ATOM 1026 C ILE A 133 26.528 -13.252 20.893 1.00 7.52 C ATOM 1027 O ILE A 133 25.603 -13.767 21.527 1.00 8.05 O ATOM 1028 CB ILE A 133 26.299 -11.795 18.888 1.00 7.16 C ATOM 1029 CG1 ILE A 133 24.888 -11.333 19.291 1.00 7.09 C ATOM 1030 CG2 ILE A 133 26.487 -11.676 17.393 1.00 7.37 C ATOM 1031 CD1 ILE A 133 24.715 -9.827 19.262 1.00 6.98 C ATOM 1032 H ILE A 133 24.617 -14.198 19.313 1.00 0.00 H ATOM 1033 N GLU A 134 27.544 -12.628 21.471 1.00 7.90 N ATOM 1034 CA GLU A 134 27.468 -12.147 22.858 1.00 8.37 C ATOM 1035 C GLU A 134 26.906 -10.727 22.873 1.00 7.77 C ATOM 1036 O GLU A 134 27.193 -9.925 21.985 1.00 7.51 O ATOM 1037 CB GLU A 134 28.847 -12.213 23.529 1.00 9.70 C ATOM 1038 CG GLU A 134 29.304 -13.656 23.666 1.00 11.23 C ATOM 1039 CD GLU A 134 30.601 -13.857 24.385 1.00 13.08 C ATOM 1040 OE1 GLU A 134 31.334 -12.885 24.618 1.00 14.76 O ATOM 1041 OE2 GLU A 134 30.859 -15.037 24.694 1.00 16.20 O ATOM 1042 H GLU A 134 28.418 -12.474 20.929 1.00 0.00 H ATOM 1043 N VAL A 135 26.127 -10.434 23.909 1.00 7.54 N ATOM 1044 CA VAL A 135 25.526 -9.109 24.115 1.00 7.48 C ATOM 1045 C VAL A 135 26.065 -8.382 25.344 1.00 7.69 C ATOM 1046 O VAL A 135 25.872 -7.160 25.449 1.00 7.65 O ATOM 1047 CB VAL A 135 23.985 -9.172 24.167 1.00 7.42 C ATOM 1048 CG1 VAL A 135 23.418 -9.721 22.867 1.00 7.40 C ATOM 1049 CG2 VAL A 135 23.480 -9.978 25.363 1.00 7.68 C ATOM 1050 H VAL A 135 25.933 -11.179 24.608 1.00 0.00 H ATOM 1051 N ASN A 136 26.720 -9.127 26.251 1.00 8.01 N ATOM 1052 CA ASN A 136 27.366 -8.553 27.433 1.00 8.65 C ATOM 1053 C ASN A 136 28.851 -8.886 27.461 1.00 9.28 C ATOM 1054 O ASN A 136 29.288 -9.855 26.859 1.00 9.15 O ATOM 1055 CB ASN A 136 26.747 -9.115 28.708 1.00 8.88 C ATOM 1056 CG ASN A 136 25.384 -8.563 29.016 1.00 8.86 C ATOM 1057 OD1 ASN A 136 25.008 -7.461 28.609 1.00 8.71 O ATOM 1058 ND2 ASN A 136 24.632 -9.326 29.792 1.00 9.16 N ATOM 1059 HD22 ASN A 136 24.986 -10.249 30.114 1.00 0.00 H ATOM 1060 HD21 ASN A 136 23.687 -9.003 30.080 1.00 0.00 H ATOM 1061 H ASN A 136 26.770 -10.156 26.107 1.00 0.00 H ATOM 1062 N GLY A 137 29.606 -8.069 28.190 1.00 10.31 N ATOM 1063 CA GLY A 137 31.033 -8.280 28.393 1.00 11.41 C ATOM 1064 C GLY A 137 31.859 -7.658 27.302 1.00 12.06 C ATOM 1065 O GLY A 137 31.347 -7.050 26.346 1.00 11.58 O ATOM 1066 H GLY A 137 29.158 -7.243 28.635 1.00 0.00 H ATOM 1067 N ASP A 138 33.168 -7.834 27.444 1.00 13.54 N ATOM 1068 CA ASP A 138 34.131 -7.169 26.563 1.00 14.77 C ATOM 1069 C ASP A 138 34.076 -7.668 25.134 1.00 14.37 C ATOM 1070 O ASP A 138 34.508 -6.960 24.226 1.00 14.53 O ATOM 1071 CB ASP A 138 35.583 -7.375 27.052 1.00 16.75 C ATOM 1072 CG ASP A 138 35.877 -6.709 28.387 1.00 18.56 C ATOM 1073 OD1 ASP A 138 35.133 -5.788 28.780 1.00 20.59 O ATOM 1074 OD2 ASP A 138 36.879 -7.103 29.035 1.00 21.29 O ATOM 1075 H ASP A 138 33.517 -8.459 28.199 1.00 0.00 H ATOM 1076 N ASP A 139 33.575 -8.886 24.936 1.00 13.95 N ATOM 1077 CA ASP A 139 33.452 -9.477 23.600 1.00 13.97 C ATOM 1078 C ASP A 139 32.025 -9.402 23.038 1.00 12.35 C ATOM 1079 O ASP A 139 31.678 -10.150 22.135 1.00 12.59 O ATOM 1080 CB ASP A 139 33.973 -10.929 23.620 1.00 15.33 C ATOM 1081 CG ASP A 139 35.463 -11.027 23.934 1.00 17.31 C ATOM 1082 OD1 ASP A 139 36.200 -10.024 23.801 1.00 19.54 O ATOM 1083 OD2 ASP A 139 35.894 -12.131 24.324 1.00 19.65 O ATOM 1084 H ASP A 139 33.260 -9.438 25.759 1.00 0.00 H ATOM 1085 N ALA A 140 31.200 -8.515 23.575 1.00 10.70 N ATOM 1086 CA ALA A 140 29.871 -8.297 23.020 1.00 9.63 C ATOM 1087 C ALA A 140 29.959 -7.638 21.655 1.00 8.96 C ATOM 1088 O ALA A 140 30.883 -6.861 21.368 1.00 9.51 O ATOM 1089 CB ALA A 140 29.040 -7.444 23.952 1.00 9.43 C ATOM 1090 H ALA A 140 31.506 -7.967 24.404 1.00 0.00 H ATOM 1091 N HIS A 141 28.989 -7.919 20.807 1.00 8.19 N ATOM 1092 CA HIS A 141 28.886 -7.190 19.541 1.00 7.67 C ATOM 1093 C HIS A 141 28.797 -5.688 19.811 1.00 7.43 C ATOM 1094 O HIS A 141 28.028 -5.257 20.669 1.00 7.12 O ATOM 1095 CB HIS A 141 27.672 -7.667 18.747 1.00 7.39 C ATOM 1096 CG HIS A 141 27.688 -7.204 17.334 1.00 7.44 C ATOM 1097 ND1 HIS A 141 27.377 -5.917 16.979 1.00 7.38 N ATOM 1098 CD2 HIS A 141 28.011 -7.847 16.192 1.00 7.76 C ATOM 1099 CE1 HIS A 141 27.500 -5.787 15.676 1.00 7.62 C ATOM 1100 NE2 HIS A 141 27.880 -6.946 15.176 1.00 7.94 N ATOM 1101 H HIS A 141 28.296 -8.659 21.038 1.00 0.00 H ATOM 1102 N PRO A 142 29.552 -4.873 19.048 1.00 7.54 N ATOM 1103 CA PRO A 142 29.560 -3.437 19.354 1.00 7.55 C ATOM 1104 C PRO A 142 28.224 -2.728 19.178 1.00 7.12 C ATOM 1105 O PRO A 142 28.016 -1.712 19.819 1.00 7.00 O ATOM 1106 CB PRO A 142 30.653 -2.866 18.447 1.00 8.20 C ATOM 1107 CG PRO A 142 30.842 -3.847 17.406 1.00 8.45 C ATOM 1108 CD PRO A 142 30.546 -5.198 18.014 1.00 7.93 C ATOM 1109 N LEU A 143 27.322 -3.228 18.337 1.00 6.82 N ATOM 1110 CA LEU A 143 25.975 -2.646 18.292 1.00 6.77 C ATOM 1111 C LEU A 143 25.309 -2.719 19.677 1.00 6.46 C ATOM 1112 O LEU A 143 24.637 -1.785 20.112 1.00 6.40 O ATOM 1113 CB LEU A 143 25.095 -3.378 17.306 1.00 7.01 C ATOM 1114 CG LEU A 143 23.605 -2.984 17.343 1.00 7.18 C ATOM 1115 CD1 LEU A 143 23.387 -1.525 17.006 1.00 7.46 C ATOM 1116 CD2 LEU A 143 22.776 -3.876 16.440 1.00 7.35 C ATOM 1117 H LEU A 143 27.569 -4.025 17.716 1.00 0.00 H ATOM 1118 N TRP A 144 25.450 -3.868 20.336 1.00 6.25 N ATOM 1119 CA TRP A 144 24.876 -4.083 21.664 1.00 6.37 C ATOM 1120 C TRP A 144 25.579 -3.257 22.720 1.00 6.61 C ATOM 1121 O TRP A 144 24.922 -2.672 23.567 1.00 6.84 O ATOM 1122 CB TRP A 144 24.844 -5.589 21.970 1.00 6.30 C ATOM 1123 CG TRP A 144 23.715 -6.253 21.227 1.00 6.13 C ATOM 1124 CD1 TRP A 144 23.680 -6.626 19.911 1.00 6.11 C ATOM 1125 CD2 TRP A 144 22.424 -6.542 21.750 1.00 6.24 C ATOM 1126 NE1 TRP A 144 22.439 -7.110 19.594 1.00 6.05 N ATOM 1127 CE2 TRP A 144 21.649 -7.062 20.706 1.00 6.08 C ATOM 1128 CE3 TRP A 144 21.843 -6.385 23.004 1.00 6.36 C ATOM 1129 CZ2 TRP A 144 20.328 -7.459 20.903 1.00 5.96 C ATOM 1130 CZ3 TRP A 144 20.549 -6.760 23.195 1.00 6.40 C ATOM 1131 CH2 TRP A 144 19.803 -7.284 22.157 1.00 6.22 C ATOM 1132 HE1 TRP A 144 22.146 -7.457 18.659 1.00 0.00 H ATOM 1133 H TRP A 144 25.987 -4.639 19.891 1.00 0.00 H ATOM 1134 N LYS A 145 26.909 -3.158 22.649 1.00 6.80 N ATOM 1135 CA LYS A 145 27.622 -2.227 23.525 1.00 7.15 C ATOM 1136 C LYS A 145 27.034 -0.810 23.397 1.00 7.11 C ATOM 1137 O LYS A 145 26.781 -0.121 24.384 1.00 7.27 O ATOM 1138 CB LYS A 145 29.112 -2.218 23.194 1.00 7.54 C ATOM 1139 CG LYS A 145 29.821 -3.538 23.434 1.00 8.01 C ATOM 1140 CD LYS A 145 31.324 -3.409 23.269 1.00 8.63 C ATOM 1141 CE LYS A 145 32.087 -4.653 23.719 1.00 9.17 C ATOM 1142 NZ LYS A 145 33.549 -4.505 23.448 1.00 9.78 N ATOM 1143 HZ1 LYS A 145 33.699 -4.369 22.428 1.00 0.00 H ATOM 1144 HZ2 LYS A 145 33.915 -3.681 23.966 1.00 0.00 H ATOM 1145 HZ3 LYS A 145 34.047 -5.362 23.762 1.00 0.00 H ATOM 1146 H LYS A 145 27.438 -3.743 21.971 1.00 0.00 H ATOM 1147 N TRP A 146 26.822 -0.393 22.152 1.00 6.89 N ATOM 1148 CA TRP A 146 26.331 0.957 21.842 1.00 6.88 C ATOM 1149 C TRP A 146 24.895 1.153 22.347 1.00 6.70 C ATOM 1150 O TRP A 146 24.597 2.155 22.981 1.00 6.81 O ATOM 1151 CB TRP A 146 26.423 1.210 20.332 1.00 6.93 C ATOM 1152 CG TRP A 146 25.862 2.519 19.885 1.00 7.15 C ATOM 1153 CD1 TRP A 146 26.492 3.720 19.847 1.00 7.48 C ATOM 1154 CD2 TRP A 146 24.544 2.742 19.379 1.00 7.20 C ATOM 1155 NE1 TRP A 146 25.647 4.682 19.373 1.00 7.62 N ATOM 1156 CE2 TRP A 146 24.437 4.109 19.084 1.00 7.44 C ATOM 1157 CE3 TRP A 146 23.444 1.914 19.159 1.00 7.06 C ATOM 1158 CZ2 TRP A 146 23.265 4.664 18.572 1.00 7.60 C ATOM 1159 CZ3 TRP A 146 22.274 2.478 18.679 1.00 7.21 C ATOM 1160 CH2 TRP A 146 22.193 3.828 18.380 1.00 7.43 C ATOM 1161 HE1 TRP A 146 25.884 5.687 19.251 1.00 0.00 H ATOM 1162 H TRP A 146 27.011 -1.048 21.367 1.00 0.00 H ATOM 1163 N MET A 147 24.001 0.197 22.066 1.00 6.54 N ATOM 1164 CA MET A 147 22.598 0.370 22.464 1.00 6.75 C ATOM 1165 C MET A 147 22.478 0.569 23.971 1.00 6.94 C ATOM 1166 O MET A 147 21.673 1.388 24.440 1.00 6.96 O ATOM 1167 CB MET A 147 21.713 -0.799 22.022 1.00 6.70 C ATOM 1168 CG MET A 147 21.494 -0.896 20.528 1.00 6.69 C ATOM 1169 SD MET A 147 20.243 -2.106 20.056 1.00 6.82 S ATOM 1170 CE MET A 147 20.913 -3.628 20.745 1.00 6.75 C ATOM 1171 H MET A 147 24.299 -0.666 21.567 1.00 0.00 H ATOM 1172 N LYS A 148 23.281 -0.175 24.727 1.00 7.20 N ATOM 1173 CA LYS A 148 23.224 -0.159 26.184 1.00 7.77 C ATOM 1174 C LYS A 148 23.637 1.155 26.810 1.00 8.36 C ATOM 1175 O LYS A 148 23.244 1.402 27.945 1.00 8.97 O ATOM 1176 CB LYS A 148 24.067 -1.295 26.776 1.00 7.88 C ATOM 1177 CG LYS A 148 23.502 -2.691 26.534 1.00 7.85 C ATOM 1178 CD LYS A 148 24.314 -3.780 27.237 1.00 8.16 C ATOM 1179 CE LYS A 148 25.682 -3.980 26.623 1.00 8.26 C ATOM 1180 NZ LYS A 148 26.436 -5.044 27.327 1.00 8.61 N ATOM 1181 HZ1 LYS A 148 26.556 -4.780 28.326 1.00 0.00 H ATOM 1182 HZ2 LYS A 148 25.910 -5.939 27.265 1.00 0.00 H ATOM 1183 HZ3 LYS A 148 27.370 -5.157 26.883 1.00 0.00 H ATOM 1184 H LYS A 148 23.976 -0.792 24.261 1.00 0.00 H ATOM 1185 N ILE A 149 