Browse entries in the PDBbind-CN Database
HEADER 4OZJ_COMPLEX COMPND 4OZJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 44 LEU PRO ASN ASP GLY GLY ILE LYS LEU VAL MET ALA ILE SEQRES 2 A 44 ILE ARG PRO ASP LYS LEU ALA ASP VAL LYS THR ALA LEU SEQRES 3 A 44 ALA GLU VAL GLY ALA PRO SER LEU THR VAL THR ASN VAL SEQRES 4 A 44 SER GLY ARG GLY SER SEQRES 1 A 60 VAL ASP LEU HIS GLN LYS VAL LYS VAL GLU CYS VAL VAL SEQRES 2 A 60 ALA ASP THR PRO ALA GLU ASP VAL ALA ASP ALA ILE ALA SEQRES 3 A 60 ASP ALA ALA HIS THR GLY GLU LYS GLY ASP GLY LYS ILE SEQRES 4 A 60 PHE ILE LEU PRO VAL GLU ASN ALA ILE GLN VAL ARG THR SEQRES 5 A 60 GLY LYS THR GLY ARG ASP ALA VAL SEQRES 1 B 44 LEU PRO ASN ASP GLY GLY ILE LYS LEU VAL MET ALA ILE SEQRES 2 B 44 ILE ARG PRO ASP LYS LEU ALA ASP VAL LYS THR ALA LEU SEQRES 3 B 44 ALA GLU VAL GLY ALA PRO SER LEU THR VAL THR ASN VAL SEQRES 4 B 44 SER GLY ARG GLY SER SEQRES 1 B 60 VAL ASP LEU HIS GLN LYS VAL LYS VAL GLU CYS VAL VAL SEQRES 2 B 60 ALA ASP THR PRO ALA GLU ASP VAL ALA ASP ALA ILE ALA SEQRES 3 B 60 ASP ALA ALA HIS THR GLY GLU LYS GLY ASP GLY LYS ILE SEQRES 4 B 60 PHE ILE LEU PRO VAL GLU ASN ALA ILE GLN VAL ARG THR SEQRES 5 B 60 GLY LYS THR GLY ARG ASP ALA VAL SEQRES 1 C 44 LEU PRO ASN ASP GLY GLY ILE LYS LEU VAL MET ALA ILE SEQRES 2 C 44 ILE ARG PRO ASP LYS LEU ALA ASP VAL LYS THR ALA LEU SEQRES 3 C 44 ALA GLU VAL GLY ALA PRO SER LEU THR VAL THR ASN VAL SEQRES 4 C 44 SER GLY ARG GLY SER SEQRES 1 C 60 VAL ASP LEU HIS GLN LYS VAL LYS VAL GLU CYS VAL VAL SEQRES 2 C 60 ALA ASP THR PRO ALA GLU ASP VAL ALA ASP ALA ILE ALA SEQRES 3 C 60 ASP ALA ALA HIS THR GLY GLU LYS GLY ASP GLY LYS ILE SEQRES 4 C 60 PHE ILE LEU PRO VAL GLU ASN ALA ILE GLN VAL ARG THR SEQRES 5 C 60 GLY LYS THR GLY ARG ASP ALA VAL HET ADP A 517 39 ATOM 1 N LEU A 6 1.949 17.969 34.368 1.00 64.45 N ATOM 2 CA LEU A 6 2.445 18.003 32.957 1.00 59.46 C ATOM 3 C LEU A 6 1.507 17.241 32.011 1.00 55.16 C ATOM 4 O LEU A 6 0.794 16.335 32.443 1.00 52.43 O ATOM 5 CB LEU A 6 3.854 17.414 32.873 1.00 61.94 C ATOM 6 HN3 LEU A 6 1.888 16.982 34.689 1.00 0.00 H ATOM 7 HN2 LEU A 6 1.007 18.408 34.414 1.00 0.00 H ATOM 8 HN1 LEU A 6 2.608 18.494 34.978 1.00 0.00 H ATOM 9 N PRO A 7 1.504 17.608 30.716 1.00 43.87 N ATOM 10 CA PRO A 7 0.615 16.950 29.750 1.00 41.34 C ATOM 11 C PRO A 7 0.855 15.440 29.634 1.00 39.89 C ATOM 12 O PRO A 7 1.988 14.974 29.763 1.00 42.12 O ATOM 13 CB PRO A 7 0.922 17.659 28.423 1.00 40.82 C ATOM 14 CG PRO A 7 2.192 18.413 28.643 1.00 47.42 C ATOM 15 CD PRO A 7 2.276 18.703 30.105 1.00 49.43 C ATOM 16 N ASN A 8 -0.225 14.695 29.410 1.00 40.45 N ATOM 17 CA ASN A 8 -0.179 13.233 29.300 1.00 35.08 C ATOM 18 C ASN A 8 0.466 12.565 30.520 1.00 40.24 C ATOM 19 O ASN A 8 1.137 11.541 30.398 1.00 39.66 O ATOM 20 CB ASN A 8 0.535 12.816 28.011 1.00 32.63 C ATOM 21 CG ASN A 8 -0.103 13.421 26.776 1.00 31.67 C ATOM 22 OD1 ASN A 8 -1.265 13.150 26.470 1.00 33.68 O ATOM 23 ND2 ASN A 8 0.652 14.237 26.054 1.00 30.86 N ATOM 24 HD22 ASN A 8 1.629 14.439 26.349 1.00 0.00 H ATOM 25 HD21 ASN A 8 0.268 14.675 25.193 1.00 0.00 H ATOM 26 H ASN A 8 -1.144 15.171 29.308 1.00 0.00 H ATOM 27 N ASP A 9 0.254 13.167 31.690 1.00 45.64 N ATOM 28 CA ASP A 9 0.790 12.670 32.958 1.00 48.21 C ATOM 29 C ASP A 9 2.321 12.484 32.916 1.00 45.23 C ATOM 30 O ASP A 9 2.871 11.581 33.554 1.00 49.52 O ATOM 31 CB ASP A 9 0.076 11.362 33.344 1.00 51.93 C ATOM 32 CG ASP A 9 -0.293 11.294 34.827 1.00 64.30 C ATOM 33 OD1 ASP A 9 -0.106 12.295 35.560 1.00 78.67 O ATOM 34 OD2 ASP A 9 -0.787 10.229 35.259 1.00 78.04 O ATOM 35 H ASP A 9 -0.321 14.033 31.703 1.00 0.00 H ATOM 36 N GLY A 10 2.997 13.351 32.162 1.00 41.58 N ATOM 37 CA GLY A 10 4.453 13.295 32.017 1.00 39.56 C ATOM 38 C GLY A 10 4.958 12.213 31.079 1.00 39.41 C ATOM 39 O GLY A 10 6.164 11.996 30.983 1.00 44.63 O ATOM 40 H GLY A 10 2.471 14.094 31.659 1.00 0.00 H ATOM 41 N GLY A 11 4.041 11.550 30.375 1.00 38.35 N ATOM 42 CA GLY A 11 4.378 10.445 29.496 1.00 34.77 C ATOM 43 C GLY A 11 4.185 10.727 28.018 1.00 30.70 C ATOM 44 O GLY A 11 4.087 11.872 27.585 1.00 33.76 O ATOM 45 H GLY A 11 3.044 11.836 30.459 1.00 0.00 H ATOM 46 N ILE A 12 4.121 9.647 27.252 1.00 26.81 N ATOM 47 CA ILE A 12 4.058 9.682 25.798 1.00 24.74 C ATOM 48 C ILE A 12 2.837 8.857 25.406 1.00 23.89 C ATOM 49 O ILE A 12 2.567 7.824 26.023 1.00 25.74 O ATOM 50 CB ILE A 12 5.306 9.023 25.169 1.00 24.43 C ATOM 51 CG1 ILE A 12 6.591 9.631 25.749 1.00 24.97 C ATOM 52 CG2 ILE A 12 5.308 9.181 23.656 1.00 22.95 C ATOM 53 CD1 ILE A 12 7.836 8.815 25.448 1.00 28.43 C ATOM 54 H ILE A 12 4.115 8.717 27.718 1.00 0.00 H ATOM 55 N LYS A 13 2.103 9.322 24.397 1.00 23.66 N ATOM 56 CA LYS A 13 0.913 8.625 23.907 1.00 22.93 C ATOM 57 C LYS A 13 0.913 8.550 22.400 1.00 20.46 C ATOM 58 O LYS A 13 1.431 9.438 21.732 1.00 22.61 O ATOM 59 CB LYS A 13 -0.368 9.355 24.334 1.00 23.98 C ATOM 60 CG LYS A 13 -0.490 9.635 25.813 1.00 27.30 C ATOM 61 CD LYS A 13 -0.685 8.379 26.630 1.00 30.45 C ATOM 62 CE LYS A 13 -0.735 8.709 28.111 1.00 34.17 C ATOM 63 NZ LYS A 13 -0.617 7.491 28.954 1.00 40.72 N ATOM 64 HZ1 LYS A 13 -1.401 6.843 28.737 1.00 0.00 H ATOM 65 HZ2 LYS A 13 0.288 7.020 28.755 1.00 0.00 H ATOM 66 HZ3 LYS A 13 -0.656 7.761 29.958 1.00 0.00 H ATOM 67 H LYS A 13 2.386 10.213 23.941 1.00 0.00 H ATOM 68 N LEU A 14 0.315 7.476 21.877 1.00 20.00 N ATOM 69 CA LEU A 14 0.075 7.314 20.462 1.00 18.69 C ATOM 70 C LEU A 14 -1.406 7.566 20.199 1.00 19.01 C ATOM 71 O LEU A 14 -2.275 6.905 20.786 1.00 21.60 O ATOM 72 CB LEU A 14 0.437 5.893 19.999 1.00 20.30 C ATOM 73 CG LEU A 14 -0.071 5.473 18.613 1.00 22.20 C ATOM 74 CD1 LEU A 14 0.551 6.325 17.529 1.00 24.58 C ATOM 75 CD2 LEU A 14 0.212 3.998 18.363 1.00 22.42 C ATOM 76 H LEU A 14 0.007 6.719 22.520 1.00 0.00 H ATOM 77 N VAL A 15 -1.684 8.537 19.338 1.00 20.39 N ATOM 78 CA VAL A 15 -3.034 8.803 18.873 1.00 19.37 C ATOM 79 C VAL A 15 -3.150 8.174 17.494 1.00 20.11 C ATOM 80 O VAL A 15 -2.402 8.516 16.597 1.00 21.30 O ATOM 81 CB VAL A 15 -3.324 10.309 18.792 1.00 20.64 C ATOM 82 CG1 VAL A 15 -4.769 10.545 18.354 1.00 21.82 C ATOM 83 CG2 VAL A 15 -3.056 10.957 20.145 1.00 23.77 C ATOM 84 H VAL A 15 -0.906 9.129 18.983 1.00 0.00 H ATOM 85 N MET A 16 -4.067 7.219 17.358 1.00 17.90 N ATOM 86 CA MET A 16 -4.278 6.478 16.128 1.00 18.28 C ATOM 87 C MET A 16 -5.698 6.712 15.655 1.00 17.79 C ATOM 88 O MET A 16 -6.646 6.349 16.351 1.00 23.47 O ATOM 89 CB MET A 16 -4.082 4.983 16.394 1.00 21.81 C ATOM 90 CG MET A 16 -4.350 4.082 15.211 1.00 27.97 C ATOM 91 SD MET A 16 -4.398 2.325 15.665 1.00 38.37 S ATOM 92 CE MET A 16 -2.757 2.106 16.339 1.00 38.66 C ATOM 93 H MET A 16 -4.665 6.991 18.178 1.00 0.00 H ATOM 94 N ALA A 17 -5.847 7.308 14.481 1.00 15.99 N ATOM 95 CA ALA A 17 -7.161 7.655 13.933 1.00 17.49 C ATOM 96 C ALA A 17 -7.391 6.938 12.624 1.00 17.79 C ATOM 97 O ALA A 17 -6.485 6.847 11.800 1.00 19.88 O ATOM 98 CB ALA A 17 -7.240 9.157 13.703 1.00 19.00 C ATOM 99 H ALA A 17 -4.998 7.539 13.927 1.00 0.00 H ATOM 100 N ILE A 18 -8.581 6.366 12.447 1.00 15.81 N ATOM 101 CA ILE A 18 -8.965 5.850 11.154 1.00 16.84 C ATOM 102 C ILE A 18 -10.053 6.757 10.636 1.00 16.58 C ATOM 103 O ILE A 18 -11.077 6.931 11.307 1.00 20.48 O ATOM 104 CB ILE A 18 -9.455 4.392 11.187 1.00 18.72 C ATOM 105 CG1 ILE A 18 -8.408 3.476 11.811 1.00 25.10 C ATOM 106 CG2 ILE A 18 -9.803 3.940 9.776 1.00 22.21 C ATOM 107 CD1 ILE A 18 -8.549 3.337 13.297 1.00 32.62 C ATOM 108 H ILE A 18 -9.240 6.290 13.248 1.00 0.00 H ATOM 109 N ILE A 19 -9.830 7.334 9.465 1.00 17.24 N ATOM 110 CA ILE A 19 -10.701 8.394 8.943 1.00 18.29 C ATOM 111 C ILE A 19 -10.927 8.211 7.454 1.00 17.01 C ATOM 112 O ILE A 19 -10.291 7.368 6.819 1.00 17.47 O ATOM 113 CB ILE A 19 -10.094 9.798 9.180 1.00 21.94 C ATOM 114 CG1 ILE A 19 -8.771 9.921 8.416 1.00 19.14 C ATOM 115 CG2 ILE A 19 -9.928 10.050 10.659 1.00 23.74 C ATOM 116 CD1 ILE A 19 -8.103 11.279 8.469 1.00 22.65 C ATOM 117 H ILE A 19 -9.014 7.027 8.899 1.00 0.00 H ATOM 118 N ARG A 20 -11.841 8.990 6.889 1.00 17.37 N ATOM 119 CA ARG A 20 -12.063 9.006 5.452 1.00 17.90 C ATOM 120 C ARG A 20 -10.861 9.590 4.720 1.00 19.17 C ATOM 121 O ARG A 20 -10.308 10.608 5.167 1.00 21.63 O ATOM 122 CB ARG A 20 -13.277 9.882 5.120 1.00 18.55 C ATOM 123 CG ARG A 20 -14.566 9.377 5.715 1.00 19.76 C ATOM 124 CD ARG A 20 -15.694 10.386 5.510 1.00 21.23 C ATOM 125 NE ARG A 20 -16.912 9.968 6.195 1.00 22.29 N ATOM 126 CZ ARG A 20 -17.755 9.031 5.775 1.00 23.55 C ATOM 127 NH1 ARG A 20 -17.561 8.384 4.635 1.00 26.12 N ATOM 128 NH2 ARG A 20 -18.828 8.760 6.510 1.00 26.45 N ATOM 129 HE ARG A 20 -17.141 10.445 7.090 1.00 0.00 H ATOM 130 HH12 ARG A 20 -18.237 7.655 4.329 1.00 0.00 H ATOM 131 HH11 ARG A 20 -16.733 8.605 4.046 1.00 0.00 H ATOM 132 HH22 ARG A 20 -19.500 8.030 6.199 1.00 0.00 H ATOM 133 HH21 ARG A 20 -18.996 9.278 7.396 1.00 0.00 H ATOM 134 H ARG A 20 -12.417 9.609 7.494 1.00 0.00 H ATOM 135 N PRO A 21 -10.486 9.001 3.568 1.00 19.92 N ATOM 136 CA PRO A 21 -9.332 9.541 2.824 1.00 21.24 C ATOM 137 C PRO A 21 -9.456 11.021 2.448 1.00 22.81 C ATOM 138 O PRO A 21 -8.458 11.776 2.496 1.00 24.08 O ATOM 139 CB PRO A 21 -9.280 8.651 1.575 1.00 24.57 C ATOM 140 CG PRO A 21 -9.900 7.367 2.015 1.00 24.23 C ATOM 141 CD PRO A 21 -11.022 7.787 2.920 1.00 22.07 C ATOM 142 N ASP A 22 -10.668 11.459 2.119 1.00 22.24 N ATOM 143 CA ASP A 22 -10.858 12.841 1.684 1.00 22.45 C ATOM 144 C ASP A 22 -10.699 13.880 2.804 1.00 23.48 C ATOM 145 O ASP A 22 -10.610 15.075 2.521 1.00 27.97 O ATOM 146 CB ASP A 22 -12.195 13.017 0.967 1.00 27.47 C ATOM 147 CG ASP A 22 -13.392 12.850 1.885 1.00 40.15 C ATOM 148 OD1 ASP A 22 -13.237 12.316 3.006 1.00 56.09 O ATOM 149 OD2 ASP A 22 -14.508 13.253 1.483 1.00 67.78 O ATOM 150 H ASP A 22 -11.483 10.816 2.172 1.00 0.00 H ATOM 151 N LYS A 23 -10.645 13.428 4.055 1.00 20.49 N ATOM 152 CA LYS A 23 -10.458 14.303 5.219 1.00 20.80 C ATOM 153 C LYS A 23 -9.007 14.432 5.664 1.00 21.08 C ATOM 154 O LYS A 23 -8.704 15.155 6.599 1.00 20.55 O ATOM 155 CB LYS A 23 -11.286 13.773 6.381 1.00 20.64 C ATOM 156 CG LYS A 23 -12.783 13.910 6.183 1.00 21.92 C ATOM 157 CD LYS A 23 -13.130 15.351 5.862 1.00 23.59 C ATOM 158 CE LYS A 23 -14.582 15.628 6.100 1.00 26.62 C ATOM 159 NZ LYS A 23 -14.810 17.088 5.965 1.00 34.42 N ATOM 160 HZ1 LYS A 23 -14.232 17.594 6.666 1.00 0.00 H ATOM 161 HZ2 LYS A 23 -14.542 17.392 5.007 1.00 0.00 H ATOM 162 HZ3 LYS A 23 -15.816 17.297 6.128 1.00 0.00 H ATOM 163 H LYS A 23 -10.740 12.405 4.216 1.00 0.00 H ATOM 164 N LEU A 24 -8.099 13.697 5.024 1.00 20.10 N ATOM 165 CA LEU A 24 -6.697 13.773 5.432 1.00 19.71 C ATOM 166 C LEU A 24 -6.130 15.204 5.347 1.00 20.52 C ATOM 167 O LEU A 24 -5.433 15.650 6.268 1.00 21.19 O ATOM 168 CB LEU A 24 -5.838 12.805 4.613 1.00 18.63 C ATOM 169 CG LEU A 24 -4.336 12.837 4.917 1.00 19.53 C ATOM 170 CD1 LEU A 24 -4.066 12.559 6.392 1.00 22.24 C ATOM 171 CD2 LEU A 24 -3.585 11.870 4.006 1.00 20.98 C ATOM 172 H LEU A 24 -8.385 13.075 4.241 1.00 0.00 H ATOM 173 N ALA A 25 -6.420 15.925 4.266 1.00 21.02 N ATOM 174 CA ALA A 25 -5.879 17.283 4.127 1.00 24.45 C ATOM 175 C ALA A 25 -6.321 18.174 5.300 1.00 25.28 C ATOM 176 O ALA A 25 -5.519 18.902 5.890 1.00 25.96 O ATOM 177 CB ALA A 25 -6.279 17.889 2.791 1.00 28.27 C ATOM 178 H ALA A 25 -7.028 15.527 3.522 1.00 0.00 H ATOM 179 N ASP A 26 -7.599 18.101 5.655 1.00 21.64 N ATOM 180 CA ASP A 26 -8.119 18.909 6.762 1.00 25.95 C ATOM 181 C ASP A 26 -7.539 18.483 8.115 1.00 22.14 C ATOM 182 O ASP A 26 -7.239 19.332 8.961 1.00 22.82 O ATOM 183 CB ASP A 26 -9.646 18.854 6.778 1.00 27.19 C ATOM 184 CG ASP A 26 -10.280 19.705 5.669 1.00 35.65 C ATOM 185 OD1 ASP A 26 -9.574 20.523 5.032 1.00 38.22 O ATOM 186 OD2 ASP A 26 -11.496 19.550 5.421 1.00 43.64 O ATOM 187 H ASP A 26 -8.239 17.462 5.141 1.00 0.00 H ATOM 188 N VAL A 27 -7.326 17.176 8.297 1.00 20.43 N ATOM 189 CA VAL A 27 -6.693 16.666 9.517 1.00 20.78 C ATOM 190 C VAL A 27 -5.231 17.167 9.631 1.00 19.93 C ATOM 191 O VAL A 27 -4.787 17.578 10.702 1.00 21.47 O ATOM 192 CB VAL A 27 -6.780 15.123 9.575 1.00 19.37 C ATOM 193 CG1 VAL A 27 -5.839 14.561 10.630 1.00 24.18 C ATOM 194 CG2 VAL A 27 -8.229 14.750 9.861 1.00 20.57 C ATOM 195 H VAL A 27 -7.616 16.506 7.556 1.00 0.00 H ATOM 196 N LYS A 28 -4.501 17.147 8.524 1.00 20.46 N ATOM 197 CA LYS A 28 -3.127 17.642 8.527 1.00 21.22 C ATOM 198 C LYS A 28 -3.083 19.125 8.973 1.00 23.30 C ATOM 199 O LYS A 28 -2.259 19.518 9.803 1.00 25.88 O ATOM 200 CB LYS A 28 -2.499 17.476 7.141 1.00 22.81 C ATOM 201 CG LYS A 28 -2.137 16.047 6.781 1.00 25.08 C ATOM 202 CD LYS A 28 -1.229 16.017 5.577 1.00 32.25 C ATOM 203 CE LYS A 28 -1.897 16.475 4.304 1.00 34.41 C ATOM 204 NZ LYS A 28 -0.871 16.465 3.232 1.00 33.45 N ATOM 205 HZ1 LYS A 28 -0.097 17.110 3.489 1.00 0.00 H ATOM 206 HZ2 LYS A 28 -0.498 15.501 3.120 1.00 0.00 H ATOM 207 HZ3 LYS A 28 -1.302 16.777 2.338 1.00 0.00 H ATOM 208 H LYS A 28 -4.912 16.775 7.644 1.00 0.00 H ATOM 209 N THR A 29 -3.996 19.931 8.435 1.00 24.57 N ATOM 210 CA THR A 29 -4.077 21.353 8.775 1.00 24.41 C ATOM 211 C THR A 29 -4.406 21.519 10.258 1.00 27.42 C ATOM 212 O THR A 29 -3.758 22.298 10.951 1.00 28.04 O ATOM 213 CB THR A 29 -5.130 22.046 7.903 1.00 28.36 C ATOM 214 OG1 THR A 29 -4.777 21.878 6.523 1.00 31.74 O ATOM 215 CG2 THR A 29 -5.229 23.550 8.237 1.00 28.78 C ATOM 216 HG1 THR A 29 -5.454 22.324 5.954 1.00 0.00 H ATOM 217 H THR A 29 -4.674 19.538 7.751 1.00 0.00 H ATOM 218 N ALA A 30 -5.365 20.734 10.756 1.00 25.21 N ATOM 219 CA ALA A 30 -5.749 20.806 12.166 1.00 28.79 C ATOM 220 C ALA A 30 -4.611 20.428 13.112 1.00 25.40 C ATOM 221 O ALA A 30 -4.422 21.060 14.155 1.00 30.43 O ATOM 222 CB ALA A 30 -6.973 19.953 12.439 1.00 26.94 C ATOM 223 H ALA A 30 -5.848 20.059 10.130 1.00 0.00 H ATOM 224 N LEU A 31 -3.838 19.413 12.736 1.00 23.52 N ATOM 225 CA LEU A 31 -2.699 19.005 13.545 1.00 24.63 C ATOM 226 C LEU A 31 -1.627 20.086 13.596 1.00 26.66 C ATOM 227 O LEU A 31 -1.080 20.379 14.659 1.00 29.36 O ATOM 228 CB LEU A 31 -2.118 17.697 13.016 1.00 22.00 C ATOM 229 CG LEU A 31 -2.952 16.449 13.283 1.00 23.25 C ATOM 230 CD1 LEU A 31 -2.451 15.282 12.441 1.00 26.71 C ATOM 231 CD2 LEU A 31 -2.900 16.088 14.755 1.00 28.37 C ATOM 232 H LEU A 31 -4.050 18.905 11.854 1.00 0.00 H ATOM 233 N ALA A 32 -1.344 20.699 12.455 1.00 25.31 N ATOM 234 CA ALA A 32 -0.396 21.818 12.413 1.00 28.18 C ATOM 235 C ALA A 32 -0.880 22.964 13.308 1.00 29.98 C ATOM 236 O ALA A 32 -0.093 23.571 14.028 1.00 39.01 O ATOM 237 CB ALA A 32 -0.207 22.302 10.985 1.00 31.65 C ATOM 238 H ALA A 32 -1.801 20.382 11.576 1.00 0.00 H ATOM 239 N GLU A 33 -2.183 23.238 13.265 1.00 33.38 N ATOM 240 CA GLU A 33 -2.768 24.351 14.017 1.00 34.85 C ATOM 241 C GLU A 33 -2.752 24.124 15.533 1.00 35.51 C ATOM 242 O GLU A 33 -2.640 25.080 16.297 1.00 44.50 O ATOM 243 CB GLU A 33 -4.191 24.653 13.530 1.00 39.01 C ATOM 244 CG GLU A 33 -4.240 25.320 12.155 1.00 50.03 C ATOM 245 CD GLU A 33 -5.639 25.773 11.742 1.00 61.24 C ATOM 246 OE1 GLU A 33 -5.839 26.089 10.544 1.00 68.37 O ATOM 247 OE2 GLU A 33 -6.544 25.821 12.609 1.00 71.98 O ATOM 248 H GLU A 33 -2.804 22.644 12.680 1.00 0.00 H ATOM 249 N VAL A 34 -2.829 22.867 15.965 1.00 33.55 N ATOM 250 CA VAL A 34 -2.805 22.541 17.395 1.00 37.60 C ATOM 251 C VAL A 34 -1.362 22.413 17.923 1.00 36.80 C ATOM 252 O VAL A 34 -1.141 22.257 19.127 1.00 40.59 O ATOM 253 CB VAL A 34 -3.675 21.291 17.696 1.00 38.37 C ATOM 254 CG1 VAL A 34 -2.939 19.997 17.391 1.00 37.33 C ATOM 255 CG2 VAL A 34 -4.160 21.293 19.139 1.00 46.05 C ATOM 256 H VAL A 34 -2.908 22.097 15.271 1.00 0.00 H ATOM 257 N GLY A 35 -0.387 22.492 17.018 1.00 32.85 N ATOM 258 CA GLY A 35 1.031 22.515 17.391 1.00 36.47 C ATOM 259 C GLY A 35 1.699 21.156 17.455 1.00 36.53 C ATOM 260 O GLY A 35 2.736 20.996 18.095 1.00 39.93 O ATOM 261 H GLY A 35 -0.641 22.539 16.011 1.00 0.00 H ATOM 262 N ALA A 36 1.097 20.180 16.788 1.00 34.12 N ATOM 263 CA ALA A 36 1.610 18.818 16.758 1.00 31.24 C ATOM 264 C ALA A 36 1.543 18.315 15.323 1.00 29.02 C ATOM 265 O ALA A 36 0.761 17.416 15.017 1.00 36.81 O ATOM 266 CB ALA A 36 0.774 17.940 17.683 1.00 35.97 C ATOM 267 H ALA A 36 0.224 20.396 16.266 1.00 0.00 H ATOM 268 N PRO A 37 2.361 18.900 14.430 1.00 29.54 N ATOM 269 CA PRO A 37 2.255 18.574 13.009 1.00 32.00 C ATOM 270 C PRO A 37 2.725 17.166 12.607 1.00 31.46 C ATOM 271 O PRO A 37 2.278 16.671 11.571 1.00 30.31 O ATOM 272 CB PRO A 37 3.146 19.626 12.345 1.00 34.80 C ATOM 273 CG PRO A 37 4.169 19.949 13.383 1.00 37.46 C ATOM 274 CD PRO A 37 3.433 19.881 14.692 1.00 32.97 C ATOM 275 N SER A 38 3.613 16.550 13.397 1.00 25.89 N ATOM 276 CA SER A 38 4.214 15.251 13.053 1.00 23.35 C ATOM 277 C SER A 38 3.173 14.161 12.931 1.00 23.75 C ATOM 278 O SER A 38 2.351 13.995 13.819 1.00 27.99 O ATOM 279 CB SER A 38 5.213 14.794 14.121 1.00 27.01 C ATOM 280 OG SER A 38 6.294 15.689 14.233 1.00 31.05 O ATOM 281 HG SER A 38 5.955 16.585 14.483 1.00 0.00 H ATOM 282 H SER A 38 3.889 17.007 14.289 1.00 0.00 H ATOM 283 N LEU A 39 3.229 13.399 11.848 1.00 20.45 N ATOM 284 CA LEU A 39 2.269 12.301 11.660 1.00 17.52 C ATOM 285 C LEU A 39 2.812 11.291 10.686 1.00 15.84 C ATOM 286 O LEU A 39 3.634 11.614 9.822 1.00 17.28 O ATOM 287 CB LEU A 39 0.897 12.840 11.184 1.00 22.57 C ATOM 288 CG LEU A 39 0.665 13.082 9.686 1.00 23.51 C ATOM 289 CD1 LEU A 39 -0.818 13.209 9.346 1.00 26.74 C ATOM 290 CD2 LEU A 39 1.410 14.308 9.245 1.00 26.97 C ATOM 291 H LEU A 39 3.956 13.579 11.127 1.00 0.00 H ATOM 292 N THR A 40 2.282 10.073 10.824 1.00 16.91 N ATOM 293 CA THR A 40 2.525 8.986 9.890 1.00 16.11 C ATOM 294 C THR A 40 1.147 8.494 9.394 1.00 13.89 C ATOM 295 O THR A 40 0.237 8.271 10.189 1.00 18.23 O ATOM 296 CB THR A 40 3.312 7.858 10.580 1.00 17.19 C ATOM 297 OG1 THR A 40 4.615 8.341 10.938 1.00 18.75 O ATOM 298 CG2 THR A 40 3.503 6.682 9.665 1.00 19.67 C ATOM 299 HG1 THR A 40 5.123 7.617 11.382 1.00 0.00 H ATOM 300 H THR A 40 1.664 9.893 11.641 1.00 0.00 H ATOM 301 N VAL A 41 1.028 8.390 8.084 1.00 13.73 N ATOM 302 CA VAL A 41 -0.190 7.976 7.389 1.00 14.03 C ATOM 303 C VAL A 41 -0.007 6.601 6.744 1.00 14.22 C ATOM 304 O VAL A 41 0.956 6.372 6.027 1.00 14.91 O ATOM 305 CB VAL A 41 -0.527 8.989 6.269 1.00 17.67 C ATOM 306 CG1 VAL A 41 -1.696 8.515 5.407 1.00 22.48 C ATOM 307 CG2 VAL A 41 -0.811 10.365 6.884 1.00 20.82 C ATOM 308 H VAL A 41 1.860 8.619 7.504 1.00 0.00 H ATOM 309 N THR A 42 -1.028 5.746 6.893 1.00 14.58 N ATOM 310 CA THR A 42 -1.063 4.427 6.284 1.00 15.00 C ATOM 311 C THR A 42 -2.388 4.315 5.548 1.00 14.91 C ATOM 312 O THR A 42 -3.423 4.662 6.100 1.00 16.41 O ATOM 313 CB THR A 42 -1.004 3.312 7.366 1.00 17.72 C ATOM 314 OG1 THR A 42 0.138 3.513 8.202 1.00 22.87 O ATOM 315 CG2 THR A 42 -0.913 1.922 6.732 1.00 18.00 C ATOM 316 HG1 THR A 42 0.172 2.801 8.889 1.00 0.00 H ATOM 317 H THR A 42 -1.838 6.042 7.475 1.00 0.00 H ATOM 318 N ASN A 43 -2.341 3.808 4.336 1.00 14.15 N ATOM 319 CA ASN A 43 -3.534 3.478 3.599 1.00 14.76 C ATOM 320 C ASN A 43 -4.063 2.114 4.042 1.00 13.31 C ATOM 321 O ASN A 43 -3.331 1.133 4.044 1.00 17.00 O ATOM 322 CB ASN A 43 -3.246 3.518 2.120 1.00 16.69 C ATOM 323 CG ASN A 43 -2.793 4.879 1.688 1.00 19.76 C ATOM 324 OD1 ASN A 43 -3.535 5.851 1.811 1.00 25.36 O ATOM 325 ND2 ASN A 43 -1.558 4.966 1.233 1.00 21.77 N ATOM 326 HD22 ASN A 43 -0.973 4.110 1.149 1.00 0.00 H ATOM 327 HD21 ASN A 43 -1.169 5.891 0.958 1.00 0.00 H ATOM 328 H ASN A 43 -1.414 3.640 3.896 1.00 0.00 H ATOM 329 N VAL A 44 -5.344 2.058 4.404 1.00 12.87 N ATOM 330 CA VAL A 44 -5.969 0.851 4.979 1.00 13.19 C ATOM 331 C VAL A 44 -7.350 0.642 4.381 1.00 13.00 C ATOM 332 O VAL A 44 -7.819 1.428 3.580 1.00 15.43 O ATOM 333 CB VAL A 44 -6.034 0.935 6.517 1.00 14.84 C ATOM 334 CG1 VAL A 44 -4.646 1.159 7.123 1.00 15.23 C ATOM 335 CG2 VAL A 44 -6.980 2.060 6.953 1.00 15.04 C ATOM 336 H VAL A 44 -5.932 2.906 4.275 1.00 0.00 H ATOM 337 N SER A 45 -7.968 -0.476 4.741 1.00 14.10 N ATOM 338 CA SER A 45 -9.329 -0.837 4.349 1.00 14.91 C ATOM 339 C SER A 45 -10.071 -1.237 5.619 1.00 13.87 C ATOM 340 O SER A 45 -9.461 -1.755 6.546 1.00 17.43 O ATOM 341 CB SER A 45 -9.290 -2.020 3.378 1.00 16.46 C ATOM 342 OG SER A 45 -8.478 -1.749 2.241 1.00 16.57 O ATOM 343 HG SER A 45 -7.552 -1.559 2.536 1.00 0.00 H ATOM 344 H SER A 45 -7.447 -1.143 5.345 1.00 0.00 H ATOM 345 N GLY A 46 -11.377 -1.046 5.669 1.00 14.95 N ATOM 346 CA GLY A 46 -12.063 -1.426 6.879 1.00 17.44 C ATOM 347 C GLY A 46 -13.562 -1.534 6.751 1.00 15.45 C ATOM 348 O GLY A 46 -14.138 -1.223 5.709 1.00 17.87 O ATOM 349 H GLY A 46 -11.892 -0.636 4.864 1.00 0.00 H ATOM 350 N ARG A 47 -14.165 -2.030 7.813 1.00 17.51 N ATOM 351 CA ARG A 47 -15.602 -1.937 8.010 1.00 18.68 C ATOM 352 C ARG A 47 -15.863 -1.676 9.475 1.00 20.10 C ATOM 353 O ARG A 47 -15.048 -1.980 10.333 1.00 21.10 O ATOM 354 CB ARG A 47 -16.329 -3.200 7.540 1.00 21.75 C ATOM 355 CG ARG A 47 -16.038 -4.394 8.416 1.00 23.27 C ATOM 356 CD ARG A 47 -16.801 -5.650 8.035 1.00 25.32 C ATOM 357 NE ARG A 47 -16.416 -6.725 8.938 1.00 24.92 N ATOM 358 CZ ARG A 47 -16.573 -8.031 8.689 1.00 26.70 C ATOM 359 NH1 ARG A 47 -16.177 -8.917 9.598 1.00 27.90 N ATOM 360 NH2 ARG A 47 -17.079 -8.455 7.531 1.00 32.05 N ATOM 361 HE ARG A 47 -15.986 -6.458 9.846 1.00 0.00 H ATOM 362 HH12 ARG A 47 -16.293 -9.935 9.417 1.00 0.00 H ATOM 363 HH11 ARG A 47 -15.751 -8.592 10.490 1.00 0.00 H ATOM 364 HH22 ARG A 47 -17.194 -9.474 7.355 1.00 0.00 H ATOM 365 HH21 ARG A 47 -17.359 -7.767 6.803 1.00 0.00 H ATOM 366 H ARG A 47 -13.591 -2.506 8.538 1.00 0.00 H ATOM 367 N GLY A 48 -17.023 -1.083 9.765 1.00 22.35 N ATOM 368 CA GLY A 48 -17.443 -0.860 11.142 1.00 25.10 C ATOM 369 C GLY A 48 -18.548 -1.851 11.500 1.00 27.89 C ATOM 370 O GLY A 48 -18.462 -3.042 11.160 1.00 34.85 O ATOM 371 H GLY A 48 -17.642 -0.773 8.989 1.00 0.00 H ATOM 372 N SER A 49 -19.579 -1.352 12.181 1.00 35.09 N ATOM 373 CA SER A 49 -20.766 -2.137 12.550 1.00 38.51 C ATOM 374 C SER A 49 -21.833 -2.148 11.437 1.00 37.70 C ATOM 375 O SER A 49 -22.950 -2.637 11.649 1.00 57.69 O ATOM 376 CB SER A 49 -21.388 -1.558 13.829 1.00 45.27 C ATOM 377 OG SER A 49 -20.443 -1.485 14.881 1.00 50.20 O ATOM 378 HG SER A 49 -20.877 -1.108 15.687 1.00 0.00 H ATOM 379 H SER A 49 -19.542 -0.353 12.467 1.00 0.00 H TER 380 SER A 49 ATOM 381 N VAL A 64 -19.622 -6.827 4.434 1.00 41.85 N ATOM 382 CA VAL A 64 -18.536 -7.741 4.059 1.00 40.31 C ATOM 383 C VAL A 64 -17.383 -7.056 3.325 1.00 43.75 C ATOM 384 O VAL A 64 -16.220 -7.274 3.678 1.00 49.67 O ATOM 385 CB VAL A 64 -19.050 -8.911 3.185 1.00 44.15 C ATOM 386 CG1 VAL A 64 -17.896 -9.791 2.711 1.00 43.81 C ATOM 387 CG2 VAL A 64 -20.064 -9.742 3.960 1.00 45.69 C ATOM 388 HN3 VAL A 64 -20.016 -6.389 3.577 1.00 0.00 H ATOM 389 HN2 VAL A 64 -19.249 -6.087 5.063 1.00 0.00 H ATOM 390 HN1 VAL A 64 -20.367 -7.360 4.927 1.00 0.00 H ATOM 391 N ASP A 65 -17.697 -6.265 2.295 1.00 40.07 N ATOM 392 CA ASP A 65 -16.650 -5.611 1.477 1.00 40.66 C ATOM 393 C ASP A 65 -16.015 -4.476 2.225 1.00 38.88 C ATOM 394 O ASP A 65 -16.683 -3.708 2.912 1.00 54.64 O ATOM 395 CB ASP A 65 -17.218 -5.086 0.158 1.00 42.41 C ATOM 396 CG ASP A 65 -17.722 -6.203 -0.744 1.00 50.81 C ATOM 397 OD1 ASP A 65 -17.343 -7.374 -0.513 1.00 57.02 O ATOM 398 OD2 ASP A 65 -18.496 -5.912 -1.685 1.00 64.65 O ATOM 399 H ASP A 65 -18.698 -6.105 2.063 1.00 0.00 H ATOM 400 N LEU A 66 -14.711 -4.344 2.094 1.00 22.61 N ATOM 401 CA LEU A 66 -14.074 -3.307 2.858 1.00 19.10 C ATOM 402 C LEU A 66 -13.948 -2.024 2.053 1.00 17.67 C ATOM 403 O LEU A 66 -13.824 -2.043 0.831 1.00 18.78 O ATOM 404 CB LEU A 66 -12.724 -3.802 3.332 1.00 18.85 C ATOM 405 CG LEU A 66 -12.755 -5.099 4.142 1.00 19.35 C ATOM 406 CD1 LEU A 66 -11.355 -5.340 4.663 1.00 21.25 C ATOM 407 CD2 LEU A 66 -13.742 -5.072 5.292 1.00 21.97 C ATOM 408 H LEU A 66 -14.165 -4.965 1.463 1.00 0.00 H ATOM 409 N HIS A 67 -14.024 -0.917 2.779 1.00 17.19 N ATOM 410 CA HIS A 67 -13.936 0.408 2.199 1.00 15.91 C ATOM 411 C HIS A 67 -12.546 0.997 2.446 1.00 15.50 C ATOM 412 O HIS A 67 -11.927 0.747 3.476 1.00 16.56 O ATOM 413 CB HIS A 67 -15.005 1.346 2.819 1.00 19.33 C ATOM 414 CG HIS A 67 -16.420 1.041 2.419 1.00 30.26 C ATOM 415 ND1 HIS A 67 -17.499 1.719 2.939 1.00 41.20 N ATOM 416 CD2 HIS A 67 -16.924 0.140 1.552 1.00 36.80 C ATOM 417 CE1 HIS A 67 -18.612 1.248 2.405 1.00 55.53 C ATOM 418 NE2 HIS A 67 -18.293 0.283 1.562 1.00 55.13 N ATOM 419 H HIS A 67 -14.152 -1.003 3.807 1.00 0.00 H ATOM 420 N GLN A 68 -12.120 1.824 1.508 1.00 15.59 N ATOM 421 CA GLN A 68 -10.851 2.573 1.623 1.00 14.97 C ATOM 422 C GLN A 68 -10.913 3.530 2.809 1.00 15.13 C ATOM 423 O GLN A 68 -11.854 4.318 2.922 1.00 18.32 O ATOM 424 CB GLN A 68 -10.625 3.337 0.319 1.00 18.73 C ATOM 425 CG GLN A 68 -9.344 4.146 0.201 1.00 21.63 C ATOM 426 CD GLN A 68 -9.378 5.183 -0.930 1.00 24.60 C ATOM 427 OE1 GLN A 68 -10.423 5.774 -1.247 1.00 27.12 O ATOM 428 NE2 GLN A 68 -8.233 5.427 -1.520 1.00 31.16 N ATOM 429 HE22 GLN A 68 -7.378 4.912 -1.228 1.00 0.00 H ATOM 430 HE21 GLN A 68 -8.180 6.135 -2.280 1.00 0.00 H ATOM 431 H GLN A 68 -12.701 1.953 0.655 1.00 0.00 H ATOM 432 N LYS A 69 -9.904 3.495 3.671 1.00 15.15 N ATOM 433 CA LYS A 69 -9.774 4.435 4.781 1.00 15.91 C ATOM 434 C LYS A 69 -8.307 4.891 4.888 1.00 14.03 C ATOM 435 O LYS A 69 -7.421 4.368 4.187 1.00 15.18 O ATOM 436 CB LYS A 69 -10.265 3.851 6.110 1.00 16.33 C ATOM 437 CG LYS A 69 -11.720 3.353 6.114 1.00 16.53 C ATOM 438 CD LYS A 69 -12.715 4.503 6.084 1.00 17.47 C ATOM 439 CE LYS A 69 -14.122 3.949 5.867 1.00 19.42 C ATOM 440 NZ LYS A 69 -15.148 5.027 5.810 1.00 21.14 N ATOM 441 HZ1 LYS A 69 -15.143 5.556 6.705 1.00 0.00 H ATOM 442 HZ2 LYS A 69 -14.929 5.671 5.024 1.00 0.00 H ATOM 443 HZ3 LYS A 69 -16.086 4.603 5.662 1.00 0.00 H ATOM 444 H LYS A 69 -9.173 2.765 3.550 1.00 0.00 H ATOM 445 N VAL A 70 -8.055 5.851 5.769 1.00 15.15 N ATOM 446 CA VAL A 70 -6.701 6.307 6.079 1.00 15.20 C ATOM 447 C VAL A 70 -6.461 6.155 7.578 1.00 15.03 C ATOM 448 O VAL A 70 -7.326 6.503 8.368 1.00 16.80 O ATOM 449 CB VAL A 70 -6.494 7.777 5.656 1.00 16.97 C ATOM 450 CG1 VAL A 70 -5.190 8.311 6.220 1.00 16.52 C ATOM 451 CG2 VAL A 70 -6.471 7.872 4.149 1.00 22.19 C ATOM 452 H VAL A 70 -8.855 6.298 6.260 1.00 0.00 H ATOM 453 N LYS A 71 -5.294 5.627 7.966 1.00 14.15 N ATOM 454 CA LYS A 71 -4.878 5.597 9.358 1.00 14.45 C ATOM 455 C LYS A 71 -3.854 6.727 9.548 1.00 14.91 C ATOM 456 O LYS A 71 -2.882 6.811 8.785 1.00 18.50 O ATOM 457 CB LYS A 71 -4.241 4.247 9.722 1.00 17.85 C ATOM 458 CG LYS A 71 -3.741 4.164 11.151 1.00 20.07 C ATOM 459 CD LYS A 71 -2.865 2.954 11.422 1.00 28.46 C ATOM 460 CE LYS A 71 -3.682 1.718 11.579 1.00 29.49 C ATOM 461 NZ LYS A 71 -2.741 0.637 11.949 1.00 32.37 N ATOM 462 HZ1 LYS A 71 -2.033 0.522 11.196 1.00 0.00 H ATOM 463 HZ2 LYS A 71 -2.264 0.884 12.840 1.00 0.00 H ATOM 464 HZ3 LYS A 71 -3.267 -0.252 12.071 1.00 0.00 H ATOM 465 H LYS A 71 -4.662 5.224 7.245 1.00 0.00 H ATOM 466 N VAL A 72 -4.075 7.571 10.552 1.00 16.93 N ATOM 467 CA VAL A 72 -3.156 8.633 10.935 1.00 16.55 C ATOM 468 C VAL A 72 -2.640 8.289 12.312 1.00 18.35 C ATOM 469 O VAL A 72 -3.413 7.975 13.212 1.00 20.48 O ATOM 470 CB VAL A 72 -3.876 9.994 10.962 1.00 20.94 C ATOM 471 CG1 VAL A 72 -2.978 11.093 11.493 1.00 24.73 C ATOM 472 CG2 VAL A 72 -4.390 10.332 9.576 1.00 22.98 C ATOM 473 H VAL A 72 -4.956 7.466 11.095 1.00 0.00 H ATOM 474 N GLU A 73 -1.320 8.326 12.477 1.00 17.98 N ATOM 475 CA GLU A 73 -0.712 8.087 13.768 1.00 17.85 C ATOM 476 C GLU A 73 0.153 9.271 14.151 1.00 16.38 C ATOM 477 O GLU A 73 0.998 9.716 13.359 1.00 19.16 O ATOM 478 CB GLU A 73 0.143 6.832 13.745 1.00 18.34 C ATOM 479 CG GLU A 73 -0.686 5.567 13.717 1.00 20.85 C ATOM 480 CD GLU A 73 0.127 4.314 13.493 1.00 27.76 C ATOM 481 OE1 GLU A 73 0.898 4.263 12.500 1.00 31.47 O ATOM 482 OE2 GLU A 73 -0.027 3.357 14.295 1.00 36.88 O ATOM 483 H GLU A 73 -0.711 8.531 11.659 1.00 0.00 H ATOM 484 N CYS A 74 -0.055 9.726 15.381 1.00 18.29 N ATOM 485 CA CYS A 74 0.650 10.865 15.964 1.00 18.55 C ATOM 486 C CYS A 74 1.101 10.491 17.351 1.00 18.01 C ATOM 487 O CYS A 74 0.271 10.253 18.236 1.00 21.04 O ATOM 488 CB CYS A 74 -0.287 12.072 16.097 1.00 18.04 C ATOM 489 SG CYS A 74 -0.957 12.689 14.552 1.00 19.32 S ATOM 490 H CYS A 74 -0.765 9.241 15.966 1.00 0.00 H ATOM 491 N VAL A 75 2.414 10.439 17.566 1.00 19.78 N ATOM 492 CA VAL A 75 2.930 10.211 18.899 1.00 19.99 C ATOM 493 C VAL A 75 3.153 11.596 19.509 1.00 20.78 C ATOM 494 O VAL A 75 3.764 12.475 18.882 1.00 23.02 O ATOM 495 CB VAL A 75 4.210 9.339 18.892 1.00 19.95 C ATOM 496 CG1 VAL A 75 4.751 9.176 20.303 1.00 22.69 C ATOM 497 CG2 VAL A 75 3.893 7.982 18.281 1.00 20.60 C ATOM 498 H VAL A 75 3.073 10.563 16.771 1.00 0.00 H ATOM 499 N VAL A 76 2.636 11.784 20.720 1.00 21.26 N ATOM 500 CA VAL A 76 2.647 13.076 21.395 1.00 22.58 C ATOM 501 C VAL A 76 3.164 12.957 22.823 1.00 23.37 C ATOM 502 O VAL A 76 3.039 11.907 23.465 1.00 25.16 O ATOM 503 CB VAL A 76 1.229 13.703 21.409 1.00 24.60 C ATOM 504 CG1 VAL A 76 0.716 13.874 19.996 1.00 28.83 C ATOM 505 CG2 VAL A 76 0.243 12.872 22.226 1.00 25.09 C ATOM 506 H VAL A 76 2.205 10.973 21.207 1.00 0.00 H ATOM 507 N ALA A 77 3.740 14.047 23.316 1.00 26.74 N ATOM 508 CA ALA A 77 4.170 14.146 24.706 1.00 26.62 C ATOM 509 C ALA A 77 3.833 15.528 25.272 1.00 29.75 C ATOM 510 O ALA A 77 3.144 15.626 26.287 1.00 34.27 O ATOM 511 CB ALA A 77 5.659 13.850 24.829 1.00 29.48 C ATOM 512 H ALA A 77 3.890 14.861 22.687 1.00 0.00 H ATOM 513 N ASP A 78 4.311 16.578 24.600 1.00 32.12 N ATOM 514 CA ASP A 78 4.086 17.971 25.022 1.00 33.47 C ATOM 515 C ASP A 78 2.636 18.447 24.872 1.00 35.75 C ATOM 516 O ASP A 78 2.179 19.298 25.632 1.00 43.80 O ATOM 517 CB ASP A 78 4.986 18.921 24.221 1.00 39.21 C ATOM 518 CG ASP A 78 6.452 18.847 24.634 1.00 47.05 C ATOM 519 OD1 ASP A 78 6.752 18.322 25.730 1.00 55.30 O ATOM 520 OD2 ASP A 78 7.309 19.332 23.859 1.00 57.36 O ATOM 521 H ASP A 78 4.868 16.404 23.739 1.00 0.00 H ATOM 522 N THR A 79 1.928 17.910 23.882 1.00 33.07 N ATOM 523 CA THR A 79 0.555 18.296 23.594 1.00 32.37 C ATOM 524 C THR A 79 -0.383 17.226 24.153 1.00 29.09 C ATOM 525 O THR A 79 -0.203 16.047 23.850 1.00 30.51 O ATOM 526 CB THR A 79 0.337 18.403 22.075 1.00 33.42 C ATOM 527 OG1 THR A 79 1.306 19.293 21.513 1.00 38.29 O ATOM 528 CG2 THR A 79 -1.068 18.905 21.745 1.00 35.29 C ATOM 529 HG1 THR A 79 1.163 19.360 20.536 1.00 0.00 H ATOM 530 H THR A 79 2.375 17.183 23.288 1.00 0.00 H ATOM 531 N PRO A 80 -1.400 17.628 24.942 1.00 31.89 N ATOM 532 CA PRO A 80 -2.334 16.631 25.477 1.00 31.77 C ATOM 533 C PRO A 80 -2.949 15.760 24.379 1.00 29.58 C ATOM 534 O PRO A 80 -3.398 16.274 23.351 1.00 29.89 O ATOM 535 CB PRO A 80 -3.411 17.486 26.160 1.00 31.56 C ATOM 536 CG PRO A 80 -2.709 18.741 26.523 1.00 36.45 C ATOM 537 CD PRO A 80 -1.740 18.989 25.401 1.00 32.54 C ATOM 538 N ALA A 81 -2.948 14.449 24.593 1.00 28.87 N ATOM 539 CA ALA A 81 -3.437 13.513 23.583 1.00 27.58 C ATOM 540 C ALA A 81 -4.915 13.736 23.246 1.00 29.12 C ATOM 541 O ALA A 81 -5.309 13.602 22.096 1.00 27.65 O ATOM 542 CB ALA A 81 -3.210 12.084 24.039 1.00 28.43 C ATOM 543 H ALA A 81 -2.592 14.081 25.498 1.00 0.00 H ATOM 544 N GLU A 82 -5.719 14.096 24.245 1.00 34.60 N ATOM 545 CA GLU A 82 -7.131 14.415 24.005 1.00 36.25 C ATOM 546 C GLU A 82 -7.321 15.684 23.156 1.00 31.84 C ATOM 547 O GLU A 82 -8.263 15.760 22.373 1.00 36.85 O ATOM 548 CB GLU A 82 -7.916 14.502 25.322 1.00 43.14 C ATOM 549 CG GLU A 82 -8.561 13.174 25.711 1.00 50.55 C ATOM 550 CD GLU A 82 -9.033 13.127 27.154 1.00 57.00 C ATOM 551 OE1 GLU A 82 -10.216 12.792 27.385 1.00 68.29 O ATOM 552 OE2 GLU A 82 -8.222 13.416 28.059 1.00 76.57 O ATOM 553 H GLU A 82 -5.340 14.152 25.212 1.00 0.00 H ATOM 554 N ASP A 83 -6.415 16.655 23.280 1.00 32.17 N ATOM 555 CA ASP A 83 -6.441 17.838 22.403 1.00 36.06 C ATOM 556 C ASP A 83 -6.161 17.475 20.946 1.00 29.90 C ATOM 557 O ASP A 83 -6.807 17.976 20.035 1.00 31.14 O ATOM 558 CB ASP A 83 -5.419 18.884 22.857 1.00 38.82 C ATOM 559 CG ASP A 83 -5.776 19.521 24.185 1.00 48.80 C ATOM 560 OD1 ASP A 83 -6.882 19.258 24.710 1.00 54.23 O ATOM 561 OD2 ASP A 83 -4.940 20.293 24.702 1.00 55.04 O ATOM 562 H ASP A 83 -5.677 16.575 24.009 1.00 0.00 H ATOM 563 N VAL A 84 -5.174 16.613 20.731 1.00 27.18 N ATOM 564 CA VAL A 84 -4.859 16.141 19.385 1.00 26.06 C ATOM 565 C VAL A 84 -6.044 15.333 18.819 1.00 23.89 C ATOM 566 O VAL A 84 -6.441 15.528 17.674 1.00 24.67 O ATOM 567 CB VAL A 84 -3.569 15.284 19.390 1.00 25.66 C ATOM 568 CG1 VAL A 84 -3.314 14.662 18.024 1.00 28.91 C ATOM 569 CG2 VAL A 84 -2.380 16.130 19.830 1.00 28.36 C ATOM 570 H VAL A 84 -4.614 16.267 21.537 1.00 0.00 H ATOM 571 N ALA A 85 -6.598 14.435 19.634 1.00 23.26 N ATOM 572 CA ALA A 85 -7.759 13.632 19.236 1.00 25.10 C ATOM 573 C ALA A 85 -8.961 14.509 18.853 1.00 26.78 C ATOM 574 O ALA A 85 -9.613 14.271 17.836 1.00 25.85 O ATOM 575 CB ALA A 85 -8.132 12.656 20.347 1.00 28.82 C ATOM 576 H ALA A 85 -6.194 14.300 20.583 1.00 0.00 H ATOM 577 N ASP A 86 -9.214 15.549 19.644 1.00 30.27 N ATOM 578 CA ASP A 86 -10.314 16.475 19.361 1.00 29.85 C ATOM 579 C ASP A 86 -10.114 17.207 18.044 1.00 28.70 C ATOM 580 O ASP A 86 -11.061 17.368 17.273 1.00 33.20 O ATOM 581 CB ASP A 86 -10.469 17.497 20.490 1.00 34.21 C ATOM 582 CG ASP A 86 -11.054 16.890 21.762 1.00 46.61 C ATOM 583 OD1 ASP A 86 -11.498 15.717 21.731 1.00 55.50 O ATOM 584 OD2 ASP A 86 -11.068 17.597 22.798 1.00 60.42 O ATOM 585 H ASP A 86 -8.618 15.708 20.481 1.00 0.00 H ATOM 586 N ALA A 87 -8.879 17.651 17.796 1.00 26.40 N ATOM 587 CA ALA A 87 -8.524 18.311 16.536 1.00 27.60 C ATOM 588 C ALA A 87 -8.750 17.409 15.326 1.00 23.17 C ATOM 589 O ALA A 87 -9.296 17.837 14.303 1.00 25.23 O ATOM 590 CB ALA A 87 -7.074 18.777 16.577 1.00 27.22 C ATOM 591 H ALA A 87 -8.144 17.524 18.521 1.00 0.00 H ATOM 592 N ILE A 88 -8.323 16.151 15.436 1.00 23.24 N ATOM 593 CA ILE A 88 -8.548 15.209 14.346 1.00 23.16 C ATOM 594 C ILE A 88 -10.043 14.958 14.157 1.00 22.27 C ATOM 595 O ILE A 88 -10.543 15.009 13.038 1.00 23.17 O ATOM 596 CB ILE A 88 -7.822 13.868 14.584 1.00 21.60 C ATOM 597 CG1 ILE A 88 -6.305 14.098 14.627 1.00 21.98 C ATOM 598 CG2 ILE A 88 -8.184 12.883 13.485 1.00 24.16 C ATOM 599 CD1 ILE A 88 -5.514 12.889 15.110 1.00 24.48 C ATOM 600 H ILE A 88 -7.830 15.842 16.298 1.00 0.00 H ATOM 601 N ALA A 89 -10.748 14.691 15.249 1.00 22.96 N ATOM 602 CA ALA A 89 -12.178 14.358 15.162 1.00 25.41 C ATOM 603 C ALA A 89 -12.970 15.488 14.493 1.00 26.89 C ATOM 604 O ALA A 89 -13.783 15.249 13.600 1.00 27.63 O ATOM 605 CB ALA A 89 -12.734 14.061 16.537 1.00 28.46 C ATOM 606 H ALA A 89 -10.283 14.718 16.179 1.00 0.00 H ATOM 607 N ASP A 90 -12.702 16.724 14.901 1.00 25.42 N ATOM 608 CA ASP A 90 -13.440 17.863 14.361 1.00 27.25 C ATOM 609 C ASP A 90 -13.176 17.994 12.854 1.00 23.55 C ATOM 610 O ASP A 90 -14.092 18.267 12.082 1.00 30.10 O ATOM 611 CB ASP A 90 -13.034 19.144 15.084 1.00 31.07 C ATOM 612 CG ASP A 90 -13.508 19.198 16.542 1.00 37.21 C ATOM 613 OD1 ASP A 90 -14.251 18.295 17.001 1.00 49.41 O ATOM 614 OD2 ASP A 90 -13.127 20.168 17.235 1.00 54.13 O ATOM 615 H ASP A 90 -11.959 16.882 15.612 1.00 0.00 H ATOM 616 N ALA A 91 -11.918 17.782 12.442 1.00 21.59 N ATOM 617 CA ALA A 91 -11.555 17.906 11.032 1.00 23.42 C ATOM 618 C ALA A 91 -12.045 16.726 10.179 1.00 21.65 C ATOM 619 O ALA A 91 -12.327 16.874 8.998 1.00 24.29 O ATOM 620 CB ALA A 91 -10.045 18.065 10.885 1.00 22.28 C ATOM 621 H ALA A 91 -11.189 17.525 13.137 1.00 0.00 H ATOM 622 N ALA A 92 -12.120 15.551 10.785 1.00 20.87 N ATOM 623 CA ALA A 92 -12.539 14.339 10.078 1.00 20.08 C ATOM 624 C ALA A 92 -14.061 14.127 10.027 1.00 19.94 C ATOM 625 O ALA A 92 -14.558 13.293 9.278 1.00 21.71 O ATOM 626 CB ALA A 92 -11.893 13.134 10.718 1.00 20.28 C ATOM 627 H ALA A 92 -11.874 15.487 11.793 1.00 0.00 H ATOM 628 N HIS A 93 -14.795 14.921 10.793 1.00 22.03 N ATOM 629 CA HIS A 93 -16.230 14.745 10.933 1.00 22.14 C ATOM 630 C HIS A 93 -17.011 15.074 9.649 1.00 22.76 C ATOM 631 O HIS A 93 -16.719 16.063 8.971 1.00 27.13 O ATOM 632 CB HIS A 93 -16.722 15.621 12.080 1.00 21.47 C ATOM 633 CG HIS A 93 -18.196 15.553 12.298 1.00 22.65 C ATOM 634 ND1 HIS A 93 -19.079 16.407 11.676 1.00 27.60 N ATOM 635 CD2 HIS A 93 -18.942 14.720 13.056 1.00 24.08 C ATOM 636 CE1 HIS A 93 -20.312 16.102 12.043 1.00 27.89 C ATOM 637 NE2 HIS A 93 -20.257 15.091 12.893 1.00 27.49 N ATOM 638 H HIS A 93 -14.329 15.694 11.310 1.00 0.00 H ATOM 639 N THR A 94 -18.000 14.237 9.327 1.00 23.80 N ATOM 640 CA THR A 94 -19.016 14.563 8.320 1.00 25.99 C ATOM 641 C THR A 94 -20.437 14.376 8.857 1.00 26.35 C ATOM 642 O THR A 94 -21.357 15.001 8.349 1.00 31.43 O ATOM 643 CB THR A 94 -18.911 13.726 7.023 1.00 26.45 C ATOM 644 OG1 THR A 94 -19.403 12.389 7.245 1.00 27.79 O ATOM 645 CG2 THR A 94 -17.491 13.688 6.478 1.00 26.54 C ATOM 646 HG1 THR A 94 -18.866 11.954 7.954 1.00 0.00 H ATOM 647 H THR A 94 -18.052 13.317 9.809 1.00 0.00 H ATOM 648 N GLY A 95 -20.611 13.517 9.862 1.00 27.05 N ATOM 649 CA GLY A 95 -21.927 13.184 10.397 1.00 26.82 C ATOM 650 C GLY A 95 -22.586 11.939 9.813 1.00 26.74 C ATOM 651 O GLY A 95 -23.664 11.548 10.260 1.00 33.47 O ATOM 652 H GLY A 95 -19.774 13.065 10.282 1.00 0.00 H ATOM 653 N GLU A 96 -21.941 11.320 8.822 1.00 29.95 N ATOM 654 CA GLU A 96 -22.403 10.078 8.211 1.00 29.96 C ATOM 655 C GLU A 96 -21.628 8.884 8.768 1.00 25.43 C ATOM 656 O GLU A 96 -20.448 8.996 9.132 1.00 27.07 O ATOM 657 CB GLU A 96 -22.219 10.124 6.688 1.00 34.61 C ATOM 658 CG GLU A 96 -22.909 11.292 5.983 1.00 36.14 C ATOM 659 CD GLU A 96 -24.427 11.195 5.989 1.00 46.49 C ATOM 660 OE1 GLU A 96 -25.090 12.241 5.820 1.00 57.49 O ATOM 661 OE2 GLU A 96 -24.970 10.082 6.158 1.00 57.39 O ATOM 662 H GLU A 96 -21.062 11.746 8.466 1.00 0.00 H ATOM 663 N LYS A 97 -22.288 7.736 8.818 1.00 27.11 N ATOM 664 CA LYS A 97 -21.628 6.490 9.180 1.00 24.51 C ATOM 665 C LYS A 97 -20.416 6.272 8.274 1.00 23.63 C ATOM 666 O LYS A 97 -20.466 6.556 7.074 1.00 25.21 O ATOM 667 CB LYS A 97 -22.610 5.317 9.110 1.00 29.21 C ATOM 668 CG LYS A 97 -23.739 5.460 10.128 1.00 35.37 C ATOM 669 CD LYS A 97 -24.697 4.279 10.116 1.00 43.11 C ATOM 670 CE LYS A 97 -25.768 4.431 11.187 1.00 53.35 C ATOM 671 NZ LYS A 97 -25.219 4.263 12.562 1.00 60.27 N ATOM 672 HZ1 LYS A 97 -24.802 3.315 12.654 1.00 0.00 H ATOM 673 HZ2 LYS A 97 -24.487 4.982 12.732 1.00 0.00 H ATOM 674 HZ3 LYS A 97 -25.985 4.375 13.256 1.00 0.00 H ATOM 675 H LYS A 97 -23.303 7.725 8.593 1.00 0.00 H ATOM 676 N GLY A 98 -19.322 5.801 8.871 1.00 23.99 N ATOM 677 CA GLY A 98 -18.038 5.668 8.178 1.00 21.06 C ATOM 678 C GLY A 98 -16.997 6.721 8.548 1.00 18.61 C ATOM 679 O GLY A 98 -15.866 6.658 8.078 1.00 22.06 O ATOM 680 H GLY A 98 -19.382 5.516 9.869 1.00 0.00 H ATOM 681 N ASP A 99 -17.367 7.667 9.408 1.00 21.55 N ATOM 682 CA ASP A 99 -16.443 8.728 9.824 1.00 20.73 C ATOM 683 C ASP A 99 -15.210 8.226 10.570 1.00 20.69 C ATOM 684 O ASP A 99 -14.189 8.878 10.546 1.00 20.78 O ATOM 685 CB ASP A 99 -17.139 9.747 10.715 1.00 21.88 C ATOM 686 CG ASP A 99 -17.877 10.819 9.930 1.00 22.80 C ATOM 687 OD1 ASP A 99 -17.893 10.811 8.673 1.00 23.36 O ATOM 688 OD2 ASP A 99 -18.430 11.699 10.611 1.00 23.63 O ATOM 689 H ASP A 99 -18.333 7.654 9.794 1.00 0.00 H ATOM 690 N GLY A 100 -15.313 7.103 11.269 1.00 20.56 N ATOM 691 CA GLY A 100 -14.139 6.478 11.878 1.00 20.34 C ATOM 692 C GLY A 100 -14.018 6.716 13.358 1.00 17.80 C ATOM 693 O GLY A 100 -14.966 7.172 14.020 1.00 20.00 O ATOM 694 H GLY A 100 -16.246 6.659 11.386 1.00 0.00 H ATOM 695 N LYS A 101 -12.854 6.399 13.888 1.00 17.37 N ATOM 696 CA LYS A 101 -12.624 6.372 15.302 1.00 19.89 C ATOM 697 C LYS A 101 -11.189 6.766 15.566 1.00 17.13 C ATOM 698 O LYS A 101 -10.322 6.592 14.711 1.00 20.82 O ATOM 699 CB LYS A 101 -12.887 4.972 15.872 1.00 22.87 C ATOM 700 CG LYS A 101 -14.367 4.569 15.828 1.00 26.22 C ATOM 701 CD LYS A 101 -14.720 3.480 16.828 1.00 30.31 C ATOM 702 CE LYS A 101 -16.188 3.079 16.705 1.00 32.98 C ATOM 703 NZ LYS A 101 -16.431 2.231 15.516 1.00 31.85 N ATOM 704 HZ1 LYS A 101 -16.163 2.754 14.658 1.00 0.00 H ATOM 705 HZ2 LYS A 101 -15.861 1.364 15.588 1.00 0.00 H ATOM 706 HZ3 LYS A 101 -17.440 1.981 15.470 1.00 0.00 H ATOM 707 H LYS A 101 -12.067 6.158 13.252 1.00 0.00 H ATOM 708 N ILE A 102 -10.969 7.286 16.763 1.00 19.20 N ATOM 709 CA ILE A 102 -9.663 7.626 17.256 1.00 19.61 C ATOM 710 C ILE A 102 -9.401 6.845 18.531 1.00 19.51 C ATOM 711 O ILE A 102 -10.246 6.774 19.411 1.00 21.67 O ATOM 712 CB ILE A 102 -9.557 9.137 17.541 1.00 20.56 C ATOM 713 CG1 ILE A 102 -10.014 9.925 16.309 1.00 24.51 C ATOM 714 CG2 ILE A 102 -8.113 9.486 17.912 1.00 22.69 C ATOM 715 CD1 ILE A 102 -10.242 11.390 16.579 1.00 28.69 C ATOM 716 H ILE A 102 -11.787 7.458 17.381 1.00 0.00 H ATOM 717 N PHE A 103 -8.203 6.260 18.609 1.00 18.97 N ATOM 718 CA PHE A 103 -7.775 5.490 19.751 1.00 18.45 C ATOM 719 C PHE A 103 -6.495 6.079 20.326 1.00 19.00 C ATOM 720 O PHE A 103 -5.644 6.550 19.582 1.00 23.85 O ATOM 721 CB PHE A 103 -7.526 4.036 19.327 1.00 19.67 C ATOM 722 CG PHE A 103 -8.687 3.418 18.601 1.00 20.26 C ATOM 723 CD1 PHE A 103 -9.842 3.123 19.292 1.00 20.59 C ATOM 724 CD2 PHE A 103 -8.636 3.171 17.242 1.00 22.64 C ATOM 725 CE1 PHE A 103 -10.919 2.555 18.645 1.00 21.84 C ATOM 726 CE2 PHE A 103 -9.724 2.614 16.579 1.00 22.79 C ATOM 727 CZ PHE A 103 -10.862 2.300 17.289 1.00 23.10 C ATOM 728 H PHE A 103 -7.548 6.365 17.808 1.00 0.00 H ATOM 729 N ILE A 104 -6.367 6.043 21.641 1.00 19.54 N ATOM 730 CA ILE A 104 -5.152 6.513 22.315 1.00 22.84 C ATOM 731 C ILE A 104 -4.502 5.328 23.030 1.00 23.04 C ATOM 732 O ILE A 104 -5.157 4.638 23.810 1.00 24.28 O ATOM 733 CB ILE A 104 -5.457 7.669 23.295 1.00 23.98 C ATOM 734 CG1 ILE A 104 -6.063 8.867 22.532 1.00 26.03 C ATOM 735 CG2 ILE A 104 -4.196 8.131 24.006 1.00 24.80 C ATOM 736 CD1 ILE A 104 -6.653 9.939 23.424 1.00 28.24 C ATOM 737 H ILE A 104 -7.151 5.671 22.215 1.00 0.00 H ATOM 738 N LEU A 105 -3.222 5.092 22.733 1.00 23.10 N ATOM 739 CA LEU A 105 -2.454 3.986 23.299 1.00 23.14 C ATOM 740 C LEU A 105 -1.250 4.511 24.064 1.00 23.18 C ATOM 741 O LEU A 105 -0.655 5.520 23.671 1.00 24.34 O ATOM 742 CB LEU A 105 -1.952 3.067 22.186 1.00 23.21 C ATOM 743 CG LEU A 105 -3.029 2.233 21.480 1.00 24.53 C ATOM 744 CD1 LEU A 105 -3.681 3.007 20.347 1.00 26.31 C ATOM 745 CD2 LEU A 105 -2.471 0.919 20.962 1.00 28.42 C ATOM 746 H LEU A 105 -2.746 5.730 22.063 1.00 0.00 H ATOM 747 N PRO A 106 -0.861 3.816 25.137 1.00 25.40 N ATOM 748 CA PRO A 106 0.355 4.195 25.848 1.00 25.55 C ATOM 749 C PRO A 106 1.647 3.860 25.087 1.00 25.68 C ATOM 750 O PRO A 106 1.746 2.837 24.395 1.00 27.11 O ATOM 751 CB PRO A 106 0.263 3.393 27.145 1.00 28.65 C ATOM 752 CG PRO A 106 -0.507 2.178 26.774 1.00 28.55 C ATOM 753 CD PRO A 106 -1.467 2.596 25.696 1.00 28.76 C ATOM 754 N VAL A 107 2.621 4.753 25.205 1.00 25.70 N ATOM 755 CA VAL A 107 3.958 4.547 24.651 1.00 23.66 C ATOM 756 C VAL A 107 4.916 4.657 25.821 1.00 24.92 C ATOM 757 O VAL A 107 4.814 5.589 26.604 1.00 28.75 O ATOM 758 CB VAL A 107 4.290 5.608 23.586 1.00 23.49 C ATOM 759 CG1 VAL A 107 5.742 5.526 23.150 1.00 23.71 C ATOM 760 CG2 VAL A 107 3.374 5.466 22.382 1.00 24.03 C ATOM 761 H VAL A 107 2.425 5.638 25.714 1.00 0.00 H ATOM 762 N GLU A 108 5.843 3.709 25.945 1.00 24.63 N ATOM 763 CA GLU A 108 