Browse entries in the PDBbind-CN Database
HEADER 5EWK_COMPLEX COMPND 5EWK_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 165 LYS ALA ALA ALA PRO ALA CYS PRO ARG PHE ASP ASP PRO SEQRES 2 A 165 VAL HIS ALA ALA ALA ASP PRO ARG VAL ASP VAL GLU ARG SEQRES 3 A 165 ILE THR PRO ASP PRO VAL TRP ARG THR THR CYS GLY THR SEQRES 4 A 165 LEU TYR ARG SER ASP SER ARG GLY PRO ALA VAL VAL PHE SEQRES 5 A 165 GLU GLN GLY PHE LEU PRO LYS ASP VAL ILE ASP GLY GLN SEQRES 6 A 165 TYR ASP ILE GLU SER TYR VAL LEU VAL ASN GLN PRO SER SEQRES 7 A 165 PRO TYR VAL SER THR THR TYR ASP HIS ASP LEU TYR LYS SEQRES 8 A 165 THR TRP TYR LYS SER GLY TYR ASN TYR TYR ILE ASP ALA SEQRES 9 A 165 PRO GLY GLY VAL ASP VAL ASN LYS THR ILE GLY ASP ARG SEQRES 10 A 165 HIS LYS TRP ALA ASP GLN VAL GLU VAL ALA PHE PRO GLY SEQRES 11 A 165 GLY ILE ARG THR GLU PHE VAL ILE GLY VAL CYS PRO VAL SEQRES 12 A 165 ASP LYS LYS THR ARG THR GLU LYS MET SER GLU CYS VAL SEQRES 13 A 165 GLY ASN PRO HIS TYR GLU PRO TRP HIS HET P A 34 40 SSBOND 1 CYS A 42 CYS A 72 SSBOND 2 CYS A 176 CYS A 190 ATOM 1 N LYS A 36 58.559 35.148 8.368 1.00 82.08 N ATOM 2 CA LYS A 36 57.242 35.759 8.533 1.00 75.76 C ATOM 3 C LYS A 36 56.609 36.115 7.180 1.00 78.58 C ATOM 4 O LYS A 36 57.294 36.214 6.157 1.00 86.62 O ATOM 5 CB LYS A 36 57.336 37.016 9.409 1.00 65.27 C ATOM 6 CG LYS A 36 57.734 36.764 10.860 1.00 62.43 C ATOM 7 CD LYS A 36 57.868 38.070 11.644 1.00 62.53 C ATOM 8 CE LYS A 36 58.239 37.837 13.120 1.00 62.17 C ATOM 9 NZ LYS A 36 58.294 39.120 13.910 1.00 57.77 N ATOM 10 HZ1 LYS A 36 59.009 39.751 13.495 1.00 0.00 H ATOM 11 HZ2 LYS A 36 57.363 39.583 13.882 1.00 0.00 H ATOM 12 HZ3 LYS A 36 58.548 38.908 14.896 1.00 0.00 H ATOM 13 HN3 LYS A 36 59.189 35.813 7.875 1.00 0.00 H ATOM 14 HN2 LYS A 36 58.468 34.276 7.809 1.00 0.00 H ATOM 15 HN1 LYS A 36 58.954 34.922 9.303 1.00 0.00 H ATOM 16 N ALA A 37 55.290 36.291 7.188 1.00 67.30 N ATOM 17 CA ALA A 37 54.551 36.777 6.030 1.00 58.40 C ATOM 18 C ALA A 37 53.321 37.522 6.530 1.00 56.61 C ATOM 19 O ALA A 37 52.786 37.202 7.592 1.00 53.52 O ATOM 20 CB ALA A 37 54.128 35.636 5.104 1.00 59.79 C ATOM 21 H ALA A 37 54.764 36.072 8.058 1.00 0.00 H ATOM 22 N ALA A 38 52.883 38.522 5.767 1.00 54.18 N ATOM 23 CA ALA A 38 51.684 39.280 6.110 1.00 52.65 C ATOM 24 C ALA A 38 50.468 38.667 5.417 1.00 49.50 C ATOM 25 O ALA A 38 50.562 38.165 4.292 1.00 51.65 O ATOM 26 CB ALA A 38 51.842 40.753 5.719 1.00 52.56 C ATOM 27 H ALA A 38 53.409 38.769 4.905 1.00 0.00 H ATOM 28 N ALA A 39 49.326 38.703 6.100 1.00 46.27 N ATOM 29 CA ALA A 39 48.120 38.068 5.596 1.00 55.49 C ATOM 30 C ALA A 39 47.578 38.804 4.370 1.00 60.89 C ATOM 31 O ALA A 39 47.815 40.001 4.191 1.00 55.37 O ATOM 32 CB ALA A 39 47.049 38.026 6.685 1.00 54.41 C ATOM 33 H ALA A 39 49.296 39.197 7.015 1.00 0.00 H ATOM 34 N PRO A 40 46.840 38.104 3.505 1.00 71.17 N ATOM 35 CA PRO A 40 46.168 38.787 2.391 1.00 78.72 C ATOM 36 C PRO A 40 44.814 39.352 2.796 1.00 78.77 C ATOM 37 O PRO A 40 44.368 39.125 3.925 1.00 59.66 O ATOM 38 CB PRO A 40 46.019 37.673 1.352 1.00 77.47 C ATOM 39 CG PRO A 40 45.869 36.427 2.173 1.00 73.09 C ATOM 40 CD PRO A 40 46.638 36.643 3.458 1.00 74.90 C ATOM 41 N ALA A 41 44.151 40.070 1.886 1.00 81.63 N ATOM 42 CA ALA A 41 42.789 40.548 2.102 1.00 66.70 C ATOM 43 C ALA A 41 41.792 39.428 1.798 1.00 57.75 C ATOM 44 O ALA A 41 42.161 38.344 1.336 1.00 56.45 O ATOM 45 CB ALA A 41 42.506 41.778 1.239 1.00 58.83 C ATOM 46 H ALA A 41 44.624 40.298 0.988 1.00 0.00 H ATOM 47 N CYS A 42 40.426 39.714 2.042 1.00 42.23 N ATOM 48 CA CYS A 42 39.377 38.695 1.993 1.00 41.20 C ATOM 49 C CYS A 42 38.590 38.744 0.684 1.00 41.85 C ATOM 50 O CYS A 42 38.302 39.831 0.174 1.00 47.26 O ATOM 51 CB CYS A 42 38.397 38.877 3.158 1.00 39.91 C ATOM 52 SG CYS A 42 39.166 38.777 4.785 1.00 38.90 S ATOM 53 H CYS A 42 40.156 40.693 2.266 1.00 0.00 H ATOM 54 N PRO A 43 38.184 37.598 0.129 1.00 41.26 N ATOM 55 CA PRO A 43 37.223 37.621 -0.980 1.00 42.13 C ATOM 56 C PRO A 43 35.893 38.206 -0.538 1.00 44.15 C ATOM 57 O PRO A 43 35.436 37.981 0.589 1.00 45.82 O ATOM 58 CB PRO A 43 37.063 36.144 -1.356 1.00 44.96 C ATOM 59 CG PRO A 43 38.198 35.431 -0.712 1.00 44.80 C ATOM 60 CD PRO A 43 38.578 36.223 0.487 1.00 40.55 C ATOM 61 N ARG A 44 35.243 38.922 -1.455 1.00 49.33 N ATOM 62 CA ARG A 44 33.937 39.519 -1.189 1.00 56.37 C ATOM 63 C ARG A 44 32.907 38.957 -2.156 1.00 51.54 C ATOM 64 O ARG A 44 33.056 39.093 -3.377 1.00 45.90 O ATOM 65 CB ARG A 44 33.981 41.044 -1.301 1.00 69.14 C ATOM 66 CG ARG A 44 32.623 41.680 -1.029 1.00 83.37 C ATOM 67 CD ARG A 44 32.684 43.194 -0.988 1.00 95.13 C ATOM 68 NE ARG A 44 33.503 43.683 0.117 1.00100.37 N ATOM 69 CZ ARG A 44 33.518 44.944 0.536 1.00107.35 C ATOM 70 NH1 ARG A 44 32.751 45.854 -0.051 1.00108.60 N ATOM 71 NH2 ARG A 44 34.299 45.297 1.548 1.00111.89 N ATOM 72 HE ARG A 44 34.114 43.000 0.608 1.00 0.00 H ATOM 73 HH12 ARG A 44 32.767 46.840 0.281 1.00 0.00 H ATOM 74 HH11 ARG A 44 32.134 45.582 -0.843 1.00 0.00 H ATOM 75 HH22 ARG A 44 34.311 46.284 1.876 1.00 0.00 H ATOM 76 HH21 ARG A 44 34.900 44.587 2.014 1.00 0.00 H ATOM 77 H ARG A 44 35.679 39.060 -2.389 1.00 0.00 H ATOM 78 N PHE A 45 31.851 38.357 -1.610 1.00 45.49 N ATOM 79 CA PHE A 45 30.745 37.882 -2.425 1.00 45.29 C ATOM 80 C PHE A 45 29.787 39.027 -2.731 1.00 46.97 C ATOM 81 O PHE A 45 29.575 39.928 -1.917 1.00 53.14 O ATOM 82 CB PHE A 45 29.999 36.744 -1.723 1.00 48.09 C ATOM 83 CG PHE A 45 30.798 35.489 -1.619 1.00 42.03 C ATOM 84 CD1 PHE A 45 31.656 35.289 -0.559 1.00 42.51 C ATOM 85 CD2 PHE A 45 30.733 34.525 -2.614 1.00 53.09 C ATOM 86 CE1 PHE A 45 32.422 34.137 -0.476 1.00 41.04 C ATOM 87 CE2 PHE A 45 31.487 33.371 -2.531 1.00 57.18 C ATOM 88 CZ PHE A 45 32.336 33.179 -1.466 1.00 51.18 C ATOM 89 H PHE A 45 31.817 38.225 -0.579 1.00 0.00 H ATOM 90 N ASP A 46 29.214 38.990 -3.933 1.00 44.50 N ATOM 91 CA ASP A 46 28.240 40.006 -4.304 1.00 53.94 C ATOM 92 C ASP A 46 27.031 39.944 -3.383 1.00 56.87 C ATOM 93 O ASP A 46 26.491 40.980 -2.974 1.00 52.13 O ATOM 94 CB ASP A 46 27.819 39.812 -5.757 1.00 68.62 C ATOM 95 CG ASP A 46 27.043 40.995 -6.304 1.00 76.97 C ATOM 