24.409 1.991 26.111 1.00 8.41 N ATOM 1186 CA ILE A 149 24.810 3.309 26.650 1.00 8.83 C ATOM 1187 C ILE A 149 23.936 4.434 26.119 1.00 8.65 C ATOM 1188 O ILE A 149 24.196 5.586 26.459 1.00 9.03 O ATOM 1189 CB ILE A 149 26.318 3.645 26.417 1.00 9.36 C ATOM 1190 CG1 ILE A 149 26.652 3.928 24.949 1.00 9.49 C ATOM 1191 CG2 ILE A 149 27.178 2.520 26.992 1.00 9.53 C ATOM 1192 CD1 ILE A 149 27.999 4.589 24.764 1.00 9.90 C ATOM 1193 H ILE A 149 24.736 1.709 25.165 1.00 0.00 H ATOM 1194 N GLN A 150 22.921 4.149 25.293 1.00 8.31 N ATOM 1195 CA GLN A 150 22.092 5.242 24.765 1.00 8.50 C ATOM 1196 C GLN A 150 21.201 5.812 25.850 1.00 8.98 C ATOM 1197 O GLN A 150 20.808 5.083 26.769 1.00 8.73 O ATOM 1198 CB GLN A 150 21.245 4.774 23.581 1.00 8.05 C ATOM 1199 CG GLN A 150 22.096 4.304 22.407 1.00 7.82 C ATOM 1200 CD GLN A 150 23.141 5.332 22.021 1.00 7.98 C ATOM 1201 OE1 GLN A 150 22.804 6.448 21.624 1.00 8.33 O ATOM 1202 NE2 GLN A 150 24.403 4.994 22.205 1.00 7.95 N ATOM 1203 HE22 GLN A 150 24.642 4.039 22.542 1.00 0.00 H ATOM 1204 HE21 GLN A 150 25.159 5.682 22.013 1.00 0.00 H ATOM 1205 H GLN A 150 22.721 3.163 25.028 1.00 0.00 H ATOM 1206 N PRO A 151 20.868 7.115 25.771 1.00 9.89 N ATOM 1207 CA PRO A 151 20.014 7.718 26.792 1.00 10.63 C ATOM 1208 C PRO A 151 18.704 6.964 27.041 1.00 10.86 C ATOM 1209 O PRO A 151 18.283 6.845 28.187 1.00 11.63 O ATOM 1210 CB PRO A 151 19.738 9.111 26.229 1.00 11.11 C ATOM 1211 CG PRO A 151 20.955 9.435 25.456 1.00 11.05 C ATOM 1212 CD PRO A 151 21.388 8.138 24.843 1.00 10.44 C ATOM 1213 N LYS A 152 18.077 6.453 25.981 1.00 10.85 N ATOM 1214 CA LYS A 152 16.832 5.674 26.129 1.00 11.28 C ATOM 1215 C LYS A 152 17.068 4.167 26.102 1.00 10.70 C ATOM 1216 O LYS A 152 16.116 3.387 26.007 1.00 10.97 O ATOM 1217 CB LYS A 152 15.812 6.084 25.072 1.00 12.17 C ATOM 1218 CG LYS A 152 15.484 7.560 25.077 1.00 13.75 C ATOM 1219 CD LYS A 152 14.791 7.973 26.362 1.00 15.45 C ATOM 1220 CE LYS A 152 14.478 9.453 26.400 1.00 16.86 C ATOM 1221 NZ LYS A 152 13.724 9.949 25.217 1.00 18.05 N ATOM 1222 HZ1 LYS A 152 14.281 9.777 24.356 1.00 0.00 H ATOM 1223 HZ2 LYS A 152 12.816 9.447 25.151 1.00 0.00 H ATOM 1224 HZ3 LYS A 152 13.550 10.969 25.321 1.00 0.00 H ATOM 1225 H LYS A 152 18.473 6.606 25.032 1.00 0.00 H ATOM 1226 N GLY A 153 18.323 3.754 26.199 1.00 10.19 N ATOM 1227 CA GLY A 153 18.685 2.344 26.318 1.00 10.00 C ATOM 1228 C GLY A 153 19.082 1.910 27.718 1.00 10.10 C ATOM 1229 O GLY A 153 19.713 0.863 27.895 1.00 9.96 O ATOM 1230 H GLY A 153 19.083 4.464 26.190 1.00 0.00 H ATOM 1231 N LYS A 154 18.721 2.718 28.709 1.00 10.88 N ATOM 1232 CA LYS A 154 19.136 2.477 30.089 1.00 11.46 C ATOM 1233 C LYS A 154 18.409 1.276 30.671 1.00 10.92 C ATOM 1234 O LYS A 154 17.223 1.122 30.457 1.00 11.31 O ATOM 1235 CB LYS A 154 18.737 3.694 30.907 1.00 13.07 C ATOM 1236 CG LYS A 154 19.621 4.892 30.715 1.00 14.55 C ATOM 1237 CD LYS A 154 19.236 5.950 31.739 1.00 16.05 C ATOM 1238 CE LYS A 154 20.005 7.222 31.520 1.00 17.27 C ATOM 1239 NZ LYS A 154 19.404 7.995 30.409 1.00 17.92 N ATOM 1240 HZ1 LYS A 154 19.429 7.426 29.539 1.00 0.00 H ATOM 1241 HZ2 LYS A 154 18.418 8.228 30.644 1.00 0.00 H ATOM 1242 HZ3 LYS A 154 19.944 8.872 30.267 1.00 0.00 H ATOM 1243 H LYS A 154 18.127 3.545 28.497 1.00 0.00 H ATOM 1244 N GLY A 155 19.138 0.429 31.399 1.00 10.74 N ATOM 1245 CA GLY A 155 18.550 -0.696 32.133 1.00 10.67 C ATOM 1246 C GLY A 155 18.154 -0.230 33.527 1.00 10.92 C ATOM 1247 O GLY A 155 18.218 1.017 33.839 1.00 11.41 O ATOM 1248 H GLY A 155 20.167 0.572 31.448 1.00 0.00 H ATOM 1249 N ILE A 156 17.716 -1.166 34.369 1.00 10.73 N ATOM 1250 CA ILE A 156 17.187 -0.817 35.701 1.00 11.08 C ATOM 1251 C ILE A 156 18.287 -0.666 36.792 1.00 11.14 C ATOM 1252 O ILE A 156 18.470 0.388 37.344 1.00 11.64 O ATOM 1253 CB ILE A 156 16.004 -1.750 36.077 1.00 11.46 C ATOM 1254 CG1 ILE A 156 14.805 -1.435 35.152 1.00 11.55 C ATOM 1255 CG2 ILE A 156 15.610 -1.597 37.535 1.00 12.02 C ATOM 1256 CD1 ILE A 156 13.613 -2.356 35.279 1.00 11.89 C ATOM 1257 H ILE A 156 17.748 -2.165 34.080 1.00 0.00 H ATOM 1258 N LEU A 157 19.056 -1.693 37.074 1.00 10.72 N ATOM 1259 CA LEU A 157 20.203 -2.117 37.849 1.00 10.45 C ATOM 1260 C LEU A 157 21.388 -2.162 36.901 1.00 9.85 C ATOM 1261 O LEU A 157 21.975 -3.216 36.656 1.00 9.78 O ATOM 1262 CB LEU A 157 19.975 -3.433 38.590 1.00 10.54 C ATOM 1263 CG LEU A 157 18.776 -3.456 39.545 1.00 10.86 C ATOM 1264 CD1 LEU A 157 18.762 -4.807 40.231 1.00 11.24 C ATOM 1265 CD2 LEU A 157 18.788 -2.334 40.568 1.00 11.47 C ATOM 1266 H LEU A 157 18.709 -2.513 36.536 1.00 0.00 H ATOM 1267 N GLY A 158 21.729 -1.001 36.357 1.00 9.64 N ATOM 1268 CA GLY A 158 22.775 -0.900 35.354 1.00 9.42 C ATOM 1269 C GLY A 158 22.251 -1.298 33.992 1.00 8.92 C ATOM 1270 O GLY A 158 21.097 -1.704 33.825 1.00 8.76 O ATOM 1271 H GLY A 158 21.233 -0.138 36.657 1.00 0.00 H ATOM 1272 N ASN A 159 23.118 -1.192 32.998 1.00 8.77 N ATOM 1273 CA ASN A 159 22.711 -1.305 31.592 1.00 8.53 C ATOM 1274 C ASN A 159 22.926 -2.662 30.964 1.00 8.12 C ATOM 1275 O ASN A 159 22.508 -2.842 29.818 1.00 7.65 O ATOM 1276 CB ASN A 159 23.393 -0.200 30.774 1.00 8.96 C ATOM 1277 CG ASN A 159 23.018 1.178 31.264 1.00 9.52 C ATOM 1278 OD1 ASN A 159 21.904 1.393 31.678 1.00 10.05 O ATOM 1279 ND2 ASN A 159 23.963 2.122 31.201 1.00 10.33 N ATOM 1280 HD22 ASN A 159 24.908 1.888 30.836 1.00 0.00 H ATOM 1281 HD21 ASN A 159 23.753 3.090 31.517 1.00 0.00 H ATOM 1282 H ASN A 159 24.120 -1.023 33.220 1.00 0.00 H ATOM 1283 N ALA A 160 23.526 -3.616 31.674 1.00 8.13 N ATOM 1284 CA ALA A 160 23.758 -4.933 31.094 1.00 7.99 C ATOM 1285 C ALA A 160 22.441 -5.568 30.666 1.00 7.60 C ATOM 1286 O ALA A 160 21.380 -5.311 31.263 1.00 7.62 O ATOM 1287 CB ALA A 160 24.481 -5.832 32.079 1.00 8.43 C ATOM 1288 H ALA A 160 23.831 -3.420 32.649 1.00 0.00 H ATOM 1289 N ILE A 161 22.500 -6.397 29.632 1.00 7.31 N ATOM 1290 CA ILE A 161 21.335 -7.191 29.261 1.00 7.29 C ATOM 1291 C ILE A 161 21.110 -8.216 30.370 1.00 7.62 C ATOM 1292 O ILE A 161 22.043 -8.902 30.761 1.00 8.20 O ATOM 1293 CB ILE A 161 21.558 -7.890 27.903 1.00 7.04 C ATOM 1294 CG1 ILE A 161 21.944 -6.879 26.821 1.00 6.84 C ATOM 1295 CG2 ILE A 161 20.320 -8.682 27.509 1.00 7.04 C ATOM 1296 CD1 ILE A 161 21.013 -5.685 26.729 1.00 6.84 C ATOM 1297 H ILE A 161 23.380 -6.481 29.084 1.00 0.00 H ATOM 1298 N LYS A 162 19.890 -8.306 30.886 1.00 7.71 N ATOM 1299 CA LYS A 162 19.652 -9.140 32.073 1.00 8.09 C ATOM 1300 C LYS A 162 19.238 -10.555 31.774 1.00 7.90 C ATOM 1301 O LYS A 162 19.463 -11.438 32.593 1.00 8.17 O ATOM 1302 CB LYS A 162 18.623 -8.485 33.004 1.00 8.56 C ATOM 1303 CG LYS A 162 18.983 -7.083 33.459 1.00 8.92 C ATOM 1304 CD LYS A 162 20.377 -6.983 34.046 1.00 9.35 C ATOM 1305 CE LYS A 162 20.622 -5.642 34.724 1.00 9.77 C ATOM 1306 NZ LYS A 162 20.453 -4.500 33.779 1.00 9.60 N ATOM 1307 HZ1 LYS A 162 21.130 -4.597 32.995 1.00 0.00 H ATOM 1308 HZ2 LYS A 162 19.483 -4.503 33.404 1.00 0.00 H ATOM 1309 HZ3 LYS A 162 20.629 -3.607 34.282 1.00 0.00 H ATOM 1310 H LYS A 162 19.102 -7.786 30.450 1.00 0.00 H ATOM 1311 N TRP A 163 18.595 -10.784 30.642 1.00 7.60 N ATOM 1312 CA TRP A 163 18.189 -12.135 30.260 1.00 7.53 C ATOM 1313 C TRP A 163 17.839 -12.102 28.780 1.00 7.12 C ATOM 1314 O TRP A 163 17.972 -11.064 28.098 1.00 6.96 O ATOM 1315 CB TRP A 163 17.005 -12.658 31.124 1.00 7.91 C ATOM 1316 CG TRP A 163 16.971 -14.166 31.219 1.00 8.22 C ATOM 1317 CD1 TRP A 163 16.043 -15.001 30.675 1.00 8.31 C ATOM 1318 CD2 TRP A 163 17.944 -15.009 31.838 1.00 8.47 C ATOM 1319 NE1 TRP A 163 16.359 -16.310 30.930 1.00 8.58 N ATOM 1320 CE2 TRP A 163 17.531 -16.347 31.630 1.00 8.68 C ATOM 1321 CE3 TRP A 163 19.123 -14.769 32.558 1.00 8.65 C ATOM 1322 CZ2 TRP A 163 18.252 -17.440 32.129 1.00 9.05 C ATOM 1323 CZ3 TRP A 163 19.839 -15.867 33.049 1.00 9.00 C ATOM 1324 CH2 TRP A 163 19.403 -17.176 32.812 1.00 9.18 C ATOM 1325 HE1 TRP A 163 15.800 -17.137 30.639 1.00 0.00 H ATOM 1326 H TRP A 163 18.374 -9.987 30.011 1.00 0.00 H ATOM 1327 N ASN A 164 17.407 -13.251 28.264 1.00 7.03 N ATOM 1328 CA ASN A 164 16.938 -13.340 26.885 1.00 6.86 C ATOM 1329 C ASN A 164 15.746 -12.419 26.682 1.00 6.80 C ATOM 1330 O ASN A 164 14.984 -12.142 27.612 1.00 7.13 O ATOM 1331 CB ASN A 164 16.547 -14.778 26.538 1.00 7.08 C ATOM 1332 CG ASN A 164 17.639 -15.758 26.857 1.00 7.24 C ATOM 1333 OD1 ASN A 164 18.743 -15.677 26.328 1.00 7.24 O ATOM 1334 ND2 ASN A 164 17.348 -16.662 27.787 1.00 7.69 N ATOM 1335 HD22 ASN A 164 16.396 -16.690 28.205 1.00 0.00 H ATOM 1336 HD21 ASN A 164 18.072 -17.342 28.096 1.00 0.00 H ATOM 1337 H ASN A 164 17.404 -14.105 28.858 1.00 0.00 H ATOM 1338 N PHE A 165 15.605 -11.934 25.458 1.00 6.42 N ATOM 1339 CA PHE A 165 14.419 -11.164 25.028 1.00 6.49 C ATOM 1340 C PHE A 165 14.336 -9.776 25.655 1.00 6.47 C ATOM 1341 O PHE A 165 13.250 -9.283 25.945 1.00 6.96 O ATOM 1342 CB PHE A 165 13.125 -11.961 25.157 1.00 6.84 C ATOM 1343 CG PHE A 165 13.136 -13.237 24.371 1.00 6.92 C ATOM 1344 CD1 PHE A 165 13.047 -13.207 22.992 1.00 6.86 C ATOM 