6.750 3.689 27.092 1.00 26.95 C ATOM 764 C GLU A 108 8.071 4.410 26.848 1.00 27.64 C ATOM 765 O GLU A 108 8.701 4.877 27.789 1.00 31.67 O ATOM 766 CB GLU A 108 7.006 2.247 27.529 1.00 30.28 C ATOM 767 CG GLU A 108 5.780 1.625 28.185 1.00 35.84 C ATOM 768 CD GLU A 108 5.979 0.178 28.598 1.00 45.37 C ATOM 769 OE1 GLU A 108 7.023 -0.415 28.245 1.00 46.90 O ATOM 770 OE2 GLU A 108 5.079 -0.374 29.280 1.00 53.07 O ATOM 771 H GLU A 108 5.923 2.972 25.215 1.00 0.00 H ATOM 772 N ASN A 109 8.493 4.491 25.595 1.00 25.57 N ATOM 773 CA ASN A 109 9.729 5.177 25.260 1.00 26.19 C ATOM 774 C ASN A 109 9.750 5.600 23.805 1.00 26.05 C ATOM 775 O ASN A 109 8.994 5.079 22.973 1.00 23.73 O ATOM 776 CB ASN A 109 10.951 4.297 25.571 1.00 30.64 C ATOM 777 CG ASN A 109 12.226 5.106 25.820 1.00 40.31 C ATOM 778 OD1 ASN A 109 12.215 6.347 25.896 1.00 40.70 O ATOM 779 ND2 ASN A 109 13.339 4.396 25.949 1.00 50.13 N ATOM 780 HD22 ASN A 109 13.305 3.359 25.879 1.00 0.00 H ATOM 781 HD21 ASN A 109 14.245 4.876 26.120 1.00 0.00 H ATOM 782 H ASN A 109 7.929 4.056 24.837 1.00 0.00 H ATOM 783 N ALA A 110 10.631 6.556 23.518 1.00 26.41 N ATOM 784 CA ALA A 110 10.856 7.049 22.176 1.00 25.29 C ATOM 785 C ALA A 110 12.339 7.328 21.977 1.00 23.74 C ATOM 786 O ALA A 110 13.029 7.783 22.905 1.00 27.27 O ATOM 787 CB ALA A 110 10.051 8.314 21.922 1.00 28.67 C ATOM 788 H ALA A 110 11.184 6.969 24.296 1.00 0.00 H ATOM 789 N ILE A 111 12.811 7.092 20.760 1.00 23.96 N ATOM 790 CA ILE A 111 14.173 7.415 20.366 1.00 24.37 C ATOM 791 C ILE A 111 14.169 8.167 19.042 1.00 23.15 C ATOM 792 O ILE A 111 13.540 7.753 18.080 1.00 25.65 O ATOM 793 CB ILE A 111 15.031 6.138 20.207 1.00 29.08 C ATOM 794 CG1 ILE A 111 15.005 5.319 21.499 1.00 36.03 C ATOM 795 CG2 ILE A 111 16.456 6.507 19.800 1.00 31.16 C ATOM 796 CD1 ILE A 111 15.776 4.017 21.424 1.00 43.77 C ATOM 797 H ILE A 111 12.180 6.657 20.057 1.00 0.00 H ATOM 798 N GLN A 112 14.890 9.283 18.997 1.00 23.49 N ATOM 799 CA GLN A 112 15.145 9.958 17.731 1.00 24.86 C ATOM 800 C GLN A 112 16.294 9.259 17.028 1.00 24.57 C ATOM 801 O GLN A 112 17.386 9.158 17.590 1.00 31.12 O ATOM 802 CB GLN A 112 15.539 11.413 17.953 1.00 30.67 C ATOM 803 CG GLN A 112 14.391 12.382 18.037 1.00 36.69 C ATOM 804 CD GLN A 112 14.828 13.792 18.369 1.00 36.51 C ATOM 805 OE1 GLN A 112 14.012 14.613 18.789 1.00 52.44 O ATOM 806 NE2 GLN A 112 16.109 14.084 18.186 1.00 33.70 N ATOM 807 HE22 GLN A 112 16.762 13.358 17.829 1.00 0.00 H ATOM 808 HE21 GLN A 112 16.460 15.039 18.400 1.00 0.00 H ATOM 809 H GLN A 112 15.277 9.680 19.877 1.00 0.00 H ATOM 810 N VAL A 113 16.084 8.822 15.797 1.00 22.43 N ATOM 811 CA VAL A 113 17.129 8.122 15.050 1.00 23.38 C ATOM 812 C VAL A 113 18.329 9.052 14.759 1.00 24.29 C ATOM 813 O VAL A 113 19.472 8.646 14.880 1.00 26.04 O ATOM 814 CB VAL A 113 16.581 7.547 13.725 1.00 20.44 C ATOM 815 CG1 VAL A 113 17.710 6.978 12.867 1.00 23.30 C ATOM 816 CG2 VAL A 113 15.514 6.474 13.990 1.00 19.78 C ATOM 817 H VAL A 113 15.158 8.979 15.352 1.00 0.00 H ATOM 818 N ARG A 114 18.059 10.295 14.374 1.00 22.93 N ATOM 819 CA ARG A 114 19.134 11.218 13.939 1.00 24.32 C ATOM 820 C ARG A 114 20.142 11.510 15.036 1.00 26.37 C ATOM 821 O ARG A 114 21.326 11.592 14.740 1.00 28.65 O ATOM 822 CB ARG A 114 18.532 12.514 13.414 1.00 26.56 C ATOM 823 CG ARG A 114 19.519 13.451 12.719 1.00 30.18 C ATOM 824 CD ARG A 114 18.786 14.595 12.043 1.00 34.54 C ATOM 825 NE ARG A 114 18.407 15.631 13.001 1.00 39.47 N ATOM 826 CZ ARG A 114 19.091 16.763 13.205 1.00 41.55 C ATOM 827 NH1 ARG A 114 20.189 17.037 12.503 1.00 44.72 N ATOM 828 NH2 ARG A 114 18.666 17.629 14.109 1.00 45.21 N ATOM 829 HE ARG A 114 17.546 15.478 13.564 1.00 0.00 H ATOM 830 HH12 ARG A 114 20.709 17.921 12.674 1.00 0.00 H ATOM 831 HH11 ARG A 114 20.527 16.367 11.783 1.00 0.00 H ATOM 832 HH22 ARG A 114 19.193 18.511 14.273 1.00 0.00 H ATOM 833 HH21 ARG A 114 17.805 17.429 14.657 1.00 0.00 H ATOM 834 H ARG A 114 17.073 10.627 14.378 1.00 0.00 H ATOM 835 N THR A 115 19.681 11.629 16.277 1.00 24.83 N ATOM 836 CA THR A 115 20.521 12.040 17.410 1.00 26.15 C ATOM 837 C THR A 115 20.749 10.941 18.441 1.00 27.29 C ATOM 838 O THR A 115 21.701 11.019 19.228 1.00 37.23 O ATOM 839 CB THR A 115 19.848 13.193 18.159 1.00 27.25 C ATOM 840 OG1 THR A 115 18.541 12.747 18.579 1.00 29.89 O ATOM 841 CG2 THR A 115 19.679 14.365 17.241 1.00 29.29 C ATOM 842 HG1 THR A 115 18.085 13.478 19.067 1.00 0.00 H ATOM 843 H THR A 115 18.678 11.421 16.454 1.00 0.00 H ATOM 844 N GLY A 116 19.890 9.921 18.449 1.00 28.46 N ATOM 845 CA GLY A 116 19.874 8.945 19.533 1.00 29.34 C ATOM 846 C GLY A 116 19.332 9.479 20.855 1.00 29.10 C ATOM 847 O GLY A 116 19.426 8.817 21.884 1.00 32.75 O ATOM 848 H GLY A 116 19.216 9.819 17.664 1.00 0.00 H ATOM 849 N LYS A 117 18.752 10.674 20.835 1.00 29.03 N ATOM 850 CA LYS A 117 18.056 11.207 22.000 1.00 30.67 C ATOM 851 C LYS A 117 16.850 10.319 22.350 1.00 28.34 C ATOM 852 O LYS A 117 16.123 9.892 21.467 1.00 29.78 O ATOM 853 CB LYS A 117 17.557 12.617 21.715 1.00 32.30 C ATOM 854 CG LYS A 117 16.912 13.276 22.918 1.00 38.07 C ATOM 855 CD LYS A 117 16.905 14.785 22.797 1.00 41.79 C ATOM 856 CE LYS A 117 16.222 15.428 23.993 1.00 45.50 C ATOM 857 NZ LYS A 117 16.834 15.051 25.304 1.00 49.01 N ATOM 858 HZ1 LYS A 117 16.776 14.020 25.429 1.00 0.00 H ATOM 859 HZ2 LYS A 117 17.831 15.347 25.318 1.00 0.00 H ATOM 860 HZ3 LYS A 117 16.320 15.524 26.074 1.00 0.00 H ATOM 861 H LYS A 117 18.796 11.244 19.966 1.00 0.00 H ATOM 862 N THR A 118 16.651 10.079 23.646 1.00 30.22 N ATOM 863 CA THR A 118 15.574 9.214 24.122 1.00 31.58 C ATOM 864 C THR A 118 14.669 9.922 25.130 1.00 34.24 C ATOM 865 O THR A 118 15.035 10.952 25.710 1.00 41.66 O ATOM 866 CB THR A 118 16.118 7.942 24.807 1.00 38.59 C ATOM 867 OG1 THR A 118 16.670 8.280 26.084 1.00 44.44 O ATOM 868 CG2 THR A 118 17.181 7.272 23.952 1.00 38.22 C ATOM 869 HG1 THR A 118 17.408 8.929 25.962 1.00 0.00 H ATOM 870 H THR A 118 17.284 10.523 24.342 1.00 0.00 H ATOM 871 N GLY A 119 13.495 9.337 25.343 1.00 34.84 N ATOM 872 CA GLY A 119 12.532 9.832 26.327 1.00 35.41 C ATOM 873 C GLY A 119 11.505 10.782 25.738 1.00 35.01 C ATOM 874 O GLY A 119 11.381 10.909 24.518 1.00 33.34 O ATOM 875 H GLY A 119 13.251 8.493 24.787 1.00 0.00 H ATOM 876 N ARG A 120 10.785 11.474 26.618 1.00 35.78 N ATOM 877 CA ARG A 120 9.681 12.345 26.191 1.00 27.54 C ATOM 878 C ARG A 120 10.139 13.507 25.322 1.00 32.05 C ATOM 879 O ARG A 120 9.418 13.937 24.416 1.00 38.40 O ATOM 880 CB ARG A 120 8.858 12.837 27.394 1.00 37.94 C ATOM 881 CG ARG A 120 9.610 13.682 28.410 1.00 44.18 C ATOM 882 CD ARG A 120 8.687 14.201 29.505 1.00 49.57 C ATOM 883 NE ARG A 120 7.468 14.807 28.966 1.00 52.99 N ATOM 884 CZ ARG A 120 7.401 15.994 28.363 1.00 57.11 C ATOM 885 NH1 ARG A 120 6.232 16.435 27.912 1.00 55.87 N ATOM 886 NH2 ARG A 120 8.488 16.746 28.200 1.00 60.52 N ATOM 887 HE ARG A 120 6.584 14.268 29.061 1.00 0.00 H ATOM 888 HH12 ARG A 120 6.172 17.360 27.441 1.00 0.00 H ATOM 889 HH11 ARG A 120 5.377 15.855 28.030 1.00 0.00 H ATOM 890 HH22 ARG A 120 8.415 17.669 27.727 1.00 0.00 H ATOM 891 HH21 ARG A 120 9.409 16.410 28.546 1.00 0.00 H ATOM 892 H ARG A 120 11.009 11.397 27.631 1.00 0.00 H ATOM 893 N ASP A 121 11.352 13.992 25.574 1.00 38.03 N ATOM 894 CA ASP A 121 11.917 15.073 24.784 1.00 40.21 C ATOM 895 C ASP A 121 12.356 14.622 23.379 1.00 36.48 C ATOM 896 O ASP A 121 12.603 15.465 22.514 1.00 42.66 O ATOM 897 CB ASP A 121 13.084 15.718 25.543 1.00 45.87 C ATOM 898 CG ASP A 121 12.657 16.312 26.881 1.00 56.55 C ATOM 899 OD1 ASP A 121 11.512 16.804 26.992 1.00 61.63 O ATOM 900 OD2 ASP A 121 13.473 16.287 27.827 1.00 72.06 O ATOM 901 H ASP A 121 11.909 13.588 26.354 1.00 0.00 H ATOM 902 N ALA A 122 12.444 13.306 23.144 1.00 31.68 N ATOM 903 CA ALA A 122 12.661 12.789 21.791 1.00 34.32 C ATOM 904 C ALA A 122 11.386 12.904 20.941 1.00 32.95 C ATOM 905 O ALA A 122 11.451 12.778 19.718 1.00 35.72 O ATOM 906 CB ALA A 122 13.151 11.349 21.833 1.00 34.61 C ATOM 907 H ALA A 122 12.357 12.639 23.937 1.00 0.00 H ATOM 908 N VAL A 123 10.247 13.099 21.619 1.00 33.86 N ATOM 909 CA VAL A 123 8.957 13.572 21.058 1.00 40.75 C ATOM 910 C VAL A 123 7.841 12.528 21.267 1.00 38.69 C ATOM 911 O VAL A 123 6.667 12.726 20.929 1.00 43.70 O ATOM 912 CB VAL A 123 9.061 14.161 19.607 1.00 42.61 C ATOM 913 CG1 VAL A 123 8.177 13.442 18.598 1.00 43.28 C ATOM 914 CG2 VAL A 123 8.705 15.638 19.604 1.00 46.54 C ATOM 915 OXT VAL A 123 8.079 11.454 21.833 1.00 45.79 O ATOM 916 H VAL A 123 10.269 12.899 22.639 1.00 0.00 H TER 917 VAL A 123 ATOM 918 N LEU B 6 -16.536 -7.297 34.368 1.00 64.45 N ATOM 919 CA LEU B 6 -16.814 -6.884 32.957 1.00 59.46 C ATOM 920 C LEU B 6 -15.685 -7.315 32.011 1.00 55.16 C ATOM 921 O LEU B 6 -14.544 -7.480 32.443 1.00 52.43 O ATOM 922 CB LEU B 6 -17.008 -5.369 32.873 1.00 61.94 C ATOM 923 HN3 LEU B 6 -15.651 -6.856 34.689 1.00 0.00 H ATOM 924 HN2 LEU B 6 -16.445 -8.332 34.413 1.00 0.00 H ATOM 925 HN1 LEU B 6 -17.320 -6.989 34.979 1.00 0.00 H ATOM 926 N PRO B 7 -16.001 -7.501 30.716 1.00 43.87 N ATOM 927 CA PRO B 7 -14.987 -7.942 29.750 1.00 41.34 C ATOM 928 C PRO B 7 -13.799 -6.980 29.634 1.00 39.89 C ATOM 929 O PRO B 7 -13.962 -5.765 29.763 1.00 42.12 O ATOM 930 CB PRO B 7 -15.754 -8.031 28.423 1.00 40.82 C ATOM 931 CG PRO B 7 -17.042 -7.308 28.643 1.00 47.42 C ATOM 932 CD PRO B 7 -17.335 -7.380 30.105 1.00 49.43 C ATOM 933 N ASN B 8 -12.614 -7.542 29.410 1.00 40.45 N ATOM 934 CA ASN B 8 -11.371 -6.772 29.300 1.00 35.08 C ATOM 935 C ASN B 8 -11.115 -5.879 30.520 1.00 40.24 C ATOM 936 O ASN B 8 -10.563 -4.786 30.398 1.00 39.66 O ATOM 937 CB ASN B 8 -11.366 -5.945 28.011 1.00 32.63 C ATOM 938 CG ASN B 8 -11.571 -6.800 26.776 1.00 31.67 C ATOM 939 OD1 ASN B 8 -10.756 -7.671 26.470 1.00 33.68 O ATOM 940 ND2 ASN B 8 -12.656 -6.554 26.054 1.00 30.86 N ATOM 941 HD22 ASN B 8 -13.319 -5.809 26.349 1.00 0.00 H ATOM 942 HD21 ASN B 8 -12.844 -7.106 25.193 1.00 0.00 H ATOM 943 H ASN B 8 -12.567 -8.576 29.308 1.00 0.00 H ATOM 944 N ASP B 9 -11.530 -6.364 31.690 1.00 45.64 N ATOM 945 CA ASP B 9 -11.368 -5.651 32.958 1.00 48.21 C ATOM 946 C ASP B 9 -11.972 -4.232 32.916 1.00 45.23 C ATOM 947 O ASP B 9 -11.465 -3.304 33.554 1.00 49.52 O ATOM 948 CB ASP B 9 -9.878 -5.615 33.344 1.00 51.93 C ATOM 949 CG ASP B 9 -9.634 -5.901 34.827 1.00 64.30 C ATOM 950 OD1 ASP B 9 -10.595 -6.239 35.560 1.00 78.67 O ATOM 951 OD2 ASP B 9 -8.465 -5.796 35.259 1.00 78.04 O ATOM 952 H ASP B 9 -11.992 -7.296 31.703 1.00 0.00 H ATOM 953 N GLY B 10 -13.061 -4.080 32.162 1.00 41.58 N ATOM 954 CA GLY B 10 -13.740 -2.791 32.017 1.00 39.56 C ATOM 955 C GLY B 10 -13.056 -1.813 31.079 1.00 39.41 C ATOM 956 O GLY B 10 -13.471 -0.660 30.983 1.00 44.63 O ATOM 957 H GLY B 10 -13.442 -4.907 31.659 1.00 0.00 H ATOM 958 N GLY B 11 -12.023 -2.275 30.375 1.00 38.35 N ATOM 959 CA GLY B 11 -11.235 -1.431 29.496 1.00 34.77 C ATOM 960 C GLY B 11 -11.382 -1.739 28.018 1.00 30.70 C ATOM 961 O GLY B 11 -12.325 -2.397 27.585 1.00 33.76 O ATOM 962 H GLY B 11 -11.772 -3.281 30.459 1.00 0.00 H ATOM 963 N ILE B 12 -10.415 -1.255 27.252 1.00 26.81 N ATOM 964 CA ILE B 12 -10.414 -1.327 25.798 1.00 24.74 C ATOM 965 C ILE B 12 -9.089 -1.972 25.406 1.00 23.89 C ATOM 966 O ILE B 12 -8.059 -1.689 26.023 1.00 25.74 O ATOM 967 CB ILE B 12 -10.467 0.084 25.169 1.00 24.43 C ATOM 968 CG1 ILE B 12 -11.636 0.892 25.749 1.00 24.97 C ATOM 969 CG2 ILE B 12 -10.605 0.006 23.656 1.00 22.95 C ATOM 970 CD1 ILE B 12 -11.552 2.379 25.448 1.00 28.43 C ATOM 971 H ILE B 12 -9.607 -0.795 27.718 1.00 0.00 H ATOM 972 N LYS B 13 -9.125 -2.840 24.397 1.00 23.66 N ATOM 973 CA LYS B 13 -7.926 -3.522 23.907 1.00 22.93 C ATOM 974 C LYS B 13 -7.861 -3.484 22.400 1.00 20.46 C ATOM 975 O LYS B 13 -8.889 -3.480 21.732 1.00 22.61 O ATOM 976 CB LYS B 13 -7.918 -4.996 24.334 1.00 23.98 C ATOM 977 CG LYS B 13 -8.099 -5.242 25.813 1.00 27.30 C ATOM 978 CD LYS B 13 -6.914 -4.783 26.630 1.00 30.45 C ATOM 979 CE LYS B 13 -7.175 -4.991 28.111 1.00 34.17 C ATOM 980 NZ LYS B 13 -6.179 -4.280 28.954 1.00 40.72 N ATOM 981 HZ1 LYS B 13 -5.226 -4.636 28.737 1.00 0.00 H ATOM 982 HZ2 LYS B 13 -6.223 -3.260 28.755 1.00 0.00 H ATOM 983 HZ3 LYS B 13 -6.393 -4.448 29.958 1.00 0.00 H ATOM 984 H LYS B 13 -10.038 -3.041 23.941 1.00 0.00 H ATOM 985 N LEU B 14 -6.632 -3.465 21.877 1.00 20.00 N ATOM 986 CA LEU B 14 -6.372 -3.592 20.462 1.00 18.69 C ATOM 987 C LEU B 14 -5.849 -5.001 20.199 1.00 19.01 C ATOM 988 O LEU B 14 -4.842 -5.423 20.786 1.00 21.60 O ATOM 989 CB LEU B 14 -5.322 -2.568 19.999 1.00 20.30 C ATOM 990 CG LEU B 14 -4.704 -2.798 18.613 1.00 22.20 C ATOM 991 CD1 LEU B 14 -5.753 -2.685 17.529 1.00 24.58 C ATOM 992 CD2 LEU B 14 -3.568 -1.815 18.363 1.00 22.42 C ATOM 993 H LEU B 14 -5.823 -3.353 22.520 1.00 0.00 H ATOM 994 N VAL B 15 -6.551 -5.727 19.338 1.00 20.39 N ATOM 995 CA VAL B 15 -6.107 -7.029 18.873 1.00 19.37 C ATOM 996 C VAL B 15 -5.504 -6.815 17.494 1.00 20.11 C ATOM 997 O VAL B 15 -6.174 -6.338 16.597 1.00 21.30 O ATOM 998 CB VAL B 15 -7.266 -8.033 18.792 1.00 20.64 C ATOM 999 CG1 VAL B 15 -6.748 -9.403 18.354 1.00 21.82 C ATOM 1000 CG2 VAL B 15 -7.961 -8.125 20.145 1.00 23.77 C ATOM 1001 H VAL B 15 -7.453 -5.349 18.983 1.00 0.00 H ATOM 1002 N MET B 16 -4.218 -7.132 17.358 1.00 17.90 N ATOM 1003 CA MET B 16 -3.471 -6.944 16.128 1.00 18.28 C ATOM 1004 C MET B 16 -2.964 -8.291 15.655 1.00 17.79 C ATOM 1005 O MET B 16 -2.175 -8.930 16.351 1.00 23.47 O ATOM 1006 CB MET B 16 -2.274 -6.027 16.394 1.00 21.81 C ATOM 1007 CG MET B 16 -1.360 -5.808 15.211 1.00 27.97 C ATOM 1008 SD MET B 16 0.185 -4.971 15.665 1.00 38.37 S ATOM 1009 CE MET B 16 -0.445 -3.441 16.339 1.00 38.66 C ATOM 1010 H MET B 16 -3.722 -7.536 18.178 1.00 0.00 H ATOM 1011 N ALA B 17 -3.405 -8.718 14.481 1.00 15.99 N ATOM 1012 CA ALA B 17 -3.049 -10.029 13.933 1.00 17.49 C ATOM 1013 C ALA B 17 -2.313 -9.870 12.624 1.00 17.79 C ATOM 1014 O ALA B 17 -2.687 -9.040 11.800 1.00 19.88 O ATOM 1015 CB ALA B 17 -4.310 -10.849 13.703 1.00 19.00 C ATOM 1016 H ALA B 17 -4.029 -8.098 13.926 1.00 0.00 H ATOM 1017 N ILE B 18 -1.223 -10.614 12.447 1.00 15.81 N ATOM 1018 CA ILE B 18 -0.584 -10.689 11.154 1.00 16.84 C ATOM 1019 C ILE B 18 -0.825 -12.085 10.636 1.00 16.58 C ATOM 1020 O ILE B 18 -0.464 -13.058 11.307 1.00 20.48 O ATOM 1021 CB ILE B 18 0.924 -10.384 11.187 1.00 18.72 C ATOM 1022 CG1 ILE B 18 1.194 -9.020 11.811 1.00 25.10 C ATOM 1023 CG2 ILE B 18 1.489 -10.460 9.776 1.00 22.21 C ATOM 1024 CD1 ILE B 18 1.385 -9.072 13.297 1.00 32.62 C ATOM 1025 H ILE B 18 -0.828 -11.147 13.248 1.00 0.00 H ATOM 1026 N ILE B 19 -1.436 -12.180 9.465 1.00 17.24 N ATOM 1027 CA ILE B 19 -1.919 -13.464 8.943 1.00 18.29 C ATOM 1028 C ILE B 19 -1.647 -13.569 7.454 1.00 17.01 C ATOM 1029 O ILE B 19 -1.235 -12.596 6.819 1.00 17.47 O ATOM 1030 CB ILE B 19 -3.438 -13.641 9.180 1.00 21.94 C ATOM 1031 CG1 ILE B 19 -4.206 -12.556 8.416 1.00 19.14 C ATOM 1032 CG2 ILE B 19 -3.740 -13.623 10.659 1.00 23.74 C ATOM 1033 CD1 ILE B 19 -5.716 -12.657 8.469 1.00 22.65 C ATOM 1034 H ILE B 19 -1.578 -11.319 8.898 1.00 0.00 H ATOM 1035 N ARG B 20 -1.865 -14.750 6.889 1.00 17.37 N ATOM 1036 CA ARG B 20 -1.768 -14.950 5.452 1.00 17.90 C ATOM 1037 C ARG B 20 -2.875 -14.201 4.720 1.00 19.17 C ATOM 1038 O ARG B 20 -4.033 -14.231 5.167 1.00 21.63 O ATOM 1039 CB ARG B 20 -1.920 -16.439 5.120 1.00 18.55 C ATOM 1040 CG ARG B 20 -0.838 -17.303 5.715 1.00 19.76 C ATOM 1041 CD ARG B 20 -1.148 -18.784 5.510 1.00 21.23 C ATOM 1042 NE ARG B 20 -0.177 -19.630 6.195 1.00 22.29 N ATOM 1043 CZ ARG B 20 1.056 -19.892 5.775 1.00 23.55 C ATOM 1044 NH1 ARG B 20 1.520 -19.400 4.635 1.00 26.12 N ATOM 1045 NH2 ARG B 20 1.828 -20.686 6.510 1.00 26.45 N ATOM 1046 HE ARG B 20 -0.476 -20.066 7.090 1.00 0.00 H ATOM 1047 HH12 ARG B 20 2.489 -19.621 4.330 1.00 0.00 H ATOM 1048 HH11 ARG B 20 0.915 -18.793 4.046 1.00 0.00 H ATOM 1049 HH22 ARG B 20 2.796 -20.903 6.199 1.00 0.00 H ATOM 1050 HH21 ARG B 20 1.464 -21.090 7.396 1.00 0.00 H ATOM 1051 H ARG B 20 -2.113 -15.559 7.494 1.00 0.00 H ATOM 1052 N PRO B 21 -2.552 -13.582 3.568 1.00 19.92 N ATOM 1053 CA PRO B 21 -3.597 -12.852 2.824 1.00 21.24 C ATOM 1054 C PRO B 21 -4.816 -13.700 2.448 1.00 22.81 C ATOM 1055 O PRO B 21 -5.969 -13.213 2.496 1.00 24.08 O ATOM 1056 CB PRO B 21 -2.852 -12.362 1.575 1.00 24.57 C ATOM 1057 CG PRO B 21 -1.430 -12.257 2.015 1.00 24.23 C ATOM 1058 CD PRO B 21 -1.233 -13.439 2.920 1.00 22.07 C ATOM 1059 N ASP B 22 -4.590 -14.968 2.119 1.00 22.24 N ATOM 1060 CA ASP B 22 -5.692 -15.824 1.684 1.00 22.45 C ATOM 1061 C ASP B 22 -6.671 -16.206 2.804 1.00 23.48 C ATOM 1062 O ASP B 22 -7.750 -16.726 2.521 1.00 27.97 O ATOM 1063 CB ASP B 22 -5.176 -17.070 0.967 1.00 27.47 C ATOM 1064 CG ASP B 22 -4.432 -18.023 1.885 1.00 40.15 C ATOM 1065 OD1 ASP B 22 -4.047 -17.622 3.006 1.00 56.09 O ATOM 1066 OD2 ASP B 22 -4.223 -19.191 1.483 1.00 67.78 O ATOM 1067 H ASP B 22 -3.625 -15.353 2.171 1.00 0.00 H ATOM 1068 N LYS B 23 -6.306 -15.933 4.055 1.00 20.49 N ATOM 1069 CA LYS B 23 -7.158 -16.208 5.219 1.00 20.80 C ATOM 1070 C LYS B 23 -7.995 -15.016 5.664 1.00 21.08 C ATOM 1071 O LYS B 23 -8.773 -15.115 6.599 1.00 20.55 O ATOM 1072 CB LYS B 23 -6.285 -16.660 6.381 1.00 20.64 C ATOM 1073 CG LYS B 23 -5.655 -18.025 6.183 1.00 21.92 C ATOM 1074 CD LYS B 23 -6.729 -19.046 5.862 1.00 23.59 C ATOM 1075 CE LYS B 23 -6.243 -20.442 6.100 1.00 26.62 C ATOM 1076 NZ LYS B 23 -7.394 -21.370 5.965 1.00 34.42 N ATOM 1077 HZ1 LYS B 23 -8.122 -21.122 6.666 1.00 0.00 H ATOM 1078 HZ2 LYS B 23 -7.792 -21.290 5.007 1.00 0.00 H ATOM 1079 HZ3 LYS B 23 -7.072 -22.345 6.128 1.00 0.00 H ATOM 1080 H LYS B 23 -5.372 -15.504 4.216 1.00 0.00 H ATOM 1081 N LEU B 24 -7.812 -13.862 5.024 1.00 20.10 N ATOM 1082 CA LEU B 24 -8.579 -12.686 5.432 1.00 19.71 C ATOM 1083 C LEU B 24 -10.102 -12.911 5.347 1.00 20.52 C ATOM 1084 O LEU B 24 -10.837 -12.530 6.268 1.00 21.19 O ATOM 1085 CB LEU B 24 -8.170 -11.458 4.613 1.00 18.63 C ATOM 1086 CG LEU B 24 -8.949 -10.174 4.917 1.00 19.53 C ATOM 1087 CD1 LEU B 24 -8.843 -9.801 6.392 1.00 22.24 C ATOM 1088 CD2 LEU B 24 -8.487 -9.040 4.006 1.00 20.98 C ATOM 1089 H LEU B 24 -7.130 -13.798 4.241 1.00 0.00 H ATOM 1090 N ALA B 25 -10.581 -13.522 4.266 1.00 21.02 N ATOM 1091 CA ALA B 25 -12.028 -13.733 4.127 1.00 24.45 C ATOM 1092 C ALA B 25 -12.579 -14.561 5.300 1.00 25.28 C ATOM 1093 O ALA B 25 -13.610 -14.231 5.890 1.00 25.96 O ATOM 1094 CB ALA B 25 -12.353 -14.382 2.791 1.00 28.27 C ATOM 1095 H ALA B 25 -9.933 -13.849 3.522 1.00 0.00 H ATOM 1096 N ASP B 26 -11.876 -15.631 5.655 1.00 21.64 N ATOM 1097 CA ASP B 26 -12.316 -16.486 6.762 1.00 25.95 C ATOM 1098 C ASP B 26 -12.237 -15.770 8.115 1.00 22.14 C ATOM 1099 O ASP B 26 -13.123 -15.935 8.961 1.00 22.82 O ATOM 1100 CB ASP B 26 -11.505 -17.781 6.778 1.00 27.19 C ATOM 1101 CG ASP B 26 -11.925 -18.755 5.669 1.00 35.65 C ATOM 1102 OD1 ASP B 26 -12.986 -18.553 5.032 1.00 38.22 O ATOM 1103 OD2 ASP B 26 -11.183 -19.731 5.421 1.00 43.64 O ATOM 1104 H ASP B 26 -11.003 -15.865 5.141 1.00 0.00 H ATOM 1105 N VAL B 27 -11.212 -14.933 8.297 1.00 20.43 N ATOM 1106 CA VAL B 27 -11.087 -14.129 9.517 1.00 20.78 C ATOM 1107 C VAL B 27 -12.252 -13.114 9.631 1.00 19.93 C ATOM 1108 O VAL B 27 -12.829 -12.935 10.702 1.00 21.47 O ATOM 1109 CB VAL B 27 -9.707 -13.433 9.575 1.00 19.37 C ATOM 1110 CG1 VAL B 27 -9.691 -12.337 10.630 1.00 24.18 C ATOM 1111 CG2 VAL B 27 -8.659 -14.502 9.861 1.00 20.57 C ATOM 1112 H VAL B 27 -10.486 -14.850 7.557 1.00 0.00 H ATOM 1113 N LYS B 28 -12.599 -12.471 8.524 1.00 20.46 N ATOM 1114 CA LYS B 28 -13.715 -11.529 8.527 1.00 21.22 C ATOM 1115 C LYS B 28 -15.021 -12.232 8.973 1.00 23.30 C ATOM 1116 O LYS B 28 -15.774 -11.715 9.803 1.00 25.88 O ATOM 1117 CB LYS B 28 -13.885 -10.902 7.141 1.00 22.81 C ATOM 1118 CG LYS B 28 -12.829 -9.874 6.781 1.00 25.08 C ATOM 1119 CD LYS B 28 -13.257 -9.073 5.577 1.00 32.25 C ATOM 1120 CE LYS B 28 -13.319 -9.880 4.304 1.00 34.41 C ATOM 1121 NZ LYS B 28 -13.824 -8.987 3.232 1.00 33.45 N ATOM 1122 HZ1 LYS B 28 -14.770 -8.640 3.489 1.00 0.00 H ATOM 1123 HZ2 LYS B 28 -13.176 -8.181 3.120 1.00 0.00 H ATOM 1124 HZ3 LYS B 28 -13.878 -9.516 2.338 1.00 0.00 H ATOM 1125 H LYS B 28 -12.071 -12.639 7.644 1.00 0.00 H ATOM 1126 N THR B 29 -15.263 -13.426 8.435 1.00 24.57 N ATOM 1127 CA THR B 29 -16.454 -14.207 8.775 1.00 24.41 C ATOM 1128 C THR B 29 -16.433 -14.575 10.258 1.00 27.42 C ATOM 1129 O THR B 29 -17.432 -14.404 10.951 1.00 28.04 O ATOM 1130 CB THR B 29 -16.527 -15.466 7.903 1.00 28.36 C ATOM 1131 OG1 THR B 29 -16.558 -15.076 6.523 1.00 31.74 O ATOM 1132 CG2 THR B 29 -17.780 -16.303 8.237 1.00 28.78 C ATOM 1133 HG1 THR B 29 -16.605 -15.885 5.954 1.00 0.00 H ATOM 1134 H THR B 29 -14.584 -13.816 7.751 1.00 0.00 H ATOM 1135 N ALA B 30 -15.274 -15.013 10.756 1.00 25.21 N ATOM 1136 CA ALA B 30 -15.144 -15.382 12.166 1.00 28.79 C ATOM 1137 C ALA B 30 -15.386 -14.207 13.112 1.00 25.40 C ATOM 1138 O ALA B 30 -16.027 -14.360 14.155 1.00 30.43 O ATOM 1139 CB ALA B 30 -13.793 -16.015 12.439 1.00 26.94 C ATOM 1140 H ALA B 30 -14.448 -15.093 10.130 1.00 0.00 H ATOM 1141 N LEU B 31 -14.893 -13.030 12.736 1.00 23.52 N ATOM 1142 CA LEU B 31 -15.109 -11.840 13.545 1.00 24.63 C ATOM 1143 C LEU B 31 -16.581 -11.452 13.596 1.00 26.66 C ATOM 1144 O LEU B 31 -17.109 -11.125 14.659 1.00 29.36 O ATOM 1145 CB LEU B 31 -14.267 -10.683 13.016 1.00 22.00 C ATOM 1146 CG LEU B 31 -12.769 -10.781 13.283 1.00 23.25 C ATOM 1147 CD1 LEU B 31 -12.009 -9.764 12.441 1.00 26.71 C ATOM 1148 CD2 LEU B 31 -12.483 -10.555 14.755 1.00 28.37 C ATOM 1149 H LEU B 31 -14.347 -12.960 11.854 1.00 0.00 H ATOM 1150 N ALA