96 OD1 ASP A 46 27.236 42.122 -5.799 1.00 80.82 O ATOM 97 OD2 ASP A 46 26.246 40.795 -7.245 1.00 77.92 O ATOM 98 H ASP A 46 29.462 38.236 -4.605 1.00 0.00 H ATOM 99 N ASP A 47 26.628 38.730 -3.012 1.00 52.15 N ATOM 100 CA ASP A 47 25.416 38.499 -2.237 1.00 52.70 C ATOM 101 C ASP A 47 25.738 38.610 -0.752 1.00 51.06 C ATOM 102 O ASP A 47 26.516 37.793 -0.241 1.00 45.18 O ATOM 103 CB ASP A 47 24.861 37.120 -2.574 1.00 49.58 C ATOM 104 CG ASP A 47 23.671 36.728 -1.742 1.00 51.79 C ATOM 105 OD1 ASP A 47 23.151 37.569 -0.984 1.00 45.84 O ATOM 106 OD2 ASP A 47 23.259 35.555 -1.870 1.00 49.18 O ATOM 107 H ASP A 47 27.205 37.910 -3.288 1.00 0.00 H ATOM 108 N PRO A 48 25.171 39.581 -0.020 1.00 44.28 N ATOM 109 CA PRO A 48 25.579 39.765 1.377 1.00 44.66 C ATOM 110 C PRO A 48 25.129 38.647 2.294 1.00 38.78 C ATOM 111 O PRO A 48 25.679 38.539 3.394 1.00 36.95 O ATOM 112 CB PRO A 48 24.925 41.099 1.764 1.00 46.29 C ATOM 113 CG PRO A 48 23.712 41.160 0.915 1.00 48.69 C ATOM 114 CD PRO A 48 24.054 40.471 -0.380 1.00 48.92 C ATOM 115 N VAL A 49 24.155 37.824 1.884 1.00 38.26 N ATOM 116 CA VAL A 49 23.743 36.662 2.676 1.00 32.65 C ATOM 117 C VAL A 49 24.093 35.394 1.911 1.00 35.08 C ATOM 118 O VAL A 49 23.387 34.386 1.979 1.00 38.06 O ATOM 119 CB VAL A 49 22.246 36.702 3.038 1.00 37.43 C ATOM 120 CG1 VAL A 49 21.962 37.882 3.948 1.00 37.72 C ATOM 121 CG2 VAL A 49 21.371 36.757 1.803 1.00 38.26 C ATOM 122 H VAL A 49 23.678 38.015 0.979 1.00 0.00 H ATOM 123 N HIS A 50 25.217 35.432 1.198 1.00 30.40 N ATOM 124 CA HIS A 50 25.692 34.249 0.502 1.00 31.98 C ATOM 125 C HIS A 50 25.770 33.041 1.417 1.00 33.77 C ATOM 126 O HIS A 50 25.553 31.910 0.975 1.00 37.19 O ATOM 127 CB HIS A 50 27.067 34.529 -0.088 1.00 38.48 C ATOM 128 CG HIS A 50 27.718 33.322 -0.674 1.00 39.05 C ATOM 129 ND1 HIS A 50 27.329 32.791 -1.884 1.00 41.94 N ATOM 130 CD2 HIS A 50 28.716 32.530 -0.216 1.00 36.63 C ATOM 131 CE1 HIS A 50 28.075 31.736 -2.158 1.00 38.82 C ATOM 132 NE2 HIS A 50 28.928 31.558 -1.166 1.00 38.67 N ATOM 133 H HIS A 50 25.760 36.317 1.139 1.00 0.00 H ATOM 134 N ALA A 51 26.119 33.256 2.685 1.00 31.44 N ATOM 135 CA ALA A 51 26.307 32.169 3.636 1.00 26.25 C ATOM 136 C ALA A 51 25.005 31.556 4.146 1.00 26.88 C ATOM 137 O ALA A 51 25.068 30.528 4.826 1.00 29.72 O ATOM 138 CB ALA A 51 27.097 32.665 4.844 1.00 28.35 C ATOM 139 H ALA A 51 26.262 34.235 3.007 1.00 0.00 H ATOM 140 N ALA A 52 23.849 32.134 3.831 1.00 28.77 N ATOM 141 CA ALA A 52 22.621 31.793 4.550 1.00 27.31 C ATOM 142 C ALA A 52 22.204 30.345 4.315 1.00 28.70 C ATOM 143 O ALA A 52 22.204 29.853 3.182 1.00 35.00 O ATOM 144 CB ALA A 52 21.489 32.725 4.122 1.00 29.67 C ATOM 145 H ALA A 52 23.818 32.836 3.065 1.00 0.00 H ATOM 146 N ALA A 53 21.800 29.674 5.404 1.00 31.19 N ATOM 147 CA ALA A 53 21.195 28.351 5.299 1.00 31.16 C ATOM 148 C ALA A 53 19.728 28.436 4.908 1.00 32.34 C ATOM 149 O ALA A 53 19.191 27.501 4.297 1.00 34.63 O ATOM 150 CB ALA A 53 21.352 27.607 6.623 1.00 31.45 C ATOM 151 H ALA A 53 21.921 30.106 6.342 1.00 0.00 H ATOM 152 N ASP A 54 19.082 29.556 5.210 1.00 35.94 N ATOM 153 CA ASP A 54 17.693 29.795 4.820 1.00 37.72 C ATOM 154 C ASP A 54 17.666 31.042 3.951 1.00 41.06 C ATOM 155 O ASP A 54 17.660 32.169 4.479 1.00 36.81 O ATOM 156 CB ASP A 54 16.797 29.974 6.042 1.00 36.88 C ATOM 157 CG ASP A 54 15.331 29.922 5.688 1.00 36.97 C ATOM 158 OD1 ASP A 54 14.979 30.224 4.525 1.00 37.79 O ATOM 159 OD2 ASP A 54 14.531 29.572 6.581 1.00 42.30 O ATOM 160 H ASP A 54 19.584 30.293 5.745 1.00 0.00 H ATOM 161 N PRO A 55 17.676 30.898 2.621 1.00 46.49 N ATOM 162 CA PRO A 55 17.749 32.076 1.746 1.00 44.29 C ATOM 163 C PRO A 55 16.468 32.890 1.680 1.00 44.35 C ATOM 164 O PRO A 55 16.443 33.911 0.984 1.00 44.78 O ATOM 165 CB PRO A 55 18.073 31.461 0.379 1.00 48.72 C ATOM 166 CG PRO A 55 17.416 30.110 0.443 1.00 49.69 C ATOM 167 CD PRO A 55 17.645 29.642 1.850 1.00 48.79 C ATOM 168 N ARG A 56 15.398 32.483 2.362 1.00 44.13 N ATOM 169 CA ARG A 56 14.194 33.299 2.374 1.00 42.97 C ATOM 170 C ARG A 56 14.368 34.574 3.181 1.00 39.27 C ATOM 171 O ARG A 56 13.472 35.425 3.165 1.00 46.10 O ATOM 172 CB ARG A 56 13.023 32.501 2.939 1.00 48.47 C ATOM 173 CG ARG A 56 12.698 31.237 2.157 1.00 49.41 C ATOM 174 CD ARG A 56 11.625 30.438 2.877 1.00 52.63 C ATOM 175 NE ARG A 56 12.066 30.058 4.215 1.00 54.94 N ATOM 176 CZ ARG A 56 11.271 29.558 5.155 1.00 53.34 C ATOM 177 NH1 ARG A 56 9.975 29.367 4.917 1.00 52.31 N ATOM 178 NH2 ARG A 56 11.774 29.250 6.337 1.00 47.29 N ATOM 179 HE ARG A 56 13.071 30.187 4.449 1.00 0.00 H ATOM 180 HH12 ARG A 56 9.362 28.975 5.660 1.00 0.00 H ATOM 181 HH11 ARG A 56 9.576 29.610 3.988 1.00 0.00 H ATOM 182 HH22 ARG A 56 11.158 28.858 7.078 1.00 0.00 H ATOM 183 HH21 ARG A 56 12.786 29.399 6.527 1.00 0.00 H ATOM 184 H ARG A 56 15.424 31.584 2.884 1.00 0.00 H ATOM 185 N VAL A 57 15.476 34.721 3.903 1.00 39.82 N ATOM 186 CA VAL A 57 15.669 35.921 4.698 1.00 38.15 C ATOM 187 C VAL A 57 15.581 37.139 3.788 1.00 39.07 C ATOM 188 O VAL A 57 16.014 37.109 2.627 1.00 42.14 O ATOM 189 CB VAL A 57 17.008 35.853 5.446 1.00 32.04 C ATOM 190 CG1 VAL A 57 18.204 35.756 4.462 1.00 33.37 C ATOM 191 CG2 VAL A 57 17.154 37.040 6.382 1.00 32.37 C ATOM 192 H VAL A 57 16.203 33.977 3.898 1.00 0.00 H ATOM 193 N ASP A 58 15.007 38.214 4.320 1.00 39.66 N ATOM 194 CA ASP A 58 14.735 39.440 3.576 1.00 47.55 C ATOM 195 C ASP A 58 15.660 40.541 4.084 1.00 44.41 C ATOM 196 O ASP A 58 15.357 41.214 5.075 1.00 38.26 O ATOM 197 CB ASP A 58 13.272 39.848 3.723 1.00 55.70 C ATOM 198 CG ASP A 58 12.922 41.062 2.880 1.00 57.80 C ATOM 199 OD1 ASP A 58 13.808 41.547 2.134 1.00 48.91 O ATOM 200 OD2 ASP A 58 11.761 41.515 2.954 1.00 59.86 O ATOM 201 H ASP A 58 14.736 38.179 5.324 1.00 0.00 H ATOM 202 N VAL A 59 16.763 40.749 3.366 1.00 41.45 N ATOM 203 CA VAL A 59 17.778 41.710 3.777 1.00 45.75 C ATOM 204 C VAL A 59 17.204 43.118 3.897 1.00 39.83 C ATOM 205 O VAL A 59 17.664 43.913 4.725 1.00 45.96 O ATOM 206 CB VAL A 59 18.960 41.643 2.786 1.00 48.36 C ATOM 207 CG1 VAL A 59 19.852 42.868 2.895 1.00 49.76 C ATOM 208 CG2 VAL A 59 19.774 40.375 3.029 1.00 50.02 C ATOM 209 