1345 CD2 PHE A 165 13.238 -14.468 25.002 1.00 7.40 C ATOM 1346 CE1 PHE A 165 13.035 -14.398 22.272 1.00 7.09 C ATOM 1347 CE2 PHE A 165 13.218 -15.652 24.276 1.00 7.47 C ATOM 1348 CZ PHE A 165 13.120 -15.615 22.914 1.00 7.36 C ATOM 1349 H PHE A 165 16.364 -12.103 24.767 1.00 0.00 H ATOM 1350 N THR A 166 15.481 -9.116 25.803 1.00 6.41 N ATOM 1351 CA THR A 166 15.457 -7.669 25.942 1.00 6.47 C ATOM 1352 C THR A 166 15.136 -7.092 24.557 1.00 6.30 C ATOM 1353 O THR A 166 15.548 -7.668 23.550 1.00 6.30 O ATOM 1354 CB THR A 166 16.790 -7.173 26.513 1.00 6.60 C ATOM 1355 OG1 THR A 166 16.988 -7.775 27.792 1.00 7.02 O ATOM 1356 CG2 THR A 166 16.807 -5.666 26.696 1.00 6.66 C ATOM 1357 HG1 THR A 166 17.847 -7.463 28.173 1.00 0.00 H ATOM 1358 H THR A 166 16.385 -9.630 25.819 1.00 0.00 H ATOM 1359 N LYS A 167 14.404 -5.971 24.526 1.00 6.37 N ATOM 1360 CA LYS A 167 14.056 -5.309 23.259 1.00 6.39 C ATOM 1361 C LYS A 167 14.418 -3.846 23.271 1.00 6.44 C ATOM 1362 O LYS A 167 14.196 -3.157 24.258 1.00 7.02 O ATOM 1363 CB LYS A 167 12.558 -5.425 22.970 1.00 6.57 C ATOM 1364 CG LYS A 167 11.987 -6.835 22.996 1.00 6.70 C ATOM 1365 CD LYS A 167 11.386 -7.224 24.343 1.00 7.03 C ATOM 1366 CE LYS A 167 10.793 -8.621 24.282 1.00 7.14 C ATOM 1367 NZ LYS A 167 10.527 -9.198 25.609 1.00 7.51 N ATOM 1368 HZ1 LYS A 167 11.417 -9.257 26.144 1.00 0.00 H ATOM 1369 HZ2 LYS A 167 9.853 -8.593 26.120 1.00 0.00 H ATOM 1370 HZ3 LYS A 167 10.124 -10.150 25.497 1.00 0.00 H ATOM 1371 H LYS A 167 14.073 -5.558 25.421 1.00 0.00 H ATOM 1372 N PHE A 168 14.946 -3.364 22.154 1.00 6.22 N ATOM 1373 CA PHE A 168 15.180 -1.940 21.946 1.00 6.40 C ATOM 1374 C PHE A 168 14.355 -1.495 20.751 1.00 6.41 C ATOM 1375 O PHE A 168 14.437 -2.085 19.670 1.00 6.64 O ATOM 1376 CB PHE A 168 16.656 -1.653 21.667 1.00 6.46 C ATOM 1377 CG PHE A 168 17.585 -1.947 22.816 1.00 6.79 C ATOM 1378 CD1 PHE A 168 18.057 -3.225 23.032 1.00 6.99 C ATOM 1379 CD2 PHE A 168 18.004 -0.926 23.678 1.00 7.10 C ATOM 1380 CE1 PHE A 168 18.917 -3.490 24.084 1.00 7.29 C ATOM 1381 CE2 PHE A 168 18.867 -1.183 24.720 1.00 7.27 C ATOM 1382 CZ PHE A 168 19.322 -2.466 24.940 1.00 7.39 C ATOM 1383 H PHE A 168 15.203 -4.028 21.396 1.00 0.00 H ATOM 1384 N LEU A 169 13.557 -0.457 20.942 1.00 6.59 N ATOM 1385 CA LEU A 169 12.839 0.185 19.837 1.00 6.78 C ATOM 1386 C LEU A 169 13.700 1.319 19.312 1.00 6.96 C ATOM 1387 O LEU A 169 14.214 2.141 20.083 1.00 7.03 O ATOM 1388 CB LEU A 169 11.481 0.708 20.316 1.00 6.93 C ATOM 1389 CG LEU A 169 10.618 1.461 19.292 1.00 7.13 C ATOM 1390 CD1 LEU A 169 10.210 0.559 18.142 1.00 7.21 C ATOM 1391 CD2 LEU A 169 9.391 2.012 19.984 1.00 7.43 C ATOM 1392 H LEU A 169 13.435 -0.085 21.906 1.00 0.00 H ATOM 1393 N ILE A 170 13.850 1.351 17.992 1.00 7.13 N ATOM 1394 CA ILE A 170 14.762 2.258 17.305 1.00 7.58 C ATOM 1395 C ILE A 170 13.972 2.990 16.226 1.00 7.58 C ATOM 1396 O ILE A 170 13.213 2.382 15.461 1.00 7.34 O ATOM 1397 CB ILE A 170 15.958 1.467 16.763 1.00 8.15 C ATOM 1398 CG1 ILE A 170 16.691 0.813 17.978 1.00 8.91 C ATOM 1399 CG2 ILE A 170 16.872 2.380 15.964 1.00 8.35 C ATOM 1400 CD1 ILE A 170 18.006 0.139 17.698 1.00 9.19 C ATOM 1401 H ILE A 170 13.286 0.693 17.417 1.00 0.00 H ATOM 1402 N ASP A 171 14.147 4.304 16.179 1.00 7.66 N ATOM 1403 CA ASP A 171 13.384 5.129 15.248 1.00 8.11 C ATOM 1404 C ASP A 171 13.957 5.055 13.819 1.00 8.11 C ATOM 1405 O ASP A 171 14.935 4.356 13.564 1.00 7.87 O ATOM 1406 CB ASP A 171 13.217 6.565 15.777 1.00 8.52 C ATOM 1407 CG ASP A 171 14.467 7.412 15.681 1.00 8.81 C ATOM 1408 OD1 ASP A 171 15.445 7.042 15.015 1.00 8.86 O ATOM 1409 OD2 ASP A 171 14.413 8.509 16.279 1.00 9.78 O ATOM 1410 H ASP A 171 14.837 4.752 16.814 1.00 0.00 H ATOM 1411 N LYS A 172 13.336 5.775 12.889 1.00 8.47 N ATOM 1412 CA LYS A 172 13.720 5.718 11.472 1.00 8.87 C ATOM 1413 C LYS A 172 15.126 6.250 11.220 1.00 8.97 C ATOM 1414 O LYS A 172 15.719 5.941 10.178 1.00 9.15 O ATOM 1415 CB LYS A 172 12.721 6.488 10.601 1.00 9.56 C ATOM 1416 CG LYS A 172 11.367 5.838 10.530 1.00 9.89 C ATOM 1417 CD LYS A 172 10.417 6.544 9.572 1.00 10.65 C ATOM 1418 CE LYS A 172 10.062 7.942 10.005 1.00 11.24 C ATOM 1419 NZ LYS A 172 9.054 8.502 9.080 1.00 11.89 N ATOM 1420 HZ1 LYS A 172 9.444 8.525 8.116 1.00 0.00 H ATOM 1421 HZ2 LYS A 172 8.202 7.906 9.096 1.00 0.00 H ATOM 1422 HZ3 LYS A 172 8.809 9.467 9.379 1.00 0.00 H ATOM 1423 H LYS A 172 12.554 6.398 13.174 1.00 0.00 H ATOM 1424 N ASN A 173 15.645 7.063 12.140 1.00 9.19 N ATOM 1425 CA ASN A 173 17.018 7.569 12.062 1.00 9.70 C ATOM 1426 C ASN A 173 18.040 6.708 12.792 1.00 8.99 C ATOM 1427 O ASN A 173 19.233 7.056 12.836 1.00 9.43 O ATOM 1428 CB ASN A 173 17.069 8.986 12.627 1.00 11.03 C ATOM 1429 CG ASN A 173 16.155 9.929 11.879 1.00 12.55 C ATOM 1430 OD1 ASN A 173 16.077 9.861 10.662 1.00 14.12 O ATOM 1431 ND2 ASN A 173 15.443 10.779 12.596 1.00 13.90 N ATOM 1432 HD22 ASN A 173 15.545 10.799 13.631 1.00 0.00 H ATOM 1433 HD21 ASN A 173 14.781 11.428 12.126 1.00 0.00 H ATOM 1434 H ASN A 173 15.052 7.350 12.945 1.00 0.00 H ATOM 1435 N GLY A 174 17.592 5.586 13.352 1.00 8.23 N ATOM 1436 CA GLY A 174 18.494 4.672 14.046 1.00 7.84 C ATOM 1437 C GLY A 174 18.813 5.066 15.475 1.00 7.64 C ATOM 1438 O GLY A 174 19.763 4.546 16.053 1.00 7.77 O ATOM 1439 H GLY A 174 16.579 5.356 13.294 1.00 0.00 H ATOM 1440 N VAL A 175 18.010 5.949 16.057 1.00 7.72 N ATOM 1441 CA VAL A 175 18.168 6.375 17.437 1.00 8.00 C ATOM 1442 C VAL A 175 17.335 5.473 18.353 1.00 7.73 C ATOM 1443 O VAL A 175 16.167 5.176 18.066 1.00 7.66 O ATOM 1444 CB VAL A 175 17.743 7.850 17.565 1.00 8.56 C ATOM 1445 CG1 VAL A 175 17.756 8.306 19.013 1.00 8.84 C ATOM 1446 CG2 VAL A 175 18.660 8.736 16.719 1.00 8.91 C ATOM 1447 H VAL A 175 17.232 6.355 15.499 1.00 0.00 H ATOM 1448 N VAL A 176 17.915 5.047 19.458 1.00 7.68 N ATOM 1449 CA VAL A 176 17.179 4.232 20.435 1.00 7.76 C ATOM 1450 C VAL A 176 16.142 5.120 21.113 1.00 7.87 C ATOM 1451 O VAL A 176 16.474 6.198 21.638 1.00 8.18 O ATOM 1452 CB VAL A 176 18.110 3.624 21.493 1.00 7.92 C ATOM 1453 CG1 VAL A 176 17.321 2.897 22.559 1.00 8.06 C ATOM 1454 CG2 VAL A 176 19.092 2.655 20.866 1.00 7.93 C ATOM 1455 H VAL A 176 18.909 5.292 19.641 1.00 0.00 H ATOM 1456 N VAL A 177 14.886 4.694 21.111 1.00 7.93 N ATOM 1457 CA VAL A 177 13.832 5.466 21.738 1.00 8.44 C ATOM 1458 C VAL A 177 13.244 4.802 22.961 1.00 8.38 C ATOM 1459 O VAL A 177 12.675 5.507 23.781 1.00 8.78 O ATOM 1460 CB VAL A 177 12.758 5.923 20.732 1.00 8.98 C ATOM 1461 CG1 VAL A 177 13.369 6.868 19.711 1.00 9.24 C ATOM 1462 CG2 VAL A 177 12.078 4.749 20.066 1.00 8.97 C ATOM 1463 H VAL A 177 14.654 3.790 20.652 1.00 0.00 H ATOM 1464 N LYS A 178 13.381 3.486 23.129 1.00 8.22 N ATOM 1465 CA LYS A 178 12.896 2.840 24.351 1.00 8.33 C ATOM 1466 C LYS A 178 13.525 1.457 24.463 1.00 7.85 C ATOM 1467 O LYS A 178 13.876 0.834 23.468 1.00 8.01 O ATOM 1468 CB LYS A 178 11.371 2.727 24.325 1.00 8.84 C ATOM 1469 CG LYS A 178 10.744 2.340 25.650 1.00 9.41 C ATOM 1470 CD LYS A 178 9.287 2.745 25.699 1.00 10.14 C ATOM 1471 CE LYS A 178 8.573 2.157 26.895 1.00 10.92 C ATOM 1472 NZ LYS A 178 7.135 2.485 26.831 1.00 11.71 N ATOM 1473 HZ1 LYS A 178 7.016 3.518 26.833 1.00 0.00 H ATOM 1474 HZ2 LYS A 178 6.729 2.090 25.959 1.00 0.00 H ATOM 1475 HZ3 LYS A 178 6.651 2.078 27.656 1.00 0.00 H ATOM 1476 H LYS A 178 13.835 2.915 22.388 1.00 0.00 H ATOM 1477 N ARG A 179 13.666 1.003 25.704 1.00 7.79 N ATOM 1478 CA ARG A 179 14.142 -0.339 26.030 1.00 7.67 C ATOM 1479 C ARG A 179 13.087 -1.054 26.848 1.00 7.80 C ATOM 1480 O ARG A 179 12.498 -0.446 27.742 1.00 8.31 O ATOM 1481 CB ARG A 179 15.447 -0.244 26.847 1.00 7.79 C ATOM 1482 CG ARG A 179 16.031 -1.578 27.294 1.00 7.84 C ATOM 1483 CD ARG A 179 17.319 -1.313 28.031 1.00 8.03 C ATOM 1484 NE ARG A 179 17.814 -2.516 28.680 1.00 8.15 N ATOM 1485 CZ ARG A 179 19.079 -2.712 29.043 1.00 8.17 C ATOM 1486 NH1 ARG A 179 20.015 -1.819 28.765 1.00 8.14 N ATOM 1487 NH2 ARG A 179 19.399 -3.845 29.651 1.00 8.31 N ATOM 1488 HE ARG A 179 17.132 -3.277 28.874 1.00 0.00 H ATOM 1489 HH12 ARG A 179 20.999 -1.989 29.056 1.00 0.00 H ATOM 1490 HH11 ARG A 179 19.767 -0.947 28.255 1.00 0.00 H ATOM 1491 HH22 ARG A 179 20.382 -4.019 29.943 1.00 0.00 H ATOM 1492 HH21 ARG A 179 18.667 -4.561 29.836 1.00 0.00 H ATOM 1493 H ARG A 179 13.423 1.640 26.489 1.00 0.00 H ATOM 1494 N TYR A 180 12.889 -2.329 26.556 1.00 7.54 N ATOM 1495 CA TYR A 180 11.910 -3.168 27.235 1.00 7.80 C ATOM 1496 C TYR A 180 12.614 -4.408 27.752 1.00 7.82 C ATOM 1497 O TYR A 180 13.397 -5.027 27.045 1.00 7.74 O ATOM 1498 CB TYR A 180 10.823 -3.613 26.261 1.00 7.79 C ATOM 1499 CG TYR A 180 10.167 -2.503 25.469 1.00 7.94 C ATOM 1500 CD1 TYR A 180 10.795 -1.950 24.355 1.00 7.85 C ATOM 1501 CD2 TYR A 180 8.926 -1.985 25.827 1.00 8.34 C ATOM 1502 CE1 TYR A 180 10.206 -0.942 23.618 1.00 8.01 C ATOM 1503 CE2 TYR A 180 8.327 -0.974 25.080 1.00 8.52 C ATOM 1504 CZ TYR A 180 8.974 -0.469 23.961 1.00 8.40 C ATOM 1505 OH TYR A 180 8.435 0.521 23.176 1.00 9.32 O ATOM 1506 HH TYR A 180 8.288 