B 32 -17.254 -11.513 12.455 1.00 25.31 N ATOM 1151 CA ALA B 32 -18.697 -11.252 12.413 1.00 28.18 C ATOM 1152 C ALA B 32 -19.447 -12.244 13.308 1.00 29.98 C ATOM 1153 O ALA B 32 -20.367 -11.866 14.028 1.00 39.01 O ATOM 1154 CB ALA B 32 -19.211 -11.330 10.985 1.00 31.65 C ATOM 1155 H ALA B 32 -16.751 -11.750 11.576 1.00 0.00 H ATOM 1156 N GLU B 33 -19.033 -13.510 13.265 1.00 33.38 N ATOM 1157 CA GLU B 33 -19.705 -14.573 14.017 1.00 34.85 C ATOM 1158 C GLU B 33 -19.516 -14.445 15.533 1.00 35.51 C ATOM 1159 O GLU B 33 -20.400 -14.826 16.297 1.00 44.50 O ATOM 1160 CB GLU B 33 -19.255 -15.956 13.530 1.00 39.01 C ATOM 1161 CG GLU B 33 -19.808 -16.332 12.155 1.00 50.03 C ATOM 1162 CD GLU B 33 -19.501 -17.770 11.742 1.00 61.24 C ATOM 1163 OE1 GLU B 33 -19.674 -18.101 10.544 1.00 68.37 O ATOM 1164 OE2 GLU B 33 -19.090 -18.578 12.609 1.00 71.98 O ATOM 1165 H GLU B 33 -18.208 -13.751 12.680 1.00 0.00 H ATOM 1166 N VAL B 34 -18.389 -13.883 15.965 1.00 33.55 N ATOM 1167 CA VAL B 34 -18.119 -13.700 17.395 1.00 37.60 C ATOM 1168 C VAL B 34 -18.729 -12.386 17.923 1.00 36.80 C ATOM 1169 O VAL B 34 -18.705 -12.117 19.127 1.00 40.59 O ATOM 1170 CB VAL B 34 -16.601 -13.828 17.696 1.00 38.37 C ATOM 1171 CG1 VAL B 34 -15.848 -12.544 17.391 1.00 37.33 C ATOM 1172 CG2 VAL B 34 -16.360 -14.249 19.139 1.00 46.05 C ATOM 1173 H VAL B 34 -17.682 -13.566 15.271 1.00 0.00 H ATOM 1174 N GLY B 35 -19.285 -11.581 17.018 1.00 32.85 N ATOM 1175 CA GLY B 35 -20.014 -10.365 17.391 1.00 36.47 C ATOM 1176 C GLY B 35 -19.171 -9.107 17.455 1.00 36.53 C ATOM 1177 O GLY B 35 -19.551 -8.129 18.095 1.00 39.93 O ATOM 1178 H GLY B 35 -19.199 -11.824 16.011 1.00 0.00 H ATOM 1179 N ALA B 36 -18.025 -9.140 16.788 1.00 34.12 N ATOM 1180 CA ALA B 36 -17.102 -8.015 16.758 1.00 31.24 C ATOM 1181 C ALA B 36 -16.633 -7.821 15.323 1.00 29.02 C ATOM 1182 O ALA B 36 -15.463 -8.049 15.017 1.00 36.81 O ATOM 1183 CB ALA B 36 -15.923 -8.300 17.683 1.00 35.97 C ATOM 1184 H ALA B 36 -17.776 -10.004 16.266 1.00 0.00 H ATOM 1185 N PRO B 37 -17.548 -7.405 14.430 1.00 29.54 N ATOM 1186 CA PRO B 37 -17.213 -7.334 13.009 1.00 32.00 C ATOM 1187 C PRO B 37 -16.229 -6.223 12.607 1.00 31.46 C ATOM 1188 O PRO B 37 -15.577 -6.363 11.571 1.00 30.31 O ATOM 1189 CB PRO B 37 -18.570 -7.088 12.345 1.00 34.80 C ATOM 1190 CG PRO B 37 -19.361 -6.364 13.383 1.00 37.46 C ATOM 1191 CD PRO B 37 -18.934 -6.967 14.692 1.00 32.97 C ATOM 1192 N SER B 38 -16.139 -5.146 13.397 1.00 25.89 N ATOM 1193 CA SER B 38 -15.315 -3.976 13.053 1.00 23.35 C ATOM 1194 C SER B 38 -13.850 -4.333 12.931 1.00 23.75 C ATOM 1195 O SER B 38 -13.296 -4.961 13.819 1.00 27.99 O ATOM 1196 CB SER B 38 -15.418 -2.882 14.121 1.00 27.01 C ATOM 1197 OG SER B 38 -16.734 -2.394 14.233 1.00 31.05 O ATOM 1198 HG SER B 38 -17.340 -3.136 14.484 1.00 0.00 H ATOM 1199 H SER B 38 -16.673 -5.136 14.290 1.00 0.00 H ATOM 1200 N LEU B 39 -13.218 -3.903 11.848 1.00 20.45 N ATOM 1201 CA LEU B 39 -11.787 -4.185 11.660 1.00 17.52 C ATOM 1202 C LEU B 39 -11.184 -3.210 10.686 1.00 15.84 C ATOM 1203 O LEU B 39 -11.875 -2.660 9.822 1.00 17.28 O ATOM 1204 CB LEU B 39 -11.568 -5.643 11.184 1.00 22.57 C ATOM 1205 CG LEU B 39 -11.662 -5.965 9.686 1.00 23.51 C ATOM 1206 CD1 LEU B 39 -11.030 -7.313 9.346 1.00 26.74 C ATOM 1207 CD2 LEU B 39 -13.096 -5.933 9.245 1.00 26.97 C ATOM 1208 H LEU B 39 -13.737 -3.363 11.127 1.00 0.00 H ATOM 1209 N THR B 40 -9.864 -3.060 10.824 1.00 16.91 N ATOM 1210 CA THR B 40 -9.045 -2.306 9.890 1.00 16.11 C ATOM 1211 C THR B 40 -7.930 -3.254 9.394 1.00 13.89 C ATOM 1212 O THR B 40 -7.281 -3.930 10.189 1.00 18.23 O ATOM 1213 CB THR B 40 -8.461 -1.061 10.580 1.00 17.19 C ATOM 1214 OG1 THR B 40 -9.531 -0.174 10.938 1.00 18.75 O ATOM 1215 CG2 THR B 40 -7.538 -0.307 9.665 1.00 19.67 C ATOM 1216 HG1 THR B 40 -10.021 0.097 10.121 1.00 0.00 H ATOM 1217 H THR B 40 -9.399 -3.505 11.641 1.00 0.00 H ATOM 1218 N VAL B 41 -7.780 -3.305 8.084 1.00 13.73 N ATOM 1219 CA VAL B 41 -6.812 -4.153 7.389 1.00 14.03 C ATOM 1220 C VAL B 41 -5.713 -3.307 6.744 1.00 14.22 C ATOM 1221 O VAL B 41 -5.996 -2.358 6.027 1.00 14.91 O ATOM 1222 CB VAL B 41 -7.521 -4.951 6.269 1.00 17.67 C ATOM 1223 CG1 VAL B 41 -6.526 -5.726 5.407 1.00 22.48 C ATOM 1224 CG2 VAL B 41 -8.571 -5.885 6.884 1.00 20.82 C ATOM 1225 H VAL B 41 -8.394 -2.699 7.504 1.00 0.00 H ATOM 1226 N THR B 42 -4.462 -3.763 6.893 1.00 14.58 N ATOM 1227 CA THR B 42 -3.302 -3.134 6.284 1.00 15.00 C ATOM 1228 C THR B 42 -2.543 -4.226 5.548 1.00 14.91 C ATOM 1229 O THR B 42 -2.326 -5.295 6.100 1.00 16.41 O ATOM 1230 CB THR B 42 -2.366 -2.525 7.366 1.00 17.72 C ATOM 1231 OG1 THR B 42 -3.111 -1.637 8.202 1.00 22.87 O ATOM 1232 CG2 THR B 42 -1.208 -1.752 6.732 1.00 18.00 C ATOM 1233 HG1 THR B 42 -2.511 -1.252 8.889 1.00 0.00 H ATOM 1234 H THR B 42 -4.313 -4.612 7.475 1.00 0.00 H ATOM 1235 N ASN B 43 -2.127 -3.931 4.336 1.00 14.15 N ATOM 1236 CA ASN B 43 -1.245 -4.800 3.599 1.00 14.76 C ATOM 1237 C ASN B 43 0.201 -4.576 4.042 1.00 13.31 C ATOM 1238 O ASN B 43 0.684 -3.451 4.044 1.00 17.00 O ATOM 1239 CB ASN B 43 -1.424 -4.570 2.120 1.00 16.69 C ATOM 1240 CG ASN B 43 -2.829 -4.858 1.688 1.00 19.76 C ATOM 1241 OD1 ASN B 43 -3.300 -5.987 1.811 1.00 25.36 O ATOM 1242 ND2 ASN B 43 -3.522 -3.832 1.233 1.00 21.77 N ATOM 1243 HD22 ASN B 43 -3.073 -2.898 1.149 1.00 0.00 H ATOM 1244 HD21 ASN B 43 -4.517 -3.958 0.958 1.00 0.00 H ATOM 1245 H ASN B 43 -2.444 -3.044 3.896 1.00 0.00 H ATOM 1246 N VAL B 44 0.890 -5.657 4.404 1.00 12.87 N ATOM 1247 CA VAL B 44 2.248 -5.595 4.979 1.00 13.19 C ATOM 1248 C VAL B 44 3.119 -6.686 4.381 1.00 13.00 C ATOM 1249 O VAL B 44 2.673 -7.485 3.580 1.00 15.43 O ATOM 1250 CB VAL B 44 2.207 -5.693 6.517 1.00 14.84 C ATOM 1251 CG1 VAL B 44 1.319 -4.603 7.123 1.00 15.23 C ATOM 1252 CG2 VAL B 44 1.706 -7.075 6.953 1.00 15.04 C ATOM 1253 H VAL B 44 0.450 -6.590 4.275 1.00 0.00 H ATOM 1254 N SER B 45 4.396 -6.662 4.741 1.00 14.10 N ATOM 1255 CA SER B 45 5.389 -7.661 4.349 1.00 14.91 C ATOM 1256 C SER B 45 6.107 -8.103 5.619 1.00 13.87 C ATOM 1257 O SER B 45 6.250 -7.316 6.546 1.00 17.43 O ATOM 1258 CB SER B 45 6.394 -7.035 3.378 1.00 16.46 C ATOM 1259 OG SER B 45 5.754 -6.468 2.241 1.00 16.57 O ATOM 1260 HG SER B 45 5.126 -5.761 2.535 1.00 0.00 H ATOM 1261 H SER B 45 4.713 -5.877 5.345 1.00 0.00 H ATOM 1262 N GLY B 46 6.594 -9.330 5.669 1.00 14.95 N ATOM 1263 CA GLY B 46 7.266 -9.734 6.879 1.00 17.44 C ATOM 1264 C GLY B 46 8.109 -10.978 6.751 1.00 15.45 C ATOM 1265 O GLY B 46 8.128 -11.632 5.709 1.00 17.87 O ATOM 1266 H GLY B 46 6.496 -9.981 4.864 1.00 0.00 H ATOM 1267 N ARG B 47 8.841 -11.252 7.813 1.00 17.51 N ATOM 1268 CA ARG B 47 9.478 -12.543 8.010 1.00 18.68 C ATOM 1269 C ARG B 47 9.383 -12.900 9.475 1.00 20.10 C ATOM 1270 O ARG B 47 9.239 -12.042 10.333 1.00 21.10 O ATOM 1271 CB ARG B 47 10.936 -12.541 7.540 1.00 21.75 C ATOM 1272 CG ARG B 47 11.824 -11.692 8.416 1.00 23.27 C ATOM 1273 CD ARG B 47 13.294 -11.725 8.035 1.00 25.32 C ATOM 1274 NE ARG B 47 14.032 -10.854 8.938 1.00 24.92 N ATOM 1275 CZ ARG B 47 15.242 -10.337 8.689 1.00 26.70 C ATOM 1276 NH1 ARG B 47 15.811 -9.551 9.598 1.00 27.90 N ATOM 1277 NH2 ARG B 47 15.862 -10.563 7.531 1.00 32.05 N ATOM 1278 HE ARG B 47 13.585 -10.615 9.846 1.00 0.00 H ATOM 1279 HH12 ARG B 47 16.750 -9.143 9.418 1.00 0.00 H ATOM 1280 HH11 ARG B 47 15.317 -9.344 10.489 1.00 0.00 H ATOM 1281 HH22 ARG B 47 16.802 -10.153 7.356 1.00 0.00 H ATOM 1282 HH21 ARG B 47 15.406 -11.149 6.803 1.00 0.00 H ATOM 1283 H ARG B 47 8.967 -10.516 8.537 1.00 0.00 H ATOM 1284 N GLY B 48 9.449 -14.201 9.765 1.00 22.35 N ATOM 1285 CA GLY B 48 9.466 -14.676 11.142 1.00 25.10 C ATOM 1286 C GLY B 48 10.877 -15.138 11.500 1.00 27.89 C ATOM 1287 O GLY B 48 11.865 -14.468 11.160 1.00 34.85 O ATOM 1288 H GLY B 48 9.489 -14.892 8.989 1.00 0.00 H ATOM 1289 N SER B 49 10.960 -16.280 12.181 1.00 35.09 N ATOM 1290 CA SER B 49 12.234 -16.915 12.550 1.00 38.51 C ATOM 1291 C SER B 49 12.777 -17.834 11.437 1.00 37.70 C ATOM 1292 O SER B 49 13.759 -18.557 11.649 1.00 57.69 O ATOM 1293 CB SER B 49 12.043 -17.744 13.829 1.00 45.27 C ATOM 1294 OG SER B 49 11.508 -16.962 14.881 1.00 50.20 O ATOM 1295 HG SER B 49 11.398 -17.526 15.687 1.00 0.00 H ATOM 1296 H SER B 49 10.076 -16.748 12.467 1.00 0.00 H TER 1297 SER B 49 ATOM 1298 N VAL B 64 15.723 -13.580 4.434 1.00 41.85 N ATOM 1299 CA VAL B 64 15.972 -12.182 4.059 1.00 40.31 C ATOM 1300 C VAL B 64 14.802 -11.526 3.325 1.00 43.75 C ATOM 1301 O VAL B 64 14.409 -10.410 3.678 1.00 49.67 O ATOM 1302 CB VAL B 64 17.242 -12.042 3.185 1.00 44.15 C ATOM 1303 CG1 VAL B 64 17.427 -10.603 2.711 1.00 43.81 C ATOM 1304 CG2 VAL B 64 18.469 -12.505 3.960 1.00 45.69 C ATOM 1305 HN3 VAL B 64 15.540 -14.140 3.577 1.00 0.00 H ATOM 1306 HN2 VAL B 64 14.896 -13.627 5.063 1.00 0.00 H ATOM 1307 HN1 VAL B 64 16.557 -13.959 4.927 1.00 0.00 H ATOM 1308 N ASP B 65 14.274 -12.194 2.295 1.00 40.07 N ATOM 1309 CA ASP B 65 13.184 -11.614 1.477 1.00 40.66 C ATOM 1310 C ASP B 65 11.884 -11.631 2.225 1.00 38.88 C ATOM 1311 O ASP B 65 11.553 -12.594 2.912 1.00 54.64 O ATOM 1312 CB ASP B 65 13.014 -12.368 0.158 1.00 42.41 C ATOM 1313 CG ASP B 65 14.233 -12.246 -0.744 1.00 50.81 C ATOM 1314 OD1 ASP B 65 15.058 -11.332 -0.513 1.00 57.02 O ATOM 1315 OD2 ASP B 65 14.368 -13.062 -1.685 1.00 64.65 O ATOM 1316 H ASP B 65 14.636 -13.141 2.063 1.00 0.00 H ATOM 1317 N LEU B 66 11.118 -10.568 2.094 1.00 22.61 N ATOM 1318 CA LEU B 66 9.901 -10.535 2.858 1.00 19.10 C ATOM 1319 C LEU B 66 8.727 -11.067 2.053 1.00 17.67 C ATOM 1320 O LEU B 66 8.681 -10.950 0.831 1.00 18.78 O ATOM 1321 CB LEU B 66 9.655 -9.118 3.332 1.00 18.85 C ATOM 1322 CG LEU B 66 10.793 -8.497 4.142 1.00 19.35 C ATOM 1323 CD1 LEU B 66 10.302 -7.164 4.663 1.00 21.25 C ATOM 1324 CD2 LEU B 66 11.263 -9.365 5.292 1.00 21.97 C ATOM 1325 H LEU B 66 11.383 -9.784 1.464 1.00 0.00 H ATOM 1326 N HIS B 67 7.806 -11.687 2.779 1.00 17.19 N ATOM 1327 CA HIS B 67 6.615 -12.273 2.199 1.00 15.91 C ATOM 1328 C HIS B 67 5.410 -11.364 2.446 1.00 15.50 C ATOM 1329 O HIS B 67 5.317 -10.703 3.476 1.00 16.56 O ATOM 1330 CB HIS B 67 6.337 -13.668 2.819 1.00 19.33 C ATOM 1331 CG HIS B 67 7.308 -14.741 2.419 1.00 30.26 C ATOM 1332 ND1 HIS B 67 7.261 -16.014 2.939 1.00 41.20 N ATOM 1333 CD2 HIS B 67 8.341 -14.727 1.552 1.00 36.80 C ATOM 1334 CE1 HIS B 67 8.225 -16.742 2.405 1.00 55.53 C ATOM 1335 NE2 HIS B 67 8.901 -15.984 1.562 1.00 55.13 N ATOM 1336 H HIS B 67 7.945 -11.755 3.807 1.00 0.00 H ATOM 1337 N GLN B 68 4.480 -11.408 1.508 1.00 15.59 N ATOM 1338 CA GLN B 68 3.197 -10.684 1.623 1.00 14.97 C ATOM 1339 C GLN B 68 2.399 -11.216 2.809 1.00 15.13 C ATOM 1340 O GLN B 68 2.188 -12.425 2.922 1.00 18.32 O ATOM 1341 CB GLN B 68 2.423 -10.870 0.319 1.00 18.73 C ATOM 1342 CG GLN B 68 1.081 -10.165 0.201 1.00 21.63 C ATOM 1343 CD GLN B 68 0.200 -10.713 -0.930 1.00 24.60 C ATOM 1344 OE1 GLN B 68 0.211 -11.914 -1.247 1.00 27.12 O ATOM 1345 NE2 GLN B 68 -0.583 -9.843 -1.520 1.00 31.16 N ATOM 1346 HE22 GLN B 68 -0.565 -8.845 -1.228 1.00 0.00 H ATOM 1347 HE21 GLN B 68 -1.222 -10.151 -2.280 1.00 0.00 H ATOM 1348 H GLN B 68 4.658 -11.975 0.655 1.00 0.00 H ATOM 1349 N LYS B 69 1.925 -10.325 3.671 1.00 15.15 N ATOM 1350 CA LYS B 69 1.046 -10.682 4.781 1.00 15.91 C ATOM 1351 C LYS B 69 -0.082 -9.640 4.888 1.00 14.03 C ATOM 1352 O LYS B 69 -0.072 -8.611 4.187 1.00 15.18 O ATOM 1353 CB LYS B 69 1.797 -10.815 6.110 1.00 16.33 C ATOM 1354 CG LYS B 69 2.956 -11.826 6.114 1.00 16.53 C ATOM 1355 CD LYS B 69 2.458 -13.263 6.084 1.00 17.47 C ATOM 1356 CE LYS B 69 3.641 -14.205 5.867 1.00 19.42 C ATOM 1357 NZ LYS B 69 3.220 -15.632 5.810 1.00 21.14 N ATOM 1358 HZ1 LYS B 69 2.759 -15.892 6.705 1.00 0.00 H ATOM 1359 HZ2 LYS B 69 2.552 -15.764 5.024 1.00 0.00 H ATOM 1360 HZ3 LYS B 69 4.056 -16.233 5.662 1.00 0.00 H ATOM 1361 H LYS B 69 2.192 -9.327 3.550 1.00 0.00 H ATOM 1362 N VAL B 70 -1.040 -9.901 5.769 1.00 15.15 N ATOM 1363 CA VAL B 70 -2.112 -8.957 6.079 1.00 15.20 C ATOM 1364 C VAL B 70 -2.100 -8.673 7.578 1.00 15.03 C ATOM 1365 O VAL B 70 -1.969 -9.596 8.368 1.00 16.80 O ATOM 1366 CB VAL B 70 -3.488 -9.512 5.656 1.00 16.97 C ATOM 1367 CG1 VAL B 70 -4.603 -8.650 6.220 1.00 16.52 C ATOM 1368 CG2 VAL B 70 -3.582 -9.540 4.149 1.00 22.19 C ATOM 1369 H VAL B 70 -1.027 -10.818 6.260 1.00 0.00 H ATOM 1370 N LYS B 71 -2.226 -7.398 7.966 1.00 14.15 N ATOM 1371 CA LYS B 71 -2.408 -7.023 9.358 1.00 14.45 C ATOM 1372 C LYS B 71 -3.899 -6.701 9.548 1.00 14.91 C ATOM 1373 O LYS B 71 -4.457 -5.901 8.785 1.00 18.50 O ATOM 1374 CB LYS B 71 -1.558 -5.796 9.722 1.00 17.85 C ATOM 1375 CG LYS B 71 -1.736 -5.322 11.151 1.00 20.07 C ATOM 1376 CD LYS B 71 -1.126 -3.958 11.422 1.00 28.46 C ATOM 1377 CE LYS B 71 0.353 -4.048 11.579 1.00 29.49 C ATOM 1378 NZ LYS B 71 0.819 -2.692 11.949 1.00 32.37 N ATOM 1379 HZ1 LYS B 71 0.565 -2.022 11.196 1.00 0.00 H ATOM 1380 HZ2 LYS B 71 0.367 -2.402 12.840 1.00 0.00 H ATOM 1381 HZ3 LYS B 71 1.852 -2.703 12.071 1.00 0.00 H ATOM 1382 H LYS B 71 -2.192 -6.649 7.245 1.00 0.00 H ATOM 1383 N VAL B 72 -4.519 -7.315 10.552 1.00 16.93 N ATOM 1384 CA VAL B 72 -5.898 -7.050 10.935 1.00 16.55 C ATOM 1385 C VAL B 72 -5.858 -6.431 12.312 1.00 18.35 C ATOM 1386 O VAL B 72 -5.200 -6.943 13.212 1.00 20.48 O ATOM 1387 CB VAL B 72 -6.717 -8.354 10.962 1.00 20.94 C ATOM 1388 CG1 VAL B 72 -8.118 -8.126 11.493 1.00 24.73 C ATOM 1389 CG2 VAL B 72 -6.753 -8.968 9.576 1.00 22.98 C ATOM 1390 H VAL B 72 -3.988 -8.025 11.095 1.00 0.00 H ATOM 1391 N GLU B 73 -6.551 -5.306 12.477 1.00 17.98 N ATOM 1392 CA GLU B 73 -6.648 -4.660 13.768 1.00 17.85 C ATOM 1393 C GLU B 73 -8.105 -4.503 14.151 1.00 16.38 C ATOM 1394 O GLU B 73 -8.913 -3.994 13.359 1.00 19.16 O ATOM 1395 CB GLU B 73 -5.988 -3.292 13.745 1.00 18.34 C ATOM 1396 CG GLU B 73 -4.478 -3.378 13.717 1.00 20.85 C ATOM 1397 CD GLU B 73 -3.800 -2.047 13.493 1.00 27.76 C ATOM 1398 OE1 GLU B 73 -4.141 -1.354 12.500 1.00 31.47 O ATOM 1399 OE2 GLU B 73 -2.894 -1.702 14.295 1.00 36.88 O ATOM 1400 H GLU B 73 -7.034 -4.882 11.659 1.00 0.00 H ATOM 1401 N CYS B 74 -8.395 -4.911 15.381 1.00 18.29 N ATOM 1402 CA CYS B 74 -9.734 -4.870 15.964 1.00 18.55 C ATOM 1403 C CYS B 74 -9.636 -4.292 17.351 1.00 18.01 C ATOM 1404 O CYS B 74 -9.015 -4.892 18.236 1.00 21.04 O ATOM 1405 CB CYS B 74 -10.311 -6.285 16.097 1.00 18.04 C ATOM 1406 SG CYS B 74 -10.510 -7.173 14.552 1.00 19.32 S ATOM 1407 H CYS B 74 -7.620 -5.283 15.966 1.00 0.00 H ATOM 1408 N VAL B 75 -10.247 -3.129 17.566 1.00 19.78 N ATOM 1409 CA VAL B 75 -10.308 -2.568 18.899 1.00 19.99 C ATOM 1410 C VAL B 75 -11.619 -3.067 19.509 1.00 20.78 C ATOM 1411 O VAL B 75 -12.686 -2.978 18.882 1.00 23.02 O ATOM 1412 CB VAL B 75 -10.193 -1.024 18.892 1.00 19.95 C ATOM 1413 CG1 VAL B 75 -10.322 -0.474 20.303 1.00 22.69 C ATOM 1414 CG2 VAL B 75 -8.859 -0.620 18.281 1.00 20.60 C ATOM 1415 H VAL B 75 -10.683 -2.620 16.771 1.00 0.00 H ATOM 1416 N VAL B 76 -11.523 -3.609 20.720 1.00 21.26 N ATOM 1417 CA VAL B 76 -12.648 -4.246 21.395 1.00 22.58 C ATOM 1418 C VAL B 76 -12.803 -3.738 22.823 1.00 23.37 C ATOM 1419 O VAL B 76 -11.831 -3.322 23.465 1.00 25.16 O ATOM 1420 CB VAL B 76 -12.482 -5.787 21.409 1.00 24.60 C ATOM 1421 CG1 VAL B 76 -12.373 -6.317 19.996 1.00 28.83 C ATOM 1422 CG2 VAL B 76 -11.269 -6.226 22.226 1.00 25.09 C ATOM 1423 H VAL B 76 -10.605 -3.577 21.207 1.00 0.00 H ATOM 1424 N ALA B 77 -14.035 -3.785 23.316 1.00 26.74 N ATOM 1425 CA ALA B 77 -14.336 -3.462 24.706 1.00 26.62 C ATOM 1426 C ALA B 77 -15.364 -4.445 25.272 1.00 29.75 C ATOM 1427 O ALA B 77 -15.105 -5.090 26.287 1.00 34.27 O ATOM 1428 CB ALA B 77 -14.824 -2.024 24.829 1.00 29.48 C ATOM 1429 H ALA B 77 -14.815 -4.063 22.687 1.00 0.00 H ATOM 1430 N ASP B 78 -16.512 -4.556 24.600 1.00 32.12 N ATOM 1431 CA ASP B 78 -17.606 -5.447 25.022 1.00 33.47 C ATOM 1432 C ASP B 78 -17.294 -6.941 24.872 1.00 35.75 C ATOM 1433 O ASP B 78 -17.802 -7.762 25.632 1.00 43.80 O ATOM 1434 CB ASP B 78 -18.879 -5.142 24.221 1.00 39.21 C ATOM 1435 CG ASP B 78 -19.548 -3.836 24.634 1.00 47.05 C ATOM 1436 OD1 ASP B 78 -19.243 -3.314 25.730 1.00 55.30 O ATOM 1437 OD2 ASP B 78 -20.397 -3.336 23.859 1.00 57.36 O ATOM 1438 H ASP B 78 -16.640 -3.987 23.739 1.00 0.00 H ATOM 1439 N THR B 79 -16.475 -7.285 23.882 1.00 33.07 N ATOM 1440 CA THR B 79 -16.122 -8.667 23.594 1.00 32.37 C ATOM 1441 C THR B 79 -14.727 -8.945 24.153 1.00 29.09 C ATOM 1442 O THR B 79 -13.796 -8.199 23.850 1.00 30.51 O ATOM 1443 CB THR B 79 -16.106 -8.910 22.075 1.00 33.42 C ATOM 1444 OG1 THR B 79 -17.361 -8.515 21.513 1.00 38.29 O ATOM 1445 CG2 THR B 79 -15.838 -10.377 21.745 1.00 35.29 C ATOM 1446 HG1 THR B 79 -17.348 -8.672 20.536 1.00 0.00 H ATOM 1447 H THR B 79 -16.069 -6.534 23.288 1.00 0.00 H ATOM 1448 N PRO B 80 -14.566 -10.026 24.942 1.00 31.89 N ATOM 1449 CA PRO B 80 -13.236 -10.337 25.477 1.00 31.77 C ATOM 1450 C PRO B 80 -12.174 -10.434 24.379 1.00 29.58 C ATOM 1451 O PRO B 80 -12.395 -11.080 23.351 1.00 29.89 O ATOM 1452 CB PRO B 80 -13.438 -11.697 26.160 1.00 31.56 C ATOM 1453 CG PRO B 80 -14.876 -11.717 26.523 1.00 36.45 C ATOM 1454 CD PRO B 80 -15.575 -11.001 25.401 1.00 32.54 C ATOM 1455 N ALA B 81 -11.039 -9.778 24.593 1.00 28.87 N ATOM 1456 CA ALA B 81 -9.984 -9.733 23.583 1.00 27.58 C ATOM 1457 C ALA B 81 -9.438 -11.125 23.246 1.00 29.12 C ATOM 1458 O ALA B 81 -9.125 -11.399 22.096 1.00 27.65 O ATOM 1459 CB ALA B 81 -8.860 -8.822 24.039 1.00 28.43 C ATOM 1460 H ALA B 81 -10.898 -9.286 25.498 1.00 0.00 H ATOM 1461 N GLU B 82 -9.348 -12.001 24.245 1.00 34.60 N ATOM 1462 CA GLU B 82 -8.918 -13.383 24.005 1.00 36.25 C ATOM 1463 C GLU B 82 -9.922 -14.182 23.156 1.00 31.84 C ATOM 1464 O GLU B 82 -9.517 -15.036 22.373 1.00 36.85 O ATOM 1465 CB GLU B 82 -8.601 -14.106 25.322 1.00 43.14 C ATOM 1466 CG GLU B 82 -7.129 -14.001 25.711 1.00 50.55 C ATOM 1467 CD GLU B 82 -6.852 -14.386 27.154 1.00 57.00 C ATOM 1468 OE1 GLU B 82 -5.970 -15.243 27.385 1.00 68.29 O ATOM 1469 OE2 GLU B 82 -7.508 -13.828 28.059 1.00 76.57 O ATOM 1470 H GLU B 82 -9.587 -11.700 25.212 1.00 0.00 H ATOM 1471 N ASP B 83 -11.216 -13.883 23.280 1.00 32.17 N ATOM 1472 CA ASP B 83 -12.228 -14.497 22.403 1.00 36.06 C ATOM 1473 C ASP B 83 -12.053 -14.073 20.946 1.00 29.90 C ATOM 1474 O ASP B 83 -12.164 -14.883 20.035 1.00 31.14 O ATOM 1475 CB ASP B 83 -13.645 -14.135 22.857 1.00 38.82 C ATOM 1476 CG ASP B 83 -14.018 -14.763 24.185 1.00 48.80 C ATOM 1477 OD1 ASP B 83 -13.237 -15.589 24.710 1.00 54.23 O ATOM 1478 OD2 ASP B 83 -15.104 -14.425 24.702 1.00 55.04 O ATOM 1479 H ASP B 83 -11.516 -13.204 24.009 1.00 0.00 H ATOM 1480 N VAL B 84 -11.800 -12.787 20.731 1.00 27.18 N ATOM 1481 CA VAL B 84 -11.549 -12.279 19.385 1.00 26.06 C ATOM 1482 C VAL B 84 -10.257 -12.901 18.819 1.00 23.89 C ATOM 1483 O VAL B 84 -10.227 -13.342 17.674 1.00 24.67 O ATOM 1484 CB VAL B 84 -11.452 -10.733 19.390 1.00 25.66 C ATOM 1485 CG1 VAL B 84 -11.041 -10.201 18.024 1.00 28.91 C ATOM 1486 CG2 VAL B 84 -12.779 -10.126 19.830 1.00 28.36 C ATOM 1487 H VAL B 84 -11.780 -12.129 21.536 1.00 0.00 H ATOM 1488 N ALA B 85 -9.202 -12.932 19.634 1.00 23.26 N ATOM 1489 CA ALA B 85 -7.926 -13.535 19.236 1.00 25.10 C ATOM 1490 C ALA B 85 -8.085 -15.015 18.853 1.00 26.78 C ATOM 1491 O ALA B 85 -7.553 -15.461 17.836 1.00 25.85 O ATOM 1492 CB ALA B 85 -6.894 -13.371 20.347 1.00 28.82 C ATOM 1493 H ALA B 85 -9.287 -12.515 20.583 1.00 0.00 H ATOM 1494 N ASP B 86 -8.859 -15.754 19.644 1.00 30.27 N ATOM 1495 CA ASP B 86 -9.111 -17.170 19.361 1.00 29.85 C ATOM 1496 C ASP B 86 -9.845 -17.362 18.044 1.00 28.70 C ATOM 1497 O ASP B 86 -9.511 -18.263 17.273 1.00 33.20 O ATOM 1498 CB ASP B 86 -9.918 -17.815 20.490 1.00 34.21 C ATOM 1499 CG ASP B 86 -9.100 -18.018 21.762 1.00 46.61 C ATOM 1500 OD1 ASP B 86 -7.862 -17.816 21.731 1.00 55.50 O ATOM 1501 OD2 ASP B 86 -9.705 -18.384 22.798 1.00 60.42 O ATOM 1502 H ASP B 86 -9.295 -15.317 20.481 1.00 0.00 H ATOM 1503 N ALA B 87 -10.847 -16.515 17.796 1.00 26.40 N ATOM 1504 CA ALA B 87 -11.596 -16.538 16.536 1.00 27.60 C ATOM 1505 C ALA B 87 -10.702 -16.282 15.326 1.00 23.17 C ATOM 1506 O ALA B 87 -10.799 -16.969 14.303 1.00 25.23 O ATOM 1507 CB ALA B 87 -12.724 -15.515 16.577 1.00 27.22 C ATOM 1508 H ALA B 87 -11.105 -15.815 18.521 1.00 0.00 H ATOM 1509 N ILE B 88 -9.826 -15.283 15.436 1.00 23.24 N ATOM 1510 CA ILE B 88 -8.897 -15.007 14.346 1.00 23.16 C ATOM 1511 C ILE B 88 -7.933 -16.176 14.157 1.00 22.27 C ATOM 1512 O ILE B 88 -7.727 -16.635 13.038 1.00 23.17 O ATOM 1513 CB ILE B 88 -8.099 -13.708 14.584 1.00 21.60 C ATOM 1514 CG1 ILE B 88 -9.057 -12.509 14.627 1.00 21.98 C ATOM 1515 CG2 ILE B 88 -7.065 -13.529 13.485 1.00 24.16 C ATOM 1516 CD1 ILE B 88 -8.405 -11.220 15.110 1.00 24.48 C ATOM 1517 H ILE B 88 -9.805 -14.701 16.298 1.00 0.00 H ATOM 1518 N ALA B 89 -7.349 -16.654 15.249 1.00 22.96 N ATOM 1519 CA ALA B 89 -6.345 -17.725 15.162 1.00 25.41 C ATOM 1520 C ALA B 89 -6.928 -18.976 14.493 1.00 26.89 C ATOM 1521 O ALA B 89 -6.315 -19.561 13.600 1.00 27.63 O ATOM 1522 CB ALA B 89 -5.810 -18.058 16.537 1.00 28.46 C ATOM 1523 H ALA B 89 -7.605 -16.266 16.179 1.00 0.00 H ATOM 1524 N ASP B 90 -8.132 -19.362 14.901 1.00 25.42 N ATOM 1525 CA ASP B 90 -8.750 -20.571 14.361 1.00 27.25 C ATOM 1526 C ASP B 90 -8.995 -20.408 12.854 1.00 23.55 C ATOM 1527 O ASP B 90 -8.774 -21.338 12.082 1.00 30.10 O ATOM 1528 CB ASP B 90 -10.062 -20.860 15.084 1.00 31.07 C ATOM 1529 CG ASP B 90 -9.872 -21.297 16.542 1.00 37.21 C ATOM 1530 OD1 ASP B 90 -8.718 -21.489 17.001 1.00 49.41 O ATOM 1531 OD2 ASP B 90 -10.903 -21.452 17.235 1.00 54.13 O ATOM 1532 H ASP B 90 -8.640 -18.798 15.612 1.00 0.00 H ATOM 1533 N ALA B 91 -9.441 -19.212 12.442 