H VAL A 59 16.903 40.210 2.488 1.00 0.00 H ATOM 210 N GLU A 60 16.206 43.461 3.081 1.00 39.70 N ATOM 211 CA GLU A 60 15.680 44.820 3.118 1.00 41.34 C ATOM 212 C GLU A 60 14.902 45.112 4.394 1.00 44.41 C ATOM 213 O GLU A 60 14.652 46.286 4.687 1.00 45.31 O ATOM 214 CB GLU A 60 14.809 45.080 1.883 1.00 52.18 C ATOM 215 CG GLU A 60 15.645 45.244 0.610 1.00 69.60 C ATOM 216 CD GLU A 60 14.814 45.423 -0.648 1.00 96.45 C ATOM 217 OE1 GLU A 60 13.598 45.143 -0.610 1.00108.52 O ATOM 218 OE2 GLU A 60 15.385 45.841 -1.679 1.00104.82 O ATOM 219 H GLU A 60 15.806 42.763 2.422 1.00 0.00 H ATOM 220 N ARG A 61 14.537 44.088 5.167 1.00 42.70 N ATOM 221 CA ARG A 61 13.841 44.294 6.432 1.00 41.47 C ATOM 222 C ARG A 61 14.790 44.453 7.614 1.00 40.50 C ATOM 223 O ARG A 61 14.335 44.738 8.723 1.00 38.11 O ATOM 224 CB ARG A 61 12.882 43.131 6.701 1.00 42.85 C ATOM 225 CG ARG A 61 11.672 43.109 5.772 1.00 46.69 C ATOM 226 CD ARG A 61 10.796 41.880 6.014 1.00 49.95 C ATOM 227 NE ARG A 61 10.340 41.789 7.401 1.00 55.41 N ATOM 228 CZ ARG A 61 9.823 40.692 7.953 1.00 54.30 C ATOM 229 NH1 ARG A 61 9.697 39.579 7.239 1.00 52.37 N ATOM 230 NH2 ARG A 61 9.437 40.701 9.224 1.00 59.35 N ATOM 231 HE ARG A 61 10.425 42.638 7.996 1.00 0.00 H ATOM 232 HH12 ARG A 61 9.293 38.725 7.674 1.00 0.00 H ATOM 233 HH11 ARG A 61 10.002 39.561 6.245 1.00 0.00 H ATOM 234 HH22 ARG A 61 9.034 39.843 9.651 1.00 0.00 H ATOM 235 HH21 ARG A 61 9.538 41.566 9.792 1.00 0.00 H ATOM 236 H ARG A 61 14.754 43.118 4.860 1.00 0.00 H ATOM 237 N ILE A 62 16.092 44.292 7.407 1.00 34.33 N ATOM 238 CA ILE A 62 17.047 44.479 8.493 1.00 32.17 C ATOM 239 C ILE A 62 17.035 45.933 8.930 1.00 38.85 C ATOM 240 O ILE A 62 17.121 46.847 8.099 1.00 40.77 O ATOM 241 CB ILE A 62 18.460 44.063 8.064 1.00 30.94 C ATOM 242 CG1 ILE A 62 18.521 42.559 7.815 1.00 31.67 C ATOM 243 CG2 ILE A 62 19.448 44.409 9.151 1.00 30.77 C ATOM 244 CD1 ILE A 62 19.801 42.109 7.070 1.00 29.44 C ATOM 245 H ILE A 62 16.434 44.030 6.460 1.00 0.00 H ATOM 246 N THR A 63 16.916 46.152 10.236 1.00 39.04 N ATOM 247 CA THR A 63 17.029 47.487 10.800 1.00 34.04 C ATOM 248 C THR A 63 17.948 47.444 12.010 1.00 30.53 C ATOM 249 O THR A 63 18.014 46.429 12.714 1.00 31.12 O ATOM 250 CB THR A 63 15.671 48.069 11.211 1.00 34.92 C ATOM 251 OG1 THR A 63 15.085 47.287 12.262 1.00 32.97 O ATOM 252 CG2 THR A 63 14.735 48.086 10.027 1.00 44.04 C ATOM 253 HG1 THR A 63 15.687 47.289 13.048 1.00 0.00 H ATOM 254 H THR A 63 16.737 45.347 10.870 1.00 0.00 H ATOM 255 N PRO A 64 18.698 48.532 12.247 1.00 32.96 N ATOM 256 CA PRO A 64 18.902 49.667 11.339 1.00 38.86 C ATOM 257 C PRO A 64 19.730 49.232 10.135 1.00 34.33 C ATOM 258 O PRO A 64 20.045 48.049 10.043 1.00 34.85 O ATOM 259 CB PRO A 64 19.655 50.685 12.202 1.00 40.70 C ATOM 260 CG PRO A 64 20.333 49.880 13.231 1.00 43.12 C ATOM 261 CD PRO A 64 19.469 48.678 13.496 1.00 32.96 C ATOM 262 N ASP A 65 20.064 50.152 9.227 1.00 40.97 N ATOM 263 CA ASP A 65 20.827 49.773 8.046 1.00 49.22 C ATOM 264 C ASP A 65 22.067 48.983 8.470 1.00 38.91 C ATOM 265 O ASP A 65 22.849 49.472 9.302 1.00 33.55 O ATOM 266 CB ASP A 65 21.235 51.005 7.242 1.00 60.15 C ATOM 267 CG ASP A 65 20.061 51.636 6.502 1.00 66.79 C ATOM 268 OD1 ASP A 65 19.008 50.969 6.350 1.00 53.68 O ATOM 269 OD2 ASP A 65 20.201 52.798 6.067 1.00 69.95 O ATOM 270 H ASP A 65 19.778 51.143 9.364 1.00 0.00 H ATOM 271 N PRO A 66 22.264 47.762 7.966 1.00 37.12 N ATOM 272 CA PRO A 66 23.364 46.934 8.482 1.00 30.66 C ATOM 273 C PRO A 66 24.719 47.395 7.978 1.00 31.79 C ATOM 274 O PRO A 66 24.857 47.846 6.838 1.00 33.96 O ATOM 275 CB PRO A 66 23.029 45.534 7.956 1.00 34.50 C ATOM 276 CG PRO A 66 22.238 45.780 6.727 1.00 35.45 C ATOM 277 CD PRO A 66 21.437 47.024 6.993 1.00 38.55 C ATOM 278 N VAL A 67 25.701 47.317 8.867 1.00 29.10 N ATOM 279 CA VAL A 67 27.109 47.398 8.502 1.00 30.87 C ATOM 280 C VAL A 67 27.618 45.969 8.425 1.00 26.92 C ATOM 281 O VAL A 67 27.736 45.277 9.443 1.00 27.82 O ATOM 282 CB VAL A 67 27.922 48.220 9.506 1.00 33.12 C ATOM 283 CG1 VAL A 67 29.398 48.240 9.089 1.00 34.30 C ATOM 284 CG2 VAL A 67 27.355 49.606 9.607 1.00 35.70 C ATOM 285 H VAL A 67 25.454 47.192 9.870 1.00 0.00 H ATOM 286 N TRP A 68 27.939 45.533 7.207 1.00 31.43 N ATOM 287 CA TRP A 68 28.358 44.161 6.980 1.00 26.14 C ATOM 288 C TRP A 68 29.822 43.981 7.336 1.00 29.64 C ATOM 289 O TRP A 68 30.664 44.836 7.018 1.00 30.65 O ATOM 290 CB TRP A 68 28.161 43.784 5.511 1.00 29.66 C ATOM 291 CG TRP A 68 26.749 43.890 5.086 1.00 34.28 C ATOM 292 CD1 TRP A 68 26.155 44.936 4.447 1.00 38.08 C ATOM 293 CD2 TRP A 68 25.728 42.911 5.299 1.00 33.10 C ATOM 294 NE1 TRP A 68 24.824 44.665 4.237 1.00 38.67 N ATOM 295 CE2 TRP A 68 24.535 43.429 4.749 1.00 38.03 C ATOM 296 CE3 TRP A 68 25.708 41.646 5.897 1.00 29.54 C ATOM 297 CZ2 TRP A 68 23.332 42.728 4.774 1.00 38.20 C ATOM 298 CZ3 TRP A 68 24.509 40.943 5.915 1.00 33.41 C ATOM 299 CH2 TRP A 68 23.338 41.491 5.362 1.00 33.44 C ATOM 300 HE1 TRP A 68 24.146 45.297 3.765 1.00 0.00 H ATOM 301 H TRP A 68 27.888 46.189 6.402 1.00 0.00 H ATOM 302 N ARG A 69 30.109 42.859 7.971 1.00 27.46 N ATOM 303 CA ARG A 69 31.478 42.415 8.196 1.00 28.06 C ATOM 304 C ARG A 69 32.190 42.190 6.863 1.00 30.82 C ATOM 305 O ARG A 69 31.647 41.560 5.948 1.00 29.37 O ATOM 306 CB ARG A 69 31.449 41.134 9.027 1.00 23.72 C ATOM 307 CG ARG A 69 32.755 40.351 9.043 1.00 23.55 C ATOM 308 CD ARG A 69 32.633 39.256 10.033 1.00 23.77 C ATOM 309 NE ARG A 69 33.632 38.196 9.894 1.00 22.51 N ATOM 310 CZ ARG A 69 33.501 37.149 9.093 1.00 23.96 C ATOM 311 NH1 ARG A 69 34.426 36.197 9.108 1.00 21.54 N ATOM 312 NH2 ARG A 69 32.437 37.033 8.296 1.00 21.86 N ATOM 313 HE ARG A 69 34.501 38.269 10.461 1.00 0.00 H ATOM 314 HH12 ARG A 69 34.332 35.371 8.483 1.00 0.00 H ATOM 315 HH11 ARG A 69 35.244 36.277 9.745 1.00 0.00 H ATOM 316 HH22 ARG A 69 32.343 36.207 7.671 1.00 0.00 H ATOM 317 HH21 ARG A 69 31.702 37.768 8.300 1.00 0.00 H ATOM 318 H ARG A 69 29.328 42.270 8.324 1.00 0.00 H ATOM 319 N THR A 70 33.407 42.718 6.746 1.00 31.18 N ATOM 320 CA THR A 70 34.208 42.558 5.538 1.00 27.89 C ATOM 321 C THR A 70 35.493 41.779 5.789 1.00 