1.332 23.724 1.00 0.00 H ATOM 1507 H TYR A 180 13.463 -2.756 25.801 1.00 0.00 H ATOM 1508 N GLY A 181 12.331 -4.779 28.991 1.00 8.29 N ATOM 1509 CA GLY A 181 13.029 -5.875 29.616 1.00 8.56 C ATOM 1510 C GLY A 181 12.493 -7.225 29.184 1.00 8.81 C ATOM 1511 O GLY A 181 11.445 -7.339 28.534 1.00 8.80 O ATOM 1512 H GLY A 181 11.594 -4.272 29.522 1.00 0.00 H ATOM 1513 N PRO A 182 13.198 -8.290 29.585 1.00 9.39 N ATOM 1514 CA PRO A 182 12.841 -9.666 29.240 1.00 9.95 C ATOM 1515 C PRO A 182 11.386 -9.980 29.491 1.00 11.16 C ATOM 1516 O PRO A 182 10.741 -10.596 28.650 1.00 11.95 O ATOM 1517 CB PRO A 182 13.779 -10.489 30.136 1.00 9.83 C ATOM 1518 CG PRO A 182 15.013 -9.644 30.165 1.00 9.64 C ATOM 1519 CD PRO A 182 14.490 -8.236 30.301 1.00 9.56 C ATOM 1520 N MET A 183 10.843 -9.529 30.610 1.00 12.20 N ATOM 1521 CA MET A 183 9.463 -9.886 30.980 1.00 13.85 C ATOM 1522 C MET A 183 8.386 -9.044 30.346 1.00 13.29 C ATOM 1523 O MET A 183 7.198 -9.340 30.542 1.00 13.97 O ATOM 1524 CB MET A 183 9.294 -9.834 32.485 1.00 16.36 C ATOM 1525 CG MET A 183 10.176 -10.845 33.160 1.00 18.62 C ATOM 1526 SD MET A 183 9.995 -10.734 34.922 1.00 24.73 S ATOM 1527 CE MET A 183 11.232 -11.943 35.344 1.00 23.46 C ATOM 1528 H MET A 183 11.399 -8.913 31.237 1.00 0.00 H ATOM 1529 N GLU A 184 8.764 -8.017 29.598 1.00 12.09 N ATOM 1530 CA GLU A 184 7.787 -7.219 28.871 1.00 12.00 C ATOM 1531 C GLU A 184 7.512 -7.904 27.542 1.00 11.31 C ATOM 1532 O GLU A 184 8.367 -7.917 26.656 1.00 11.07 O ATOM 1533 CB GLU A 184 8.321 -5.820 28.663 1.00 12.41 C ATOM 1534 CG GLU A 184 8.561 -5.111 29.982 1.00 13.49 C ATOM 1535 CD GLU A 184 8.878 -3.654 29.788 1.00 14.24 C ATOM 1536 OE1 GLU A 184 7.961 -2.903 29.419 1.00 16.30 O ATOM 1537 OE2 GLU A 184 10.036 -3.283 29.990 1.00 14.78 O ATOM 1538 H GLU A 184 9.774 -7.778 29.529 1.00 0.00 H ATOM 1539 N GLU A 185 6.316 -8.468 27.398 1.00 11.42 N ATOM 1540 CA GLU A 185 5.985 -9.232 26.202 1.00 11.18 C ATOM 1541 C GLU A 185 6.029 -8.289 24.990 1.00 10.51 C ATOM 1542 O GLU A 185 5.754 -7.102 25.107 1.00 10.31 O ATOM 1543 CB GLU A 185 4.627 -9.927 26.330 1.00 12.03 C ATOM 1544 CG GLU A 185 3.440 -8.985 26.372 1.00 12.63 C ATOM 1545 CD GLU A 185 2.089 -9.678 26.383 1.00 13.33 C ATOM 1546 OE1 GLU A 185 1.983 -10.845 26.789 1.00 13.79 O ATOM 1547 OE2 GLU A 185 1.111 -9.018 25.980 1.00 14.11 O ATOM 1548 H GLU A 185 5.606 -8.362 28.151 1.00 0.00 H ATOM 1549 N PRO A 186 6.388 -8.808 23.805 1.00 9.51 N ATOM 1550 CA PRO A 186 6.545 -7.906 22.671 1.00 9.27 C ATOM 1551 C PRO A 186 5.335 -7.042 22.335 1.00 9.42 C ATOM 1552 O PRO A 186 5.513 -5.929 21.851 1.00 9.17 O ATOM 1553 CB PRO A 186 6.892 -8.855 21.517 1.00 9.06 C ATOM 1554 CG PRO A 186 7.562 -9.997 22.182 1.00 8.96 C ATOM 1555 CD PRO A 186 6.815 -10.180 23.469 1.00 9.31 C ATOM 1556 N LEU A 187 4.122 -7.519 22.596 1.00 10.01 N ATOM 1557 CA LEU A 187 2.959 -6.686 22.281 1.00 10.81 C ATOM 1558 C LEU A 187 2.889 -5.386 23.065 1.00 10.68 C ATOM 1559 O LEU A 187 2.206 -4.453 22.634 1.00 10.99 O ATOM 1560 CB LEU A 187 1.653 -7.456 22.376 1.00 11.78 C ATOM 1561 CG LEU A 187 1.413 -8.433 21.217 1.00 12.44 C ATOM 1562 CD1 LEU A 187 0.197 -9.307 21.480 1.00 13.19 C ATOM 1563 CD2 LEU A 187 1.265 -7.741 19.872 1.00 12.82 C ATOM 1564 H LEU A 187 4.001 -8.463 23.015 1.00 0.00 H ATOM 1565 N VAL A 188 3.616 -5.267 24.170 1.00 10.54 N ATOM 1566 CA VAL A 188 3.645 -3.952 24.829 1.00 10.91 C ATOM 1567 C VAL A 188 4.320 -2.886 23.970 1.00 10.16 C ATOM 1568 O VAL A 188 4.024 -1.689 24.106 1.00 10.57 O ATOM 1569 CB VAL A 188 4.250 -3.950 26.223 1.00 11.93 C ATOM 1570 CG1 VAL A 188 3.626 -5.020 27.093 1.00 12.34 C ATOM 1571 CG2 VAL A 188 5.728 -4.062 26.195 1.00 11.89 C ATOM 1572 H VAL A 188 4.146 -6.075 24.556 1.00 0.00 H ATOM 1573 N ILE A 189 5.210 -3.307 23.071 1.00 9.15 N ATOM 1574 CA ILE A 189 5.904 -2.366 22.187 1.00 8.74 C ATOM 1575 C ILE A 189 4.918 -1.742 21.192 1.00 8.84 C ATOM 1576 O ILE A 189 5.155 -0.656 20.673 1.00 8.65 O ATOM 1577 CB ILE A 189 7.075 -3.061 21.450 1.00 8.26 C ATOM 1578 CG1 ILE A 189 8.016 -3.764 22.445 1.00 8.25 C ATOM 1579 CG2 ILE A 189 7.869 -2.040 20.635 1.00 8.19 C ATOM 1580 CD1 ILE A 189 9.059 -4.654 21.808 1.00 8.23 C ATOM 1581 H ILE A 189 5.416 -4.324 22.995 1.00 0.00 H ATOM 1582 N GLU A 190 3.819 -2.437 20.924 1.00 9.05 N ATOM 1583 CA GLU A 190 2.811 -1.975 19.974 1.00 9.60 C ATOM 1584 C GLU A 190 2.239 -0.624 20.338 1.00 9.84 C ATOM 1585 O GLU A 190 1.832 0.115 19.454 1.00 10.12 O ATOM 1586 CB GLU A 190 1.674 -2.979 19.863 1.00 10.02 C ATOM 1587 CG GLU A 190 0.869 -2.801 18.597 1.00 10.55 C ATOM 1588 CD GLU A 190 -0.349 -3.695 18.529 1.00 11.17 C ATOM 1589 OE1 GLU A 190 -0.766 -4.283 19.550 1.00 12.18 O ATOM 1590 OE2 GLU A 190 -0.897 -3.822 17.416 1.00 11.78 O ATOM 1591 H GLU A 190 3.670 -3.345 21.409 1.00 0.00 H ATOM 1592 N LYS A 191 2.175 -0.280 21.620 1.00 9.90 N ATOM 1593 CA LYS A 191 1.670 1.030 22.007 1.00 10.56 C ATOM 1594 C LYS A 191 2.589 2.164 21.522 1.00 10.38 C ATOM 1595 O LYS A 191 2.128 3.274 21.196 1.00 10.85 O ATOM 1596 CB LYS A 191 1.502 1.090 23.518 1.00 11.19 C ATOM 1597 CG LYS A 191 0.664 2.287 23.932 1.00 12.13 C ATOM 1598 CD LYS A 191 0.466 2.344 25.431 1.00 12.73 C ATOM 1599 CE LYS A 191 -0.465 3.466 25.825 1.00 13.49 C ATOM 1600 NZ LYS A 191 -1.864 3.228 25.406 1.00 13.96 N ATOM 1601 HZ1 LYS A 191 -1.903 3.132 24.371 1.00 0.00 H ATOM 1602 HZ2 LYS A 191 -2.214 2.355 25.850 1.00 0.00 H ATOM 1603 HZ3 LYS A 191 -2.455 4.030 25.703 1.00 0.00 H ATOM 1604 H LYS A 191 2.487 -0.950 22.351 1.00 0.00 H ATOM 1605 N ASP A 192 3.890 1.900 21.479 1.00 9.84 N ATOM 1606 CA ASP A 192 4.871 2.940 21.195 1.00 10.02 C ATOM 1607 C ASP A 192 5.234 3.038 19.732 1.00 9.85 C ATOM 1608 O ASP A 192 5.457 4.134 19.200 1.00 9.51 O ATOM 1609 CB ASP A 192 6.128 2.693 22.029 1.00 10.15 C ATOM 1610 CG ASP A 192 5.815 2.616 23.512 1.00 10.73 C ATOM 1611 OD1 ASP A 192 4.993 3.417 23.982 1.00 12.05 O ATOM 1612 OD2 ASP A 192 6.403 1.740 24.181 1.00 11.00 O ATOM 1613 H ASP A 192 4.217 0.928 21.652 1.00 0.00 H ATOM 1614 N LEU A 193 5.346 1.896 19.062 1.00 10.10 N ATOM 1615 CA LEU A 193 5.902 1.909 17.714 1.00 10.53 C ATOM 1616 C LEU A 193 5.118 2.789 16.691 1.00 10.66 C ATOM 1617 O LEU A 193 5.760 3.362 15.819 1.00 10.63 O ATOM 1618 CB LEU A 193 6.277 0.505 17.229 1.00 10.92 C ATOM 1619 CG LEU A 193 5.181 -0.527 17.031 1.00 11.54 C ATOM 1620 CD1 LEU A 193 4.492 -0.362 15.690 1.00 12.08 C ATOM 1621 CD2 LEU A 193 5.664 -1.963 17.112 1.00 11.31 C ATOM 1622 H LEU A 193 5.040 1.001 19.495 1.00 0.00 H ATOM 1623 N PRO A 194 3.784 2.948 16.814 1.00 10.79 N ATOM 1624 CA PRO A 194 3.102 3.768 15.814 1.00 11.13 C ATOM 1625 C PRO A 194 3.501 5.236 15.808 1.00 10.81 C ATOM 1626 O PRO A 194 3.318 5.911 14.793 1.00 11.38 O ATOM 1627 CB PRO A 194 1.623 3.614 16.178 1.00 11.69 C ATOM 1628 CG PRO A 194 1.566 2.320 16.927 1.00 11.65 C ATOM 1629 CD PRO A 194 2.821 2.313 17.719 1.00 11.19 C ATOM 1630 N HIS A 195 4.040 5.736 16.917 1.00 9.98 N ATOM 1631 CA HIS A 195 4.525 7.108 16.987 1.00 9.93 C ATOM 1632 C HIS A 195 5.756 7.381 16.127 1.00 9.69 C ATOM 1633 O HIS A 195 6.090 8.546 15.917 1.00 9.72 O ATOM 1634 CB HIS A 195 4.856 7.492 18.431 1.00 10.03 C ATOM 1635 CG HIS A 195 3.746 7.261 19.400 1.00 10.52 C ATOM 1636 ND1 HIS A 195 2.431 7.525 19.118 1.00 11.00 N ATOM 1637 CD2 HIS A 195 3.773 6.829 20.683 1.00 10.78 C ATOM 1638 CE1 HIS A 195 1.683 7.247 20.175 1.00 11.29 C ATOM 1639 NE2 HIS A 195 2.482 6.813 21.131 1.00 11.30 N ATOM 1640 H HIS A 195 4.117 5.130 17.758 1.00 0.00 H ATOM 1641 N TYR A 196 6.431 6.328 15.657 1.00 9.50 N ATOM 1642 CA TYR A 196 7.710 6.468 14.975 1.00 9.76 C ATOM 1643 C TYR A 196 7.629 6.221 13.472 1.00 10.03 C ATOM 1644 O TYR A 196 8.585 6.500 12.769 1.00 9.96 O ATOM 1645 CB TYR A 196 8.768 5.582 15.657 1.00 9.53 C ATOM 1646 CG TYR A 196 8.945 6.047 17.081 1.00 9.80 C ATOM 1647 CD1 TYR A 196 9.695 7.186 17.374 1.00 10.15 C ATOM 1648 CD2 TYR A 196 8.282 5.421 18.122 1.00 10.07 C ATOM 1649 CE1 TYR A 196 9.801 7.650 18.670 1.00 10.80 C ATOM 1650 CE2 TYR A 196 8.385 5.882 19.424 1.00 10.66 C ATOM 1651 CZ TYR A 196 9.138 7.000 19.681 1.00 10.95 C ATOM 1652 OH TYR A 196 9.235 7.453 20.975 1.00 12.48 O ATOM 1653 HH TYR A 196 9.807 8.261 20.999 1.00 0.00 H ATOM 1654 H TYR A 196 6.030 5.377 15.782 1.00 0.00 H ATOM 1655 N PHE A 197 6.501 5.732 12.962 1.00 10.72 N ATOM 1656 CA PHE A 197 6.341 5.609 11.511 1.00 11.73 C ATOM 1657 C PHE A 197 6.328 6.961 10.843 1.00 12.28 C ATOM 1658 O PHE A 197 6.773 7.086 9.688 1.00 13.32 O ATOM 1659 CB PHE A 197 5.057 4.869 11.167 1.00 12.42 C ATOM 1660 CG PHE A 197 5.034 3.445 11.627 1.00 12.63 C ATOM 1661 CD1 PHE A 197 6.113 2.582 11.366 1.00 12.93 C ATOM 1662 CD2 PHE A 197 3.941 2.947 12.311 1.00 13.13 C ATOM 1663 CE1 PHE A 197 6.086 1.278 11.769 1.00 13.33 C ATOM 1664 CE2 PHE A 197 3.915 1.624 12.720 1.00 13.28 C ATOM 1665 CZ PHE A 197 4.991 0.793 12.453 1.00 13.39 C ATOM 1666 OXT PHE A 197 5.879 7.935 11.452 1.00 12.51 O ATOM 1667 H PHE A 197 5.731 5.436 13.595 1.00 0.00 H TER 1668 PHE A 197 HETATM 1669 