1.00 21.59 N ATOM 1534 CA ALA B 91 -9.730 -18.960 11.032 1.00 23.42 C ATOM 1535 C ALA B 91 -8.463 -18.794 10.179 1.00 21.65 C ATOM 1536 O ALA B 91 -8.450 -19.112 8.998 1.00 24.29 O ATOM 1537 CB ALA B 91 -10.622 -17.732 10.885 1.00 22.28 C ATOM 1538 H ALA B 91 -9.583 -18.452 13.137 1.00 0.00 H ATOM 1539 N ALA B 92 -7.408 -18.272 10.785 1.00 20.87 N ATOM 1540 CA ALA B 92 -6.148 -18.029 10.078 1.00 20.08 C ATOM 1541 C ALA B 92 -5.204 -19.241 10.027 1.00 19.94 C ATOM 1542 O ALA B 92 -4.233 -19.254 9.278 1.00 21.71 O ATOM 1543 CB ALA B 92 -5.428 -16.867 10.718 1.00 20.28 C ATOM 1544 H ALA B 92 -7.476 -18.027 11.793 1.00 0.00 H ATOM 1545 N HIS B 93 -5.524 -20.273 10.793 1.00 22.03 N ATOM 1546 CA HIS B 93 -4.655 -21.428 10.933 1.00 22.14 C ATOM 1547 C HIS B 93 -4.549 -22.269 9.649 1.00 22.76 C ATOM 1548 O HIS B 93 -5.551 -22.511 8.971 1.00 27.13 O ATOM 1549 CB HIS B 93 -5.167 -22.292 12.080 1.00 21.47 C ATOM 1550 CG HIS B 93 -4.371 -23.535 12.298 1.00 22.65 C ATOM 1551 ND1 HIS B 93 -4.669 -24.726 11.676 1.00 27.60 N ATOM 1552 CD2 HIS B 93 -3.277 -23.764 13.056 1.00 24.08 C ATOM 1553 CE1 HIS B 93 -3.789 -25.642 12.043 1.00 27.89 C ATOM 1554 NE2 HIS B 93 -2.941 -25.089 12.893 1.00 27.49 N ATOM 1555 H HIS B 93 -6.426 -20.256 11.310 1.00 0.00 H ATOM 1556 N THR B 94 -3.330 -22.707 9.327 1.00 23.80 N ATOM 1557 CA THR B 94 -3.104 -23.750 8.320 1.00 25.99 C ATOM 1558 C THR B 94 -2.231 -24.887 8.857 1.00 26.35 C ATOM 1559 O THR B 94 -2.313 -25.996 8.349 1.00 31.43 O ATOM 1560 CB THR B 94 -2.432 -23.240 7.023 1.00 26.45 C ATOM 1561 OG1 THR B 94 -1.028 -22.998 7.245 1.00 27.79 O ATOM 1562 CG2 THR B 94 -3.109 -21.992 6.478 1.00 26.54 C ATOM 1563 HG1 THR B 94 -0.920 -22.316 7.954 1.00 0.00 H ATOM 1564 H THR B 94 -2.507 -22.292 9.809 1.00 0.00 H ATOM 1565 N GLY B 95 -1.401 -24.608 9.862 1.00 27.05 N ATOM 1566 CA GLY B 95 -0.454 -25.581 10.397 1.00 26.82 C ATOM 1567 C GLY B 95 0.954 -25.530 9.813 1.00 26.74 C ATOM 1568 O GLY B 95 1.831 -26.268 10.260 1.00 33.47 O ATOM 1569 H GLY B 95 -1.429 -23.657 10.282 1.00 0.00 H ATOM 1570 N GLU B 96 1.167 -24.661 8.822 1.00 29.95 N ATOM 1571 CA GLU B 96 2.474 -24.441 8.211 1.00 29.96 C ATOM 1572 C GLU B 96 3.120 -23.172 8.768 1.00 25.43 C ATOM 1573 O GLU B 96 2.433 -22.206 9.132 1.00 27.07 O ATOM 1574 CB GLU B 96 2.342 -24.304 6.688 1.00 34.61 C ATOM 1575 CG GLU B 96 1.675 -25.486 5.983 1.00 36.14 C ATOM 1576 CD GLU B 96 2.518 -26.752 5.989 1.00 46.49 C ATOM 1577 OE1 GLU B 96 1.944 -27.849 5.820 1.00 57.49 O ATOM 1578 OE2 GLU B 96 3.754 -26.666 6.158 1.00 57.39 O ATOM 1579 H GLU B 96 0.359 -24.112 8.467 1.00 0.00 H ATOM 1580 N LYS B 97 4.444 -23.170 8.818 1.00 27.11 N ATOM 1581 CA LYS B 97 5.193 -21.975 9.180 1.00 24.51 C ATOM 1582 C LYS B 97 4.776 -20.817 8.274 1.00 23.63 C ATOM 1583 O LYS B 97 4.555 -21.002 7.074 1.00 25.21 O ATOM 1584 CB LYS B 97 6.700 -22.239 9.110 1.00 29.21 C ATOM 1585 CG LYS B 97 7.141 -23.289 10.128 1.00 35.37 C ATOM 1586 CD LYS B 97 8.643 -23.528 10.116 1.00 43.11 C ATOM 1587 CE LYS B 97 9.047 -24.531 11.187 1.00 53.35 C ATOM 1588 NZ LYS B 97 8.918 -23.972 12.562 1.00 60.27 N ATOM 1589 HZ1 LYS B 97 9.531 -23.137 12.654 1.00 0.00 H ATOM 1590 HZ2 LYS B 97 7.929 -23.698 12.732 1.00 0.00 H ATOM 1591 HZ3 LYS B 97 9.204 -24.692 13.256 1.00 0.00 H ATOM 1592 H LYS B 97 4.961 -24.044 8.593 1.00 0.00 H ATOM 1593 N GLY B 98 4.637 -19.634 8.871 1.00 23.99 N ATOM 1594 CA GLY B 98 4.110 -18.455 8.178 1.00 21.06 C ATOM 1595 C GLY B 98 2.678 -18.080 8.548 1.00 18.61 C ATOM 1596 O GLY B 98 2.167 -17.069 8.078 1.00 22.06 O ATOM 1597 H GLY B 98 4.914 -19.544 9.869 1.00 0.00 H ATOM 1598 N ASP B 99 2.044 -18.874 9.408 1.00 21.55 N ATOM 1599 CA ASP B 99 0.663 -18.604 9.824 1.00 20.73 C ATOM 1600 C ASP B 99 0.481 -17.285 10.570 1.00 20.69 C ATOM 1601 O ASP B 99 -0.594 -16.727 10.546 1.00 20.78 O ATOM 1602 CB ASP B 99 0.128 -19.716 10.715 1.00 21.88 C ATOM 1603 CG ASP B 99 -0.431 -20.891 9.930 1.00 22.80 C ATOM 1604 OD1 ASP B 99 -0.416 -20.901 8.673 1.00 23.36 O ATOM 1605 OD2 ASP B 99 -0.917 -21.810 10.611 1.00 23.63 O ATOM 1606 H ASP B 99 2.538 -19.704 9.793 1.00 0.00 H ATOM 1607 N GLY B 100 1.505 -16.813 11.269 1.00 20.56 N ATOM 1608 CA GLY B 100 1.459 -15.484 11.878 1.00 20.34 C ATOM 1609 C GLY B 100 1.193 -15.498 13.358 1.00 17.80 C ATOM 1610 O GLY B 100 1.272 -16.547 14.020 1.00 20.00 O ATOM 1611 H GLY B 100 2.356 -17.399 11.386 1.00 0.00 H ATOM 1612 N LYS B 101 0.885 -14.331 13.888 1.00 17.37 N ATOM 1613 CA LYS B 101 0.794 -14.119 15.302 1.00 19.89 C ATOM 1614 C LYS B 101 -0.265 -13.073 15.566 1.00 17.13 C ATOM 1615 O LYS B 101 -0.548 -12.235 14.711 1.00 20.82 O ATOM 1616 CB LYS B 101 2.138 -13.646 15.872 1.00 22.87 C ATOM 1617 CG LYS B 101 3.227 -14.727 15.828 1.00 26.22 C ATOM 1618 CD LYS B 101 4.346 -14.488 16.828 1.00 30.31 C ATOM 1619 CE LYS B 101 5.428 -15.559 16.705 1.00 32.98 C ATOM 1620 NZ LYS B 101 6.283 -15.345 15.516 1.00 31.85 N ATOM 1621 HZ1 LYS B 101 5.696 -15.374 14.658 1.00 0.00 H ATOM 1622 HZ2 LYS B 101 6.748 -14.418 15.587 1.00 0.00 H ATOM 1623 HZ3 LYS B 101 7.004 -16.093 15.470 1.00 0.00 H ATOM 1624 H LYS B 101 0.700 -13.529 13.252 1.00 0.00 H ATOM 1625 N ILE B 102 -0.825 -13.142 16.763 1.00 19.20 N ATOM 1626 CA ILE B 102 -1.773 -12.181 17.256 1.00 19.61 C ATOM 1627 C ILE B 102 -1.227 -11.564 18.531 1.00 19.51 C ATOM 1628 O ILE B 102 -0.743 -12.260 19.411 1.00 21.67 O ATOM 1629 CB ILE B 102 -3.134 -12.845 17.541 1.00 20.56 C ATOM 1630 CG1 ILE B 102 -3.588 -13.635 16.309 1.00 24.51 C ATOM 1631 CG2 ILE B 102 -4.159 -11.769 17.912 1.00 22.69 C ATOM 1632 CD1 ILE B 102 -4.743 -14.565 16.579 1.00 28.69 C ATOM 1633 H ILE B 102 -0.564 -13.936 17.382 1.00 0.00 H ATOM 1634 N PHE B 103 -1.320 -10.234 18.609 1.00 18.97 N ATOM 1635 CA PHE B 103 -0.867 -9.478 19.751 1.00 18.45 C ATOM 1636 C PHE B 103 -2.017 -8.664 20.326 1.00 19.00 C ATOM 1637 O PHE B 103 -2.850 -8.163 19.582 1.00 23.85 O ATOM 1638 CB PHE B 103 0.268 -8.536 19.327 1.00 19.67 C ATOM 1639 CG PHE B 103 1.383 -9.232 18.601 1.00 20.26 C ATOM 1640 CD1 PHE B 103 2.216 -10.085 19.292 1.00 20.59 C ATOM 1641 CD2 PHE B 103 1.572 -9.064 17.242 1.00 22.64 C ATOM 1642 CE1 PHE B 103 3.247 -10.734 18.645 1.00 21.84 C ATOM 1643 CE2 PHE B 103 2.598 -9.728 16.579 1.00 22.79 C ATOM 1644 CZ PHE B 103 3.439 -10.557 17.289 1.00 23.10 C ATOM 1645 H PHE B 103 -1.739 -9.719 17.808 1.00 0.00 H ATOM 1646 N ILE B 104 -2.050 -8.535 21.641 1.00 19.54 N ATOM 1647 CA ILE B 104 -3.064 -7.718 22.315 1.00 22.84 C ATOM 1648 C ILE B 104 -2.363 -6.563 23.030 1.00 23.04 C ATOM 1649 O ILE B 104 -1.438 -6.785 23.810 1.00 24.28 O ATOM 1650 CB ILE B 104 -3.913 -8.560 23.295 1.00 23.98 C ATOM 1651 CG1 ILE B 104 -4.648 -9.684 22.532 1.00 26.03 C ATOM 1652 CG2 ILE B 104 -4.944 -7.699 24.006 1.00 24.80 C ATOM 1653 CD1 ILE B 104 -5.281 -10.731 23.424 1.00 28.24 C ATOM 1654 H ILE B 104 -1.336 -9.027 22.215 1.00 0.00 H ATOM 1655 N LEU B 105 -2.799 -5.336 22.733 1.00 23.10 N ATOM 1656 CA LEU B 105 -2.225 -4.118 23.299 1.00 23.14 C ATOM 1657 C LEU B 105 -3.282 -3.338 24.064 1.00 23.18 C ATOM 1658 O LEU B 105 -4.453 -3.327 23.671 1.00 24.34 O ATOM 1659 CB LEU B 105 -1.680 -3.224 22.186 1.00 23.21 C ATOM 1660 CG LEU B 105 -0.419 -3.740 21.480 1.00 24.53 C ATOM 1661 CD1 LEU B 105 -0.764 -4.691 20.347 1.00 26.31 C ATOM 1662 CD2 LEU B 105 0.440 -2.599 20.962 1.00 28.42 C ATOM 1663 H LEU B 105 -3.589 -5.243 22.063 1.00 0.00 H ATOM 1664 N PRO B 106 -2.874 -2.654 25.137 1.00 25.40 N ATOM 1665 CA PRO B 106 -3.810 -1.790 25.848 1.00 25.55 C ATOM 1666 C PRO B 106 -4.166 -0.504 25.087 1.00 25.68 C ATOM 1667 O PRO B 106 -3.330 0.094 24.395 1.00 27.11 O ATOM 1668 CB PRO B 106 -3.070 -1.469 27.145 1.00 28.65 C ATOM 1669 CG PRO B 106 -1.633 -1.528 26.774 1.00 28.55 C ATOM 1670 CD PRO B 106 -1.515 -2.568 25.696 1.00 28.76 C ATOM 1671 N VAL B 107 -5.427 -0.107 25.205 1.00 25.70 N ATOM 1672 CA VAL B 107 -5.917 1.154 24.651 1.00 23.66 C ATOM 1673 C VAL B 107 -6.491 1.929 25.821 1.00 24.92 C ATOM 1674 O VAL B 107 -7.247 1.375 26.604 1.00 28.75 O ATOM 1675 CB VAL B 107 -7.002 0.911 23.586 1.00 23.49 C ATOM 1676 CG1 VAL B 107 -7.657 2.210 23.150 1.00 23.71 C ATOM 1677 CG2 VAL B 107 -6.421 0.189 22.382 1.00 24.03 C ATOM 1678 H VAL B 107 -6.096 -0.720 25.714 1.00 0.00 H ATOM 1679 N GLU B 108 -6.134 3.206 25.945 1.00 24.63 N ATOM 1680 CA GLU B 108 -6.570 4.001 27.092 1.00 26.95 C ATOM 1681 C GLU B 108 -7.855 4.785 26.848 1.00 27.64 C ATOM 1682 O GLU B 108 -8.574 5.097 27.789 1.00 31.67 O ATOM 1683 CB GLU B 108 -5.449 4.944 27.529 1.00 30.28 C ATOM 1684 CG GLU B 108 -4.297 4.193 28.185 1.00 35.84 C ATOM 1685 CD GLU B 108 -3.144 5.089 28.598 1.00 45.37 C ATOM 1686 OE1 GLU B 108 -3.152 6.290 28.245 1.00 46.90 O ATOM 1687 OE2 GLU B 108 -2.216 4.586 29.280 1.00 53.07 O ATOM 1688 H GLU B 108 -5.536 3.644 25.215 1.00 0.00 H ATOM 1689 N ASN B 109 -8.136 5.110 25.595 1.00 25.57 N ATOM 1690 CA ASN B 109 -9.348 5.837 25.260 1.00 26.19 C ATOM 1691 C ASN B 109 -9.725 5.644 23.805 1.00 26.05 C ATOM 1692 O ASN B 109 -8.896 5.250 22.973 1.00 23.73 O ATOM 1693 CB ASN B 109 -9.197 7.335 25.571 1.00 30.64 C ATOM 1694 CG ASN B 109 -10.535 8.035 25.820 1.00 40.31 C ATOM 1695 OD1 ASN B 109 -11.604 7.405 25.896 1.00 40.70 O ATOM 1696 ND2 ASN B 109 -10.477 9.354 25.949 1.00 50.13 N ATOM 1697 HD22 ASN B 109 -9.562 9.844 25.879 1.00 0.00 H ATOM 1698 HD21 ASN B 109 -11.346 9.898 26.120 1.00 0.00 H ATOM 1699 H ASN B 109 -7.477 4.840 24.837 1.00 0.00 H ATOM 1700 N ALA B 110 -10.993 5.929 23.518 1.00 26.41 N ATOM 1701 CA ALA B 110 -11.533 5.877 22.176 1.00 25.29 C ATOM 1702 C ALA B 110 -12.516 7.022 21.977 1.00 23.74 C ATOM 1703 O ALA B 110 -13.255 7.392 22.905 1.00 27.27 O ATOM 1704 CB ALA B 110 -12.226 4.547 21.922 1.00 28.67 C ATOM 1705 H ALA B 110 -11.627 6.202 24.296 1.00 0.00 H ATOM 1706 N ILE B 111 -12.547 7.549 20.760 1.00 23.96 N ATOM 1707 CA ILE B 111 -13.508 8.567 20.366 1.00 24.37 C ATOM 1708 C ILE B 111 -14.157 8.187 19.042 1.00 23.15 C ATOM 1709 O ILE B 111 -13.484 7.849 18.080 1.00 25.65 O ATOM 1710 CB ILE B 111 -12.831 9.948 20.207 1.00 29.08 C ATOM 1711 CG1 ILE B 111 -12.109 10.335 21.499 1.00 36.03 C ATOM 1712 CG2 ILE B 111 -13.863 10.998 19.800 1.00 31.16 C ATOM 1713 CD1 ILE B 111 -11.367 11.654 21.424 1.00 43.77 C ATOM 1714 H ILE B 111 -11.854 7.220 20.057 1.00 0.00 H ATOM 1715 N GLN B 112 -15.484 8.254 18.997 1.00 23.49 N ATOM 1716 CA GLN B 112 -16.196 8.137 17.731 1.00 24.86 C ATOM 1717 C GLN B 112 -16.166 9.482 17.028 1.00 24.57 C ATOM 1718 O GLN B 112 -16.624 10.478 17.590 1.00 31.12 O ATOM 1719 CB GLN B 112 -17.653 7.751 17.953 1.00 30.67 C ATOM 1720 CG GLN B 112 -17.919 6.272 18.037 1.00 36.69 C ATOM 1721 CD GLN B 112 -19.358 5.945 18.369 1.00 36.51 C ATOM 1722 OE1 GLN B 112 -19.661 4.828 18.789 1.00 52.44 O ATOM 1723 NE2 GLN B 112 -20.252 6.909 18.186 1.00 33.70 N ATOM 1724 HE22 GLN B 112 -19.950 7.838 17.829 1.00 0.00 H ATOM 1725 HE21 GLN B 112 -21.255 6.736 18.400 1.00 0.00 H ATOM 1726 H GLN B 112 -16.021 8.392 19.877 1.00 0.00 H ATOM 1727 N VAL B 113 -15.682 9.518 15.797 1.00 22.43 N ATOM 1728 CA VAL B 113 -15.598 10.773 15.050 1.00 23.38 C ATOM 1729 C VAL B 113 -17.004 11.347 14.759 1.00 24.29 C ATOM 1730 O VAL B 113 -17.224 12.540 14.880 1.00 26.04 O ATOM 1731 CB VAL B 113 -14.826 10.586 13.725 1.00 20.44 C ATOM 1732 CG1 VAL B 113 -14.898 11.848 12.867 1.00 23.30 C ATOM 1733 CG2 VAL B 113 -13.364 10.199 13.990 1.00 19.78 C ATOM 1734 H VAL B 113 -15.355 8.637 15.352 1.00 0.00 H ATOM 1735 N ARG B 114 -17.945 10.492 14.374 1.00 22.93 N ATOM 1736 CA ARG B 114 -19.282 10.962 13.939 1.00 24.32 C ATOM 1737 C ARG B 114 -20.039 11.688 15.036 1.00 26.37 C ATOM 1738 O ARG B 114 -20.702 12.673 14.740 1.00 28.65 O ATOM 1739 CB ARG B 114 -20.103 9.792 13.414 1.00 26.56 C ATOM 1740 CG ARG B 114 -21.408 10.178 12.719 1.00 30.18 C ATOM 1741 CD ARG B 114 -22.033 8.972 12.043 1.00 34.54 C ATOM 1742 NE ARG B 114 -22.740 8.125 13.001 1.00 39.47 N ATOM 1743 CZ ARG B 114 -24.063 8.152 13.205 1.00 41.55 C ATOM 1744 NH1 ARG B 114 -24.849 8.966 12.503 1.00 44.72 N ATOM 1745 NH2 ARG B 114 -24.600 7.351 14.109 1.00 45.21 N ATOM 1746 HE ARG B 114 -22.177 7.455 13.563 1.00 0.00 H ATOM 1747 HH12 ARG B 114 -25.875 8.974 12.674 1.00 0.00 H ATOM 1748 HH11 ARG B 114 -24.437 9.594 11.783 1.00 0.00 H ATOM 1749 HH22 ARG B 114 -25.627 7.366 14.273 1.00 0.00 H ATOM 1750 HH21 ARG B 114 -23.996 6.705 14.656 1.00 0.00 H ATOM 1751 H ARG B 114 -17.740 9.472 14.378 1.00 0.00 H ATOM 1752 N THR B 115 -19.912 11.230 16.277 1.00 24.83 N ATOM 1753 CA THR B 115 -20.687 11.752 17.410 1.00 26.15 C ATOM 1754 C THR B 115 -19.850 12.499 18.441 1.00 27.29 C ATOM 1755 O THR B 115 -20.393 13.284 19.228 1.00 37.23 O ATOM 1756 CB THR B 115 -21.349 10.592 18.159 1.00 27.25 C ATOM 1757 OG1 THR B 115 -20.310 9.683 18.579 1.00 29.89 O ATOM 1758 CG2 THR B 115 -22.280 9.860 17.241 1.00 29.29 C ATOM 1759 HG1 THR B 115 -20.715 8.923 19.067 1.00 0.00 H ATOM 1760 H THR B 115 -19.231 10.465 16.455 1.00 0.00 H ATOM 1761 N GLY B 116 -18.537 12.265 18.449 1.00 28.46 N ATOM 1762 CA GLY B 116 -17.684 12.739 19.533 1.00 29.34 C ATOM 1763 C GLY B 116 -17.875 12.003 20.855 1.00 29.10 C ATOM 1764 O GLY B 116 -17.349 12.415 21.884 1.00 32.75 O ATOM 1765 H GLY B 116 -18.111 11.732 17.664 1.00 0.00 H ATOM 1766 N LYS B 117 -18.620 10.903 20.835 1.00 29.03 N ATOM 1767 CA LYS B 117 -18.734 10.033 22.000 1.00 30.67 C ATOM 1768 C LYS B 117 -17.362 9.433 22.350 1.00 28.34 C ATOM 1769 O LYS B 117 -16.628 9.017 21.467 1.00 29.78 O ATOM 1770 CB LYS B 117 -19.705 8.896 21.715 1.00 32.30 C ATOM 1771 CG LYS B 117 -19.953 8.008 22.918 1.00 38.07 C ATOM 1772 CD LYS B 117 -21.257 7.248 22.797 1.00 41.79 C ATOM 1773 CE LYS B 117 -21.472 6.335 23.993 1.00 45.50 C ATOM 1774 NZ LYS B 117 -21.452 7.053 25.304 1.00 49.01 N ATOM 1775 HZ1 LYS B 117 -20.530 7.518 25.429 1.00 0.00 H ATOM 1776 HZ2 LYS B 117 -22.207 7.768 25.318 1.00 0.00 H ATOM 1777 HZ3 LYS B 117 -21.604 6.371 26.074 1.00 0.00 H ATOM 1778 H LYS B 117 -19.135 10.656 19.966 1.00 0.00 H ATOM 1779 N THR B 118 -17.054 9.381 23.646 1.00 30.22 N ATOM 1780 CA THR B 118 -15.767 8.880 24.122 1.00 31.58 C ATOM 1781 C THR B 118 -15.927 7.743 25.130 1.00 34.24 C ATOM 1782 O THR B 118 -17.002 7.545 25.710 1.00 41.66 O ATOM 1783 CB THR B 118 -14.937 9.988 24.807 1.00 38.59 C ATOM 1784 OG1 THR B 118 -15.506 10.297 26.084 1.00 44.44 O ATOM 1785 CG2 THR B 118 -14.888 11.243 23.952 1.00 38.22 C ATOM 1786 HG1 THR B 118 -16.437 10.611 25.962 1.00 0.00 H ATOM 1787 H THR B 118 -17.754 9.708 24.342 1.00 0.00 H ATOM 1788 N GLY B 119 -14.834 7.019 25.343 1.00 34.84 N ATOM 1789 CA GLY B 119 -14.781 5.937 26.327 1.00 35.41 C ATOM 1790 C GLY B 119 -15.090 4.573 25.738 1.00 35.01 C ATOM 1791 O GLY B 119 -15.138 4.402 24.518 1.00 33.34 O ATOM 1792 H GLY B 119 -13.980 7.230 24.787 1.00 0.00 H ATOM 1793 N ARG B 120 -15.329 3.603 26.618 1.00 35.78 N ATOM 1794 CA ARG B 120 -15.532 2.211 26.191 1.00 27.54 C ATOM 1795 C ARG B 120 -16.767 2.027 25.322 1.00 32.05 C ATOM 1796 O ARG B 120 -16.779 1.188 24.416 1.00 38.40 O ATOM 1797 CB ARG B 120 -15.546 1.253 27.394 1.00 37.94 C ATOM 1798 CG ARG B 120 -16.654 1.482 28.410 1.00 44.18 C ATOM 1799 CD ARG B 120 -16.642 0.423 29.505 1.00 49.57 C ATOM 1800 NE ARG B 120 -16.557 -0.936 28.966 1.00 52.99 N ATOM 1801 CZ ARG B 120 -17.552 -1.588 28.363 1.00 57.11 C ATOM 1802 NH1 ARG B 120 -17.349 -2.820 27.912 1.00 55.87 N ATOM 1803 NH2 ARG B 120 -18.746 -1.022 28.200 1.00 60.52 N ATOM 1804 HE ARG B 120 -15.648 -1.432 29.061 1.00 0.00 H ATOM 1805 HH12 ARG B 120 -18.120 -3.335 27.441 1.00 0.00 H ATOM 1806 HH11 ARG B 120 -16.419 -3.270 28.030 1.00 0.00 H ATOM 1807 HH22 ARG B 120 -19.510 -1.546 27.727 1.00 0.00 H ATOM 1808 HH21 ARG B 120 -18.915 -0.056 28.545 1.00 0.00 H ATOM 1809 H ARG B 120 -15.373 3.835 27.631 1.00 0.00 H ATOM 1810 N ASP B 121 -17.793 2.835 25.574 1.00 38.03 N ATOM 1811 CA ASP B 121 -19.012 2.784 24.784 1.00 40.21 C ATOM 1812 C ASP B 121 -18.841 3.390 23.379 1.00 36.48 C ATOM 1813 O ASP B 121 -19.695 3.182 22.514 1.00 42.66 O ATOM 1814 CB ASP B 121 -20.154 3.472 25.543 1.00 45.87 C ATOM 1815 CG ASP B 121 -20.455 2.805 26.881 1.00 56.55 C ATOM 1816 OD1 ASP B 121 -20.309 1.568 26.992 1.00 61.63 O ATOM 1817 OD2 ASP B 121 -20.841 3.524 27.827 1.00 72.06 O ATOM 1818 H ASP B 121 -17.721 3.519 26.354 1.00 0.00 H ATOM 1819 N ALA B 122 -17.745 4.124 23.144 1.00 31.68 N ATOM 1820 CA ALA B 122 -17.406 4.570 21.791 1.00 34.32 C ATOM 1821 C ALA B 122 -16.868 3.409 20.941 1.00 32.95 C ATOM 1822 O ALA B 122 -16.792 3.528 19.718 1.00 35.72 O ATOM 1823 CB ALA B 122 -16.404 5.715 21.833 1.00 34.61 C ATOM 1824 H ALA B 122 -17.124 4.382 23.937 1.00 0.00 H ATOM 1825 N VAL B 123 -16.468 2.325 21.619 1.00 33.86 N ATOM 1826 CA VAL B 123 -16.232 0.971 21.058 1.00 40.75 C ATOM 1827 C VAL B 123 -14.770 0.527 21.267 1.00 38.69 C ATOM 1828 O VAL B 123 -14.355 -0.589 20.929 1.00 43.70 O ATOM 1829 CB VAL B 123 -16.794 0.767 19.607 1.00 42.61 C ATOM 1830 CG1 VAL B 123 -15.730 0.360 18.598 1.00 43.28 C ATOM 1831 CG2 VAL B 123 -17.895 -0.280 19.604 1.00 46.54 C ATOM 1832 OXT VAL B 123 -13.959 1.270 21.833 1.00 45.79 O ATOM 1833 H VAL B 123 -16.307 2.444 22.640 1.00 0.00 H TER 1834 VAL B 123 ATOM 1835 N LEU C 6 14.587 -10.672 34.368 1.00 64.45 N ATOM 1836 CA LEU C 6 14.369 -11.119 32.957 1.00 59.46 C ATOM 1837 C LEU C 6 14.178 -9.926 32.011 1.00 55.16 C ATOM 1838 O LEU C 6 13.750 -8.855 32.443 1.00 52.43 O ATOM 1839 CB LEU C 6 13.154 -12.045 32.873 1.00 61.94 C ATOM 1840 HN3 LEU C 6 13.762 -10.126 34.689 1.00 0.00 H ATOM 1841 HN2 LEU C 6 15.438 -10.076 34.414 1.00 0.00 H ATOM 1842 HN1 LEU C 6 14.712 -11.504 34.979 1.00 0.00 H ATOM 1843 N PRO C 7 14.497 -10.107 30.716 1.00 43.87 N ATOM 1844 CA PRO C 7 14.372 -9.008 29.750 1.00 41.34 C ATOM 1845 C PRO C 7 12.944 -8.460 29.634 1.00 39.89 C ATOM 1846 O PRO C 7 11.974 -9.209 29.763 1.00 42.12 O ATOM 1847 CB PRO C 7 14.832 -9.628 28.423 1.00 40.82 C ATOM 1848 CG PRO C 7 14.850 -11.105 28.643 1.00 47.42 C ATOM 1849 CD PRO C 7 15.059 -11.323 30.105 1.00 49.43 C ATOM 1850 N ASN C 8 12.839 -7.153 29.410 1.00 40.45 N ATOM 1851 CA ASN C 8 11.550 -6.461 29.300 1.00 35.08 C ATOM 1852 C ASN C 8 10.649 -6.686 30.520 1.00 40.24 C ATOM 1853 O ASN C 8 9.426 -6.755 30.398 1.00 39.66 O ATOM 1854 CB ASN C 8 10.831 -6.871 28.011 1.00 32.63 C ATOM 1855 CG ASN C 8 11.674 -6.621 26.776 1.00 31.67 C ATOM 1856 OD1 ASN C 8 12.021 -5.479 26.470 1.00 33.68 O ATOM 1857 ND2 ASN C 8 12.004 -7.683 26.054 1.00 30.86 N ATOM 1858 HD22 ASN C 8 11.690 -8.630 26.348 1.00 0.00 H ATOM 1859 HD21 ASN C 8 12.577 -7.569 25.193 1.00 0.00 H ATOM 1860 H ASN C 8 13.711 -6.596 29.308 1.00 0.00 H ATOM 1861 N ASP C 9 11.276 -6.803 31.690 1.00 45.64 N ATOM 1862 CA ASP C 9 10.578 -7.019 32.958 1.00 48.21 C ATOM 1863 C ASP C 9 9.651 -8.252 32.916 1.00 45.23 C ATOM 1864 O ASP C 9 8.594 -8.277 33.554 1.00 49.52 O ATOM 1865 CB ASP C 9 9.802 -5.747 33.344 1.00 51.93 C ATOM 1866 CG ASP C 9 9.927 -5.393 34.827 1.00 64.30 C ATOM 1867 OD1 ASP C 9 10.701 -6.056 35.560 1.00 78.67 O ATOM 1868 OD2 ASP C 9 9.252 -4.433 35.259 1.00 78.04 O ATOM 1869 H ASP C 9 12.314 -6.738 31.703 1.00 0.00 H ATOM 1870 N GLY C 10 10.064 -9.271 32.162 1.00 41.58 N ATOM 1871 CA GLY C 10 9.287 -10.504 32.017 1.00 39.56 C ATOM 1872 C GLY C 10 8.098 -10.400 31.079 1.00 39.41 C ATOM 1873 O GLY C 10 7.307 -11.336 30.983 1.00 44.63 O ATOM 1874 H GLY C 10 10.970 -9.187 31.659 1.00 0.00 H ATOM 1875 N GLY C 11 7.982 -9.275 30.375 1.00 38.35 N ATOM 1876 CA GLY C 11 6.857 -9.014 29.496 1.00 34.77 C ATOM 1877 C GLY C 11 7.197 -8.988 28.018 1.00 30.70 C ATOM 1878 O GLY C 11 8.238 -9.475 27.585 1.00 33.76 O ATOM 1879 H GLY C 11 8.728 -8.555 30.459 1.00 0.00 H ATOM 1880 N ILE C 12 6.294 -8.392 27.252 1.00 26.81 N ATOM 1881 CA ILE C 12 6.356 -8.355 25.798 1.00 24.74 C ATOM 1882 C ILE C 12 6.252 -6.885 25.406 1.00 23.89 C ATOM 1883 O ILE C 12 5.492 -6.135 26.023 1.00 25.74 O ATOM 1884 CB ILE C 12 5.161 -9.107 25.169 1.00 24.43 C ATOM 1885 CG1 ILE C 12 5.045 -10.523 25.749 1.00 24.97 C ATOM 1886 CG2 ILE C 12 5.297 -9.187 23.656 1.00 22.95 C ATOM 1887 CD1 ILE C 12 3.716 -11.194 25.448 1.00 28.43 C ATOM 1888 H ILE C 12 5.492 -7.922 27.718 1.00 0.00 H ATOM 1889 N LYS C 13 7.022 -6.482 24.397 1.00 23.66 N ATOM 1890 CA LYS C 13 7.013 -5.103 23.907 1.00 22.93 C ATOM 1891 C LYS C 13 6.948 -5.066 22.400 1.00 20.46 C ATOM 1892 O LYS C 13 7.458 -5.958 21.732 1.00 22.61 O ATOM 1893 CB LYS C 13 8.286 -4.359 24.334 1.00 23.98 C ATOM 1894 CG LYS C 13 8.589 -4.393 25.813 1.00 27.30 C ATOM 1895 CD LYS C 13 7.599 -3.596 26.630 1.00 30.45 C ATOM 1896 CE LYS C 13 7.910 -3.718 28.111 1.00 34.17 C ATOM 1897 NZ LYS C 13 6.796 -3.211 28.954 1.00 40.72 N ATOM 1898 HZ1 LYS C 13 6.628 -2.208 28.737 1.00 0.00 H ATOM 1899 HZ2 LYS C 13 5.935 -3.759 28.755 1.00 0.00 H ATOM 1900 HZ3 LYS C 13 7.049 -3.312 29.958 1.00 0.00 H ATOM 1901 H LYS C 13 7.652 -7.172 23.941 1.00 0.00 H ATOM 1902 N LEU C 14 6.317 -4.011 21.877 1.00 20.00 N ATOM 1903 CA LEU C 14 6.297 -3.722 20.462 1.00 18.69 C ATOM 1904 C LEU C 14 7.255 -2.565 20.199 1.00 19.01 C ATOM 1905 O LEU C 14 7.117 -1.482 20.786 1.00 21.60 O ATOM 1906 CB LEU C 14 4.885 -3.325 19.999 1.00 20.30 C ATOM 1907 CG LEU C 14 4.775 -2.675 18.613 1.00 22.20 C ATOM 1908 CD1 LEU C 14 5.202 -3.640 17.529 1.00 24.58 C ATOM 1909 CD2 LEU C 14 3.356 -2.183 18.363 1.00 22.42 C ATOM 1910 H LEU C 14 5.815 -3.366 22.520 1.00 0.00 H ATOM 1911 N VAL C 15 8.235 -2.810 19.338 1.00 20.39 N ATOM 1912 CA VAL C 15 9.141 -1.774 18.873 1.00 19.37 C ATOM 1913 C VAL C 15 8.654 -1.359 17.494 1.00 20.11 C ATOM 1914 O VAL C 15 8.576 -2.178 16.597 1.00 21.30 O ATOM 1915 CB VAL C 15 10.590 -2.276 