28.51 C ATOM 322 O THR A 70 36.277 41.578 4.844 1.00 32.94 O ATOM 323 CB THR A 70 34.559 43.926 4.931 1.00 37.74 C ATOM 324 OG1 THR A 70 35.243 44.711 5.912 1.00 40.43 O ATOM 325 CG2 THR A 70 33.292 44.648 4.497 1.00 39.19 C ATOM 326 HG1 THR A 70 34.657 44.836 6.700 1.00 0.00 H ATOM 327 H THR A 70 33.799 43.262 7.541 1.00 0.00 H ATOM 328 N THR A 71 35.758 41.387 7.024 1.00 28.64 N ATOM 329 CA THR A 71 36.883 40.525 7.335 1.00 26.90 C ATOM 330 C THR A 71 36.474 39.064 7.200 1.00 27.59 C ATOM 331 O THR A 71 35.320 38.714 6.931 1.00 26.31 O ATOM 332 CB THR A 71 37.429 40.835 8.721 1.00 24.75 C ATOM 333 OG1 THR A 71 36.379 40.681 9.699 1.00 25.25 O ATOM 334 CG2 THR A 71 37.936 42.245 8.785 1.00 31.39 C ATOM 335 HG1 THR A 71 36.043 39.750 9.677 1.00 0.00 H ATOM 336 H THR A 71 35.140 41.707 7.797 1.00 0.00 H ATOM 337 N CYS A 72 37.440 38.177 7.374 1.00 25.33 N ATOM 338 CA CYS A 72 37.184 36.770 7.108 1.00 23.67 C ATOM 339 C CYS A 72 37.985 35.905 8.060 1.00 22.76 C ATOM 340 O CYS A 72 38.444 34.816 7.693 1.00 25.30 O ATOM 341 CB CYS A 72 37.513 36.406 5.662 1.00 26.17 C ATOM 342 SG CYS A 72 39.203 36.775 5.146 1.00 30.96 S ATOM 343 H CYS A 72 38.379 38.484 7.700 1.00 0.00 H ATOM 344 N GLY A 73 38.141 36.374 9.303 1.00 24.16 N ATOM 345 CA GLY A 73 38.698 35.546 10.343 1.00 21.48 C ATOM 346 C GLY A 73 37.676 34.562 10.896 1.00 19.32 C ATOM 347 O GLY A 73 36.485 34.635 10.616 1.00 20.42 O ATOM 348 H GLY A 73 37.856 37.350 9.522 1.00 0.00 H ATOM 349 N THR A 74 38.187 33.599 11.661 1.00 20.97 N ATOM 350 CA THR A 74 37.330 32.626 12.322 1.00 21.80 C ATOM 351 C THR A 74 36.388 33.345 13.271 1.00 19.75 C ATOM 352 O THR A 74 36.809 34.220 14.036 1.00 19.47 O ATOM 353 CB THR A 74 38.187 31.620 13.087 1.00 17.69 C ATOM 354 OG1 THR A 74 39.142 31.034 12.195 1.00 19.08 O ATOM 355 CG2 THR A 74 37.342 30.523 13.719 1.00 19.57 C ATOM 356 HG1 THR A 74 38.666 30.572 11.460 1.00 0.00 H ATOM 357 H THR A 74 39.218 33.541 11.788 1.00 0.00 H ATOM 358 N LEU A 75 35.116 32.962 13.218 1.00 17.26 N ATOM 359 CA LEU A 75 34.111 33.368 14.187 1.00 18.36 C ATOM 360 C LEU A 75 33.705 32.160 15.017 1.00 17.21 C ATOM 361 O LEU A 75 34.066 31.016 14.722 1.00 17.59 O ATOM 362 CB LEU A 75 32.881 33.967 13.497 1.00 19.31 C ATOM 363 CG LEU A 75 33.103 35.181 12.606 1.00 20.64 C ATOM 364 CD1 LEU A 75 31.824 35.543 11.843 1.00 22.36 C ATOM 365 CD2 LEU A 75 33.691 36.361 13.378 1.00 20.12 C ATOM 366 H LEU A 75 34.823 32.337 12.440 1.00 0.00 H ATOM 367 N TYR A 76 32.941 32.420 16.070 1.00 16.21 N ATOM 368 CA TYR A 76 32.627 31.384 17.038 1.00 15.43 C ATOM 369 C TYR A 76 31.155 31.468 17.399 1.00 19.07 C ATOM 370 O TYR A 76 30.545 32.529 17.334 1.00 19.23 O ATOM 371 CB TYR A 76 33.511 31.496 18.306 1.00 17.32 C ATOM 372 CG TYR A 76 34.966 31.615 17.916 1.00 15.28 C ATOM 373 CD1 TYR A 76 35.526 32.851 17.690 1.00 16.48 C ATOM 374 CD2 TYR A 76 35.732 30.511 17.764 1.00 17.38 C ATOM 375 CE1 TYR A 76 36.859 32.984 17.278 1.00 19.25 C ATOM 376 CE2 TYR A 76 37.070 30.628 17.356 1.00 18.31 C ATOM 377 CZ TYR A 76 37.599 31.861 17.136 1.00 19.34 C ATOM 378 OH TYR A 76 38.910 31.969 16.703 1.00 19.26 O ATOM 379 HH TYR A 76 39.142 32.925 16.591 1.00 0.00 H ATOM 380 H TYR A 76 32.562 33.379 16.204 1.00 0.00 H ATOM 381 N ARG A 77 30.589 30.329 17.772 1.00 18.97 N ATOM 382 CA ARG A 77 29.239 30.305 18.329 1.00 17.02 C ATOM 383 C ARG A 77 29.159 29.242 19.409 1.00 17.33 C ATOM 384 O ARG A 77 29.415 28.056 19.148 1.00 18.98 O ATOM 385 CB ARG A 77 28.183 30.027 17.249 1.00 17.48 C ATOM 386 CG ARG A 77 26.769 29.966 17.812 1.00 19.19 C ATOM 387 CD ARG A 77 25.697 29.742 16.718 1.00 17.98 C ATOM 388 NE ARG A 77 24.446 29.288 17.338 1.00 19.29 N ATOM 389 CZ ARG A 77 23.529 30.076 17.870 1.00 21.25 C ATOM 390 NH1 ARG A 77 22.450 29.527 18.439 1.00 24.73 N ATOM 391 NH2 ARG A 77 23.645 31.397 17.836 1.00 22.10 N ATOM 392 HE ARG A 77 24.267 28.264 17.360 1.00 0.00 H ATOM 393 HH12 ARG A 77 21.719 30.134 18.862 1.00 0.00 H ATOM 394 HH11 ARG A 77 22.342 28.493 18.458 1.00 0.00 H ATOM 395 HH22 ARG A 77 22.909 31.995 18.262 1.00 0.00 H ATOM 396 HH21 ARG A 77 24.472 31.835 17.383 1.00 0.00 H ATOM 397 H ARG A 77 31.115 29.438 17.666 1.00 0.00 H ATOM 398 N SER A 78 28.783 29.694 20.609 1.00 19.88 N ATOM 399 CA SER A 78 28.412 28.832 21.716 1.00 21.38 C ATOM 400 C SER A 78 26.995 28.310 21.459 1.00 21.20 C ATOM 401 O SER A 78 26.086 29.095 21.174 1.00 21.84 O ATOM 402 CB SER A 78 28.489 29.655 23.014 1.00 23.13 C ATOM 403 OG SER A 78 28.077 28.845 24.090 1.00 40.71 O ATOM 404 HG SER A 78 28.673 28.057 24.156 1.00 0.00 H ATOM 405 H SER A 78 28.755 30.723 20.758 1.00 0.00 H ATOM 406 N ASP A 79 26.806 26.996 21.502 1.00 21.28 N ATOM 407 CA ASP A 79 25.487 26.425 21.242 1.00 21.09 C ATOM 408 C ASP A 79 25.370 25.108 22.000 1.00 23.69 C ATOM 409 O ASP A 79 26.312 24.307 22.037 1.00 29.79 O ATOM 410 CB ASP A 79 25.269 26.221 19.738 1.00 24.46 C ATOM 411 CG ASP A 79 23.821 26.227 19.325 1.00 25.88 C ATOM 412 OD1 ASP A 79 22.956 25.675 20.051 1.00 29.43 O ATOM 413 OD2 ASP A 79 23.534 26.772 18.234 1.00 22.63 O ATOM 414 H ASP A 79 27.605 26.368 21.723 1.00 0.00 H ATOM 415 N SER A 80 24.209 24.885 22.593 1.00 22.90 N ATOM 416 CA SER A 80 23.943 23.596 23.219 1.00 25.50 C ATOM 417 C SER A 80 23.611 22.493 22.208 1.00 25.95 C ATOM 418 O SER A 80 23.640 21.304 22.570 1.00 29.48 O ATOM 419 CB SER A 80 22.783 23.723 24.201 1.00 26.99 C ATOM 420 OG SER A 80 21.638 24.207 23.536 1.00 30.10 O ATOM 421 HG SER A 80 20.892 24.286 24.181 1.00 0.00 H ATOM 422 H SER A 80 23.485 25.631 22.613 1.00 0.00 H ATOM 423 N ARG A 81 23.265 22.856 20.974 1.00 26.11 N ATOM 424 CA ARG A 81 22.913 21.861 19.971 1.00 26.95 C ATOM 425 C ARG A 81 24.157 21.112 19.529 1.00 24.66 C ATOM 426 O ARG A 81 25.233 21.704 19.398 1.00 24.95 O ATOM 427 CB ARG A 81 22.238 22.523 18.775 1.00 28.45 C ATOM 428 CG ARG A 81 20.821 22.996 19.099 1.00 44.18 C ATOM 429 CD ARG A 81 20.197 23.649 17.899 1.00 51.69 C ATOM 430 NE ARG A 81 19.371 22.715 17.147 1.00 52.70 N ATOM 431 CZ ARG A 81 19.025 22.883 15.876 1.00 74.04 C ATOM 432 NH1 ARG A 81 19.451 23.948 15.206 1.00 85.80 N ATOM 433 NH2 ARG A 81 18.257 