O HOH 1 24.628 13.205 14.877 1.00 30.06 O HETATM 1670 O HOH 2 21.954 -14.491 3.847 1.00 12.37 O HETATM 1671 O HOH 3 27.602 -17.185 15.474 1.00 12.45 O HETATM 1672 O HOH 4 44.448 -0.283 26.421 1.00 18.91 O HETATM 1673 O HOH 5 15.966 2.189 12.029 1.00 14.27 O HETATM 1674 O HOH 6 10.823 9.474 21.626 1.00 20.87 O HETATM 1675 O HOH 7 16.002 -18.653 19.362 1.00 8.81 O HETATM 1676 O HOH 8 23.778 6.346 9.895 1.00 26.72 O HETATM 1677 O HOH 9 40.507 5.816 18.875 1.00 22.12 O HETATM 1678 O HOH 10 19.114 -8.076 7.610 1.00 20.70 O HETATM 1679 O HOH 11 -0.788 -3.846 22.205 1.00 16.37 O HETATM 1680 O HOH 12 -0.376 4.199 20.847 1.00 20.10 O HETATM 1681 O HOH 13 5.044 10.007 9.944 1.00 19.53 O HETATM 1682 O HOH 14 11.178 -7.550 7.250 1.00 15.23 O HETATM 1683 O HOH 15 8.484 -11.579 27.538 1.00 20.30 O HETATM 1684 O HOH 16 31.843 -10.788 26.247 1.00 14.72 O HETATM 1685 O HOH 17 15.674 10.746 15.419 1.00 18.23 O HETATM 1686 O HOH 18 19.673 -23.186 20.218 1.00 10.82 O HETATM 1687 O HOH 19 17.938 -25.245 21.199 1.00 25.03 O HETATM 1688 O HOH 20 29.381 -0.611 9.281 1.00 9.28 O HETATM 1689 O HOH 21 25.805 0.167 8.130 1.00 10.63 O HETATM 1690 O HOH 22 3.561 7.976 13.041 1.00 9.78 O HETATM 1691 O HOH 23 21.857 -17.360 2.533 1.00 20.15 O HETATM 1692 O HOH 24 12.695 -9.743 6.671 1.00 14.26 O HETATM 1693 O HOH 25 22.023 3.721 28.802 1.00 10.95 O HETATM 1694 O HOH 26 33.572 6.008 16.116 1.00 12.20 O HETATM 1695 O HOH 27 14.168 -13.347 6.985 1.00 11.16 O HETATM 1696 O HOH 28 -0.352 0.731 11.439 1.00 13.91 O HETATM 1697 O HOH 29 17.190 -5.435 36.595 1.00 19.69 O HETATM 1698 O HOH 30 9.494 -22.526 22.594 1.00 22.57 O HETATM 1699 O HOH 31 20.980 -17.640 26.283 1.00 8.81 O HETATM 1700 O HOH 32 22.145 -25.795 27.376 1.00 20.66 O HETATM 1701 O HOH 33 16.867 2.634 37.353 1.00 24.42 O HETATM 1702 O HOH 34 39.036 3.624 22.540 1.00 15.82 O HETATM 1703 O HOH 35 -3.628 -3.419 17.479 1.00 18.64 O HETATM 1704 O HOH 36 28.667 9.152 12.855 1.00 19.80 O HETATM 1705 O HOH 37 14.268 -3.897 5.567 1.00 23.87 O HETATM 1706 O HOH 38 24.957 8.295 11.805 1.00 21.79 O HETATM 1707 O HOH 39 20.288 -10.931 5.397 1.00 21.81 O HETATM 1708 O HOH 40 11.059 7.526 13.466 1.00 10.94 O HETATM 1709 O HOH 41 14.984 -6.553 6.000 1.00 20.92 O HETATM 1710 O HOH 42 13.570 -27.452 21.604 1.00 28.49 O HETATM 1711 O HOH 43 19.501 -13.986 24.260 1.00 8.36 O HETATM 1712 O HOH 44 18.612 7.124 23.157 1.00 10.67 O HETATM 1713 O HOH 45 29.115 -5.240 26.605 1.00 12.00 O HETATM 1714 O HOH 46 20.287 6.488 20.432 1.00 10.86 O HETATM 1715 O HOH 47 34.140 -9.354 29.567 1.00 26.21 O HETATM 1716 O HOH 48 4.378 -17.621 15.467 1.00 13.95 O HETATM 1717 O HOH 49 10.042 -23.855 16.363 1.00 11.35 O HETATM 1718 O HOH 50 33.416 -5.769 20.885 1.00 22.41 O HETATM 1719 O HOH 51 16.343 -26.556 15.327 1.00 17.49 O HETATM 1720 O HOH 52 27.964 -0.996 26.770 1.00 11.68 O HETATM 1721 O HOH 53 14.948 0.293 31.870 1.00 24.49 O HETATM 1722 O HOH 54 17.888 -6.411 30.071 1.00 9.04 O HETATM 1723 O HOH 55 7.223 5.093 7.765 1.00 25.82 O HETATM 1724 O HOH 56 37.813 6.073 21.801 1.00 23.45 O HETATM 1725 O HOH 57 9.456 -18.899 8.516 1.00 16.61 O HETATM 1726 O HOH 58 17.784 -3.787 32.857 1.00 16.55 O HETATM 1727 O HOH 59 24.174 8.067 19.779 1.00 18.86 O HETATM 1728 O HOH 60 34.796 -1.987 24.076 1.00 16.66 O HETATM 1729 O HOH 61 35.536 7.934 19.090 1.00 17.37 O HETATM 1730 O HOH 62 4.109 2.453 26.474 1.00 17.89 O HETATM 1731 O HOH 63 26.425 -25.467 22.536 1.00 23.23 O HETATM 1732 O HOH 64 30.812 -15.960 7.715 1.00 22.62 O HETATM 1733 O HOH 65 15.632 -3.782 29.939 1.00 14.60 O HETATM 1734 O HOH 66 7.629 -12.491 10.859 1.00 11.59 O HETATM 1735 O HOH 67 2.451 -5.925 7.223 1.00 18.19 O HETATM 1736 O HOH 68 12.117 9.769 17.329 1.00 22.86 O HETATM 1737 O HOH 69 23.786 -3.934 34.610 1.00 12.89 O HETATM 1738 O HOH 70 26.535 6.974 21.597 1.00 17.11 O HETATM 1739 O HOH 71 25.715 -0.226 33.570 1.00 17.74 O HETATM 1740 O HOH 72 7.749 -22.206 8.294 1.00 26.41 O HETATM 1741 O HOH 73 22.572 2.682 34.113 1.00 25.28 O HETATM 1742 O HOH 74 25.222 -11.384 14.241 1.00 7.10 O HETATM 1743 O HOH 75 9.998 -0.381 29.083 1.00 22.38 O HETATM 1744 O HOH 76 16.822 1.969 3.625 1.00 23.79 O HETATM 1745 O HOH 77 8.726 11.148 10.071 1.00 30.06 O HETATM 1746 O HOH 78 2.306 -18.559 12.799 1.00 32.39 O HETATM 1747 O HOH 79 13.025 -13.885 28.718 1.00 14.52 O HETATM 1748 O HOH 80 -0.168 -14.696 19.089 1.00 28.87 O HETATM 1749 O HOH 81 26.406 -16.326 22.972 1.00 13.45 O HETATM 1750 O HOH 82 39.341 3.747 12.754 1.00 20.51 O HETATM 1751 O HOH 83 11.698 -7.540 32.472 1.00 25.63 O HETATM 1752 O HOH 84 16.579 -13.767 8.418 1.00 15.07 O HETATM 1753 O HOH 85 26.696 1.388 30.805 1.00 26.10 O HETATM 1754 O HOH 86 28.241 -6.157 29.817 1.00 18.14 O HETATM 1755 O HOH 87 26.674 -3.763 29.871 1.00 17.90 O HETATM 1756 O HOH 88 6.202 1.336 29.277 1.00 23.83 O HETATM 1757 O HOH 89 12.153 -25.480 10.382 1.00 21.33 O HETATM 1758 O HOH 90 6.203 -18.665 26.424 1.00 13.27 O HETATM 1759 O HOH 91 16.198 -11.597 5.878 1.00 28.25 O HETATM 1760 O HOH 92 28.340 -17.852 5.026 1.00 25.80 O HETATM 1761 O HOH 93 5.529 -24.733 12.184 1.00 25.87 O HETATM 1762 O HOH 94 30.644 9.510 14.986 1.00 22.48 O HETATM 1763 O HOH 95 11.497 5.827 26.401 1.00 27.48 O HETATM 1764 O HOH 96 22.779 -3.985 3.821 1.00 19.15 O HETATM 1765 O HOH 97 1.568 7.446 11.211 1.00 20.15 O HETATM 1766 O HOH 98 26.750 -21.828 14.635 1.00 21.45 O HETATM 1767 O HOH 99 20.473 1.631 35.686 1.00 23.33 O HETATM 1768 O HOH 100 0.435 -14.220 23.254 1.00 26.93 O HETATM 1769 O HOH 101 2.557 -15.580 15.732 1.00 13.67 O HETATM 1770 O HOH 102 33.624 1.469 27.197 1.00 30.12 O HETATM 1771 O HOH 103 25.273 -0.686 2.744 1.00 24.30 O HETATM 1772 O HOH 104 -0.326 -1.797 10.270 1.00 14.80 O HETATM 1773 O HOH 105 4.195 -15.514 9.707 1.00 23.11 O HETATM 1774 O HOH 106 10.612 6.198 5.691 1.00 27.99 O HETATM 1775 O HOH 107 8.746 -21.264 25.438 1.00 15.94 O HETATM 1776 O HOH 108 4.519 4.168 7.423 1.00 29.94 O HETATM 1777 O HOH 109 12.945 -20.852 31.609 1.00 21.16 O HETATM 1778 O HOH 110 18.356 -29.818 15.402 1.00 25.64 O HETATM 1779 O HOH 111 14.913 -18.917 32.589 1.00 23.83 O HETATM 1780 O HOH 112 12.642 -7.375 9.668 1.00 9.17 O HETATM 1781 O HOH 113 7.109 5.398 27.128 1.00 23.69 O HETATM 1782 O HOH 114 23.507 -17.459 32.678 1.00 19.93 O HETATM 1783 O HOH 115 29.467 -11.582 3.620 1.00 15.38 O HETATM 1784 O HOH 116 4.259 -8.102 29.470 1.00 19.84 O HETATM 1785 O HOH 117 35.326 6.246 23.139 1.00 21.22 O HETATM 1786 O HOH 118 22.175 -20.858 8.958 1.00 19.33 O HETATM 1787 O HOH 119 26.084 -11.597 30.979 1.00 20.07 O HETATM 1788 O HOH 120 25.876 -5.689 3.472 1.00 20.73 O HETATM 1789 O HOH 121 -1.266 -10.660 14.428 1.00 24.85 O HETATM 1790 O HOH 122 5.738 -11.915 9.586 1.00 16.51 O HETATM 1791 O HOH 123 7.801 -1.545 4.335 1.00 22.33 O HETATM 1792 O HOH 124 25.931 -24.374 25.296 1.00 19.12 O HETATM 1793 O HOH 125 13.224 10.110 9.891 1.00 28.67 O HETATM 1794 O HOH 126 18.446 -22.931 31.242 1.00 25.28 O HETATM 1795 O HOH 127 20.395 -27.731 26.281 1.00 29.85 O HETATM 1796 O HOH 128 0.872 5.329 13.158 1.00 20.16 O HETATM 1797 O HOH 129 15.573 9.063 21.608 1.00 25.72 O HETATM 1798 O HOH 130 25.273 -23.289 11.363 1.00 11.69 O HETATM 1799 O HOH 131 11.538 -17.436 31.701 1.00 23.24 O HETATM 1800 O HOH 132 7.308 9.803 13.326 1.00 30.27 O HETATM 1801 O HOH 133 21.656 10.352 14.699 1.00 33.36 O HETATM 1802 O HOH 134 9.140 2.796 9.279 1.00 21.47 O HETATM 1803 O HOH 135 6.701 -12.231 29.822 1.00 29.19 O HETATM 1804 O HOH 136 13.628 -1.743 30.242 1.00 23.65 O HETATM 1805 O HOH 137 17.543 -23.715 18.232 1.00 26.32 O HETATM 1806 O HOH 138 28.251 -20.323 24.196 1.00 28.47 O HETATM 1807 O HOH 139 35.917 -2.323 19.457 1.00 14.47 O HETATM 1808 O HOH 140 29.410 8.466 23.824 1.00 33.05 O HETATM 1809 O HOH 141 13.101 -28.089 11.193 1.00 23.29 O HETATM 1810 O HOH 142 19.211 -10.821 8.702 1.00 19.46 O HETATM 1811 O HOH 143 24.960 -18.955 30.510 1.00 26.99 O HETATM 1812 O HOH 144 10.879 -13.353 30.444 1.00 27.06 O HETATM 1813 O HOH 145 23.272 5.307 30.688 1.00 26.20 O HETATM 1814 O HOH 146 14.735 8.440 7.904 1.00 31.17 O HETATM 1815 O HOH 147 28.412 -17.378 24.855 1.00 31.60 O HETATM 1816 O HOH 148 28.192 -16.031 20.646 1.00 24.97 O HETATM 1817 O HOH 149 7.863 1.754 4.829 1.00 29.34 O HETATM 1818 O HOH 150 -3.871 -2.721 7.039 1.00 29.09 O HETATM 1819 O HOH 151 23.751 15.725 15.809 1.00 23.45 O HETATM 1820 O HOH 152 39.207 9.117 18.615 1.00 33.22 O HETATM 1821 O HOH 153 7.044 -18.589 7.043 1.00 29.77 O HETATM 1822 O HOH 154 24.768 -21.965 8.941 1.00 23.13 O HETATM 1823 O HOH 155 0.332 -16.822 17.081 1.00 26.70 O HETATM 1824 O HOH 156 17.571 -15.784 6.524 1.00 26.44 O HETATM 1825 O HOH 157 12.765 -10.318 3.969 1.00 25.63 O HETATM 1826 O HOH 158 16.142 -5.456 31.939 1.00 14.20 O HETATM 1827 O HOH 159 6.336 -22.857 25.769 1.00 29.74 O HETATM 1828 O HOH 160 18.153 10.007 22.748 1.00 24.02 O HETATM 1829 O HOH 161 26.605 -1.013 29.237 1.00 21.73 O HETATM 1830 O HOH 162 18.797 -20.889 2.325 1.00 26.10 O HETATM 1831 O HOH 163 3.574 -19.914 26.292 1.00 