18.792 1.00 20.64 C ATOM 1916 CG1 VAL C 15 11.517 -1.142 18.354 1.00 21.82 C ATOM 1917 CG2 VAL C 15 11.017 -2.832 20.145 1.00 23.77 C ATOM 1918 H VAL C 15 8.359 -3.780 18.983 1.00 0.00 H ATOM 1919 N MET C 16 8.285 -0.087 17.358 1.00 17.90 N ATOM 1920 CA MET C 16 7.749 0.466 16.128 1.00 18.28 C ATOM 1921 C MET C 16 8.662 1.579 15.655 1.00 17.79 C ATOM 1922 O MET C 16 8.821 2.581 16.351 1.00 23.47 O ATOM 1923 CB MET C 16 6.356 1.044 16.394 1.00 21.81 C ATOM 1924 CG MET C 16 5.710 1.726 15.211 1.00 27.97 C ATOM 1925 SD MET C 16 4.213 2.646 15.665 1.00 38.37 S ATOM 1926 CE MET C 16 3.202 1.335 16.339 1.00 38.66 C ATOM 1927 H MET C 16 8.386 0.545 18.178 1.00 0.00 H ATOM 1928 N ALA C 17 9.252 1.410 14.481 1.00 15.99 N ATOM 1929 CA ALA C 17 10.210 2.374 13.933 1.00 17.49 C ATOM 1930 C ALA C 17 9.704 2.932 12.624 1.00 17.79 C ATOM 1931 O ALA C 17 9.172 2.193 11.800 1.00 19.88 O ATOM 1932 CB ALA C 17 11.550 1.692 13.703 1.00 19.00 C ATOM 1933 H ALA C 17 9.026 0.560 13.926 1.00 0.00 H ATOM 1934 N ILE C 18 9.804 4.248 12.447 1.00 15.81 N ATOM 1935 CA ILE C 18 9.549 4.839 11.154 1.00 16.84 C ATOM 1936 C ILE C 18 10.878 5.328 10.636 1.00 16.58 C ATOM 1937 O ILE C 18 11.541 6.127 11.307 1.00 20.48 O ATOM 1938 CB ILE C 18 8.531 5.992 11.187 1.00 18.72 C ATOM 1939 CG1 ILE C 18 7.214 5.544 11.811 1.00 25.10 C ATOM 1940 CG2 ILE C 18 8.314 6.520 9.776 1.00 22.21 C ATOM 1941 CD1 ILE C 18 7.164 5.735 13.297 1.00 32.62 C ATOM 1942 H ILE C 18 10.068 4.856 13.248 1.00 0.00 H ATOM 1943 N ILE C 19 11.266 4.846 9.465 1.00 17.24 N ATOM 1944 CA ILE C 19 12.620 5.070 8.943 1.00 18.29 C ATOM 1945 C ILE C 19 12.574 5.358 7.454 1.00 17.01 C ATOM 1946 O ILE C 19 11.526 5.228 6.819 1.00 17.47 O ATOM 1947 CB ILE C 19 13.532 3.843 9.180 1.00 21.94 C ATOM 1948 CG1 ILE C 19 12.977 2.635 8.416 1.00 19.14 C ATOM 1949 CG2 ILE C 19 13.668 3.573 10.659 1.00 23.74 C ATOM 1950 CD1 ILE C 19 13.819 1.378 8.469 1.00 22.65 C ATOM 1951 H ILE C 19 10.592 4.293 8.899 1.00 0.00 H ATOM 1952 N ARG C 20 13.706 5.760 6.889 1.00 17.37 N ATOM 1953 CA ARG C 20 13.831 5.944 5.452 1.00 17.90 C ATOM 1954 C ARG C 20 13.736 4.611 4.720 1.00 19.17 C ATOM 1955 O ARG C 20 14.341 3.623 5.167 1.00 21.63 O ATOM 1956 CB ARG C 20 15.197 6.557 5.120 1.00 18.55 C ATOM 1957 CG ARG C 20 15.404 7.926 5.715 1.00 19.76 C ATOM 1958 CD ARG C 20 16.842 8.398 5.510 1.00 21.23 C ATOM 1959 NE ARG C 20 17.089 9.662 6.195 1.00 22.29 N ATOM 1960 CZ ARG C 20 16.699 10.861 5.775 1.00 23.55 C ATOM 1961 NH1 ARG C 20 16.041 11.016 4.635 1.00 26.12 N ATOM 1962 NH2 ARG C 20 17.000 11.926 6.510 1.00 26.45 N ATOM 1963 HE ARG C 20 17.616 9.621 7.090 1.00 0.00 H ATOM 1964 HH12 ARG C 20 15.747 11.966 4.329 1.00 0.00 H ATOM 1965 HH11 ARG C 20 15.819 10.188 4.046 1.00 0.00 H ATOM 1966 HH22 ARG C 20 16.704 12.873 6.199 1.00 0.00 H ATOM 1967 HH21 ARG C 20 17.532 11.813 7.397 1.00 0.00 H ATOM 1968 H ARG C 20 14.530 5.950 7.494 1.00 0.00 H ATOM 1969 N PRO C 21 13.038 4.581 3.568 1.00 19.92 N ATOM 1970 CA PRO C 21 12.929 3.311 2.824 1.00 21.24 C ATOM 1971 C PRO C 21 14.272 2.679 2.448 1.00 22.81 C ATOM 1972 O PRO C 21 14.427 1.437 2.496 1.00 24.08 O ATOM 1973 CB PRO C 21 12.132 3.711 1.575 1.00 24.57 C ATOM 1974 CG PRO C 21 11.330 4.890 2.015 1.00 24.23 C ATOM 1975 CD PRO C 21 12.255 5.652 2.920 1.00 22.07 C ATOM 1976 N ASP C 22 15.258 3.509 2.119 1.00 22.24 N ATOM 1977 CA ASP C 22 16.550 2.983 1.684 1.00 22.45 C ATOM 1978 C ASP C 22 17.370 2.326 2.804 1.00 23.48 C ATOM 1979 O ASP C 22 18.360 1.651 2.521 1.00 27.97 O ATOM 1980 CB ASP C 22 17.371 4.053 0.967 1.00 27.47 C ATOM 1981 CG ASP C 22 17.824 5.173 1.885 1.00 40.15 C ATOM 1982 OD1 ASP C 22 17.284 5.306 3.006 1.00 56.09 O ATOM 1983 OD2 ASP C 22 18.731 5.938 1.483 1.00 67.78 O ATOM 1984 H ASP C 22 15.109 4.537 2.172 1.00 0.00 H ATOM 1985 N LYS C 23 16.951 2.505 4.055 1.00 20.49 N ATOM 1986 CA LYS C 23 17.616 1.905 5.219 1.00 20.80 C ATOM 1987 C LYS C 23 17.002 0.584 5.664 1.00 21.08 C ATOM 1988 O LYS C 23 17.477 -0.040 6.599 1.00 20.55 O ATOM 1989 CB LYS C 23 17.571 2.887 6.381 1.00 20.64 C ATOM 1990 CG LYS C 23 18.438 4.115 6.183 1.00 21.92 C ATOM 1991 CD LYS C 23 19.859 3.695 5.862 1.00 23.59 C ATOM 1992 CE LYS C 23 20.825 4.814 6.100 1.00 26.62 C ATOM 1993 NZ LYS C 23 22.204 4.282 5.965 1.00 34.42 N ATOM 1994 HZ1 LYS C 23 22.354 3.528 6.666 1.00 0.00 H ATOM 1995 HZ2 LYS C 23 22.334 3.898 5.007 1.00 0.00 H ATOM 1996 HZ3 LYS C 23 22.888 5.049 6.128 1.00 0.00 H ATOM 1997 H LYS C 23 16.112 3.098 4.216 1.00 0.00 H ATOM 1998 N LEU C 24 15.911 0.165 5.024 1.00 20.10 N ATOM 1999 CA LEU C 24 15.276 -1.087 5.432 1.00 19.71 C ATOM 2000 C LEU C 24 16.232 -2.293 5.347 1.00 20.52 C ATOM 2001 O LEU C 24 16.270 -3.120 6.268 1.00 21.19 O ATOM 2002 CB LEU C 24 14.008 -1.347 4.613 1.00 18.63 C ATOM 2003 CG LEU C 24 13.285 -2.663 4.917 1.00 19.53 C ATOM 2004 CD1 LEU C 24 12.909 -2.758 6.392 1.00 22.24 C ATOM 2005 CD2 LEU C 24 12.072 -2.830 4.006 1.00 20.98 C ATOM 2006 H LEU C 24 15.515 0.724 4.241 1.00 0.00 H ATOM 2007 N ALA C 25 17.001 -2.403 4.266 1.00 21.02 N ATOM 2008 CA ALA C 25 17.907 -3.550 4.127 1.00 24.45 C ATOM 2009 C ALA C 25 18.900 -3.613 5.300 1.00 25.28 C ATOM 2010 O ALA C 25 19.129 -4.671 5.890 1.00 25.96 O ATOM 2011 CB ALA C 25 18.632 -3.507 2.791 1.00 28.27 C ATOM 2012 H ALA C 25 16.960 -1.678 3.521 1.00 0.00 H ATOM 2013 N ASP C 26 19.475 -2.470 5.655 1.00 21.64 N ATOM 2014 CA ASP C 26 20.435 -2.423 6.762 1.00 25.95 C ATOM 2015 C ASP C 26 19.776 -2.713 8.115 1.00 22.14 C ATOM 2016 O ASP C 26 20.362 -3.397 8.961 1.00 22.82 O ATOM 2017 CB ASP C 26 21.151 -1.073 6.778 1.00 27.19 C ATOM 2018 CG ASP C 26 22.205 -0.950 5.669 1.00 35.65 C ATOM 2019 OD1 ASP C 26 22.560 -1.970 5.032 1.00 38.22 O ATOM 2020 OD2 ASP C 26 22.679 0.181 5.421 1.00 43.64 O ATOM 2021 H ASP C 26 19.241 -1.597 5.141 1.00 0.00 H ATOM 2022 N VAL C 27 18.538 -2.243 8.297 1.00 20.43 N ATOM 2023 CA VAL C 27 17.780 -2.537 9.517 1.00 20.78 C ATOM 2024 C VAL C 27 17.483 -4.053 9.631 1.00 19.93 C ATOM 2025 O VAL C 27 17.616 -4.643 10.702 1.00 21.47 O ATOM 2026 CB VAL C 27 16.487 -1.690 9.575 1.00 19.37 C ATOM 2027 CG1 VAL C 27 15.530 -2.224 10.630 1.00 24.18 C ATOM 2028 CG2 VAL C 27 16.888 -0.248 9.861 1.00 20.57 C ATOM 2029 H VAL C 27 18.103 -1.656 7.557 1.00 0.00 H ATOM 2030 N LYS C 28 17.100 -4.676 8.524 1.00 20.46 N ATOM 2031 CA LYS C 28 16.842 -6.113 8.527 1.00 21.22 C ATOM 2032 C LYS C 28 18.104 -6.893 8.973 1.00 23.30 C ATOM 2033 O LYS C 28 18.033 -7.803 9.803 1.00 25.88 O ATOM 2034 CB LYS C 28 16.384 -6.574 7.141 1.00 22.81 C ATOM 2035 CG LYS C 28 14.966 -6.173 6.781 1.00 25.08 C ATOM 2036 CD LYS C 28 14.486 -6.944 5.577 1.00 32.25 C ATOM 2037 CE LYS C 28 15.216 -6.595 4.304 1.00 34.41 C ATOM 2038 NZ LYS C 28 14.695 -7.478 3.232 1.00 33.45 N ATOM 2039 HZ1 LYS C 28 14.867 -8.471 3.489 1.00 0.00 H ATOM 2040 HZ2 LYS C 28 13.673 -7.319 3.120 1.00 0.00 H ATOM 2041 HZ3 LYS C 28 15.181 -7.260 2.339 1.00 0.00 H ATOM 2042 H LYS C 28 16.982 -4.134 7.644 1.00 0.00 H ATOM 2043 N THR C 29 19.259 -6.505 8.435 1.00 24.57 N ATOM 2044 CA THR C 29 20.531 -7.146 8.775 1.00 24.41 C ATOM 2045 C THR C 29 20.839 -6.944 10.258 1.00 27.42 C ATOM 2046 O THR C 29 21.190 -7.894 10.951 1.00 28.04 O ATOM 2047 CB THR C 29 21.657 -6.580 7.903 1.00 28.36 C ATOM 2048 OG1 THR C 29 21.335 -6.802 6.523 1.00 31.74 O ATOM 2049 CG2 THR C 29 23.009 -7.247 8.237 1.00 28.78 C ATOM 2050 HG1 THR C 29 22.059 -6.438 5.954 1.00 0.00 H ATOM 2051 H THR C 29 19.257 -5.721 7.751 1.00 0.00 H ATOM 2052 N ALA C 30 20.639 -5.721 10.756 1.00 25.21 N ATOM 2053 CA ALA C 30 20.893 -5.424 12.166 1.00 28.79 C ATOM 2054 C ALA C 30 19.997 -6.221 13.112 1.00 25.40 C ATOM 2055 O ALA C 30 20.449 -6.700 14.155 1.00 30.43 O ATOM 2056 CB ALA C 30 20.766 -3.938 12.439 1.00 26.94 C ATOM 2057 H ALA C 30 20.296 -4.965 10.129 1.00 0.00 H ATOM 2058 N LEU C 31 18.731 -6.383 12.736 1.00 23.52 N ATOM 2059 CA LEU C 31 17.808 -7.165 13.545 1.00 24.63 C ATOM 2060 C LEU C 31 18.208 -8.634 13.596 1.00 26.66 C ATOM 2061 O LEU C 31 18.189 -9.254 14.659 1.00 29.36 O ATOM 2062 CB LEU C 31 16.385 -7.014 13.016 1.00 22.00 C ATOM 2063 CG LEU C 31 15.721 -5.668 13.283 1.00 23.25 C ATOM 2064 CD1 LEU C 31 14.460 -5.518 12.441 1.00 26.71 C ATOM 2065 CD2 LEU C 31 15.383 -5.533 14.755 1.00 28.37 C ATOM 2066 H LEU C 31 18.397 -5.946 11.854 1.00 0.00 H ATOM 2067 N ALA C 32 18.598 -9.186 12.455 1.00 25.31 N ATOM 2068 CA ALA C 32 19.093 -10.566 12.413 1.00 28.18 C ATOM 2069 C ALA C 32 20.327 -10.720 13.308 1.00 29.98 C ATOM 2070 O ALA C 32 20.460 -11.705 14.028 1.00 39.01 O ATOM 2071 CB ALA C 32 19.418 -10.972 10.985 1.00 31.65 C ATOM 2072 H ALA C 32 18.552 -8.632 11.576 1.00 0.00 H ATOM 2073 N GLU C 33 21.216 -9.728 13.265 1.00 33.38 N ATOM 2074 CA GLU C 33 22.473 -9.778 14.017 1.00 34.85 C ATOM 2075 C GLU C 33 22.268 -9.679 15.533 1.00 35.51 C ATOM 2076 O GLU C 33 23.040 -10.254 16.297 1.00 44.50 O ATOM 2077 CB GLU C 33 23.446 -8.697 13.530 1.00 39.01 C ATOM 2078 CG GLU C 33 24.048 -8.988 12.155 1.00 50.03 C ATOM 2079 CD GLU C 33 25.140 -8.003 11.742 1.00 61.24 C ATOM 2080 OE1 GLU C 33 25.513 -7.988 10.544 1.00 68.37 O ATOM 2081 OE2 GLU C 33 25.634 -7.243 12.609 1.00 71.98 O ATOM 2082 H GLU C 33 21.011 -8.893 12.680 1.00 0.00 H ATOM 2083 N VAL C 34 21.218 -8.984 15.965 1.00 33.55 N ATOM 2084 CA VAL C 34 20.924 -8.841 17.395 1.00 37.60 C ATOM 2085 C VAL C 34 20.091 -10.027 17.923 1.00 36.80 C ATOM 2086 O VAL C 34 19.846 -10.140 19.127 1.00 40.59 O ATOM 2087 CB VAL C 34 20.276 -7.463 17.696 1.00 38.37 C ATOM 2088 CG1 VAL C 34 18.787 -7.453 17.391 1.00 37.33 C ATOM 2089 CG2 VAL C 34 20.520 -7.044 19.139 1.00 46.05 C ATOM 2090 H VAL C 34 20.590 -8.531 15.271 1.00 0.00 H ATOM 2091 N GLY C 35 19.672 -10.911 17.018 1.00 32.85 N ATOM 2092 CA GLY C 35 18.983 -12.150 17.391 1.00 36.47 C ATOM 2093 C GLY C 35 17.472 -12.049 17.455 1.00 36.53 C ATOM 2094 O GLY C 35 16.815 -12.867 18.095 1.00 39.93 O ATOM 2095 H GLY C 35 19.840 -10.715 16.011 1.00 0.00 H ATOM 2096 N ALA C 36 16.928 -11.040 16.788 1.00 34.12 N ATOM 2097 CA ALA C 36 15.492 -10.803 16.758 1.00 31.24 C ATOM 2098 C ALA C 36 15.090 -10.494 15.323 1.00 29.02 C ATOM 2099 O ALA C 36 14.702 -9.367 15.017 1.00 36.81 O ATOM 2100 CB ALA C 36 15.149 -9.640 17.683 1.00 35.97 C ATOM 2101 H ALA C 36 17.552 -10.392 16.266 1.00 0.00 H ATOM 2102 N PRO C 37 15.187 -11.495 14.430 1.00 29.54 N ATOM 2103 CA PRO C 37 14.958 -11.240 13.009 1.00 32.00 C ATOM 2104 C PRO C 37 13.504 -10.943 12.607 1.00 31.46 C ATOM 2105 O PRO C 37 13.299 -10.308 11.571 1.00 30.31 O ATOM 2106 CB PRO C 37 15.424 -12.538 12.345 1.00 34.80 C ATOM 2107 CG PRO C 37 15.192 -13.585 13.383 1.00 37.46 C ATOM 2108 CD PRO C 37 15.501 -12.914 14.692 1.00 32.97 C ATOM 2109 N SER C 38 12.526 -11.404 13.397 1.00 25.89 N ATOM 2110 CA SER C 38 11.101 -11.275 13.053 1.00 23.35 C ATOM 2111 C SER C 38 10.677 -9.828 12.931 1.00 23.75 C ATOM 2112 O SER C 38 10.945 -9.034 13.819 1.00 27.99 O ATOM 2113 CB SER C 38 10.205 -11.912 14.121 1.00 27.01 C ATOM 2114 OG SER C 38 10.440 -13.295 14.233 1.00 31.05 O ATOM 2115 HG SER C 38 11.385 -13.449 14.484 1.00 0.00 H ATOM 2116 H SER C 38 12.784 -11.872 14.289 1.00 0.00 H ATOM 2117 N LEU C 39 9.989 -9.496 11.848 1.00 20.45 N ATOM 2118 CA LEU C 39 9.518 -8.116 11.660 1.00 17.52 C ATOM 2119 C LEU C 39 8.372 -8.081 10.686 1.00 15.84 C ATOM 2120 O LEU C 39 8.241 -8.954 9.822 1.00 17.28 O ATOM 2121 CB LEU C 39 10.671 -7.197 11.184 1.00 22.57 C ATOM 2122 CG LEU C 39 10.997 -7.117 9.686 1.00 23.51 C ATOM 2123 CD1 LEU C 39 11.848 -5.896 9.346 1.00 26.74 C ATOM 2124 CD2 LEU C 39 11.686 -8.375 9.245 1.00 26.97 C ATOM 2125 H LEU C 39 9.781 -10.216 11.127 1.00 0.00 H ATOM 2126 N THR C 40 7.582 -7.013 10.824 1.00 16.91 N ATOM 2127 CA THR C 40 6.520 -6.680 9.890 1.00 16.11 C ATOM 2128 C THR C 40 6.783 -5.240 9.394 1.00 13.89 C ATOM 2129 O THR C 40 7.044 -4.341 10.189 1.00 18.23 O ATOM 2130 CB THR C 40 5.149 -6.797 10.580 1.00 17.19 C ATOM 2131 OG1 THR C 40 4.916 -8.167 10.938 1.00 18.75 O ATOM 2132 CG2 THR C 40 4.035 -6.375 9.665 1.00 19.67 C ATOM 2133 HG1 THR C 40 4.035 -8.246 11.382 1.00 0.00 H ATOM 2134 H THR C 40 7.735 -6.388 11.641 1.00 0.00 H ATOM 2135 N VAL C 41 6.752 -5.085 8.084 1.00 13.73 N ATOM 2136 CA VAL C 41 7.002 -3.823 7.389 1.00 14.03 C ATOM 2137 C VAL C 41 5.720 -3.294 6.744 1.00 14.22 C ATOM 2138 O VAL C 41 5.040 -4.014 6.027 1.00 14.91 O ATOM 2139 CB VAL C 41 8.048 -4.038 6.269 1.00 17.67 C ATOM 2140 CG1 VAL C 41 8.222 -2.789 5.407 1.00 22.48 C ATOM 2141 CG2 VAL C 41 9.382 -4.480 6.884 1.00 20.82 C ATOM 2142 H VAL C 41 6.534 -5.920 7.504 1.00 0.00 H ATOM 2143 N THR C 42 5.490 -1.983 6.893 1.00 14.58 N ATOM 2144 CA THR C 42 4.365 -1.293 6.284 1.00 15.00 C ATOM 2145 C THR C 42 4.931 -0.089 5.548 1.00 14.91 C ATOM 2146 O THR C 42 5.749 0.633 6.100 1.00 16.41 O ATOM 2147 CB THR C 42 3.370 -0.787 7.366 1.00 17.72 C ATOM 2148 OG1 THR C 42 2.973 -1.876 8.202 1.00 22.87 O ATOM 2149 CG2 THR C 42 2.121 -0.170 6.732 1.00 18.00 C ATOM 2150 HG1 THR C 42 2.340 -1.549 8.889 1.00 0.00 H ATOM 2151 H THR C 42 6.151 -1.430 7.475 1.00 0.00 H ATOM 2152 N ASN C 43 4.468 0.123 4.336 1.00 14.15 N ATOM 2153 CA ASN C 43 4.779 1.322 3.599 1.00 14.76 C ATOM 2154 C ASN C 43 3.862 2.462 4.042 1.00 13.31 C ATOM 2155 O ASN C 43 2.647 2.318 4.044 1.00 17.00 O ATOM 2156 CB ASN C 43 4.670 1.052 2.120 1.00 16.69 C ATOM 2157 CG ASN C 43 5.622 -0.021 1.688 1.00 19.76 C ATOM 2158 OD1 ASN C 43 6.835 0.136 1.811 1.00 25.36 O ATOM 2159 ND2 ASN C 43 5.080 -1.134 1.233 1.00 21.77 N ATOM 2160 HD22 ASN C 43 4.046 -1.213 1.149 1.00 0.00 H ATOM 2161 HD21 ASN C 43 5.686 -1.933 0.958 1.00 0.00 H ATOM 2162 H ASN C 43 3.859 -0.596 3.896 1.00 0.00 H ATOM 2163 N VAL C 44 4.454 3.599 4.404 1.00 12.87 N ATOM 2164 CA VAL C 44 3.721 4.744 4.979 1.00 13.19 C ATOM 2165 C VAL C 44 4.231 6.044 4.381 1.00 13.00 C ATOM 2166 O VAL C 44 5.146 6.057 3.580 1.00 15.43 O ATOM 2167 CB VAL C 44 3.827 4.758 6.517 1.00 14.84 C ATOM 2168 CG1 VAL C 44 3.327 3.444 7.123 1.00 15.23 C ATOM 2169 CG2 VAL C 44 5.274 5.015 6.953 1.00 15.04 C ATOM 2170 H VAL C 44 5.482 3.684 4.275 1.00 0.00 H ATOM 2171 N SER C 45 3.572 7.138 4.741 1.00 14.10 N ATOM 2172 CA SER C 45 3.940 8.498 4.349 1.00 14.91 C ATOM 2173 C SER C 45 3.964 9.340 5.619 1.00 13.87 C ATOM 2174 O SER C 45 3.211 9.071 6.546 1.00 17.43 O ATOM 2175 CB SER C 45 2.896 9.055 3.378 1.00 16.46 C ATOM 2176 OG SER C 45 2.724 8.217 2.241 1.00 16.57 O ATOM 2177 HG SER C 45 2.425 7.320 2.536 1.00 0.00 H ATOM 2178 H SER C 45 2.734 7.020 5.345 1.00 0.00 H ATOM 2179 N GLY C 46 4.783 10.376 5.669 1.00 14.95 N ATOM 2180 CA GLY C 46 4.797 11.160 6.879 1.00 17.44 C ATOM 2181 C GLY C 46 5.453 12.512 6.751 1.00 15.45 C ATOM 2182 O GLY C 46 6.010 12.855 5.709 1.00 17.87 O ATOM 2183 H GLY C 46 5.396 10.617 4.864 1.00 0.00 H ATOM 2184 N ARG C 47 5.324 13.282 7.813 1.00 17.51 N ATOM 2185 CA ARG C 47 6.124 14.480 8.010 1.00 18.68 C ATOM 2186 C ARG C 47 6.480 14.576 9.475 1.00 20.10 C ATOM 2187 O ARG C 47 5.809 14.022 10.333 1.00 21.10 O ATOM 2188 CB ARG C 47 5.393 15.741 7.540 1.00 21.75 C ATOM 2189 CG ARG C 47 4.214 16.086 8.416 1.00 23.27 C ATOM 2190 CD ARG C 47 3.507 17.375 8.035 1.00 25.32 C ATOM 2191 NE ARG C 47 2.384 17.579 8.938 1.00 24.92 N ATOM 2192 CZ ARG C 47 1.331 18.368 8.689 1.00 26.70 C ATOM 2193 NH1 ARG C 47 0.366 18.468 9.598 1.00 27.90 N ATOM 2194 NH2 ARG C 47 1.217 19.018 7.531 1.00 32.05 N ATOM 2195 HE ARG C 47 2.401 17.073 9.847 1.00 0.00 H ATOM 2196 HH12 ARG C 47 -0.457 19.077 9.417 1.00 0.00 H ATOM 2197 HH11 ARG C 47 0.434 17.937 10.490 1.00 0.00 H ATOM 2198 HH22 ARG C 47 0.392 19.626 7.355 1.00 0.00 H ATOM 2199 HH21 ARG C 47 1.953 18.917 6.803 1.00 0.00 H ATOM 2200 H ARG C 47 4.624 13.023 8.537 1.00 0.00 H ATOM 2201 N GLY C 48 7.574 15.284 9.765 1.00 22.35 N ATOM 2202 CA GLY C 48 7.977 15.536 11.142 1.00 25.10 C ATOM 2203 C GLY C 48 7.671 16.989 11.500 1.00 27.89 C ATOM 2204 O GLY C 48 6.597 17.510 11.160 1.00 34.85 O ATOM 2205 H GLY C 48 8.152 15.665 8.989 1.00 0.00 H ATOM 2206 N SER C 49 8.619 17.632 12.181 1.00 35.09 N ATOM 2207 CA SER C 49 8.532 19.052 12.550 1.00 38.51 C ATOM 2208 C SER C 49 9.056 19.982 11.437 1.00 37.70 C ATOM 2209 O SER C 49 9.191 21.194 11.649 1.00 57.69 O ATOM 2210 CB SER C 49 9.345 19.302 13.829 1.00 45.27 C ATOM 2211 OG SER C 49 8.935 18.447 14.881 1.00 50.20 O ATOM 2212 HG SER C 49 9.478 18.634 15.687 1.00 0.00 H ATOM 2213 H SER C 49 9.466 17.100 12.467 1.00 0.00 H TER 2214 SER C 49 ATOM 2215 N VAL C 64 3.899 20.407 4.434 1.00 41.85 N ATOM 2216 CA VAL C 64 2.564 19.923 4.059 1.00 40.31 C ATOM 2217 C VAL C 64 2.581 18.582 3.325 1.00 43.75 C ATOM 2218 O VAL C 64 1.811 17.684 3.678 1.00 49.67 O ATOM 2219 CB VAL C 64 1.808 20.953 3.185 1.00 44.15 C ATOM 2220 CG1 VAL C 64 0.469 20.394 2.711 1.00 43.81 C ATOM 2221 CG2 VAL C 64 1.595 22.247 3.960 1.00 45.69 C ATOM 2222 HN3 VAL C 64 4.475 20.529 3.577 1.00 0.00 H ATOM 2223 HN2 VAL C 64 4.353 19.715 5.063 1.00 0.00 H ATOM 2224 HN1 VAL C 64 3.810 21.319 4.927 1.00 0.00 H ATOM 2225 N ASP C 65 3.423 18.459 2.295 1.00 40.07 N ATOM 2226 CA ASP C 65 3.466 17.225 1.477 1.00 40.66 C ATOM 2227 C ASP C 65 4.131 16.107 2.225 1.00 38.88 C ATOM 2228 O ASP C 65 5.130 16.302 2.912 1.00 54.64 O ATOM 2229 CB ASP C 65 4.204 17.454 0.158 1.00 42.41 C ATOM 2230 CG ASP C 65 3.489 18.449 -0.744 1.00 50.81 C ATOM 2231 OD1 ASP C 65 2.285 18.706 -0.513 1.00 57.02 O ATOM 2232 OD2 ASP C 65 4.128 18.974 -1.685 1.00 64.65 O ATOM 2233 H ASP C 65 4.062 19.246 2.063 1.00 0.00 H ATOM 2234 N LEU C 66 3.593 14.912 2.094 1.00 22.61 N ATOM 2235 CA LEU C 66 4.173 13.842 2.858 1.00 19.10 C ATOM 2236 C LEU C 66 5.221 13.091 2.053 1.00 17.67 C ATOM 2237 O LEU C 66 5.143 12.993 0.831 1.00 18.78 O ATOM 2238 CB LEU C 66 3.069 12.920 3.332 1.00 18.85 C ATOM 2239 CG LEU C 66 1.962 13.596 4.142 1.00 19.35 C ATOM 2240 CD1 LEU C 66 1.053 12.504 4.663 1.00 21.25 C ATOM 2241 CD2 LEU C 66 2.479 14.437 5.292 1.00 21.97 C ATOM 2242 H LEU C 66 2.782 14.749 1.464 1.00 0.00 H ATOM 2243 N HIS C 67 6.218 12.604 2.779 1.00 17.19 N ATOM 2244 CA HIS C 67 7.321 11.865 2.199 1.00 15.91 C ATOM 2245 C HIS C 67 7.136 10.367 2.446 1.00 15.50 C ATOM 2246 O HIS C 67 6.610 9.956 3.476 1.00 16.56 O ATOM 2247 CB HIS C 67 8.668 12.322 2.819 1.00 19.33 C ATOM 2248 CG HIS C 67 9.112 13.700 2.419 1.00 30.26 C ATOM 2249 ND1 HIS C 67 10.238 14.295 2.939 1.00 41.20 N ATOM 2250 CD2 HIS C 67 8.583 14.587 1.552 1.00 36.80 C ATOM 2251 CE1 HIS C 67 10.387 15.494 2.405 1.00 55.53 C ATOM 2252 NE2 HIS C 67 9.392 15.701 1.562 1.00 55.13 N ATOM 2253 H HIS C 67 6.208 12.759 3.807 1.00 0.00 H ATOM 2254 N GLN C 68 7.640 9.584 1.508 1.00 15.59 N ATOM 2255 CA GLN C 68 7.654 8.111 1.623 1.00 14.97 C ATOM 2256 C GLN C 68 8.514 7.686 2.809 1.00 15.13 C ATOM 2257 O GLN C 68 9.666 8.107 2.922 1.00 18.32 O ATOM 2258 CB GLN C 68 8.202 7.533 0.319 1.00 18.73 C ATOM 2259 CG GLN C 68 8.263 6.019 0.201 1.00 21.63 C ATOM 2260 CD GLN C 68 9.178 5.530 -0.930 1.00 24.60 C ATOM 2261 OE1 GLN C 68 10.212 6.140 -1.247 1.00 27.12 O ATOM 2262 NE2 GLN C 68 8.816 4.416 -1.520 1.00 31.16 N ATOM 2263 HE22 GLN C 68 7.943 3.933 -1.228 1.00 0.00 H ATOM 2264 HE21 GLN C 68 9.402 4.016 -2.280 1.00 0.00 H ATOM 2265 H GLN C 68 8.043 10.022 0.655 1.00 0.00 H ATOM 2266 N LYS C 69 7.979 6.830 3.671 1.00 15.15 N ATOM 2267 CA LYS C 69 8.728 6.247 4.781 1.00 15.91 C ATOM 2268 C LYS C 69 8.389 4.749 4.888 1.00 14.03 C ATOM 2269 O LYS C 69 7.493 4.243 4.187 1.00 15.18 O ATOM 2270 CB LYS C 69 8.468 6.964 6.110 1.00 16.33 C ATOM 2271 CG LYS C 69 8.764 8.473 6.114 1.00 16.53 C ATOM 2272 CD LYS C 69 10.257 8.760 6.084 1.00 17.47 C ATOM 2273 CE LYS C 69 10.481 10.256 5.867 1.00 19.42 C ATOM 2274 NZ LYS C 69 11.928 10.605 5.810 1.00 21.14 N ATOM 2275 HZ1 LYS C 69 12.384 10.336 6.705 1.00 0.00 H ATOM 2276 HZ2 LYS C 69 12.376 10.093 5.024 1.00 0.00 H ATOM 2277 HZ3 LYS C 69 12.031 11.629 5.662 1.00 0.00 H ATOM 2278 H LYS C 69 6.981 6.562 3.550 1.00 0.00 H ATOM 2279 N VAL C 70 9.095 4.050 5.769 1.00 15.15 N ATOM 2280 CA VAL C 70 8.813 2.650 6.079 1.00 15.20 C ATOM 2281 C VAL C 70 8.561 2.518 7.578 1.00 15.03 C ATOM 2282 O VAL C 70 9.295 3.093 8.368 1.00 16.80 O ATOM 2283 CB VAL C 70 9.982 1.735 5.656 1.00 16.97 C ATOM 2284 CG1 VAL C 70 9.793 0.339 6.220 1.00 16.52 C ATOM 2285 CG2 VAL C 70 10.053 1.668 4.149 1.00 22.19 C ATOM 2286 H VAL C 70 9.883 4.519 6.260 1.00 0.00 H ATOM 2287 N LYS C 71 7.520 1.771 7.966 1.00 14.15 N ATOM 2288 CA LYS C 71 7.286 1.426 9.358 1.00 14.45 C ATOM 2289 C LYS C 71 7.753 -0.026 9.548 1.00 14.91 C ATOM 2290 O LYS C 71 7.339 -0.910 8.785 1.00 18.50 O ATOM 2291 CB LYS C 71 5.799 1.549 9.722 1.00 17.85 C ATOM 2292 CG LYS C 71 5.477 1.158 11.151 1.00 20.07 C ATOM 2293 CD LYS C 71 3.991 1.004 11.422 1.00 28.46 C ATOM 2294 CE LYS C 71 3.329 2.330 11.579 1.00 29.49 C ATOM 2295 NZ LYS C 71 1.922 2.055 11.949 1.00 32.37 N ATOM 2296 HZ1 LYS C 71 1.469 1.499 11.196 1.00 0.00 H ATOM 2297 HZ2 LYS C 71 1.898 1.519 12.840 1.00 0.00 H ATOM 2298 HZ3 LYS C 71 1.415 2.955 12.071 1.00 0.00 H ATOM 2299 H LYS C 71 6.855 1.425 7.245 1.00 0.00 H ATOM 2300 N VAL C 72 8.594 -0.256 10.552 1.00 16.93 N ATOM 2301 CA VAL C 72 9.054 -1.583 10.935 1.00 16.55 C ATOM 2302 C VAL C 72 8.498 -1.858 12.312 1.00 18.35 C ATOM 2303 O VAL C 72 8.613 -1.032 13.212 1.00 20.48 O ATOM 2304 CB VAL C 72 10.593 -1.640 10.962 1.00 20.94 C ATOM 2305 CG1 VAL C 72 11.096 -2.967 11.493 1.00 24.73 C ATOM 2306 CG2 VAL C 72 11.143 -1.364 9.576 1.00 22.98 C ATOM 2307 H VAL C 72 8.943 0.559 11.095 1.00 0.00 H ATOM 2308 N GLU C 73 7.871 -3.020 12.477 1.00 17.98 N ATOM 2309 CA GLU C 73 7.360 -3.427 13.768 1.00 17.85 C ATOM 2310 C GLU C 73 7.952 -4.768 14.151 1.00 