21.982 15.273 1.00 75.17 N ATOM 434 HE ARG A 81 19.031 21.863 17.636 1.00 0.00 H ATOM 435 HH12 ARG A 81 19.180 24.079 14.211 1.00 0.00 H ATOM 436 HH11 ARG A 81 20.056 24.651 15.677 1.00 0.00 H ATOM 437 HH22 ARG A 81 17.986 22.113 14.278 1.00 0.00 H ATOM 438 HH21 ARG A 81 17.927 21.146 15.796 1.00 0.00 H ATOM 439 H ARG A 81 23.246 23.865 20.723 1.00 0.00 H ATOM 440 N GLY A 82 23.997 19.817 19.285 1.00 31.26 N ATOM 441 CA GLY A 82 25.123 18.940 19.109 1.00 33.48 C ATOM 442 C GLY A 82 25.628 18.936 17.676 1.00 30.72 C ATOM 443 O GLY A 82 24.904 19.265 16.733 1.00 28.36 O ATOM 444 H GLY A 82 23.035 19.428 19.220 1.00 0.00 H ATOM 445 N PRO A 83 26.881 18.525 17.491 1.00 30.22 N ATOM 446 CA PRO A 83 27.481 18.587 16.144 1.00 32.23 C ATOM 447 C PRO A 83 26.833 17.669 15.131 1.00 28.83 C ATOM 448 O PRO A 83 26.829 17.996 13.937 1.00 30.62 O ATOM 449 CB PRO A 83 28.945 18.196 16.377 1.00 34.88 C ATOM 450 CG PRO A 83 29.045 17.741 17.798 1.00 36.34 C ATOM 451 CD PRO A 83 27.863 18.252 18.551 1.00 34.54 C ATOM 452 N ALA A 84 26.283 16.525 15.550 1.00 26.87 N ATOM 453 CA ALA A 84 25.573 15.684 14.596 1.00 30.07 C ATOM 454 C ALA A 84 24.502 16.496 13.878 1.00 35.78 C ATOM 455 O ALA A 84 24.304 16.358 12.667 1.00 37.26 O ATOM 456 CB ALA A 84 24.970 14.477 15.315 1.00 33.30 C ATOM 457 H ALA A 84 26.361 16.238 16.547 1.00 0.00 H ATOM 458 N VAL A 85 23.830 17.382 14.611 1.00 30.04 N ATOM 459 CA VAL A 85 22.757 18.186 14.041 1.00 27.69 C ATOM 460 C VAL A 85 23.324 19.364 13.250 1.00 29.17 C ATOM 461 O VAL A 85 22.918 19.622 12.111 1.00 31.55 O ATOM 462 CB VAL A 85 21.822 18.664 15.170 1.00 34.88 C ATOM 463 CG1 VAL A 85 20.692 19.501 14.596 1.00 34.39 C ATOM 464 CG2 VAL A 85 21.282 17.456 15.954 1.00 36.27 C ATOM 465 H VAL A 85 24.077 17.503 15.614 1.00 0.00 H ATOM 466 N VAL A 86 24.275 20.093 13.838 1.00 25.77 N ATOM 467 CA VAL A 86 24.803 21.298 13.206 1.00 24.91 C ATOM 468 C VAL A 86 25.573 20.954 11.934 1.00 27.30 C ATOM 469 O VAL A 86 25.455 21.628 10.907 1.00 26.58 O ATOM 470 CB VAL A 86 25.693 22.060 14.198 1.00 23.03 C ATOM 471 CG1 VAL A 86 26.379 23.220 13.519 1.00 23.45 C ATOM 472 CG2 VAL A 86 24.877 22.578 15.333 1.00 24.66 C ATOM 473 H VAL A 86 24.646 19.797 14.763 1.00 0.00 H ATOM 474 N PHE A 87 26.350 19.889 11.970 1.00 29.11 N ATOM 475 CA PHE A 87 27.093 19.541 10.769 1.00 25.68 C ATOM 476 C PHE A 87 26.170 19.119 9.635 1.00 27.27 C ATOM 477 O PHE A 87 26.514 19.300 8.465 1.00 29.17 O ATOM 478 CB PHE A 87 28.098 18.449 11.088 1.00 26.25 C ATOM 479 CG PHE A 87 29.212 18.901 11.991 1.00 23.92 C ATOM 480 CD1 PHE A 87 29.344 20.238 12.385 1.00 24.92 C ATOM 481 CD2 PHE A 87 30.174 17.986 12.410 1.00 28.58 C ATOM 482 CE1 PHE A 87 30.387 20.647 13.215 1.00 25.02 C ATOM 483 CE2 PHE A 87 31.224 18.403 13.246 1.00 29.09 C ATOM 484 CZ PHE A 87 31.330 19.720 13.630 1.00 23.82 C ATOM 485 H PHE A 87 26.429 19.314 12.833 1.00 0.00 H ATOM 486 N GLU A 88 25.008 18.542 9.945 1.00 27.66 N ATOM 487 CA GLU A 88 24.080 18.169 8.892 1.00 31.47 C ATOM 488 C GLU A 88 23.311 19.376 8.348 1.00 31.74 C ATOM 489 O GLU A 88 23.118 19.489 7.128 1.00 33.75 O ATOM 490 CB GLU A 88 23.106 17.102 9.423 1.00 34.95 C ATOM 491 CG GLU A 88 22.114 16.638 8.391 1.00 56.03 C ATOM 492 CD GLU A 88 21.909 15.138 8.426 1.00 76.47 C ATOM 493 OE1 GLU A 88 22.924 14.405 8.410 1.00 81.40 O ATOM 494 OE2 GLU A 88 20.740 14.697 8.480 1.00 81.73 O ATOM 495 H GLU A 88 24.767 18.359 10.940 1.00 0.00 H ATOM 496 N GLN A 89 22.813 20.250 9.236 1.00 30.61 N ATOM 497 CA GLN A 89 21.873 21.307 8.865 1.00 30.25 C ATOM 498 C GLN A 89 22.501 22.671 8.663 1.00 26.85 C ATOM 499 O GLN A 89 21.845 23.552 8.086 1.00 31.87 O ATOM 500 CB GLN A 89 20.828 21.522 9.961 1.00 35.01 C ATOM 501 CG GLN A 89 19.922 20.396 10.197 1.00 36.59 C ATOM 502 CD GLN A 89 18.972 20.687 11.347 1.00 34.96 C ATOM 503 OE1 GLN A 89 19.046 21.737 12.011 1.00 37.23 O ATOM 504 NE2 GLN A 89 18.105 19.754 11.601 1.00 39.18 N ATOM 505 HE22 GLN A 89 18.081 18.893 11.018 1.00 0.00 H ATOM 506 HE21 GLN A 89 17.434 19.868 12.388 1.00 0.00 H ATOM 507 H GLN A 89 23.108 20.172 10.230 1.00 0.00 H ATOM 508 N GLY A 90 23.687 22.884 9.203 1.00 26.30 N ATOM 509 CA GLY A 90 24.200 24.215 9.452 1.00 23.89 C ATOM 510 C GLY A 90 23.478 24.823 10.647 1.00 22.35 C ATOM 511 O GLY A 90 22.795 24.135 11.415 1.00 27.13 O ATOM 512 H GLY A 90 24.275 22.065 9.459 1.00 0.00 H ATOM 513 N PHE A 91 23.626 26.142 10.781 1.00 23.23 N ATOM 514 CA PHE A 91 22.890 26.918 11.781 1.00 24.80 C ATOM 515 C PHE A 91 21.661 27.551 11.134 1.00 27.17 C ATOM 516 O PHE A 91 21.777 28.430 10.271 1.00 22.96 O ATOM 517 CB PHE A 91 23.772 27.986 12.419 1.00 21.75 C ATOM 518 CG PHE A 91 24.826 27.429 13.343 1.00 21.78 C ATOM 519 CD1 PHE A 91 24.469 26.917 14.586 1.00 24.06 C ATOM 520 CD2 PHE A 91 26.155 27.408 12.958 1.00 21.80 C ATOM 521 CE1 PHE A 91 25.408 26.398 15.444 1.00 20.73 C ATOM 522 CE2 PHE A 91 27.124 26.887 13.812 1.00 21.14 C ATOM 523 CZ PHE A 91 26.758 26.381 15.053 1.00 21.45 C ATOM 524 H PHE A 91 24.289 26.638 10.152 1.00 0.00 H ATOM 525 N LEU A 92 20.476 27.119 11.576 1.00 29.59 N ATOM 526 CA LEU A 92 19.264 27.722 11.046 1.00 30.40 C ATOM 527 C LEU A 92 18.721 28.749 12.024 1.00 28.93 C ATOM 528 O LEU A 92 18.779 28.533 13.239 1.00 30.29 O ATOM 529 CB LEU A 92 18.201 26.660 10.784 1.00 30.91 C ATOM 530 CG LEU A 92 18.518 25.662 9.675 1.00 34.06 C ATOM 531 CD1 LEU A 92 17.594 24.444 9.788 1.00 37.26 C ATOM 532 CD2 LEU A 92 18.363 26.315 8.313 1.00 35.63 C ATOM 533 H LEU A 92 20.422 26.363 12.288 1.00 0.00 H ATOM 534 N PRO A 93 18.207 29.872 11.529 1.00 31.28 N ATOM 535 CA PRO A 93 17.581 30.848 12.421 1.00 29.94 C ATOM 536 C PRO A 93 16.220 30.366 12.882 1.00 25.69 C ATOM 537 O PRO A 93 15.564 29.544 12.231 1.00 31.54 O ATOM 538 CB PRO A 93 17.450 32.089 11.539 1.00 32.88 C ATOM 539 CG PRO A 93 17.229 31.532 10.200 1.00 34.47 C ATOM 540 CD PRO A 93 18.089 30.287 10.121 1.00 31.02 C ATOM 541 N LYS A 94 15.779 30.945 13.998 1.00 29.47 N ATOM 542 CA LYS A 94 14.486 30.571 14.568 1.00 33.18 C ATOM 543 C LYS A 94 13.321 30.963 13.654 1.00 38.76 C ATOM 544 O LYS A 94 12.406 30.163 13.438 1.00 38.18 O ATOM 