31.76 O HETATM 1832 O HOH 164 14.011 -27.057 16.412 1.00 16.01 O HETATM 1833 O HOH 165 30.208 -2.620 26.984 1.00 17.45 O HETATM 1834 O HOH 166 24.799 -26.304 26.741 1.00 20.49 O HETATM 1835 O HOH 167 29.390 -14.245 16.980 1.00 21.03 O HETATM 1836 O HOH 168 27.882 -11.359 13.927 1.00 12.77 O HETATM 1837 O HOH 169 38.063 5.360 10.962 1.00 26.65 O HETATM 1838 O HOH 170 35.619 0.442 18.975 1.00 10.07 O HETATM 1839 O HOH 171 29.389 3.219 9.603 1.00 12.44 O HETATM 1840 O HOH 172 33.940 -4.274 18.630 1.00 19.81 O HETATM 1841 O HOH 173 29.501 -13.642 14.091 1.00 26.23 O HETATM 1842 O HOH 174 34.764 -6.763 7.358 1.00 24.33 O HETATM 1843 O HOH 175 35.800 1.374 7.201 1.00 17.84 O HETATM 1844 O HOH 176 35.191 -10.259 18.694 1.00 29.15 O HETATM 1845 O HOH 177 39.637 -0.818 7.960 1.00 17.40 O HETATM 1846 O HOH 178 34.048 -13.406 19.598 1.00 38.01 O HETATM 1847 C ACE A 179 38.021 2.217 9.624 1.00 0.18 C HETATM 1848 O ACE A 179 37.311 2.926 10.308 1.00 -0.40 O HETATM 1849 CH3 ACE A 179 38.973 2.835 8.623 1.00 0.03 C HETATM 1850 H1 ACE A 179 39.526 2.039 8.103 1.00 0.05 H HETATM 1851 H2 ACE A 179 39.682 3.491 9.148 1.00 0.05 H HETATM 1852 H3 ACE A 179 38.403 3.424 7.890 1.00 0.05 H HETATM 1853 N ACE A 179 37.972 0.898 9.719 1.00 -0.27 N HETATM 1854 CA ACE A 179 37.045 0.212 10.658 1.00 0.14 C HETATM 1855 C ACE A 179 37.211 0.742 12.079 1.00 0.20 C HETATM 1856 O ACE A 179 38.337 0.849 12.591 1.00 -0.39 O HETATM 1857 N ACE A 179 36.082 1.047 12.718 1.00 -0.26 N HETATM 1858 CA ACE A 179 36.061 1.606 14.061 1.00 0.13 C HETATM 1859 C ACE A 179 35.825 0.578 15.146 1.00 0.20 C HETATM 1860 O ACE A 179 36.054 0.864 16.303 1.00 -0.39 O HETATM 1861 N ACE A 179 35.341 -0.608 14.783 1.00 -0.26 N HETATM 1862 CA ACE A 179 35.090 -1.675 15.756 1.00 0.13 C HETATM 1863 C ACE A 179 35.013 -2.992 14.989 1.00 0.20 C HETATM 1864 O ACE A 179 34.183 -3.156 14.099 1.00 -0.39 O HETATM 1865 N ACE A 179 35.915 -3.916 15.316 1.00 -0.26 N HETATM 1866 CA ACE A 179 35.939 -5.280 14.757 1.00 0.14 C HETATM 1867 C ACE A 179 35.168 -6.229 15.670 1.00 0.21 C HETATM 1868 O ACE A 179 35.180 -6.064 16.900 1.00 -0.39 O HETATM 1869 N ACE A 179 34.492 -7.210 15.069 1.00 -0.26 N HETATM 1870 CA ACE A 179 33.819 -8.263 15.822 1.00 0.14 C HETATM 1871 C ACE A 179 34.079 -9.549 15.084 1.00 0.21 C HETATM 1872 O ACE A 179 33.822 -9.636 13.903 1.00 -0.39 O HETATM 1873 N ACE A 179 34.603 -10.542 15.808 1.00 -0.26 N HETATM 1874 CA ACE A 179 35.088 -11.772 15.202 1.00 0.13 C HETATM 1875 C ACE A 179 35.947 -11.463 13.973 1.00 0.20 C HETATM 1876 O ACE A 179 36.965 -10.808 14.135 1.00 -0.39 O HETATM 1877 N ACE A 179 35.545 -11.871 12.773 1.00 -0.26 N HETATM 1878 CA ACE A 179 36.381 -11.665 11.589 1.00 0.15 C HETATM 1879 C ACE A 179 35.865 -10.584 10.635 1.00 0.21 C HETATM 1880 O ACE A 179 36.174 -10.620 9.433 1.00 -0.39 O HETATM 1881 N ACE A 179 35.088 -9.625 11.148 1.00 -0.26 N HETATM 1882 CA ACE A 179 34.553 -8.604 10.280 1.00 0.14 C HETATM 1883 C ACE A 179 34.448 -7.252 10.973 1.00 0.21 C HETATM 1884 O ACE A 179 34.465 -7.113 12.205 1.00 -0.39 O HETATM 1885 N ACE A 179 34.343 -6.242 10.125 1.00 -0.26 N HETATM 1886 CA ACE A 179 34.170 -4.879 10.606 1.00 0.14 C HETATM 1887 C ACE A 179 32.710 -4.634 10.940 1.00 0.20 C HETATM 1888 O ACE A 179 31.838 -4.636 10.060 1.00 -0.39 O HETATM 1889 N ACE A 179 32.455 -4.418 12.216 1.00 -0.26 N HETATM 1890 CA ACE A 179 31.101 -4.167 12.721 1.00 0.13 C HETATM 1891 C ACE A 179 30.706 -2.690 12.714 1.00 0.20 C HETATM 1892 O ACE A 179 29.560 -2.363 12.998 1.00 -0.39 O HETATM 1893 N ACE A 179 31.647 -1.797 12.408 1.00 -0.26 N HETATM 1894 CA ACE A 179 31.397 -0.358 12.412 1.00 0.13 C HETATM 1895 C ACE A 179 32.362 0.299 11.454 1.00 0.20 C HETATM 1896 O ACE A 179 33.479 0.686 11.842 1.00 -0.39 O HETATM 1897 N ACE A 179 31.941 0.421 10.201 1.00 -0.26 N HETATM 1898 CA ACE A 179 32.805 1.007 9.166 1.00 0.13 C HETATM 1899 C ACE A 179 32.972 2.508 9.363 1.00 0.20 C HETATM 1900 O ACE A 179 32.130 3.160 9.983 1.00 -0.39 O HETATM 1901 N ACE A 179 34.044 3.055 8.801 1.00 -0.26 N HETATM 1902 CA ACE A 179 34.193 4.510 8.701 1.00 0.13 C HETATM 1903 C ACE A 179 32.967 5.136 8.035 1.00 0.20 C HETATM 1904 O ACE A 179 32.544 4.627 6.996 1.00 -0.39 O HETATM 1905 N ACE A 179 32.442 6.248 8.556 1.00 -0.30 N HETATM 1906 H114 ACE A 179 31.640 6.669 8.132 1.00 0.18 H HETATM 1907 H115 ACE A 179 32.851 6.660 9.371 1.00 0.18 H HETATM 1908 CB ACE A 179 35.425 4.849 7.881 1.00 -0.01 C HETATM 1909 CG ACE A 179 35.678 6.348 7.698 1.00 -0.02 C HETATM 1910 CD ACE A 179 36.864 6.580 6.785 1.00 0.06 C HETATM 1911 NE ACE A 179 38.141 6.408 7.477 1.00 -0.27 N HETATM 1912 CZ ACE A 179 39.281 6.007 6.907 1.00 0.29 C HETATM 1913 NH1 ACE A 179 40.380 5.898 7.650 1.00 -0.28 N HETATM 1914 H110 ACE A 179 41.264 5.590 7.220 1.00 0.26 H HETATM 1915 H111 ACE A 179 40.347 6.122 8.655 1.00 0.26 H HETATM 1916 NH2 ACE A 179 39.339 5.696 5.608 1.00 -0.28 N HETATM 1917 H112 ACE A 179 38.496 5.776 5.021 1.00 0.26 H HETATM 1918 H113 ACE A 179 40.227 5.377 5.194 1.00 0.26 H HETATM 1919 H109 ACE A 179 38.163 6.613 8.486 1.00 0.26 H HETATM 1920 H107 ACE A 179 36.811 7.605 6.391 1.00 0.07 H HETATM 1921 H108 ACE A 179 36.814 5.864 5.952 1.00 0.07 H HETATM 1922 H105 ACE A 179 35.882 6.803 8.679 1.00 0.03 H HETATM 1923 H106 ACE A 179 34.785 6.814 7.256 1.00 0.03 H HETATM 1924 H103 ACE A 179 35.309 4.397 6.885 1.00 0.03 H HETATM 1925 H104 ACE A 179 36.301 4.412 8.382 1.00 0.03 H HETATM 1926 H102 ACE A 179 34.305 4.927 9.713 1.00 0.08 H HETATM 1927 H101 ACE A 179 34.764 2.463 8.439 1.00 0.19 H HETATM 1928 CB ACE A 179 32.236 0.811 7.759 1.00 -0.01 C HETATM 1929 CG ACE A 179 32.036 -0.611 7.302 1.00 -0.02 C HETATM 1930 CD ACE A 179 31.143 -0.636 6.060 1.00 0.06 C HETATM 1931 NE ACE A 179 29.770 -0.260 6.395 1.00 -0.27 N HETATM 1932 CZ ACE A 179 28.878 0.281 5.561 1.00 0.29 C HETATM 1933 NH1 ACE A 179 27.664 0.572 6.029 1.00 -0.28 N HETATM 1934 H97 ACE A 179 26.958 0.990 5.406 1.00 0.26 H HETATM 1935 H98 ACE A 179 27.432 0.379 7.014 1.00 0.26 H HETATM 1936 NH2 ACE A 179 29.175 0.530 4.286 1.00 -0.28 N HETATM 1937 H99 ACE A 179 30.112 0.306 3.922 1.00 0.26 H HETATM 1938 H100 ACE A 179 28.467 0.947 3.664 1.00 0.26 H HETATM 1939 H96 ACE A 179 29.462 -0.428 7.364 1.00 0.26 H HETATM 1940 H94 ACE A 179 31.145 -1.651 5.636 1.00 0.07 H HETATM 1941 H95 ACE A 179 31.539 0.072 5.318 1.00 0.07 H HETATM 1942 H92 ACE A 179 31.558 -1.189 8.107 1.00 0.03 H HETATM 1943 H93 ACE A 179 33.012 -1.057 7.059 1.00 0.03 H HETATM 1944 H90 ACE A 179 32.924 1.295 7.051 1.00 0.03 H HETATM 1945 H91 ACE A 179 31.258 1.314 7.722 1.00 0.03 H HETATM 1946 H89 ACE A 179 33.790 0.521 9.227 1.00 0.08 H HETATM 1947 H88 ACE A 179 31.022 0.110 9.957 1.00 0.19 H HETATM 1948 CB ACE A 179 31.561 0.190 13.833 1.00 -0.01 C HETATM 1949 CG ACE A 179 31.257 1.681 14.030 1.00 -0.04 C HETATM 1950 CD1 ACE A 179 29.812 2.025 13.671 1.00 -0.06 C HETATM 1951 H82 ACE A 179 29.641 3.100 13.827 1.00 0.02 H HETATM 1952 H83 ACE A 179 29.128 1.448 14.311 1.00 0.02 H HETATM 1953 H84 ACE A 179 29.627 1.774 12.616 1.00 0.02 H HETATM 1954 CD2 ACE A 179 31.523 2.096 15.459 1.00 -0.06 C HETATM 1955 H85 ACE A 179 32.562 1.851 15.725 1.00 0.02 H HETATM 1956 H86 ACE A 179 30.837 1.559 16.131 1.00 0.02 H HETATM 1957 H87 ACE A 179 31.364 3.179 15.562 1.00 0.02 H HETATM 1958 H81 ACE A 179 31.923 2.254 13.368 1.00 0.03 H HETATM 1959 H79 ACE A 179 32.603 0.018 14.140 1.00 0.03 H HETATM 1960 H80 ACE A 179 30.887 -0.378 14.491 1.00 0.03 H HETATM 1961 H78 ACE A 179 30.368 -0.165 12.074 1.00 0.08 H HETATM 1962 H77 ACE A 179 32.560 -2.125 12.166 1.00 0.19 H HETATM 1963 CB ACE A 179 30.973 -4.753 14.104 1.00 -0.02 C HETATM 1964 H74 ACE A 179 29.959 -4.568 14.488 1.00 0.03 H HETATM 1965 H75 ACE A 179 31.710 -4.282 14.771 1.00 0.03 H HETATM 1966 H76 ACE A 179 31.157 -5.837 14.062 1.00 0.03 H HETATM 1967 H73 ACE A 179 30.398 -4.695 12.060 1.00 0.08 H HETATM 1968 H72 ACE A 179 33.215 -4.426 12.865 1.00 0.19 H HETATM 1969 CB ACE A 179 34.608 -3.865 9.573 1.00 0.04 C HETATM 1970 SG ACE A 179 34.504 -2.186 10.257 1.00 -0.09 S HETATM 1971 SG ACE A 179 36.126 -2.183 11.625 1.00 -0.09 S HETATM 1972 CB ACE A 179 37.331 -1.280 10.653 1.00 0.04 C HETATM 1973 H6 ACE A 179 38.332 -1.454 11.074 1.00 0.04 H HETATM 1974 H7 ACE A 179 37.301 -1.646 9.616 1.00 0.04 H HETATM 1975 H70 ACE A 179 33.954 -3.939 8.691 1.00 0.04 H HETATM 1976 H71 ACE A 179 35.647 -4.073 9.278 1.00 0.04 H HETATM 1977 H69 ACE A 179 34.777 -4.747 11.514 1.00 0.08 H HETATM 1978 H68 ACE A 179 34.383 -6.417 9.141 1.00 0.19 H HETATM 1979 CB ACE A 179 33.205 -9.034 9.687 1.00 0.02 C HETATM 1980 CG ACE A 179 32.066 -9.066 10.674 1.00 -0.05 C HETATM 1981 CD1 ACE A 179 31.776 -10.204 11.416 1.00 -0.07 C HETATM 1982 CE1 ACE A 179 30.725 -10.223 12.317 1.00 -0.04 C HETATM 1983 CZ ACE A 179 29.950 -9.085 12.468 1.00 0.08 C HETATM 1984 CE2 ACE A 179 30.226 -7.943 11.750 1.00 -0.04 C HETATM 1985 CD2 ACE A 179 31.278 -7.945 10.854 1.00 -0.07 C HETATM 1986 H64 ACE A 179 31.489 -7.050 10.281 1.00 0.05 H HETATM 1987 H66 