16.38 C ATOM 2311 O GLU C 73 7.915 -5.722 13.359 1.00 19.16 O ATOM 2312 CB GLU C 73 5.845 -3.540 13.745 1.00 18.34 C ATOM 2313 CG GLU C 73 5.164 -2.189 13.717 1.00 20.85 C ATOM 2314 CD GLU C 73 3.673 -2.267 13.493 1.00 27.76 C ATOM 2315 OE1 GLU C 73 3.243 -2.909 12.500 1.00 31.47 O ATOM 2316 OE2 GLU C 73 2.921 -1.655 14.295 1.00 36.88 O ATOM 2317 H GLU C 73 7.745 -3.650 11.659 1.00 0.00 H ATOM 2318 N CYS C 74 8.450 -4.815 15.381 1.00 18.29 N ATOM 2319 CA CYS C 74 9.084 -5.995 15.964 1.00 18.55 C ATOM 2320 C CYS C 74 8.535 -6.199 17.351 1.00 18.01 C ATOM 2321 O CYS C 74 8.744 -5.361 18.236 1.00 21.04 O ATOM 2322 CB CYS C 74 10.598 -5.787 16.097 1.00 18.04 C ATOM 2323 SG CYS C 74 11.467 -5.516 14.552 1.00 19.32 S ATOM 2324 H CYS C 74 8.385 -3.958 15.966 1.00 0.00 H ATOM 2325 N VAL C 75 7.833 -7.310 17.566 1.00 19.78 N ATOM 2326 CA VAL C 75 7.378 -7.643 18.899 1.00 19.99 C ATOM 2327 C VAL C 75 8.466 -8.529 19.509 1.00 20.78 C ATOM 2328 O VAL C 75 8.922 -9.497 18.882 1.00 23.02 O ATOM 2329 CB VAL C 75 5.983 -8.315 18.892 1.00 19.95 C ATOM 2330 CG1 VAL C 75 5.571 -8.702 20.303 1.00 22.69 C ATOM 2331 CG2 VAL C 75 4.966 -7.362 18.281 1.00 20.60 C ATOM 2332 H VAL C 75 7.610 -7.942 16.771 1.00 0.00 H ATOM 2333 N VAL C 76 8.887 -8.175 20.720 1.00 21.26 N ATOM 2334 CA VAL C 76 10.001 -8.830 21.395 1.00 22.58 C ATOM 2335 C VAL C 76 9.639 -9.219 22.823 1.00 23.37 C ATOM 2336 O VAL C 76 8.792 -8.585 23.465 1.00 25.16 O ATOM 2337 CB VAL C 76 11.253 -7.916 21.409 1.00 24.60 C ATOM 2338 CG1 VAL C 76 11.657 -7.557 19.996 1.00 28.83 C ATOM 2339 CG2 VAL C 76 11.026 -6.646 22.226 1.00 25.09 C ATOM 2340 H VAL C 76 8.400 -7.396 21.207 1.00 0.00 H ATOM 2341 N ALA C 77 10.295 -10.262 23.316 1.00 26.74 N ATOM 2342 CA ALA C 77 10.166 -10.684 24.706 1.00 26.62 C ATOM 2343 C ALA C 77 11.531 -11.083 25.272 1.00 29.75 C ATOM 2344 O ALA C 77 11.961 -10.536 26.287 1.00 34.27 O ATOM 2345 CB ALA C 77 9.165 -11.826 24.829 1.00 29.48 C ATOM 2346 H ALA C 77 10.925 -10.799 22.687 1.00 0.00 H ATOM 2347 N ASP C 78 12.201 -12.022 24.600 1.00 32.12 N ATOM 2348 CA ASP C 78 13.520 -12.524 25.022 1.00 33.47 C ATOM 2349 C ASP C 78 14.658 -11.506 24.872 1.00 35.75 C ATOM 2350 O ASP C 78 15.623 -11.536 25.632 1.00 43.80 O ATOM 2351 CB ASP C 78 13.893 -13.779 24.221 1.00 39.21 C ATOM 2352 CG ASP C 78 13.096 -15.011 24.634 1.00 47.05 C ATOM 2353 OD1 ASP C 78 12.491 -15.008 25.730 1.00 55.30 O ATOM 2354 OD2 ASP C 78 13.088 -15.996 23.859 1.00 57.36 O ATOM 2355 H ASP C 78 11.772 -12.417 23.739 1.00 0.00 H ATOM 2356 N THR C 79 14.547 -10.625 23.882 1.00 33.07 N ATOM 2357 CA THR C 79 15.567 -9.629 23.594 1.00 32.37 C ATOM 2358 C THR C 79 15.110 -8.281 24.153 1.00 29.09 C ATOM 2359 O THR C 79 13.999 -7.848 23.850 1.00 30.51 O ATOM 2360 CB THR C 79 15.769 -9.493 22.075 1.00 33.42 C ATOM 2361 OG1 THR C 79 16.055 -10.778 21.513 1.00 38.29 O ATOM 2362 CG2 THR C 79 16.906 -8.528 21.745 1.00 35.29 C ATOM 2363 HG1 THR C 79 16.185 -10.688 20.536 1.00 0.00 H ATOM 2364 H THR C 79 13.694 -10.649 23.288 1.00 0.00 H ATOM 2365 N PRO C 80 15.966 -7.602 24.942 1.00 31.89 N ATOM 2366 CA PRO C 80 15.570 -6.294 25.477 1.00 31.77 C ATOM 2367 C PRO C 80 15.123 -5.326 24.379 1.00 29.58 C ATOM 2368 O PRO C 80 15.793 -5.194 23.351 1.00 29.89 O ATOM 2369 CB PRO C 80 16.849 -5.789 26.160 1.00 31.56 C ATOM 2370 CG PRO C 80 17.585 -7.024 26.523 1.00 36.45 C ATOM 2371 CD PRO C 80 17.315 -7.988 25.401 1.00 32.54 C ATOM 2372 N ALA C 81 13.987 -4.671 24.593 1.00 28.87 N ATOM 2373 CA ALA C 81 13.421 -3.780 23.583 1.00 27.58 C ATOM 2374 C ALA C 81 14.353 -2.611 23.246 1.00 29.12 C ATOM 2375 O ALA C 81 14.434 -2.203 22.096 1.00 27.65 O ATOM 2376 CB ALA C 81 12.070 -3.262 24.039 1.00 28.43 C ATOM 2377 H ALA C 81 13.490 -4.795 25.498 1.00 0.00 H ATOM 2378 N GLU C 82 15.067 -2.095 24.245 1.00 34.60 N ATOM 2379 CA GLU C 82 16.049 -1.032 24.005 1.00 36.25 C ATOM 2380 C GLU C 82 17.243 -1.502 23.156 1.00 31.84 C ATOM 2381 O GLU C 82 17.780 -0.724 22.373 1.00 36.85 O ATOM 2382 CB GLU C 82 16.517 -0.396 25.322 1.00 43.14 C ATOM 2383 CG GLU C 82 15.690 0.827 25.711 1.00 50.55 C ATOM 2384 CD GLU C 82 15.885 1.259 27.154 1.00 57.00 C ATOM 2385 OE1 GLU C 82 16.186 2.451 27.385 1.00 68.29 O ATOM 2386 OE2 GLU C 82 15.730 0.412 28.059 1.00 76.57 O ATOM 2387 H GLU C 82 14.926 -2.452 25.212 1.00 0.00 H ATOM 2388 N ASP C 83 17.631 -2.772 23.280 1.00 32.17 N ATOM 2389 CA ASP C 83 18.669 -3.341 22.403 1.00 36.06 C ATOM 2390 C ASP C 83 18.214 -3.402 20.946 1.00 29.90 C ATOM 2391 O ASP C 83 18.971 -3.093 20.035 1.00 31.14 O ATOM 2392 CB ASP C 83 19.064 -4.749 22.857 1.00 38.82 C ATOM 2393 CG ASP C 83 19.794 -4.758 24.185 1.00 48.80 C ATOM 2394 OD1 ASP C 83 20.119 -3.669 24.710 1.00 54.23 O ATOM 2395 OD2 ASP C 83 20.044 -5.868 24.702 1.00 55.04 O ATOM 2396 H ASP C 83 17.193 -3.371 24.009 1.00 0.00 H ATOM 2397 N VAL C 84 16.974 -3.826 20.731 1.00 27.18 N ATOM 2398 CA VAL C 84 16.408 -3.862 19.385 1.00 26.06 C ATOM 2399 C VAL C 84 16.301 -2.432 18.819 1.00 23.89 C ATOM 2400 O VAL C 84 16.668 -2.186 17.674 1.00 24.67 O ATOM 2401 CB VAL C 84 15.021 -4.551 19.390 1.00 25.66 C ATOM 2402 CG1 VAL C 84 14.355 -4.461 18.024 1.00 28.91 C ATOM 2403 CG2 VAL C 84 15.159 -6.004 19.830 1.00 28.36 C ATOM 2404 H VAL C 84 16.395 -4.138 21.536 1.00 0.00 H ATOM 2405 N ALA C 85 15.800 -1.503 19.634 1.00 23.26 N ATOM 2406 CA ALA C 85 15.685 -0.097 19.236 1.00 25.10 C ATOM 2407 C ALA C 85 17.046 0.506 18.853 1.00 26.78 C ATOM 2408 O ALA C 85 17.166 1.190 17.836 1.00 25.85 O ATOM 2409 CB ALA C 85 15.026 0.715 20.347 1.00 28.82 C ATOM 2410 H ALA C 85 15.481 -1.785 20.583 1.00 0.00 H ATOM 2411 N ASP C 86 18.073 0.205 19.644 1.00 30.27 N ATOM 2412 CA ASP C 86 19.425 0.695 19.361 1.00 29.85 C ATOM 2413 C ASP C 86 19.959 0.155 18.044 1.00 28.70 C ATOM 2414 O ASP C 86 20.572 0.895 17.273 1.00 33.20 O ATOM 2415 CB ASP C 86 20.387 0.318 20.490 1.00 34.21 C ATOM 2416 CG ASP C 86 20.154 1.128 21.762 1.00 46.61 C ATOM 2417 OD1 ASP C 86 19.360 2.099 21.731 1.00 55.50 O ATOM 2418 OD2 ASP C 86 20.773 0.787 22.798 1.00 60.42 O ATOM 2419 H ASP C 86 17.913 -0.391 20.481 1.00 0.00 H ATOM 2420 N ALA C 87 19.726 -1.136 17.796 1.00 26.40 N ATOM 2421 CA ALA C 87 20.120 -1.773 16.536 1.00 27.60 C ATOM 2422 C ALA C 87 19.452 -1.127 15.326 1.00 23.17 C ATOM 2423 O ALA C 87 20.095 -0.868 14.303 1.00 25.23 O ATOM 2424 CB ALA C 87 19.798 -3.262 16.577 1.00 27.22 C ATOM 2425 H ALA C 87 19.249 -1.709 18.521 1.00 0.00 H ATOM 2426 N ILE C 88 18.149 -0.868 15.436 1.00 23.24 N ATOM 2427 CA ILE C 88 17.445 -0.202 14.346 1.00 23.16 C ATOM 2428 C ILE C 88 17.976 1.218 14.157 1.00 22.27 C ATOM 2429 O ILE C 88 18.270 1.626 13.038 1.00 23.17 O ATOM 2430 CB ILE C 88 15.921 -0.160 14.584 1.00 21.60 C ATOM 2431 CG1 ILE C 88 15.362 -1.589 14.627 1.00 21.98 C ATOM 2432 CG2 ILE C 88 15.249 0.646 13.485 1.00 24.16 C ATOM 2433 CD1 ILE C 88 13.919 -1.669 15.110 1.00 24.48 C ATOM 2434 H ILE C 88 17.635 -1.141 16.298 1.00 0.00 H ATOM 2435 N ALA C 89 18.097 1.963 15.249 1.00 22.96 N ATOM 2436 CA ALA C 89 18.523 3.367 15.162 1.00 25.41 C ATOM 2437 C ALA C 89 19.898 3.488 14.493 1.00 26.89 C ATOM 2438 O ALA C 89 20.098 4.312 13.600 1.00 27.63 O ATOM 2439 CB ALA C 89 18.544 3.997 16.537 1.00 28.46 C ATOM 2440 H ALA C 89 17.887 1.547 16.179 1.00 0.00 H ATOM 2441 N ASP C 90 20.834 2.638 14.901 1.00 25.42 N ATOM 2442 CA ASP C 90 22.190 2.708 14.361 1.00 27.25 C ATOM 2443 C ASP C 90 22.171 2.414 12.854 1.00 23.55 C ATOM 2444 O ASP C 90 22.866 3.071 12.082 1.00 30.10 O ATOM 2445 CB ASP C 90 23.096 1.716 15.084 1.00 31.07 C ATOM 2446 CG ASP C 90 23.380 2.099 16.542 1.00 37.21 C ATOM 2447 OD1 ASP C 90 22.969 3.194 17.001 1.00 49.41 O ATOM 2448 OD2 ASP C 90 24.030 1.284 17.235 1.00 54.13 O ATOM 2449 H ASP C 90 20.599 1.916 15.612 1.00 0.00 H ATOM 2450 N ALA C 91 21.359 1.430 12.442 1.00 21.59 N ATOM 2451 CA ALA C 91 21.285 1.054 11.032 1.00 23.42 C ATOM 2452 C ALA C 91 20.508 2.068 10.179 1.00 21.65 C ATOM 2453 O ALA C 91 20.777 2.238 8.998 1.00 24.29 O ATOM 2454 CB ALA C 91 20.667 -0.333 10.885 1.00 22.28 C ATOM 2455 H ALA C 91 20.772 0.926 13.137 1.00 0.00 H ATOM 2456 N ALA C 92 19.528 2.721 10.785 1.00 20.87 N ATOM 2457 CA ALA C 92 18.687 3.690 10.078 1.00 20.08 C ATOM 2458 C ALA C 92 19.265 5.114 10.027 1.00 19.94 C ATOM 2459 O ALA C 92 18.791 5.961 9.278 1.00 21.71 O ATOM 2460 CB ALA C 92 17.321 3.733 10.718 1.00 20.28 C ATOM 2461 H ALA C 92 19.350 2.540 11.794 1.00 0.00 H ATOM 2462 N HIS C 93 20.319 5.352 10.793 1.00 22.03 N ATOM 2463 CA HIS C 93 20.885 6.683 10.933 1.00 22.14 C ATOM 2464 C HIS C 93 21.560 7.195 9.649 1.00 22.76 C ATOM 2465 O HIS C 93 22.270 6.448 8.971 1.00 27.13 O ATOM 2466 CB HIS C 93 21.889 6.671 12.080 1.00 21.47 C ATOM 2467 CG HIS C 93 22.567 7.982 12.298 1.00 22.65 C ATOM 2468 ND1 HIS C 93 23.748 8.319 11.676 1.00 27.60 N ATOM 2469 CD2 HIS C 93 22.219 9.044 13.056 1.00 24.08 C ATOM 2470 CE1 HIS C 93 24.101 9.540 12.043 1.00 27.89 C ATOM 2471 NE2 HIS C 93 23.198 9.998 12.893 1.00 27.49 N ATOM 2472 H HIS C 93 20.755 4.562 11.310 1.00 0.00 H ATOM 2473 N THR C 94 21.330 8.470 9.327 1.00 23.80 N ATOM 2474 CA THR C 94 22.120 9.187 8.320 1.00 25.99 C ATOM 2475 C THR C 94 22.668 10.511 8.857 1.00 26.35 C ATOM 2476 O THR C 94 23.670 10.995 8.349 1.00 31.43 O ATOM 2477 CB THR C 94 21.343 9.514 7.023 1.00 26.45 C ATOM 2478 OG1 THR C 94 20.431 10.609 7.245 1.00 27.79 O ATOM 2479 CG2 THR C 94 20.600 8.304 6.478 1.00 26.54 C ATOM 2480 HG1 THR C 94 19.786 10.361 7.954 1.00 0.00 H ATOM 2481 H THR C 94 20.560 8.975 9.809 1.00 0.00 H ATOM 2482 N GLY C 95 22.012 11.091 9.862 1.00 27.05 N ATOM 2483 CA GLY C 95 22.381 12.397 10.397 1.00 26.82 C ATOM 2484 C GLY C 95 21.632 13.591 9.813 1.00 26.74 C ATOM 2485 O GLY C 95 21.833 14.720 10.260 1.00 33.47 O ATOM 2486 H GLY C 95 21.203 10.591 10.283 1.00 0.00 H ATOM 2487 N GLU C 96 20.774 13.341 8.822 1.00 29.95 N ATOM 2488 CA GLU C 96 19.929 14.363 8.211 1.00 29.96 C ATOM 2489 C GLU C 96 18.508 14.288 8.768 1.00 25.43 C ATOM 2490 O GLU C 96 18.015 13.210 9.132 1.00 27.07 O ATOM 2491 CB GLU C 96 19.877 14.180 6.688 1.00 34.61 C ATOM 2492 CG GLU C 96 21.234 14.194 5.983 1.00 36.14 C ATOM 2493 CD GLU C 96 21.909 15.557 5.989 1.00 46.49 C ATOM 2494 OE1 GLU C 96 23.146 15.608 5.820 1.00 57.49 O ATOM 2495 OE2 GLU C 96 21.216 16.584 6.158 1.00 57.39 O ATOM 2496 H GLU C 96 20.703 12.366 8.466 1.00 0.00 H ATOM 2497 N LYS C 97 17.844 15.434 8.818 1.00 27.11 N ATOM 2498 CA LYS C 97 16.435 15.485 9.180 1.00 24.51 C ATOM 2499 C LYS C 97 15.640 14.545 8.274 1.00 23.63 C ATOM 2500 O LYS C 97 15.911 14.446 7.074 1.00 25.21 O ATOM 2501 CB LYS C 97 15.910 16.922 9.110 1.00 29.21 C ATOM 2502 CG LYS C 97 16.598 17.829 10.128 1.00 35.37 C ATOM 2503 CD LYS C 97 16.054 19.249 10.116 1.00 43.11 C ATOM 2504 CE LYS C 97 16.721 20.100 11.187 1.00 53.35 C ATOM 2505 NZ LYS C 97 16.301 19.709 12.562 1.00 60.27 N ATOM 2506 HZ1 LYS C 97 15.271 19.823 12.654 1.00 0.00 H ATOM 2507 HZ2 LYS C 97 16.558 18.716 12.732 1.00 0.00 H ATOM 2508 HZ3 LYS C 97 16.782 20.317 13.256 1.00 0.00 H ATOM 2509 H LYS C 97 18.342 16.319 8.593 1.00 0.00 H ATOM 2510 N GLY C 98 14.685 13.833 8.871 1.00 23.99 N ATOM 2511 CA GLY C 98 13.928 12.787 8.178 1.00 21.06 C ATOM 2512 C GLY C 98 14.319 11.359 8.548 1.00 18.61 C ATOM 2513 O GLY C 98 13.699 10.411 8.078 1.00 22.06 O ATOM 2514 H GLY C 98 14.468 14.028 9.869 1.00 0.00 H ATOM 2515 N ASP C 99 15.323 11.207 9.408 1.00 21.55 N ATOM 2516 CA ASP C 99 15.780 9.876 9.824 1.00 20.73 C ATOM 2517 C ASP C 99 14.729 9.059 10.570 1.00 20.69 C ATOM 2518 O ASP C 99 14.783 7.849 10.546 1.00 20.78 O ATOM 2519 CB ASP C 99 17.011 9.969 10.715 1.00 21.88 C ATOM 2520 CG ASP C 99 18.308 10.072 9.930 1.00 22.80 C ATOM 2521 OD1 ASP C 99 18.309 10.090 8.673 1.00 23.36 O ATOM 2522 OD2 ASP C 99 19.347 10.111 10.611 1.00 23.63 O ATOM 2523 H ASP C 99 15.794 12.050 9.794 1.00 0.00 H ATOM 2524 N GLY C 100 13.808 9.710 11.269 1.00 20.56 N ATOM 2525 CA GLY C 100 12.680 9.006 11.878 1.00 20.34 C ATOM 2526 C GLY C 100 12.825 8.782 13.358 1.00 17.80 C ATOM 2527 O GLY C 100 13.694 9.375 14.020 1.00 20.00 O ATOM 2528 H GLY C 100 13.890 10.740 11.386 1.00 0.00 H ATOM 2529 N LYS C 101 11.969 7.932 13.888 1.00 17.37 N ATOM 2530 CA LYS C 101 11.830 7.747 15.302 1.00 19.89 C ATOM 2531 C LYS C 101 11.454 6.307 15.566 1.00 17.13 C ATOM 2532 O LYS C 101 10.870 5.643 14.711 1.00 20.82 O ATOM 2533 CB LYS C 101 10.749 8.674 15.872 1.00 22.87 C ATOM 2534 CG LYS C 101 11.140 10.158 15.828 1.00 26.22 C ATOM 2535 CD LYS C 101 10.374 11.008 16.828 1.00 30.31 C ATOM 2536 CE LYS C 101 10.760 12.480 16.705 1.00 32.98 C ATOM 2537 NZ LYS C 101 10.148 13.114 15.516 1.00 31.85 N ATOM 2538 HZ1 LYS C 101 10.468 12.620 14.658 1.00 0.00 H ATOM 2539 HZ2 LYS C 101 9.112 13.053 15.587 1.00 0.00 H ATOM 2540 HZ3 LYS C 101 10.436 14.112 15.470 1.00 0.00 H ATOM 2541 H LYS C 101 11.368 7.371 13.252 1.00 0.00 H ATOM 2542 N ILE C 102 11.794 5.856 16.763 1.00 19.20 N ATOM 2543 CA ILE C 102 11.436 4.555 17.256 1.00 19.61 C ATOM 2544 C ILE C 102 10.628 4.719 18.531 1.00 19.51 C ATOM 2545 O ILE C 102 10.989 5.486 19.411 1.00 21.67 O ATOM 2546 CB ILE C 102 12.691 3.708 17.541 1.00 20.56 C ATOM 2547 CG1 ILE C 102 13.602 3.710 16.309 1.00 24.51 C ATOM 2548 CG2 ILE C 102 12.272 2.283 17.912 1.00 22.69 C ATOM 2549 CD1 ILE C 102 14.985 3.175 16.579 1.00 28.69 C ATOM 2550 H ILE C 102 12.352 6.479 17.382 1.00 0.00 H ATOM 2551 N PHE C 103 9.523 3.974 18.609 1.00 18.97 N ATOM 2552 CA PHE C 103 8.642 3.988 19.751 1.00 18.45 C ATOM 2553 C PHE C 103 8.512 2.585 20.326 1.00 19.00 C ATOM 2554 O PHE C 103 8.494 1.613 19.582 1.00 23.85 O ATOM 2555 CB PHE C 103 7.258 4.500 19.327 1.00 19.67 C ATOM 2556 CG PHE C 103 7.304 5.814 18.601 1.00 20.26 C ATOM 2557 CD1 PHE C 103 7.626 6.962 19.292 1.00 20.59 C ATOM 2558 CD2 PHE C 103 7.064 5.893 17.242 1.00 22.64 C ATOM 2559 CE1 PHE C 103 7.672 8.179 18.645 1.00 21.84 C ATOM 2560 CE2 PHE C 103 7.126 7.114 16.579 1.00 22.79 C ATOM 2561 CZ PHE C 103 7.423 8.257 17.289 1.00 23.10 C ATOM 2562 H PHE C 103 9.286 3.354 17.808 1.00 0.00 H ATOM 2563 N ILE C 104 8.417 2.492 21.641 1.00 19.54 N ATOM 2564 CA ILE C 104 8.216 1.205 22.315 1.00 22.84 C ATOM 2565 C ILE C 104 6.865 1.235 23.030 1.00 23.04 C ATOM 2566 O ILE C 104 6.595 2.147 23.810 1.00 24.28 O ATOM 2567 CB ILE C 104 9.370 0.891 23.295 1.00 23.98 C ATOM 2568 CG1 ILE C 104 10.711 0.817 22.532 1.00 26.03 C ATOM 2569 CG2 ILE C 104 9.140 -0.432 24.006 1.00 24.80 C ATOM 2570 CD1 ILE C 104 11.934 0.792 23.424 1.00 28.24 C ATOM 2571 H ILE C 104 8.487 3.357 22.215 1.00 0.00 H ATOM 2572 N LEU C 105 6.021 0.244 22.733 1.00 23.10 N ATOM 2573 CA LEU C 105 4.679 0.132 23.299 1.00 23.14 C ATOM 2574 C LEU C 105 4.532 -1.173 24.064 1.00 23.18 C ATOM 2575 O LEU C 105 5.108 -2.193 23.671 1.00 24.34 O ATOM 2576 CB LEU C 105 3.632 0.157 22.186 1.00 23.21 C ATOM 2577 CG LEU C 105 3.448 1.507 21.480 1.00 24.53 C ATOM 2578 CD1 LEU C 105 4.445 1.684 20.347 1.00 26.31 C ATOM 2579 CD2 LEU C 105 2.031 1.680 20.962 1.00 28.42 C ATOM 2580 H LEU C 105 6.336 -0.487 22.063 1.00 0.00 H ATOM 2581 N PRO C 106 3.735 -1.162 25.137 1.00 25.40 N ATOM 2582 CA PRO C 106 3.455 -2.405 25.848 1.00 25.55 C ATOM 2583 C PRO C 106 2.519 -3.356 25.087 1.00 25.68 C ATOM 2584 O PRO C 106 1.584 -2.931 24.395 1.00 27.11 O ATOM 2585 CB PRO C 106 2.807 -1.924 27.145 1.00 28.65 C ATOM 2586 CG PRO C 106 2.140 -0.650 26.774 1.00 28.55 C ATOM 2587 CD PRO C 106 2.982 -0.028 25.696 1.00 28.76 C ATOM 2588 N VAL C 107 2.806 -4.646 25.205 1.00 25.70 N ATOM 2589 CA VAL C 107 1.959 -5.701 24.651 1.00 23.66 C ATOM 2590 C VAL C 107 1.575 -6.586 25.821 1.00 24.92 C ATOM 2591 O VAL C 107 2.433 -6.964 26.604 1.00 28.75 O ATOM 2592 CB VAL C 107 2.712 -6.519 23.586 1.00 23.49 C ATOM 2593 CG1 VAL C 107 1.915 -7.736 23.150 1.00 23.71 C ATOM 2594 CG2 VAL C 107 3.047 -5.655 22.382 1.00 24.03 C ATOM 2595 H VAL C 107 3.671 -4.919 25.714 1.00 0.00 H ATOM 2596 N GLU C 108 0.291 -6.915 25.945 1.00 24.63 N ATOM 2597 CA GLU C 108 -0.180 -7.690 27.092 1.00 26.95 C ATOM 2598 C GLU C 108 -0.216 -9.195 26.848 1.00 27.64 C ATOM 2599 O GLU C 108 -0.127 -9.974 27.789 1.00 31.67 O ATOM 2600 CB GLU C 108 -1.557 -7.191 27.529 1.00 30.28 C ATOM 2601 CG GLU C 108 -1.483 -5.818 28.185 1.00 35.84 C ATOM 2602 CD GLU C 108 -2.835 -5.267 28.598 1.00 45.37 C ATOM 2603 OE1 GLU C 108 -3.871 -5.875 28.245 1.00 46.90 O ATOM 2604 OE2 GLU C 108 -2.863 -4.212 29.280 1.00 53.07 O ATOM 2605 H GLU C 108 -0.387 -6.616 25.215 1.00 0.00 H ATOM 2606 N ASN C 109 -0.357 -9.601 25.595 1.00 25.57 N ATOM 2607 CA ASN C 109 -0.381 -11.014 25.260 1.00 26.19 C ATOM 2608 C ASN C 109 -0.025 -11.244 23.805 1.00 26.05 C ATOM 2609 O ASN C 109 -0.098 -10.329 22.973 1.00 23.73 O ATOM 2610 CB ASN C 109 -1.754 -11.632 25.571 1.00 30.64 C ATOM 2611 CG ASN C 109 -1.691 -13.141 25.820 1.00 40.31 C ATOM 2612 OD1 ASN C 109 -0.611 -13.752 25.896 1.00 40.70 O ATOM 2613 ND2 ASN C 109 -2.862 -13.750 25.949 1.00 50.13 N ATOM 2614 HD22 ASN C 109 -3.743 -13.202 25.879 1.00 0.00 H ATOM 2615 HD21 ASN C 109 -2.899 -14.775 26.120 1.00 0.00 H ATOM 2616 H ASN C 109 -0.452 -8.895 24.837 1.00 0.00 H ATOM 2617 N ALA C 110 0.362 -12.485 23.518 1.00 26.41 N ATOM 2618 CA ALA C 110 0.677 -12.926 22.176 1.00 25.29 C ATOM 2619 C ALA C 110 0.177 -14.350 21.977 1.00 23.74 C ATOM 2620 O ALA C 110 0.226 -15.175 22.905 1.00 27.27 O ATOM 2621 CB ALA C 110 2.175 -12.861 21.922 1.00 28.67 C ATOM 2622 H ALA C 110 0.442 -13.171 24.296 1.00 0.00 H ATOM 2623 N ILE C 111 -0.264 -14.641 20.760 1.00 23.96 N ATOM 2624 CA ILE C 111 -0.665 -15.982 20.366 1.00 24.37 C ATOM 2625 C ILE C 111 -0.012 -16.354 19.042 1.00 23.15 C ATOM 2626 O ILE C 111 -0.056 -15.602 18.080 1.00 25.65 O ATOM 2627 CB ILE C 111 -2.200 -16.086 20.207 1.00 29.08 C ATOM 2628 CG1 ILE C 111 -2.896 -15.654 21.499 1.00 36.03 C ATOM 2629 CG2 ILE C 111 -2.593 -17.505 19.800 1.00 31.16 C ATOM 2630 CD1 ILE C 111 -4.409 -15.671 21.424 1.00 43.77 C ATOM 2631 H ILE C 111 -0.326 -13.877 20.057 1.00 0.00 H ATOM 2632 N GLN C 112 0.594 -17.537 18.997 1.00 23.49 N ATOM 2633 CA GLN C 112 1.051 -18.095 17.731 1.00 24.86 C ATOM 2634 C GLN C 112 -0.128 -18.741 17.028 1.00 24.57 C ATOM 2635 O GLN C 112 -0.762 -19.636 17.590 1.00 31.12 O ATOM 2636 CB GLN C 112 2.114 -19.164 17.953 1.00 30.67 C ATOM 2637 CG GLN C 112 3.528 -18.654 18.037 1.00 36.69 C ATOM 2638 CD GLN C 112 4.530 -19.737 18.369 1.00 36.51 C ATOM 2639 OE1 GLN C 112 5.649 -19.441 18.789 1.00 52.44 O ATOM 2640 NE2 GLN C 112 4.143 -20.993 18.186 1.00 33.70 N ATOM 2641 HE22 GLN C 112 3.188 -21.196 17.829 1.00 0.00 H ATOM 2642 HE21 GLN C 112 4.795 -21.774 18.400 1.00 0.00 H ATOM 2643 H GLN C 112 0.744 -18.071 19.877 1.00 0.00 H ATOM 2644 N VAL C 113 -0.402 -18.340 15.797 1.00 22.43 N ATOM 2645 CA VAL C 113 -1.531 -18.895 15.050 1.00 23.38 C ATOM 2646 C VAL C 113 -1.325 -20.399 14.759 1.00 24.29 C ATOM 2647 O VAL C 113 -2.248 -21.186 14.880 1.00 26.04 O ATOM 2648 CB VAL C 113 -1.755 -18.133 13.725 1.00 20.44 C ATOM 2649 CG1 VAL C 113 -2.812 -18.826 12.867 1.00 23.30 C ATOM 2650 CG2 VAL C 113 -2.150 -16.673 13.990 1.00 19.78 C ATOM 2651 H VAL C 113 0.197 -17.616 15.352 1.00 0.00 H ATOM 2652 N ARG C 114 -0.114 -20.787 14.374 1.00 22.93 N ATOM 2653 CA ARG C 114 0.148 -22.180 13.939 1.00 24.32 C ATOM 2654 C ARG C 114 -0.103 -23.198 15.036 1.00 26.37 C ATOM 2655 O ARG C 114 -0.624 -24.265 14.740 1.00 28.65 O ATOM 2656 CB ARG C 114 1.571 -22.306 13.414 1.00 26.56 C ATOM 2657 CG ARG C 114 1.889 -23.629 12.719 1.00 30.18 C ATOM 2658 CD ARG C 114 3.247 -23.567 12.043 1.00 34.54 C ATOM 2659 NE ARG C 114 4.333 -23.756 13.001 1.00 39.47 N ATOM 2660 CZ ARG C 114 4.972 -24.915 13.205 1.00 41.55 C ATOM 2661 NH1 ARG C 114 4.660 -26.003 12.503 1.00 44.72 N ATOM 2662 NH2 ARG C 114 5.934 -24.980 14.109 1.00 45.21 N ATOM 2663 HE ARG C 114 4.631 -22.934 13.564 1.00 0.00 H ATOM 2664 HH12 ARG C 114 5.166 -26.895 12.674 1.00 0.00 H ATOM 2665 HH11 ARG C 114 3.910 -25.960 11.784 1.00 0.00 H ATOM 2666 HH22 ARG C 114 6.434 -25.877 14.272 1.00 0.00 H ATOM 2667 HH21 ARG C 114 6.191 -24.134 14.657 1.00 0.00 H ATOM 2668 H ARG C 114 0.666 -20.099 14.378 1.00 0.00 H ATOM 2669 N THR C 115 0.231 -22.859 16.277 1.00 24.83 N ATOM 2670 CA THR C 115 0.166 -23.792 17.410 1.00 26.15 C ATOM 2671 C THR C 115 -0.899 -23.440 18.441 1.00 27.29 C ATOM 2672 O THR C 115 -1.308 -24.303 19.228 1.00 37.23 O ATOM 2673 CB THR C 115 1.501 -23.785 18.159 1.00 27.25 C ATOM 2674 OG1 THR C 115 1.769 -22.430 18.579 1.00 29.89 O ATOM 2675 CG2 THR C 115 2.601 -24.225 17.241 1.00 29.29 C ATOM 2676 HG1 THR C 115 2.630 -22.401 19.067 1.00 0.00 H ATOM 2677 H THR C 115 0.554 -21.886 16.455 1.00 0.00 H ATOM 2678 N GLY C 116 -1.353 -22.186 18.449 1.00 28.46 N ATOM 2679 CA GLY C 116 -2.190 -21.684 19.533 1.00 29.34 C ATOM 2680 C GLY C 116 -1.457 -21.482 20.855 1.00 29.10 C ATOM 2681 O GLY C 116 -2.077 -21.232 21.884 1.00 32.75 O ATOM 2682 H GLY C 116 -1.104 -21.551 17.664 1.00 0.00 H ATOM 2683 N LYS C 117 -0.132 -21.577 20.835 1.00 29.03 N ATOM 2684 CA LYS C 117 0.678 -21.240 22.000 1.00 30.67 C ATOM 2685 C LYS C 117 0.512 -19.752 22.350 1.00 28.34 C ATOM 2686 O LYS C 117 0.505 -18.909 21.467 1.00 29.78 O ATOM 2687 CB LYS C 117 2.148 -21.513 21.715 1.00 32.30 C ATOM 2688 CG LYS C 117 3.041 -21.284 22.918 1.00 38.07 C ATOM 2689 CD LYS C 117 4.352 -22.033 22.797 1.00 41.79 C ATOM 2690 CE LYS C 117 5.250 -21.763 23.993 1.00 45.50 C ATOM 2691 NZ LYS C 117 4.618 -22.104 25.304 1.00 49.01 N ATOM 2692 HZ1 LYS C 117 3.754 -21.538 25.429 1.00 0.00 H ATOM 2693 HZ2 LYS C 117 4.376 -23.115 25.318 1.00 0.00 H ATOM 2694 HZ3 LYS C 117 5.285 -21.895 26.074 1.00 0.00 H ATOM 2695 H LYS C 117 