545 CB LYS A 94 14.325 31.209 15.943 1.00 32.97 C ATOM 546 CG LYS A 94 15.282 30.706 17.015 1.00 45.06 C ATOM 547 CD LYS A 94 14.789 31.165 18.390 1.00 64.21 C ATOM 548 CE LYS A 94 15.905 31.310 19.417 1.00 67.03 C ATOM 549 NZ LYS A 94 16.220 30.042 20.148 1.00 65.72 N ATOM 550 HZ1 LYS A 94 15.373 29.716 20.655 1.00 0.00 H ATOM 551 HZ2 LYS A 94 16.519 29.315 19.466 1.00 0.00 H ATOM 552 HZ3 LYS A 94 16.987 30.217 20.828 1.00 0.00 H ATOM 553 H LYS A 94 16.360 31.669 14.467 1.00 0.00 H ATOM 554 N ASP A 95 13.321 32.188 13.103 1.00 35.46 N ATOM 555 CA ASP A 95 12.146 32.637 12.334 1.00 35.49 C ATOM 556 C ASP A 95 12.548 33.707 11.312 1.00 37.32 C ATOM 557 O ASP A 95 12.579 34.899 11.631 1.00 36.59 O ATOM 558 CB ASP A 95 11.061 33.158 13.269 1.00 41.49 C ATOM 559 CG ASP A 95 9.748 33.424 12.551 1.00 41.75 C ATOM 560 OD1 ASP A 95 9.712 33.361 11.306 1.00 46.10 O ATOM 561 OD2 ASP A 95 8.733 33.699 13.229 1.00 45.68 O ATOM 562 H ASP A 95 14.143 32.815 13.218 1.00 0.00 H ATOM 563 N VAL A 96 12.803 33.270 10.070 1.00 40.37 N ATOM 564 CA VAL A 96 13.097 34.206 8.984 1.00 44.61 C ATOM 565 C VAL A 96 11.859 34.941 8.497 1.00 52.90 C ATOM 566 O VAL A 96 11.981 35.979 7.832 1.00 48.86 O ATOM 567 CB VAL A 96 13.750 33.521 7.759 1.00 55.25 C ATOM 568 CG1 VAL A 96 15.204 33.242 8.012 1.00 44.99 C ATOM 569 CG2 VAL A 96 13.014 32.238 7.352 1.00 56.22 C ATOM 570 H VAL A 96 12.792 32.248 9.875 1.00 0.00 H ATOM 571 N ILE A 97 10.664 34.428 8.789 1.00 51.75 N ATOM 572 CA ILE A 97 9.439 34.979 8.225 1.00 51.59 C ATOM 573 C ILE A 97 8.918 36.093 9.124 1.00 52.45 C ATOM 574 O ILE A 97 8.786 37.244 8.692 1.00 53.72 O ATOM 575 CB ILE A 97 8.383 33.871 8.038 1.00 54.24 C ATOM 576 CG1 ILE A 97 8.916 32.771 7.107 1.00 51.60 C ATOM 577 CG2 ILE A 97 7.070 34.443 7.518 1.00 57.26 C ATOM 578 CD1 ILE A 97 9.353 33.257 5.740 1.00 48.04 C ATOM 579 H ILE A 97 10.605 33.615 9.435 1.00 0.00 H ATOM 580 N ASP A 98 8.620 35.756 10.380 1.00 47.64 N ATOM 581 CA ASP A 98 7.975 36.677 11.306 1.00 44.17 C ATOM 582 C ASP A 98 8.862 37.058 12.482 1.00 41.27 C ATOM 583 O ASP A 98 8.382 37.702 13.421 1.00 39.74 O ATOM 584 CB ASP A 98 6.677 36.055 11.812 1.00 42.94 C ATOM 585 CG ASP A 98 5.769 35.658 10.682 1.00 54.30 C ATOM 586 OD1 ASP A 98 5.431 36.544 9.868 1.00 57.35 O ATOM 587 OD2 ASP A 98 5.423 34.461 10.580 1.00 61.72 O ATOM 588 H ASP A 98 8.857 34.799 10.711 1.00 0.00 H ATOM 589 N GLY A 99 10.135 36.689 12.459 1.00 35.48 N ATOM 590 CA GLY A 99 11.021 36.985 13.560 1.00 35.69 C ATOM 591 C GLY A 99 11.341 38.468 13.661 1.00 31.22 C ATOM 592 O GLY A 99 10.941 39.297 12.845 1.00 38.81 O ATOM 593 H GLY A 99 10.503 36.176 11.632 1.00 0.00 H ATOM 594 N GLN A 100 12.120 38.786 14.690 1.00 30.38 N ATOM 595 CA GLN A 100 12.520 40.157 15.010 1.00 32.12 C ATOM 596 C GLN A 100 13.698 40.564 14.124 1.00 30.53 C ATOM 597 O GLN A 100 14.840 40.194 14.386 1.00 29.51 O ATOM 598 CB GLN A 100 12.893 40.252 16.485 1.00 34.15 C ATOM 599 CG GLN A 100 13.395 41.607 16.917 1.00 29.89 C ATOM 600 CD GLN A 100 12.383 42.691 16.630 1.00 34.68 C ATOM 601 OE1 GLN A 100 12.464 43.397 15.623 1.00 36.15 O ATOM 602 NE2 GLN A 100 11.392 42.806 17.500 1.00 36.62 N ATOM 603 HE22 GLN A 100 11.361 42.190 18.337 1.00 0.00 H ATOM 604 HE21 GLN A 100 10.644 43.512 17.346 1.00 0.00 H ATOM 605 H GLN A 100 12.464 38.018 15.301 1.00 0.00 H ATOM 606 N TYR A 101 13.419 41.364 13.090 1.00 35.76 N ATOM 607 CA TYR A 101 14.464 41.850 12.193 1.00 31.00 C ATOM 608 C TYR A 101 15.224 43.043 12.755 1.00 33.46 C ATOM 609 O TYR A 101 16.279 43.393 12.221 1.00 30.89 O ATOM 610 CB TYR A 101 13.851 42.229 10.835 1.00 33.25 C ATOM 611 CG TYR A 101 13.839 41.091 9.840 1.00 32.98 C ATOM 612 CD1 TYR A 101 12.873 40.096 9.905 1.00 39.27 C ATOM 613 CD2 TYR A 101 14.809 41.004 8.844 1.00 35.19 C ATOM 614 CE1 TYR A 101 12.859 39.051 9.004 1.00 39.43 C ATOM 615 CE2 TYR A 101 14.806 39.964 7.941 1.00 34.29 C ATOM 616 CZ TYR A 101 13.827 38.986 8.025 1.00 38.80 C ATOM 617 OH TYR A 101 13.808 37.939 7.131 1.00 39.97 O ATOM 618 HH TYR A 101 13.046 37.342 7.340 1.00 0.00 H ATOM 619 H TYR A 101 12.433 41.647 12.920 1.00 0.00 H ATOM 620 N ASP A 102 14.725 43.701 13.799 1.00 32.06 N ATOM 621 CA ASP A 102 15.466 44.816 14.374 1.00 30.66 C ATOM 622 C ASP A 102 16.585 44.297 15.268 1.00 31.11 C ATOM 623 O ASP A 102 16.341 43.591 16.248 1.00 30.87 O ATOM 624 CB ASP A 102 14.559 45.761 15.154 1.00 35.70 C ATOM 625 CG ASP A 102 15.326 46.961 15.659 1.00 40.93 C ATOM 626 OD1 ASP A 102 15.608 47.860 14.838 1.00 37.53 O ATOM 627 OD2 ASP A 102 15.673 46.990 16.859 1.00 40.71 O ATOM 628 H ASP A 102 13.809 43.420 14.203 1.00 0.00 H ATOM 629 N ILE A 103 17.825 44.652 14.916 1.00 28.70 N ATOM 630 CA ILE A 103 18.993 44.077 15.584 1.00 26.78 C ATOM 631 C ILE A 103 19.055 44.503 17.043 1.00 30.01 C ATOM 632 O ILE A 103 19.361 43.697 17.926 1.00 28.23 O ATOM 633 CB ILE A 103 20.272 44.472 14.835 1.00 29.45 C ATOM 634 CG1 ILE A 103 20.275 43.757 13.480 1.00 34.77 C ATOM 635 CG2 ILE A 103 21.511 44.150 15.696 1.00 28.64 C ATOM 636 CD1 ILE A 103 21.187 44.352 12.472 1.00 35.13 C ATOM 637 H ILE A 103 17.962 45.348 14.155 1.00 0.00 H ATOM 638 N GLU A 104 18.817 45.787 17.313 1.00 28.94 N ATOM 639 CA GLU A 104 18.880 46.263 18.689 1.00 36.22 C ATOM 640 C GLU A 104 17.858 45.529 19.554 1.00 32.72 C ATOM 641 O GLU A 104 18.160 45.120 20.685 1.00 31.72 O ATOM 642 CB GLU A 104 18.643 47.774 18.708 1.00 40.76 C ATOM 643 CG GLU A 104 19.144 48.462 19.942 1.00 41.18 C ATOM 644 CD GLU A 104 18.916 49.960 19.900 1.00 44.08 C ATOM 645 OE1 GLU A 104 18.159 50.459 19.019 1.00 45.34 O ATOM 646 OE2 GLU A 104 19.509 50.646 20.754 1.00 53.64 O ATOM 647 H GLU A 104 18.587 46.447 16.543 1.00 0.00 H ATOM 648 N SER A 105 16.656 45.320 19.012 1.00 29.69 N ATOM 649 CA SER A 105 15.606 44.618 19.746 1.00 30.06 C ATOM 650 C SER A 105 16.015 43.189 20.046 1.00 31.09 C ATOM 651 O SER A 105 15.858 42.720 21.176 1.00 30.43 O ATOM 652 CB SER A 105 14.294 44.620 18.958 1.00 31.35 C ATOM 653 OG SER A 105 13.762 45.918 18.848 1.00 34.64 O ATOM 654 HG SER A 105 14.411 46.501 18.380 1.00 0.00 H ATOM 655 H SER A 105 16.464 45.663 18.049 1.00 0.00 