ACE A 179 29.624 -7.052 11.886 1.00 0.05 H HETATM 1988 OH ACE A 179 28.896 -9.064 13.333 1.00 -0.34 O HETATM 1989 H67 ACE A 179 28.820 -9.910 13.758 1.00 0.25 H HETATM 1990 H65 ACE A 179 30.512 -11.115 12.895 1.00 0.05 H HETATM 1991 H63 ACE A 179 32.383 -11.093 11.287 1.00 0.05 H HETATM 1992 H61 ACE A 179 33.322 -10.043 9.266 1.00 0.05 H HETATM 1993 H62 ACE A 179 32.943 -8.329 8.884 1.00 0.05 H HETATM 1994 H60 ACE A 179 35.258 -8.486 9.444 1.00 0.08 H HETATM 1995 H59 ACE A 179 34.879 -9.615 12.126 1.00 0.19 H HETATM 1996 CB ACE A 179 36.562 -12.997 10.850 1.00 0.08 C HETATM 1997 CG ACE A 179 35.269 -13.520 10.244 1.00 0.18 C HETATM 1998 OD1 ACE A 179 34.171 -13.179 10.689 1.00 -0.40 O HETATM 1999 ND2 ACE A 179 35.395 -14.362 9.225 1.00 -0.30 N HETATM 2000 H57 ACE A 179 34.580 -14.740 8.785 1.00 0.18 H HETATM 2001 H58 ACE A 179 36.304 -14.618 8.898 1.00 0.18 H HETATM 2002 H55 ACE A 179 36.943 -13.744 11.562 1.00 0.06 H HETATM 2003 H56 ACE A 179 37.295 -12.853 10.042 1.00 0.06 H HETATM 2004 H54 ACE A 179 37.370 -11.337 11.942 1.00 0.08 H HETATM 2005 H53 ACE A 179 34.659 -12.325 12.678 1.00 0.19 H HETATM 2006 CB ACE A 179 33.910 -12.680 14.948 1.00 0.00 C HETATM 2007 CG ACE A 179 33.354 -13.198 16.258 1.00 0.04 C HETATM 2008 CD ACE A 179 32.785 -14.576 16.107 1.00 0.17 C HETATM 2009 OE1 ACE A 179 33.501 -15.574 16.265 1.00 -0.40 O HETATM 2010 NE2 ACE A 179 31.513 -14.652 15.745 1.00 -0.30 N HETATM 2011 H51 ACE A 179 31.079 -15.545 15.629 1.00 0.18 H HETATM 2012 H52 ACE A 179 30.987 -13.816 15.588 1.00 0.18 H HETATM 2013 H49 ACE A 179 32.560 -12.519 16.602 1.00 0.05 H HETATM 2014 H50 ACE A 179 34.162 -13.225 17.004 1.00 0.05 H HETATM 2015 H47 ACE A 179 34.234 -13.530 14.330 1.00 0.03 H HETATM 2016 H48 ACE A 179 33.127 -12.118 14.418 1.00 0.03 H HETATM 2017 H46 ACE A 179 35.740 -12.279 15.928 1.00 0.08 H HETATM 2018 H45 ACE A 179 34.664 -10.436 16.800 1.00 0.19 H HETATM 2019 CB ACE A 179 32.319 -8.000 15.924 1.00 0.02 C HETATM 2020 CG ACE A 179 31.624 -9.055 16.746 1.00 -0.05 C HETATM 2021 CD1 ACE A 179 31.691 -9.054 18.139 1.00 -0.07 C HETATM 2022 CE1 ACE A 179 31.056 -10.046 18.882 1.00 -0.04 C HETATM 2023 CZ ACE A 179 30.380 -11.058 18.241 1.00 0.08 C HETATM 2024 CE2 ACE A 179 30.331 -11.094 16.867 1.00 -0.04 C HETATM 2025 CD2 ACE A 179 30.943 -10.105 16.132 1.00 -0.07 C HETATM 2026 H41 ACE A 179 30.895 -10.143 15.050 1.00 0.05 H HETATM 2027 H43 ACE A 179 29.811 -11.901 16.364 1.00 0.05 H HETATM 2028 OH ACE A 179 29.774 -12.052 18.969 1.00 -0.34 O HETATM 2029 H44 ACE A 179 30.162 -12.889 18.744 1.00 0.25 H HETATM 2030 H42 ACE A 179 31.094 -10.021 19.965 1.00 0.05 H HETATM 2031 H40 ACE A 179 32.243 -8.273 18.649 1.00 0.05 H HETATM 2032 H38 ACE A 179 31.888 -7.995 14.912 1.00 0.05 H HETATM 2033 H39 ACE A 179 32.160 -7.019 16.395 1.00 0.05 H HETATM 2034 H37 ACE A 179 34.241 -8.322 16.836 1.00 0.08 H HETATM 2035 H36 ACE A 179 34.445 -7.224 14.070 1.00 0.19 H HETATM 2036 CB ACE A 179 37.395 -5.761 14.584 1.00 0.00 C HETATM 2037 CG ACE A 179 38.078 -5.103 13.428 1.00 -0.04 C HETATM 2038 CD1 ACE A 179 38.771 -3.928 13.427 1.00 0.02 C HETATM 2039 NE1 ACE A 179 39.213 -3.638 12.159 1.00 -0.29 N HETATM 2040 CE2 ACE A 179 38.794 -4.623 11.311 1.00 0.06 C HETATM 2041 CD2 ACE A 179 38.080 -5.563 12.079 1.00 -0.02 C HETATM 2042 CE3 ACE A 179 37.567 -6.687 11.446 1.00 -0.07 C HETATM 2043 CZ3 ACE A 179 37.766 -6.841 10.077 1.00 -0.08 C HETATM 2044 CH2 ACE A 179 38.467 -5.890 9.344 1.00 -0.08 C HETATM 2045 CZ2 ACE A 179 38.991 -4.772 9.935 1.00 -0.04 C HETATM 2046 H33 ACE A 179 39.536 -4.033 9.360 1.00 0.05 H HETATM 2047 H35 ACE A 179 38.602 -6.037 8.279 1.00 0.05 H HETATM 2048 H34 ACE A 179 37.368 -7.715 9.575 1.00 0.05 H HETATM 2049 H32 ACE A 179 37.020 -7.434 12.010 1.00 0.05 H HETATM 2050 H31 ACE A 179 39.769 -2.813 11.892 1.00 0.22 H HETATM 2051 H30 ACE A 179 38.948 -3.309 14.305 1.00 0.08 H HETATM 2052 H28 ACE A 179 37.391 -6.849 14.420 1.00 0.04 H HETATM 2053 H29 ACE A 179 37.955 -5.531 15.503 1.00 0.04 H HETATM 2054 H27 ACE A 179 35.453 -5.267 13.770 1.00 0.08 H HETATM 2055 H26 ACE A 179 36.619 -3.669 15.982 1.00 0.19 H HETATM 2056 CB ACE A 179 33.808 -1.413 16.540 1.00 -0.02 C HETATM 2057 H23 ACE A 179 33.646 -2.228 17.261 1.00 0.03 H HETATM 2058 H24 ACE A 179 32.957 -1.363 15.845 1.00 0.03 H HETATM 2059 H25 ACE A 179 33.897 -0.459 17.080 1.00 0.03 H HETATM 2060 H22 ACE A 179 35.929 -1.720 16.466 1.00 0.08 H HETATM 2061 H21 ACE A 179 35.143 -0.776 13.817 1.00 0.19 H HETATM 2062 CB ACE A 179 35.006 2.705 14.129 1.00 -0.01 C HETATM 2063 CG ACE A 179 35.325 3.871 13.204 1.00 -0.02 C HETATM 2064 CD ACE A 179 34.083 4.401 12.542 1.00 0.06 C HETATM 2065 NE ACE A 179 33.194 5.020 13.507 1.00 -0.27 N HETATM 2066 CZ ACE A 179 31.904 5.283 13.307 1.00 0.29 C HETATM 2067 NH1 ACE A 179 31.239 5.880 14.267 1.00 -0.28 N HETATM 2068 H17 ACE A 179 30.240 6.097 14.143 1.00 0.26 H HETATM 2069 H18 ACE A 179 31.716 6.132 15.145 1.00 0.26 H HETATM 2070 NH2 ACE A 179 31.266 4.954 12.193 1.00 -0.28 N HETATM 2071 H19 ACE A 179 31.773 4.485 11.429 1.00 0.26 H HETATM 2072 H20 ACE A 179 30.264 5.168 12.091 1.00 0.26 H HETATM 2073 H16 ACE A 179 33.593 5.277 14.421 1.00 0.26 H HETATM 2074 H14 ACE A 179 33.556 3.570 12.051 1.00 0.07 H HETATM 2075 H15 ACE A 179 34.370 5.149 11.788 1.00 0.07 H HETATM 2076 H12 ACE A 179 36.027 3.531 12.428 1.00 0.03 H HETATM 2077 H13 ACE A 179 35.789 4.677 13.791 1.00 0.03 H HETATM 2078 H10 ACE A 179 34.950 3.078 15.162 1.00 0.03 H HETATM 2079 H11 ACE A 179 34.033 2.280 13.840 1.00 0.03 H HETATM 2080 H9 ACE A 179 37.045 2.061 14.248 1.00 0.08 H HETATM 2081 H8 ACE A 179 35.211 0.884 12.254 1.00 0.19 H HETATM 2082 H5 ACE A 179 36.010 0.386 10.329 1.00 0.08 H HETATM 2083 H4 ACE A 179 38.576 0.347 9.143 1.00 0.19 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 437 438 441 442 443 CONECT 441 437 CONECT 442 437 CONECT 443 437 CONECT 1847 1848 1849 1853 CONECT 1848 1847 CONECT 1849 1847 1850 1851 1852 CONECT 1850 1849 CONECT 1851 1849 CONECT 1852 1849 CONECT 1853 1847 1854 2083 CONECT 1854 1853 1855 1972 2082 CONECT 1855 1854 1856 1857 CONECT 1856 1855 CONECT 1857 1855 1858 2081 CONECT 1858 1857 1859 2062 2080 CONECT 1859 1858 1860 1861 CONECT 1860 1859 CONECT 1861 1859 1862 2061 CONECT 1862 1861 1863 2056 2060 CONECT 1863 1862 1864 1865 CONECT 1864 1863 CONECT 1865 1863 1866 2055 CONECT 1866 1865 1867 2036 2054 CONECT 1867 1866 1868 1869 CONECT 1868 1867 CONECT 1869 1867 1870 2035 CONECT 1870 1869 1871 2019 2034 CONECT 1871 1870 1872 1873 CONECT 1872 1871 CONECT 1873 1871 1874 2018 CONECT 1874 1873 1875 2006 2017 CONECT 1875 1874 1876 1877 CONECT 1876 1875 CONECT 1877 1875 1878 2005 CONECT 1878 1877 1879 1996 2004 CONECT 1879 1878 1880 1881 CONECT 1880 1879 CONECT 1881 1879 1882 1995 CONECT 1882 1881 1883 1979 1994 CONECT 1883 1882 1884 1885 CONECT 1884 1883 CONECT 1885 1883 1886 1978 CONECT 1886 1885 1887 1969 1977 CONECT 1887 1886 1888 1889 CONECT 1888 1887 CONECT 1889 1887 1890 1968 CONECT 1890 1889 1891 1963 1967 CONECT 1891 1890 1892 1893 CONECT 1892 1891 CONECT 1893 1891 1894 1962 CONECT 1894 1893 1895 1948 1961 CONECT 1895 1894 1896 1897 CONECT 1896 1895 CONECT 1897 1895 1898 1947 CONECT 1898 1897 1899 1928 1946 CONECT 1899 1898 1900 1901 CONECT 1900 1899 CONECT 1901 1899 1902 1927 CONECT 1902 1901 1903 1908 1926 CONECT 1903 1902 1904 1905 CONECT 1904 1903 CONECT 1905 1903 1906 1907 CONECT 1906 1905 CONECT 1907 1905 CONECT 1908 1902 1909 1924 1925 CONECT 1909 1908 1910 1922 1923 CONECT 1910 1909 1911 1920 1921 CONECT 1911 1910 1912 1919 CONECT 1912 1911 1913 1916 CONECT 1913 1912 1914 1915 CONECT 1914 1913 CONECT 1915 1913 CONECT 1916 1912 1917 1918 CONECT 1917 1916 CONECT 1918 1916 CONECT 1919 1911 CONECT 1920 1910 CONECT 1921 1910 CONECT 1922 1909 CONECT 1923 1909 CONECT 1924 1908 CONECT 1925 1908 CONECT 1926 1902 CONECT 1927 1901 CONECT 1928 1898 1929 1944 1945 CONECT 1929 1928 1930 1942 1943 CONECT 1930 1929 1931 1940 1941 CONECT 1931 1930 1932 1939 CONECT 1932 1931 1933 1936 CONECT 1933 1932 1934 1935 CONECT 1934 1933 CONECT 1935 1933 CONECT 1936 1932 1937 1938 CONECT 1937 1936 CONECT 1938 1936 CONECT 1939 1931 CONECT 1940 1930 CONECT 1941 1930 CONECT 1942 1929 CONECT 1943 1929 CONECT 1944 1928 CONECT 1945 1928 CONECT 1946 1898 CONECT 1947 1897 CONECT 1948 1894 1949 1959 1960 CONECT 1949 1948 1950 1954 1958 CONECT 1950 1949 1951 1952 1953 CONECT 1951 1950 CONECT 1952 1950 CONECT 1953 1950 CONECT 1954 1949 1955 1956 1957 CONECT 1955 1954 CONECT 1956 1954 CONECT 1957 1954 CONECT 1958 1949 CONECT 1959 1948 CONECT 1960 1948 CONECT 1961 1894 CONECT 1962 1893 CONECT 1963 1890 1964 1965 1966 CONECT 1964 1963 CONECT 1965 1963 CONECT 1966 1963 CONECT 1967 1890 CONECT 1968 1889 CONECT 1969 1886 1970 1975 1976 CONECT 1970 1969 1971 CONECT 1971 1970 1972 CONECT 1972 1854 1971 1973 1974 CONECT 1973 1972 CONECT 1974 1972 CONECT 1975 1969 CONECT 1976 1969 CONECT 1977 1886 CONECT 1978 1885 CONECT 1979 1882 1980 1992 1993 CONECT 1980 1979 1981 1985 CONECT 1981 1980 1982 1991 CONECT 