0.340 -21.900 19.966 1.00 0.00 H ATOM 2696 N THR C 118 0.403 -19.460 23.646 1.00 30.22 N ATOM 2697 CA THR C 118 0.193 -18.094 24.122 1.00 31.58 C ATOM 2698 C THR C 118 1.258 -17.665 25.130 1.00 34.24 C ATOM 2699 O THR C 118 1.967 -18.497 25.710 1.00 41.66 O ATOM 2700 CB THR C 118 -1.181 -17.930 24.807 1.00 38.59 C ATOM 2701 OG1 THR C 118 -1.164 -18.577 26.084 1.00 44.44 O ATOM 2702 CG2 THR C 118 -2.293 -18.515 23.952 1.00 38.22 C ATOM 2703 HG1 THR C 118 -0.970 -19.540 25.962 1.00 0.00 H ATOM 2704 H THR C 118 0.470 -20.230 24.342 1.00 0.00 H ATOM 2705 N GLY C 119 1.339 -16.356 25.343 1.00 34.84 N ATOM 2706 CA GLY C 119 2.249 -15.769 26.327 1.00 35.41 C ATOM 2707 C GLY C 119 3.585 -15.355 25.738 1.00 35.01 C ATOM 2708 O GLY C 119 3.757 -15.311 24.518 1.00 33.34 O ATOM 2709 H GLY C 119 0.730 -15.722 24.787 1.00 0.00 H ATOM 2710 N ARG C 120 4.544 -15.077 26.618 1.00 35.78 N ATOM 2711 CA ARG C 120 5.851 -14.556 26.191 1.00 27.54 C ATOM 2712 C ARG C 120 6.628 -15.534 25.322 1.00 32.05 C ATOM 2713 O ARG C 120 7.361 -15.125 24.416 1.00 38.40 O ATOM 2714 CB ARG C 120 6.688 -14.090 27.394 1.00 37.94 C ATOM 2715 CG ARG C 120 7.044 -15.164 28.410 1.00 44.18 C ATOM 2716 CD ARG C 120 7.955 -14.624 29.505 1.00 49.57 C ATOM 2717 NE ARG C 120 9.089 -13.871 28.966 1.00 52.99 N ATOM 2718 CZ ARG C 120 10.151 -14.406 28.363 1.00 57.11 C ATOM 2719 NH1 ARG C 120 11.117 -13.615 27.912 1.00 55.87 N ATOM 2720 NH2 ARG C 120 10.258 -15.724 28.200 1.00 60.52 N ATOM 2721 HE ARG C 120 9.064 -12.836 29.061 1.00 0.00 H ATOM 2722 HH12 ARG C 120 11.948 -14.026 27.441 1.00 0.00 H ATOM 2723 HH11 ARG C 120 11.043 -12.584 28.030 1.00 0.00 H ATOM 2724 HH22 ARG C 120 11.094 -16.123 27.727 1.00 0.00 H ATOM 2725 HH21 ARG C 120 9.506 -16.353 28.546 1.00 0.00 H ATOM 2726 H ARG C 120 4.365 -15.232 27.631 1.00 0.00 H ATOM 2727 N ASP C 121 6.441 -16.827 25.574 1.00 38.03 N ATOM 2728 CA ASP C 121 7.095 -17.857 24.784 1.00 40.21 C ATOM 2729 C ASP C 121 6.485 -18.012 23.379 1.00 36.48 C ATOM 2730 O ASP C 121 7.092 -18.647 22.514 1.00 42.66 O ATOM 2731 CB ASP C 121 7.070 -19.190 25.543 1.00 45.87 C ATOM 2732 CG ASP C 121 7.798 -19.117 26.881 1.00 56.55 C ATOM 2733 OD1 ASP C 121 8.797 -18.372 26.992 1.00 61.63 O ATOM 2734 OD2 ASP C 121 7.368 -19.811 27.827 1.00 72.06 O ATOM 2735 H ASP C 121 5.813 -17.107 26.354 1.00 0.00 H ATOM 2736 N ALA C 122 5.301 -17.430 23.144 1.00 31.68 N ATOM 2737 CA ALA C 122 4.745 -17.359 21.791 1.00 34.32 C ATOM 2738 C ALA C 122 5.482 -16.313 20.941 1.00 32.95 C ATOM 2739 O ALA C 122 5.341 -16.306 19.718 1.00 35.72 O ATOM 2740 CB ALA C 122 3.253 -17.064 21.833 1.00 34.61 C ATOM 2741 H ALA C 122 4.767 -17.021 23.937 1.00 0.00 H ATOM 2742 N VAL C 123 6.221 -15.424 21.619 1.00 33.86 N ATOM 2743 CA VAL C 123 7.275 -14.543 21.058 1.00 40.75 C ATOM 2744 C VAL C 123 6.929 -13.055 21.267 1.00 38.69 C ATOM 2745 O VAL C 123 7.688 -12.137 20.929 1.00 43.70 O ATOM 2746 CB VAL C 123 7.733 -14.928 19.607 1.00 42.61 C ATOM 2747 CG1 VAL C 123 7.553 -13.802 18.598 1.00 43.28 C ATOM 2748 CG2 VAL C 123 9.190 -15.358 19.604 1.00 46.54 C ATOM 2749 OXT VAL C 123 5.880 -12.724 21.833 1.00 45.79 O ATOM 2750 H VAL C 123 6.038 -15.344 22.640 1.00 0.00 H TER 2751 VAL C 123 HETATM 2752 O HOH 1 0.707 1.406 9.707 1.00 38.15 O HETATM 2753 O HOH 2 -19.299 6.569 11.989 1.00 35.50 O HETATM 2754 O HOH 3 -0.245 5.345 10.108 1.00 22.44 O HETATM 2755 O HOH 4 1.703 15.012 16.218 1.00 41.26 O HETATM 2756 O HOH 5 -0.294 7.200 0.429 1.00 34.81 O HETATM 2757 O HOH 6 20.793 6.723 16.223 1.00 43.87 O HETATM 2758 O HOH 7 -11.291 8.068 -2.379 1.00 39.26 O HETATM 2759 O HOH 8 -17.620 7.652 13.859 1.00 27.80 O HETATM 2760 O HOH 9 -14.098 4.775 1.468 1.00 29.17 O HETATM 2761 O HOH 10 3.983 15.144 18.304 1.00 42.14 O HETATM 2762 O HOH 11 -13.318 10.083 1.345 1.00 34.11 O HETATM 2763 O HOH 12 -5.999 11.145 1.327 1.00 31.15 O HETATM 2764 O HOH 13 1.909 6.326 28.298 1.00 39.24 O HETATM 2765 O HOH 14 -6.689 1.570 0.996 1.00 29.12 O HETATM 2766 O HOH 15 -6.290 5.216 1.740 1.00 26.88 O HETATM 2767 O HOH 16 -14.473 6.641 3.585 1.00 35.26 O HETATM 2768 O HOH 17 -17.698 -11.158 6.909 1.00 46.12 O HETATM 2769 O HOH 18 -17.541 3.323 5.311 1.00 33.28 O HETATM 2770 O HOH 19 0.212 3.108 3.234 1.00 37.17 O HETATM 2771 O HOH 20 -7.544 14.673 1.938 1.00 34.53 O HETATM 2772 O HOH 21 -15.696 8.785 2.466 1.00 37.46 O HETATM 2773 O HOH 22 -3.248 11.567 27.861 1.00 45.50 O HETATM 2774 O HOH 23 23.685 10.471 16.059 1.00 35.86 O HETATM 2775 O HOH 24 -3.084 19.904 4.604 1.00 38.79 O HETATM 2776 O HOH 25 0.820 6.479 3.098 1.00 38.53 O HETATM 2777 O HOH 26 -13.260 6.276 -0.672 1.00 31.49 O HETATM 2778 O HOH 27 2.656 1.269 29.710 1.00 48.35 O HETATM 2779 O HOH 28 18.749 11.045 25.499 1.00 42.87 O HETATM 2780 O HOH 29 -25.399 8.011 8.237 1.00 61.13 O HETATM 2781 O HOH 30 4.891 17.364 16.243 1.00 38.38 O HETATM 2782 O HOH 31 -9.397 0.000 0.000 1.00 22.34 O HETATM 2783 O HOH 32 -9.227 15.986 -0.001 1.00 40.14 O HETATM 2784 O HOH 33 -0.017 2.386 0.524 1.00 37.47 O HETATM 2785 O HOH 34 -3.834 9.018 1.599 1.00 35.29 O HETATM 2786 O HOH 35 14.972 16.129 13.271 1.00 56.69 O HETATM 2787 O HOH 36 3.301 3.972 29.292 1.00 41.49 O HETATM 2788 O HOH 37 -2.503 11.098 30.634 1.00 56.91 O HETATM 2789 O HOH 38 0.000 0.000 2.844 1.00 37.50 O HETATM 2790 O HOH 39 -4.626 -0.001 0.001 1.00 49.78 O HETATM 2791 O HOH 40 -0.013 -0.011 29.752 1.00 49.58 O HETATM 2792 O HOH 41 -13.523 10.724 8.616 1.00 21.83 O HETATM 2793 O HOH 42 -9.664 17.285 3.739 1.00 27.52 O HETATM 2794 O HOH 43 -8.671 21.816 9.211 1.00 39.76 O HETATM 2795 O HOH 44 -19.756 11.665 4.596 1.00 35.98 O HETATM 2796 O HOH 45 -9.977 20.528 14.093 1.00 32.29 O HETATM 2797 O HOH 46 5.260 7.353 28.619 1.00 36.43 O HETATM 2798 O HOH 47 -2.803 15.694 29.204 1.00 41.65 O HETATM 2799 O HOH 48 -16.799 1.727 7.679 1.00 32.54 O HETATM 2800 O HOH 49 -5.101 14.249 27.252 1.00 38.51 O HETATM 2801 O HOH 50 -6.568 22.303 15.528 1.00 39.64 O HETATM 2802 O HOH 51 4.626 14.315 28.688 1.00 41.64 O HETATM 2803 O HOH 52 6.151 16.367 22.219 1.00 49.85 O HETATM 2804 O HOH 53 -15.379 18.438 9.520 1.00 36.05 O HETATM 2805 O HOH 54 3.389 16.567 21.166 1.00 31.20 O HETATM 2806 O HOH 55 5.611 3.892 31.015 1.00 52.29 O HETATM 2807 O HOH 56 8.261 4.494 30.649 1.00 47.74 O HETATM 2808 O HOH 57 -18.730 18.581 9.894 1.00 44.70 O HETATM 2809 O HOH 58 -13.126 18.978 7.407 1.00 45.73 O HETATM 2810 O HOH 59 13.419 13.020 27.482 1.00 59.40 O HETATM 2811 O HOH 60 -11.502 21.288 9.519 1.00 44.88 O HETATM 2812 O HOH 61 -7.024 21.974 4.827 1.00 49.23 O HETATM 2813 O HOH 62 -20.609 -4.048 9.405 1.00118.46 O HETATM 2814 O HOH 63 -7.985 20.578 20.183 1.00 44.19 O HETATM 2815 O HOH 64 -16.920 -0.889 4.822 1.00 53.36 O HETATM 2816 O HOH 65 11.251 10.701 29.551 1.00 51.25 O HETATM 2817 O HOH 66 -7.756 23.646 11.155 1.00 48.15 O HETATM 2818 O HOH 67 -8.453 22.808 13.755 1.00 49.28 O HETATM 2819 O HOH 68 -10.119 24.989 14.130 1.00 57.61 O HETATM 2820 O HOH 69 -10.681 21.574 16.856 1.00 49.79 O HETATM 2821 O HOH 70 -8.717 23.073 6.710 1.00 45.80 O HETATM 2822 O HOH 71 -11.887 21.447 12.334 1.00 36.89 O HETATM 2823 O HOH 72 -20.593 -5.927 1.471 1.00 44.73 O HETATM 2824 O HOH 73 -1.571 -0.091 9.707 1.00 38.15 O HETATM 2825 O HOH 74 3.961 -19.998 11.989 1.00 35.50 O HETATM 2826 O HOH 75 -4.506 -2.885 10.108 1.00 22.44 O HETATM 2827 O HOH 76 -13.852 -6.031 16.218 1.00 41.26 O HETATM 2828 O HOH 77 -6.088 -3.855 0.429 1.00 34.81 O HETATM 2829 O HOH 78 -16.219 14.646 16.223 1.00 43.87 O HETATM 2830 O HOH 79 -1.342 -13.812 -2.379 1.00 39.26 O HETATM 2831 O HOH 80 2.183 -19.085 13.859 1.00 27.80 O HETATM 2832 O HOH 81 2.914 -14.597 1.468 1.00 29.17 O HETATM 2833 O HOH 82 -15.107 -4.123 18.304 1.00 42.14 O HETATM 2834 O HOH 83 -2.073 -16.575 1.345 1.00 34.11 O HETATM 2835 O HOH 84 -6.652 -10.768 1.327 1.00 31.15 O HETATM 2836 O HOH 85 -6.433 -1.510 28.298 1.00 39.24 O HETATM 2837 O HOH 86 1.985 -6.578 0.996 1.00 29.12 O HETATM 2838 O HOH 87 -1.372 -8.055 1.740 1.00 26.88 O HETATM 2839 O HOH 88 1.485 -15.854 3.585 1.00 35.26 O HETATM 2840 O HOH 89 18.512 -9.748 6.909 1.00 46.12 O HETATM 2841 O HOH 90 5.893 -16.852 5.311 1.00 33.28 O HETATM 2842 O HOH 91 -2.798 -1.370 3.234 1.00 37.17 O HETATM 2843 O HOH 92 -8.935 -13.870 1.938 1.00 34.53 O HETATM 2844 O HOH 93 0.240 -17.986 2.466 1.00 37.46 O HETATM 2845 O HOH 94 -8.393 -8.596 27.861 1.00 45.50 O HETATM 2846 O HOH 95 -15.695 -12.623 4.604 1.00 38.79 O HETATM 2847 O HOH 96 -6.021 -2.529 3.098 1.00 38.53 O HETATM 2848 O HOH 97 1.195 -14.621 -0.672 1.00 31.49 O HETATM 2849 O HOH 98 -2.427 1.666 29.710 1.00 48.35 O HETATM 2850 O HOH 99 -18.940 10.715 25.499 1.00 42.87 O HETATM 2851 O HOH 100 5.762 -26.002 8.237 1.00 61.13 O HETATM 2852 O HOH 101 -17.483 -4.446 16.243 1.00 38.38 O HETATM 2853 O HOH 102 -2.058 -1.208 0.524 1.00 37.47 O HETATM 2854 O HOH 103 -5.893 -7.829 1.599 1.00 35.29 O HETATM 2855 O HOH 104 -21.454 4.902 13.271 1.00 56.69 O HETATM 2856 O HOH 105 -5.090 0.873 29.292 1.00 41.49 O HETATM 2857 O HOH 106 -8.360 -7.717 30.634 1.00 56.91 O HETATM 2858 O HOH 107 -2.526 -17.073 8.616 1.00 21.83 O HETATM 2859 O HOH 108 -10.137 -17.012 3.739 1.00 27.52 O HETATM 2860 O HOH 109 -14.558 -18.417 9.211 1.00 39.76 O HETATM 2861 O HOH 110 -0.224 -22.942 4.596 1.00 35.98 O HETATM 2862 O HOH 111 -12.789 -18.904 14.093 1.00 32.29 O HETATM 2863 O HOH 112 -8.998 0.879 28.619 1.00 36.43 O HETATM 2864 O HOH 113 -12.190 -10.274 29.204 1.00 41.65 O HETATM 2865 O HOH 114 6.904 -15.412 7.679 1.00 32.54 O HETATM 2866 O HOH 115 -9.789 -11.542 27.252 1.00 38.51 O HETATM 2867 O HOH 116 -16.031 -16.840 15.528 1.00 39.64 O HETATM 2868 O HOH 117 -14.710 -3.151 28.688 1.00 41.64 O HETATM 2869 O HOH 118 -17.250 -2.857 22.219 1.00 49.85 O HETATM 2870 O HOH 119 -8.278 -22.538 9.520 1.00 36.05 O HETATM 2871 O HOH 120 -16.042 -5.349 21.166 1.00 31.20 O HETATM 2872 O HOH 121 -6.176 2.913 31.015 1.00 52.29 O HETATM 2873 O HOH 122 -8.022 4.907 30.649 1.00 47.74 O HETATM 2874 O HOH 123 -6.727 -25.511 9.894 1.00 44.70 O HETATM 2875 O HOH 124 -9.872 -20.856 7.407 1.00 45.73 O HETATM 2876 O HOH 125 -17.985 5.111 27.482 1.00 59.40 O HETATM 2877 O HOH 126 -12.685 -20.605 9.519 1.00 44.88 O HETATM 2878 O HOH 127 -15.518 -17.070 4.827 1.00 49.23 O HETATM 2879 O HOH 128 13.810 -15.824 9.405 1.00118.46 O HETATM 2880 O HOH 129 -13.829 -17.204 20.183 1.00 44.19 O HETATM 2881 O HOH 130 9.230 -14.209 4.822 1.00 53.36 O HETATM 2882 O HOH 131 -14.893 4.393 29.551 1.00 51.25 O HETATM 2883 O HOH 132 -16.600 -18.540 11.155 1.00 48.15 O HETATM 2884 O HOH 133 -15.526 -18.725 13.755 1.00 49.28 O HETATM 2885 O HOH 134 -16.582 -21.258 14.130 1.00 57.61 O HETATM 2886 O HOH 135 -13.343 -20.037 16.856 1.00 49.79 O HETATM 2887 O HOH 136 -15.623 -19.086 6.710 1.00 45.80 O HETATM 2888 O HOH 137 -12.630 -21.018 12.334 1.00 36.89 O HETATM 2889 O HOH 138 15.429 -14.871 1.471 1.00 44.73 O HETATM 2890 O HOH 139 0.864 -1.315 9.707 1.00 38.15 O HETATM 2891 O HOH 140 15.338 13.429 11.989 1.00 35.50 O HETATM 2892 O HOH 141 4.751 -2.460 10.108 1.00 22.44 O HETATM 2893 O HOH 142 12.149 -8.981 16.218 1.00 41.26 O HETATM 2894 O HOH 143 6.382 -3.345 0.429 1.00 34.81 O HETATM 2895 O HOH 144 -4.574 -21.369 16.223 1.00 43.87 O HETATM 2896 O HOH 145 12.633 5.744 -2.379 1.00 39.26 O HETATM 2897 O HOH 146 15.437 11.433 13.859 1.00 27.80 O HETATM 2898 O HOH 147 11.184 9.822 1.468 1.00 29.17 O HETATM 2899 O HOH 148 11.124 -11.021 18.304 1.00 42.14 O HETATM 2900 O HOH 149 15.391 6.492 1.345 1.00 34.11 O HETATM 2901 O HOH 150 12.651 -0.377 1.327 1.00 31.15 O HETATM 2902 O HOH 151 4.524 -4.816 28.298 1.00 39.24 O HETATM 2903 O HOH 152 4.704 5.008 0.996 1.00 29.12 O HETATM 2904 O HOH 153 7.662 2.839 1.740 1.00 26.88 O HETATM 2905 O HOH 154 12.988 9.213 3.585 1.00 35.26 O HETATM 2906 O HOH 155 -0.814 20.906 6.909 1.00 46.12 O HETATM 2907 O HOH 156 11.648 13.529 5.311 1.00 33.28 O HETATM 2908 O HOH 157 2.586 -1.738 3.234 1.00 37.17 O HETATM 2909 O HOH 158 16.479 -0.803 1.938 1.00 34.53 O HETATM 2910 O HOH 159 15.456 9.201 2.466 1.00 37.46 O HETATM 2911 O HOH 160 11.641 -2.971 27.861 1.00 45.50 O HETATM 2912 O HOH 161 18.779 -7.281 4.604 1.00 38.79 O HETATM 2913 O HOH 162 5.201 -3.950 3.098 1.00 38.53 O HETATM 2914 O HOH 163 12.065 8.345 -0.672 1.00 31.49 O HETATM 2915 O HOH 164 -0.229 -2.935 29.710 1.00 48.35 O HETATM 2916 O HOH 165 0.191 -21.760 25.499 1.00 42.87 O HETATM 2917 O HOH 166 19.637 17.991 8.237 1.00 61.13 O HETATM 2918 O HOH 167 12.592 -12.918 16.243 1.00 38.38 O HETATM 2919 O HOH 168 2.075 -1.178 0.524 1.00 37.47 O HETATM 2920 O HOH 169 9.727 -1.189 1.599 1.00 35.29 O HETATM 2921 O HOH 170 6.482 -21.031 13.271 1.00 56.69 O HETATM 2922 O HOH 171 1.789 -4.845 29.292 1.00 41.49 O HETATM 2923 O HOH 172 10.863 -3.381 30.634 1.00 56.91 O HETATM 2924 O HOH 173 16.049 6.349 8.616 1.00 21.83 O HETATM 2925 O HOH 174 19.801 -0.273 3.739 1.00 27.52 O HETATM 2926 O HOH 175 23.229 -3.399 9.211 1.00 39.76 O HETATM 2927 O HOH 176 19.980 11.277 4.596 1.00 35.98 O HETATM 2928 O HOH 177 22.766 -1.624 14.093 1.00 32.29 O HETATM 2929 O HOH 178 3.738 -8.232 28.619 1.00 36.43 O HETATM 2930 O HOH 179 14.993 -5.420 29.204 1.00 41.65 O HETATM 2931 O HOH 180 9.895 13.685 7.679 1.00 32.54 O HETATM 2932 O HOH 181 14.890 -2.707 27.252 1.00 38.51 O HETATM 2933 O HOH 182 22.599 -5.463 15.528 1.00 39.64 O HETATM 2934 O HOH 183 10.084 -11.164 28.688 1.00 41.64 O HETATM 2935 O HOH 184 11.099 -13.510 22.219 1.00 49.85 O HETATM 2936 O HOH 185 23.657 4.100 9.520 1.00 36.05 O HETATM 2937 O HOH 186 12.653 -11.218 21.166 1.00 31.20 O HETATM 2938 O HOH 187 0.565 -6.805 31.015 1.00 52.29 O HETATM 2939 O HOH 188 -0.239 -9.401 30.649 1.00 47.74 O HETATM 2940 O HOH 189 25.457 6.930 9.894 1.00 44.70 O HETATM 2941 O HOH 190 22.998 1.878 7.407 1.00 45.73 O HETATM 2942 O HOH 191 4.566 -18.131 27.482 1.00 59.40 O HETATM 2943 O HOH 192 24.187 -0.683 9.519 1.00 44.88 O HETATM 2944 O HOH 193 22.542 -4.904 4.827 1.00 49.23 O HETATM 2945 O HOH 194 6.799 19.872 9.405 1.00118.46 O HETATM 2946 O HOH 195 21.814 -3.374 20.183 1.00 44.19 O HETATM 2947 O HOH 196 7.690 15.098 4.822 1.00 53.36 O HETATM 2948 O HOH 197 3.642 -15.094 29.551 1.00 51.25 O HETATM 2949 O HOH 198 24.356 -5.106 11.155 1.00 48.15 O HETATM 2950 O HOH 199 23.979 -4.083 13.755 1.00 49.28 O HETATM 2951 O HOH 200 26.701 -3.731 14.130 1.00 57.61 O HETATM 2952 O HOH 201 24.024 -1.537 16.856 1.00 49.79 O HETATM 2953 O HOH 202 24.340 -3.987 6.710 1.00 45.80 O HETATM 2954 O HOH 203 24.517 -0.429 12.334 1.00 36.89 O HETATM 2955 O HOH 204 5.164 20.798 1.471 1.00 44.73 O HETATM 2956 PB ADP A 205 -19.613 2.536 10.839 1.00 0.21 P HETATM 2957 O1B ADP A 205 -20.072 1.883 9.550 1.00 -0.59 O HETATM 2958 O2B ADP A 205 -19.799 1.652 12.074 1.00 -0.59 O HETATM 2959 O3B ADP A 205 -20.156 3.940 11.025 1.00 -0.59 O HETATM 2960 O3A ADP A 205 -18.020 2.681 10.585 1.00 -0.15 O HETATM 2961 PA ADP A 205 -17.107 3.577 11.546 1.00 0.33 P HETATM 2962 O1A ADP A 205 -17.293 5.036 11.179 1.00 -0.56 O HETATM 2963 O2A ADP A 205 -17.377 3.072 12.946 1.00 -0.56 O HETATM 2964 O5' ADP A 205 -15.683 3.111 11.132 1.00 -0.24 O HETATM 2965 C5' ADP A 205 -15.027 3.537 9.949 1.00 0.11 C HETATM 2966 C4' ADP A 205 -13.716 2.761 9.888 1.00 0.12 C HETATM 2967 O4' ADP A 205 -12.950 2.839 11.104 1.00 -0.34 O HETATM 2968 C1' ADP A 205 -12.370 1.557 11.382 1.00 0.20 C HETATM 2969 C2' ADP A 205 -12.637 0.666 10.192 1.00 0.14 C HETATM 2970 C3' ADP A 205 -13.926 1.265 9.650 1.00 0.11 C HETATM 2971 O3' ADP A 205 -14.137 1.015 8.268 1.00 -0.39 O HETATM 2972 H ADP A 205 -14.907 1.489 7.976 1.00 0.21 H HETATM 2973 H ADP A 205 -14.791 0.890 10.216 1.00 0.06 H HETATM 2974 O2' ADP A 205 -11.578 0.841 9.257 1.00 -0.38 O HETATM 2975 H ADP A 205 -10.781 0.463 9.609 1.00 0.21 H HETATM 2976 H ADP A 205 -12.750 -0.393 10.468 1.00 0.07 H HETATM 2977 N9 ADP A 205 -12.916 1.039 12.666 1.00 -0.19 N HETATM 2978 C8 ADP A 205 -14.066 1.428 13.275 1.00 0.11 C HETATM 2979 N7 ADP A 205 -14.233 0.810 14.466 1.00 -0.30 N HETATM 2980 C5 ADP A 205 -13.156 -0.016 14.605 1.00 0.10 C HETATM 2981 C6 ADP A 205 -12.700 -0.962 15.618 1.00 0.13 C HETATM 2982 N6 ADP A 205 -13.427 -1.183 16.732 1.00 -0.32 N HETATM 2983 H ADP A 205 -13.094 -1.853 17.440 1.00 0.18 H HETATM 2984 H ADP A 205 -14.315 -0.681 16.875 1.00 0.18 H HETATM 2985 N1 ADP A 205 -11.523 -1.618 15.395 1.00 -0.27 N HETATM 2986 C2 ADP A 205 -10.795 -1.413 14.280 1.00 0.05 C HETATM 2987 N3 ADP A 205 -11.146 -0.555 13.305 1.00 -0.27 N HETATM 2988 C4 ADP A 205 -12.326 0.134 13.421 1.00 0.16 C HETATM 2989 H ADP A 205 -9.873 -1.972 14.162 1.00 0.10 H HETATM 2990 H ADP A 205 -14.767 2.148 12.856 1.00 0.13 H HETATM 2991 H ADP A 205 -11.281 1.667 11.495 1.00 0.10 H HETATM 2992 H ADP A 205 -13.122 3.179 9.062 1.00 0.07 H HETATM 2993 H ADP A 205 -14.829 4.618 9.991 1.00 0.06 H HETATM 2994 H ADP A 205 -15.645 3.311 9.068 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 381 382 388 389 390 CONECT 388 381 CONECT 389 381 CONECT 390 381 CONECT 918 919 923 924 925 CONECT 923 918 CONECT 924 918 CONECT 925 918 CONECT 1298 1299 1305 1306 1307 CONECT 1305 1298 CONECT 1306 1298 CONECT 1307 1298 CONECT 1835 1836 1840 1841 1842 CONECT 1840 1835 CONECT 1841 1835 CONECT 1842 1835 CONECT 2215 2216 2222 2223 2224 CONECT 2222 2215 CONECT 2223 2215 CONECT 2224 2215 CONECT 2956 2957 2958 2959 2960 CONECT 2957 2956 CONECT 2958 2956 CONECT 2959 2956 CONECT 2960 2956 2961 CONECT 2961 2960 2962 2963 2964 CONECT 2962 2961 CONECT 2963 2961 CONECT 2964 2961 2965 CONECT 2965 2964 2966 2993 2994 CONECT 2966 2965 2967 2970 2992 CONECT 2967 2966 2968 CONECT 2968 2967 2969 2977 2991 CONECT 2969 2968 2970 2974 2976 CONECT 2970 2966 2969 2971 2973 CONECT 2971 2970 2972 CONECT 2972 2971 CONECT 2973 2970 CONECT 2974 2969 2975 CONECT 2975 2974 CONECT 2976 2969 CONECT 2977 2968 2978 2988 CONECT 2978 2977 2979 2990 CONECT 2979 2978 2980 CONECT 2980 2979 2981 2988 CONECT 2981 2980 2982 2985 CONECT 2982 2981 2983 2984 CONECT 2983 2982 CONECT 2984 2982 CONECT 2985 2981 2986 CONECT 2986 2985 2987 2989 CONECT 2987 2986 2988 CONECT 2988 2977 2980 2987 CONECT 2989 2986 CONECT 2990 2978 CONECT 2991 2968 CONECT 2992 2966 CONECT 2993 2965 CONECT 2994 2965 MASTER 0 0 0 0 0 0 0 0 2988 6 63 27 END
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Related entries of code: 4ozj
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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143aa, >4OZL_1|Chain... at 100%
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PDBbind
143aa, >4OZN_1|Chains... at 100%
Complexes with the same small molecule ligand
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PDBbind
ADP
2o1v
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PDBbind
ADP
2qv7
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PDBbind
ADP
2r6f
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PDBbind
ADP
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PDBbind
ADP
2vhj
RCSB PDB
PDBbind
ADP
2y8i
RCSB PDB
PDBbind
ADP
2y8l
RCSB PDB
PDBbind
ADP
2y8q
RCSB PDB
PDBbind
ADP
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RCSB PDB
PDBbind
ADP
2zkj
RCSB PDB
PDBbind
ADP
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RCSB PDB
PDBbind
ADP
3atu
RCSB PDB
PDBbind
ADP
3atv
RCSB PDB
PDBbind
ADP
3ay9
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PDBbind
ADP
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PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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3cf1
RCSB PDB
PDBbind
ADP
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RCSB PDB
PDBbind
ADP
3dgn
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PDBbind
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3i73
RCSB PDB
PDBbind
ADP
3iuc
RCSB PDB
PDBbind
ADP
3k1j
RCSB PDB
PDBbind
ADP
3llm
RCSB PDB
PDBbind
ADP
3mle
RCSB PDB
PDBbind
ADP
3ncr
RCSB PDB
PDBbind
ADP
3p23
RCSB PDB
PDBbind
ADP
3qc9
RCSB PDB
PDBbind
ADP
3qxh
RCSB PDB
PDBbind
ADP
3rup
RCSB PDB
PDBbind
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3rv3
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
ADP
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PDBbind
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PDBbind
ADP
4i3z
RCSB PDB
PDBbind
ADP
4kod
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
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PDBbind
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5fsx
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PDBbind
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6czd
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PDBbind
ADP
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
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Entry Information
PDB ID
4ozj
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Nitrogen regulatory protein P-II hmGlnK2
Ligand Name
ADP
EC.Number
E.C.-.-.-.-
Resolution
1.45(Å)
Affinity (Kd/Ki/IC50)
Kd=4uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Febs J. Vol. 281: pp. 3299-3314
Ligand Properties
Formula
C
1
0
H
1
7
N
5
O
1
0
P
2
Molecular Weight
429.217
Exact Mass
429.045
No. of atoms
44
No. of bonds
46
Polar Surface Area
266.1
LOGP Value
-4.89 (
Computed with XLOGP3
)
-2.04 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 3
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(O)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C10H19N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-22,26-27H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
B8ZYW1
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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