H ATOM 656 N TYR A 106 16.549 42.487 19.031 1.00 29.34 N ATOM 657 CA TYR A 106 16.998 41.097 19.161 1.00 31.30 C ATOM 658 C TYR A 106 18.101 40.962 20.210 1.00 27.41 C ATOM 659 O TYR A 106 18.078 40.053 21.060 1.00 32.89 O ATOM 660 CB TYR A 106 17.503 40.615 17.784 1.00 42.16 C ATOM 661 CG TYR A 106 18.322 39.343 17.786 1.00 32.03 C ATOM 662 CD1 TYR A 106 17.732 38.140 18.125 1.00 55.04 C ATOM 663 CD2 TYR A 106 19.676 39.329 17.403 1.00 44.73 C ATOM 664 CE1 TYR A 106 18.442 36.961 18.137 1.00 65.79 C ATOM 665 CE2 TYR A 106 20.399 38.145 17.412 1.00 49.50 C ATOM 666 CZ TYR A 106 19.768 36.958 17.783 1.00 63.03 C ATOM 667 OH TYR A 106 20.424 35.743 17.818 1.00 54.53 O ATOM 668 HH TYR A 106 21.178 35.795 18.457 1.00 0.00 H ATOM 669 H TYR A 106 16.649 42.954 18.107 1.00 0.00 H ATOM 670 N VAL A 107 19.059 41.881 20.175 1.00 30.46 N ATOM 671 CA VAL A 107 20.205 41.818 21.074 1.00 31.02 C ATOM 672 C VAL A 107 19.770 42.069 22.515 1.00 30.89 C ATOM 673 O VAL A 107 20.272 41.431 23.452 1.00 32.48 O ATOM 674 CB VAL A 107 21.262 42.833 20.612 1.00 29.55 C ATOM 675 CG1 VAL A 107 22.288 43.101 21.727 1.00 28.72 C ATOM 676 CG2 VAL A 107 21.928 42.339 19.319 1.00 25.48 C ATOM 677 H VAL A 107 18.990 42.662 19.492 1.00 0.00 H ATOM 678 N LEU A 108 18.849 43.022 22.721 1.00 28.75 N ATOM 679 CA LEU A 108 18.483 43.421 24.071 1.00 34.34 C ATOM 680 C LEU A 108 17.469 42.473 24.695 1.00 37.75 C ATOM 681 O LEU A 108 17.524 42.220 25.901 1.00 39.95 O ATOM 682 CB LEU A 108 17.916 44.847 24.068 1.00 32.50 C ATOM 683 CG LEU A 108 17.669 45.384 25.478 1.00 54.44 C ATOM 684 CD1 LEU A 108 18.982 45.698 26.169 1.00 58.61 C ATOM 685 CD2 LEU A 108 16.767 46.610 25.449 1.00 62.44 C ATOM 686 H LEU A 108 18.392 43.480 21.907 1.00 0.00 H ATOM 687 N VAL A 109 16.550 41.946 23.899 1.00 33.51 N ATOM 688 CA VAL A 109 15.421 41.175 24.403 1.00 38.16 C ATOM 689 C VAL A 109 15.332 39.939 23.540 1.00 39.04 C ATOM 690 O VAL A 109 14.818 40.001 22.418 1.00 45.93 O ATOM 691 CB VAL A 109 14.110 41.979 24.342 1.00 39.38 C ATOM 692 CG1 VAL A 109 12.925 41.099 24.710 1.00 44.67 C ATOM 693 CG2 VAL A 109 14.197 43.182 25.260 1.00 44.45 C ATOM 694 H VAL A 109 16.638 42.089 22.873 1.00 0.00 H ATOM 695 N ASN A 110 15.864 38.823 24.017 1.00 55.17 N ATOM 696 CA ASN A 110 15.979 37.684 23.126 1.00 73.66 C ATOM 697 C ASN A 110 14.585 37.261 22.689 1.00 66.10 C ATOM 698 O ASN A 110 13.671 37.125 23.507 1.00 64.89 O ATOM 699 CB ASN A 110 16.731 36.528 23.785 1.00 95.03 C ATOM 700 CG ASN A 110 17.166 35.469 22.782 1.00105.96 C ATOM 701 OD1 ASN A 110 18.185 35.620 22.103 1.00105.46 O ATOM 702 ND2 ASN A 110 16.390 34.397 22.679 1.00111.99 N ATOM 703 HD22 ASN A 110 15.540 34.312 23.272 1.00 0.00 H ATOM 704 HD21 ASN A 110 16.632 33.642 22.005 1.00 0.00 H ATOM 705 H ASN A 110 16.190 38.765 25.003 1.00 0.00 H ATOM 706 N GLN A 111 14.418 37.134 21.383 1.00 47.95 N ATOM 707 CA GLN A 111 13.156 36.780 20.757 1.00 40.94 C ATOM 708 C GLN A 111 13.480 36.110 19.437 1.00 35.31 C ATOM 709 O GLN A 111 14.572 36.315 18.886 1.00 32.91 O ATOM 710 CB GLN A 111 12.269 38.005 20.524 1.00 48.29 C ATOM 711 CG GLN A 111 12.972 39.155 19.849 1.00 49.26 C ATOM 712 CD GLN A 111 12.344 40.501 20.188 1.00 54.19 C ATOM 713 OE1 GLN A 111 11.267 40.838 19.706 1.00 42.66 O ATOM 714 NE2 GLN A 111 13.034 41.283 21.005 1.00 65.47 N ATOM 715 HE22 GLN A 111 13.943 40.958 21.391 1.00 0.00 H ATOM 716 HE21 GLN A 111 12.666 42.222 21.260 1.00 0.00 H ATOM 717 H GLN A 111 15.240 37.297 20.767 1.00 0.00 H ATOM 718 N PRO A 112 12.581 35.280 18.916 1.00 33.27 N ATOM 719 CA PRO A 112 12.889 34.590 17.661 1.00 36.44 C ATOM 720 C PRO A 112 13.154 35.598 16.557 1.00 33.07 C ATOM 721 O PRO A 112 12.446 36.600 16.419 1.00 34.91 O ATOM 722 CB PRO A 112 11.639 33.755 17.384 1.00 35.76 C ATOM 723 CG PRO A 112 10.992 33.578 18.746 1.00 36.56 C ATOM 724 CD PRO A 112 11.275 34.870 19.465 1.00 38.67 C ATOM 725 N SER A 113 14.190 35.318 15.775 1.00 29.99 N ATOM 726 CA SER A 113 14.701 36.277 14.819 1.00 28.58 C ATOM 727 C SER A 113 15.185 35.536 13.582 1.00 31.78 C ATOM 728 O SER A 113 15.304 34.297 13.600 1.00 27.71 O ATOM 729 CB SER A 113 15.846 37.079 15.435 1.00 27.18 C ATOM 730 OG SER A 113 17.071 36.381 15.238 1.00 26.10 O ATOM 731 HG SER A 113 17.017 35.493 15.672 1.00 0.00 H ATOM 732 H SER A 113 14.646 34.386 15.851 1.00 0.00 H ATOM 733 N PRO A 114 15.453 36.269 12.498 1.00 26.59 N ATOM 734 CA PRO A 114 16.061 35.680 11.298 1.00 29.22 C ATOM 735 C PRO A 114 17.562 35.516 11.389 1.00 26.08 C ATOM 736 O PRO A 114 18.175 35.090 10.408 1.00 30.41 O ATOM 737 CB PRO A 114 15.706 36.709 10.214 1.00 36.79 C ATOM 738 CG PRO A 114 15.767 38.005 10.956 1.00 27.95 C ATOM 739 CD PRO A 114 15.132 37.696 12.297 1.00 28.51 C ATOM 740 N TYR A 115 18.159 35.838 12.531 1.00 23.69 N ATOM 741 CA TYR A 115 19.605 35.901 12.679 1.00 24.16 C ATOM 742 C TYR A 115 20.141 34.692 13.440 1.00 23.51 C ATOM 743 O TYR A 115 19.522 34.204 14.390 1.00 23.53 O ATOM 744 CB TYR A 115 20.009 37.176 13.430 1.00 23.77 C ATOM 745 CG TYR A 115 19.499 38.427 12.803 1.00 24.05 C ATOM 746 CD1 TYR A 115 20.035 38.900 11.622 1.00 24.34 C ATOM 747 CD2 TYR A 115 18.466 39.153 13.390 1.00 24.71 C ATOM 748 CE1 TYR A 115 19.561 40.063 11.024 1.00 25.23 C ATOM 749 CE2 TYR A 115 17.988 40.313 12.815 1.00 26.77 C ATOM 750 CZ TYR A 115 18.535 40.774 11.635 1.00 26.19 C ATOM 751 OH TYR A 115 18.059 41.927 11.049 1.00 29.20 O ATOM 752 HH TYR A 115 18.174 42.686 11.675 1.00 0.00 H ATOM 753 H TYR A 115 17.566 36.055 13.357 1.00 0.00 H ATOM 754 N VAL A 116 21.311 34.224 13.039 1.00 20.43 N ATOM 755 CA VAL A 116 22.121 33.356 13.892 1.00 20.84 C ATOM 756 C VAL A 116 23.290 34.170 14.422 1.00 21.37 C ATOM 757 O VAL A 116 24.103 34.687 13.636 1.00 20.87 O ATOM 758 CB VAL A 116 22.628 32.110 13.152 1.00 22.34 C ATOM 759 CG1 VAL A 116 23.590 31.311 14.050 1.00 22.67 C ATOM 760 CG2 VAL A 116 21.428 31.233 12.710 1.00 26.06 C ATOM 761 H VAL A 116 21.663 34.479 12.094 1.00 0.00 H ATOM 762 N SER A 117 23.403 34.227 15.747 1.00 22.33 N ATOM 763 CA SER A 117 24.439 35.017 16.403 1.00 20.52 C ATOM 764 C SER A 117 25.750 34.253 16.477 1.00 17.50 C ATOM 