1982 1981 1983 1990 CONECT 1983 1982 1984 1988 CONECT 1984 1983 1985 1987 CONECT 1985 1980 1984 1986 CONECT 1986 1985 CONECT 1987 1984 CONECT 1988 1983 1989 CONECT 1989 1988 CONECT 1990 1982 CONECT 1991 1981 CONECT 1992 1979 CONECT 1993 1979 CONECT 1994 1882 CONECT 1995 1881 CONECT 1996 1878 1997 2002 2003 CONECT 1997 1996 1998 1999 CONECT 1998 1997 CONECT 1999 1997 2000 2001 CONECT 2000 1999 CONECT 2001 1999 CONECT 2002 1996 CONECT 2003 1996 CONECT 2004 1878 CONECT 2005 1877 CONECT 2006 1874 2007 2015 2016 CONECT 2007 2006 2008 2013 2014 CONECT 2008 2007 2009 2010 CONECT 2009 2008 CONECT 2010 2008 2011 2012 CONECT 2011 2010 CONECT 2012 2010 CONECT 2013 2007 CONECT 2014 2007 CONECT 2015 2006 CONECT 2016 2006 CONECT 2017 1874 CONECT 2018 1873 CONECT 2019 1870 2020 2032 2033 CONECT 2020 2019 2021 2025 CONECT 2021 2020 2022 2031 CONECT 2022 2021 2023 2030 CONECT 2023 2022 2024 2028 CONECT 2024 2023 2025 2027 CONECT 2025 2020 2024 2026 CONECT 2026 2025 CONECT 2027 2024 CONECT 2028 2023 2029 CONECT 2029 2028 CONECT 2030 2022 CONECT 2031 2021 CONECT 2032 2019 CONECT 2033 2019 CONECT 2034 1870 CONECT 2035 1869 CONECT 2036 1866 2037 2052 2053 CONECT 2037 2036 2038 2041 CONECT 2038 2037 2039 2051 CONECT 2039 2038 2040 2050 CONECT 2040 2039 2041 2045 CONECT 2041 2037 2040 2042 CONECT 2042 2041 2043 2049 CONECT 2043 2042 2044 2048 CONECT 2044 2043 2045 2047 CONECT 2045 2040 2044 2046 CONECT 2046 2045 CONECT 2047 2044 CONECT 2048 2043 CONECT 2049 2042 CONECT 2050 2039 CONECT 2051 2038 CONECT 2052 2036 CONECT 2053 2036 CONECT 2054 1866 CONECT 2055 1865 CONECT 2056 1862 2057 2058 2059 CONECT 2057 2056 CONECT 2058 2056 CONECT 2059 2056 CONECT 2060 1862 CONECT 2061 1861 CONECT 2062 1858 2063 2078 2079 CONECT 2063 2062 2064 2076 2077 CONECT 2064 2063 2065 2074 2075 CONECT 2065 2064 2066 2073 CONECT 2066 2065 2067 2070 CONECT 2067 2066 2068 2069 CONECT 2068 2067 CONECT 2069 2067 CONECT 2070 2066 2071 2072 CONECT 2071 2070 CONECT 2072 2070 CONECT 2073 2065 CONECT 2074 2064 CONECT 2075 2064 CONECT 2076 2063 CONECT 2077 2063 CONECT 2078 2062 CONECT 2079 2062 CONECT 2080 1858 CONECT 2081 1857 CONECT 2082 1854 CONECT 2083 1853 MASTER 0 0 0 0 0 0 0 0 2081 2 245 14 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 5h5r
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1a37
RCSB PDB
PDBbind
15-mer
1eol
RCSB PDB
PDBbind
15-mer
1j7z
RCSB PDB
PDBbind
15-mer
1j80
RCSB PDB
PDBbind
15-mer
1j81
RCSB PDB
PDBbind
15-mer
1jyc
RCSB PDB
PDBbind
15-mer
1kc5
RCSB PDB
PDBbind
15-mer
1kcs
RCSB PDB
PDBbind
15-mer
1klg
RCSB PDB
PDBbind
15-mer
1klu
RCSB PDB
PDBbind
15-mer
1kna
RCSB PDB
PDBbind
15-mer
1kne
RCSB PDB
PDBbind
15-mer
1om9
RCSB PDB
PDBbind
15-mer
1t08
RCSB PDB
PDBbind
15-mer
1t79
RCSB PDB
PDBbind
15-mer
1t7f
RCSB PDB
PDBbind
15-mer
1t7r
RCSB PDB
PDBbind
15-mer
1tet
RCSB PDB
PDBbind
15-mer
1w70
RCSB PDB
PDBbind
15-mer
1xhm
RCSB PDB
PDBbind
15-mer
2aq9
RCSB PDB
PDBbind
15-mer
2auc
RCSB PDB
PDBbind
15-mer
2bba
RCSB PDB
PDBbind
15-mer
2co0
RCSB PDB
PDBbind
15-mer
2d1x
RCSB PDB
PDBbind
15-mer
2f6j
RCSB PDB
PDBbind
15-mer
2fsa
RCSB PDB
PDBbind
15-mer
2fuu
RCSB PDB
PDBbind
15-mer
2jk9
RCSB PDB
PDBbind
15-mer
2k00
RCSB PDB
PDBbind
15-mer
2ksp
RCSB PDB
PDBbind
15-mer
2kwn
RCSB PDB
PDBbind
15-mer
2l11
RCSB PDB
PDBbind
15-mer
2l12
RCSB PDB
PDBbind
15-mer
2l1b
RCSB PDB
PDBbind
15-mer
2lbm
RCSB PDB
PDBbind
15-mer
2lgf
RCSB PDB
PDBbind
15-mer
2ltx
RCSB PDB
PDBbind
15-mer
2lty
RCSB PDB
PDBbind
15-mer
2ltz
RCSB PDB
PDBbind
15-mer
2m41
RCSB PDB
PDBbind
15-mer
2mwo
RCSB PDB
PDBbind
15-mer
2mwy
RCSB PDB
PDBbind
15-mer
2n9e
RCSB PDB
PDBbind
15-mer
2pmc
RCSB PDB
PDBbind
15-mer
2rnw
RCSB PDB
PDBbind
15-mer
2rny
RCSB PDB
PDBbind
15-mer
2vwf
RCSB PDB
PDBbind
15-mer
2w0p
RCSB PDB
PDBbind
15-mer
2xxn
RCSB PDB
PDBbind
15-mer
2z5s
RCSB PDB
PDBbind
15-mer
2z5t
RCSB PDB
PDBbind
15-mer
3b95
RCSB PDB
PDBbind
15-mer
3btr
RCSB PDB
PDBbind
15-mer
3bu6
RCSB PDB
PDBbind
15-mer
3cfs
RCSB PDB
PDBbind
15-mer
3dab
RCSB PDB
PDBbind
15-mer
3fdt
RCSB PDB
PDBbind
15-mer
3ghe
RCSB PDB
PDBbind
15-mer
3gv6
RCSB PDB
PDBbind
15-mer
3h1z
RCSB PDB
PDBbind
15-mer
3h91
RCSB PDB
PDBbind
15-mer
3hqh
RCSB PDB
PDBbind
15-mer
3jpx
RCSB PDB
PDBbind
15-mer
3l3q
RCSB PDB
PDBbind
15-mer
3l6f
RCSB PDB
PDBbind
15-mer
3m17
RCSB PDB
PDBbind
15-mer
3o6l
RCSB PDB
PDBbind
15-mer
3ql9
RCSB PDB
PDBbind
15-mer
3qlc
RCSB PDB
PDBbind
15-mer
3qo2
RCSB PDB
PDBbind
15-mer
3qxd
RCSB PDB
PDBbind
15-mer
3r93
RCSB PDB
PDBbind
15-mer
3uig
RCSB PDB
PDBbind
15-mer
3uih
RCSB PDB
PDBbind
15-mer
3uij
RCSB PDB
PDBbind
15-mer
3wp0
RCSB PDB
PDBbind
15-mer
3wsy
RCSB PDB
PDBbind
15-mer
4b4n
RCSB PDB
PDBbind
15-mer
4bxu
RCSB PDB
PDBbind
15-mer
4cy1
RCSB PDB
PDBbind
15-mer
4dma
RCSB PDB
PDBbind
15-mer
4dx9
RCSB PDB
PDBbind
15-mer
4ezo
RCSB PDB
PDBbind
15-mer
4ft2
RCSB PDB
PDBbind
15-mer
4gnf
RCSB PDB
PDBbind
15-mer
4gng
RCSB PDB
PDBbind
15-mer
4hfz
RCSB PDB
PDBbind
15-mer
4iur
RCSB PDB
PDBbind
15-mer
4iut
RCSB PDB
PDBbind
15-mer
4iuu
RCSB PDB
PDBbind
15-mer
4iuv
RCSB PDB
PDBbind
15-mer
4j8s
RCSB PDB
PDBbind
15-mer
4k0u
RCSB PDB
PDBbind
15-mer
4n3w
RCSB PDB
PDBbind
15-mer
4n5t
RCSB PDB
PDBbind
15-mer
4nb3
RCSB PDB
PDBbind
15-mer
4nmx
RCSB PDB
PDBbind
15-mer
4nw2
RCSB PDB
PDBbind
15-mer
4o36
RCSB PDB
PDBbind
15-mer
4o37
RCSB PDB
PDBbind
15-mer
4o3u
RCSB PDB
PDBbind
15-mer
4o42
RCSB PDB
PDBbind
15-mer
4o45
RCSB PDB
PDBbind
15-mer
4os1
RCSB PDB
PDBbind
15-mer
4os4
RCSB PDB
PDBbind
15-mer
4os5
RCSB PDB
PDBbind
15-mer
4os7
RCSB PDB
PDBbind
15-mer
4psx
RCSB PDB
PDBbind
15-mer
4r1e
RCSB PDB
PDBbind
15-mer
4r3s
RCSB PDB
PDBbind
15-mer
4rrv
RCSB PDB
PDBbind
15-mer
4u0a
RCSB PDB
PDBbind
15-mer
4u0b
RCSB PDB
PDBbind
15-mer
4u6x
RCSB PDB
PDBbind
15-mer
4u6y
RCSB PDB
PDBbind
15-mer
4xyn
RCSB PDB
PDBbind
15-mer
5cfa
RCSB PDB
PDBbind
15-mer
5cin
RCSB PDB
PDBbind
15-mer
5cqx
RCSB PDB
PDBbind
15-mer
5dif
RCSB PDB
PDBbind
15-mer
5epp
RCSB PDB
PDBbind
15-mer
5etf
RCSB PDB
PDBbind
15-mer
5fb0
RCSB PDB
PDBbind
15-mer
5fb1
RCSB PDB
PDBbind
15-mer
5h5q
RCSB PDB
PDBbind
15-mer
5ix1
RCSB PDB
PDBbind
15-mer
5izu
RCSB PDB
PDBbind
15-mer
5j19
RCSB PDB
PDBbind
15-mer
5j9k
RCSB PDB
PDBbind
15-mer
5jlz
RCSB PDB
PDBbind
15-mer
5ksu
RCSB PDB
PDBbind
15-mer
5ksv
RCSB PDB
PDBbind
15-mer
5kzp
RCSB PDB
PDBbind
15-mer
5lax
RCSB PDB
PDBbind
15-mer
5mlo
RCSB PDB
PDBbind
15-mer
5o45
RCSB PDB
PDBbind
15-mer
5svz
RCSB PDB
PDBbind
15-mer
5t1i
RCSB PDB
PDBbind
15-mer
5twg
RCSB PDB
PDBbind
15-mer
5u66
RCSB PDB
PDBbind
15-mer
5ul6
RCSB PDB
PDBbind
15-mer
5uwj
RCSB PDB
PDBbind
15-mer
5v4b
RCSB PDB
PDBbind
15-mer
5vb9
RCSB PDB
PDBbind
15-mer
5vzy
RCSB PDB
PDBbind
15-mer
5wir
RCSB PDB
PDBbind
15-mer
5ypo
RCSB PDB
PDBbind
15-mer
5znp
RCSB PDB
PDBbind
15-mer
5zuj
RCSB PDB
PDBbind
15-mer
6atv
RCSB PDB
PDBbind
15-mer
6b5m
RCSB PDB
PDBbind
15-mer
6b5o
RCSB PDB
PDBbind
15-mer
6b5r
RCSB PDB
PDBbind
15-mer
6b5t
RCSB PDB
PDBbind
15-mer
6biz
RCSB PDB
PDBbind
15-mer
6f0y
RCSB PDB
PDBbind
15-mer
6rmm
RCSB PDB
PDBbind
15-mer
6rml
RCSB PDB
PDBbind
15-mer
6q9t
RCSB PDB
PDBbind
15-mer
6hol
RCSB PDB
PDBbind
15-mer
6e5x
RCSB PDB
PDBbind
15-mer
6bnt
RCSB PDB
PDBbind
15-mer
5zk9
RCSB PDB
PDBbind
15-mer
5zjz
RCSB PDB
PDBbind
15-mer
5vtb
RCSB PDB
PDBbind
15-mer
6a5e
RCSB PDB
PDBbind
15-mer
Entry Information
PDB ID
5h5r
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human phospholipid hydroperoxidase glutathione peroxidase (GPX4)
Ligand Name
15-mer
EC.Number
E.C.1.11.1.12
Resolution
1.2(Å)
Affinity (Kd/Ki/IC50)
Kd=0.61uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Biochem. Biophys. Res. Commun. Vol. 482: pp. 195-201
Ligand Properties
Formula
C
7
6
H
1
1
5
N
2
6
O
1
8
S
2
Molecular Weight
1745.020
Exact Mass
1743.830
No. of atoms
237
No. of bonds
241
Polar Surface Area
812.45
LOGP Value
1.12 (
Computed with XLOGP3
)
-1.67 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 19
No. of Hydrogen Bond Acceptors: 18
No. of Rotatable Bonds: 42
No. of Nitrogen and Oxygen Atoms: 44
No. of Rings: 5
Canonical SMILES
CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)C)C(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)Cc1ccc(cc1)O)CC(=O)N)CCC(=O)N)Cc1ccc(cc1)O)Cc1c[nH]c2c1cccc2)C)C
InChI String
InChI=1S/C76H112N26O18S2/c1-37(2)29-52(67(114)94-50(15-10-28-88-76(84)85)65(112)93-48(61(79)108)13-8-26-86-74(80)81)97-62(109)39(4)91-72(119)58-36-122-121-35-57(92-40(5)103)73(120)95-49(14-9-27-87-75(82)83)64(111)90-38(3)63(110)98-55(32-43-34-89-47-12-7-6-11-46(43)47)70(117)99-53(30-41-16-20-44(104)21-17-41)68(115)96-51(24-25-59(77)106)66(113)101-56(33-60(78)107)71(118)100-54(69(116)102-58)31-42-18-22-45(105)23-19-42/h6-7,11-12,16-23,34,37-39,48-58,89,104-105H,8-10,13-15,24-33,35-36H2,1-5H3,(H2,77,106)(H2,78,107)(H2,79,108)(H,90,111)(H,91,119)(H,92,103)(H,93,112)(H,94,114)(H,95,120)(H,96,115)(H,97,109)(H,98,110)(H,99,117)(H,100,118)(H,101,113)(H,102,116)(H4,80,81,86)(H4,82,83,87)(H4,84,85,88)/p+3/t38-,39-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P36969
Entrez Gene ID
NCBI Entrez Gene ID:
2879
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