765 O SER A 117 25.788 33.078 16.846 1.00 18.45 O ATOM 766 CB SER A 117 24.032 35.402 17.817 1.00 29.09 C ATOM 767 OG SER A 117 22.901 36.244 17.784 1.00 26.18 O ATOM 768 HG SER A 117 22.645 36.488 18.709 1.00 0.00 H ATOM 769 H SER A 117 22.731 33.691 16.333 1.00 0.00 H ATOM 770 N THR A 118 26.827 34.961 16.149 1.00 18.98 N ATOM 771 CA THR A 118 28.196 34.488 16.327 1.00 18.25 C ATOM 772 C THR A 118 28.995 35.608 16.983 1.00 17.38 C ATOM 773 O THR A 118 28.512 36.738 17.143 1.00 16.82 O ATOM 774 CB THR A 118 28.846 34.101 14.991 1.00 18.60 C ATOM 775 OG1 THR A 118 29.110 35.289 14.254 1.00 19.66 O ATOM 776 CG2 THR A 118 27.932 33.130 14.195 1.00 20.42 C ATOM 777 HG1 THR A 118 28.260 35.770 14.089 1.00 0.00 H ATOM 778 H THR A 118 26.685 35.907 15.742 1.00 0.00 H ATOM 779 N THR A 119 30.252 35.325 17.312 1.00 17.46 N ATOM 780 CA THR A 119 31.120 36.299 17.945 1.00 14.80 C ATOM 781 C THR A 119 32.532 36.253 17.362 1.00 14.99 C ATOM 782 O THR A 119 33.019 35.205 16.930 1.00 17.34 O ATOM 783 CB THR A 119 31.184 36.069 19.476 1.00 15.49 C ATOM 784 OG1 THR A 119 32.056 37.017 20.085 1.00 18.40 O ATOM 785 CG2 THR A 119 31.629 34.657 19.819 1.00 16.48 C ATOM 786 HG1 THR A 119 31.721 37.932 19.910 1.00 0.00 H ATOM 787 H THR A 119 30.624 34.375 17.109 1.00 0.00 H ATOM 788 N TYR A 120 33.175 37.415 17.402 1.00 18.14 N ATOM 789 CA TYR A 120 34.599 37.501 17.111 1.00 15.14 C ATOM 790 C TYR A 120 35.463 36.850 18.194 1.00 17.46 C ATOM 791 O TYR A 120 36.659 36.571 17.957 1.00 20.12 O ATOM 792 CB TYR A 120 35.012 38.963 16.986 1.00 17.74 C ATOM 793 CG TYR A 120 34.506 39.695 15.771 1.00 18.13 C ATOM 794 CD1 TYR A 120 35.030 39.446 14.511 1.00 19.98 C ATOM 795 CD2 TYR A 120 33.593 40.736 15.904 1.00 17.63 C ATOM 796 CE1 TYR A 120 34.601 40.169 13.396 1.00 19.59 C ATOM 797 CE2 TYR A 120 33.147 41.456 14.804 1.00 19.47 C ATOM 798 CZ TYR A 120 33.675 41.181 13.542 1.00 21.11 C ATOM 799 OH TYR A 120 33.281 41.879 12.412 1.00 22.49 O ATOM 800 HH TYR A 120 33.484 42.841 12.532 1.00 0.00 H ATOM 801 H TYR A 120 32.651 38.280 17.646 1.00 0.00 H ATOM 802 N ASP A 121 34.896 36.634 19.385 1.00 17.49 N ATOM 803 CA ASP A 121 35.654 36.267 20.582 1.00 16.50 C ATOM 804 C ASP A 121 35.639 34.762 20.805 1.00 17.55 C ATOM 805 O ASP A 121 34.617 34.181 21.232 1.00 17.90 O ATOM 806 CB ASP A 121 35.038 37.007 21.771 1.00 17.25 C ATOM 807 CG ASP A 121 35.774 36.776 23.086 1.00 22.36 C ATOM 808 OD1 ASP A 121 36.793 36.050 23.129 1.00 21.04 O ATOM 809 OD2 ASP A 121 35.268 37.343 24.111 1.00 23.42 O ATOM 810 H ASP A 121 33.864 36.732 19.465 1.00 0.00 H ATOM 811 N HIS A 122 36.798 34.144 20.585 1.00 15.43 N ATOM 812 CA HIS A 122 36.953 32.710 20.812 1.00 15.96 C ATOM 813 C HIS A 122 36.472 32.265 22.194 1.00 18.35 C ATOM 814 O HIS A 122 35.976 31.134 22.358 1.00 18.63 O ATOM 815 CB HIS A 122 38.418 32.341 20.656 1.00 17.80 C ATOM 816 CG HIS A 122 38.716 30.926 21.045 1.00 17.83 C ATOM 817 ND1 HIS A 122 39.021 30.556 22.340 1.00 17.51 N ATOM 818 CD2 HIS A 122 38.693 29.782 20.321 1.00 18.31 C ATOM 819 CE1 HIS A 122 39.185 29.250 22.392 1.00 18.04 C ATOM 820 NE2 HIS A 122 39.009 28.758 21.178 1.00 18.48 N ATOM 821 H HIS A 122 37.611 34.695 20.244 1.00 0.00 H ATOM 822 N ASP A 123 36.693 33.100 23.200 1.00 17.23 N ATOM 823 CA ASP A 123 36.434 32.775 24.603 1.00 16.00 C ATOM 824 C ASP A 123 35.035 33.120 25.104 1.00 18.45 C ATOM 825 O ASP A 123 34.785 32.935 26.303 1.00 19.73 O ATOM 826 CB ASP A 123 37.453 33.494 25.479 1.00 17.83 C ATOM 827 CG ASP A 123 38.865 33.065 25.179 1.00 19.61 C ATOM 828 OD1 ASP A 123 39.078 31.908 24.767 1.00 20.08 O ATOM 829 OD2 ASP A 123 39.754 33.910 25.349 1.00 28.85 O ATOM 830 H ASP A 123 37.073 34.042 22.979 1.00 0.00 H ATOM 831 N LEU A 124 34.135 33.640 24.262 1.00 19.64 N ATOM 832 CA LEU A 124 32.832 34.046 24.780 1.00 15.75 C ATOM 833 C LEU A 124 32.063 32.852 25.317 1.00 16.56 C ATOM 834 O LEU A 124 31.182 33.018 26.171 1.00 18.87 O ATOM 835 CB LEU A 124 32.031 34.757 23.671 1.00 16.02 C ATOM 836 CG LEU A 124 30.775 35.490 24.251 1.00 16.64 C ATOM 837 CD1 LEU A 124 31.205 36.666 25.073 1.00 20.62 C ATOM 838 CD2 LEU A 124 29.871 35.928 23.106 1.00 18.30 C ATOM 839 H LEU A 124 34.360 33.753 23.253 1.00 0.00 H ATOM 840 N TYR A 125 32.394 31.645 24.854 1.00 17.50 N ATOM 841 CA TYR A 125 31.726 30.445 25.397 1.00 19.12 C ATOM 842 C TYR A 125 31.841 30.353 26.911 1.00 20.30 C ATOM 843 O TYR A 125 31.002 29.707 27.547 1.00 23.00 O ATOM 844 CB TYR A 125 32.320 29.162 24.782 1.00 21.28 C ATOM 845 CG TYR A 125 33.702 28.788 25.309 1.00 20.22 C ATOM 846 CD1 TYR A 125 33.871 27.936 26.378 1.00 20.21 C ATOM 847 CD2 TYR A 125 34.855 29.256 24.656 1.00 20.26 C ATOM 848 CE1 TYR A 125 35.104 27.621 26.856 1.00 19.58 C ATOM 849 CE2 TYR A 125 36.119 28.941 25.127 1.00 18.86 C ATOM 850 CZ TYR A 125 36.247 28.093 26.200 1.00 19.16 C ATOM 851 OH TYR A 125 37.489 27.795 26.690 1.00 22.31 O ATOM 852 HH TYR A 125 38.029 27.367 25.979 1.00 0.00 H ATOM 853 H TYR A 125 33.119 31.550 24.114 1.00 0.00 H ATOM 854 N LYS A 126 32.880 30.939 27.508 1.00 21.69 N ATOM 855 CA LYS A 126 33.034 30.896 28.961 1.00 20.54 C ATOM 856 C LYS A 126 31.934 31.652 29.699 1.00 21.87 C ATOM 857 O LYS A 126 31.790 31.480 30.918 1.00 29.63 O ATOM 858 CB LYS A 126 34.401 31.460 29.346 1.00 25.89 C ATOM 859 CG LYS A 126 35.569 30.683 28.765 1.00 22.07 C ATOM 860 CD LYS A 126 36.877 31.313 29.157 1.00 25.47 C ATOM 861 CE LYS A 126 38.058 30.477 28.669 1.00 25.39 C ATOM 862 NZ LYS A 126 38.231 29.224 29.445 1.00 24.83 N ATOM 863 HZ1 LYS A 126 38.396 29.457 30.445 1.00 0.00 H ATOM 864 HZ2 LYS A 126 37.372 28.644 29.360 1.00 0.00 H ATOM 865 HZ3 LYS A 126 39.046 28.696 29.072 1.00 0.00 H ATOM 866 H LYS A 126 33.591 31.433 26.932 1.00 0.00 H ATOM 867 N THR A 127 31.179 32.501 29.001 1.00 21.92 N ATOM 868 CA THR A 127 30.111 33.269 29.628 1.00 25.78 C ATOM 869 C THR A 127 28.756 32.586 29.506 1.00 26.24 C ATOM 870 O THR A 127 27.805 33.020 30.168 1.00 32.56 O ATOM 871 CB THR A 127 30.020 34.687 29.017 1.00 28.17 C ATOM 872 OG1 THR A 127 29.499 34.632 27.674 1.00 26.30 O ATOM 873 CG2 THR A 127 31.397 35.374 29.003 1.00 32.27 C ATOM 874 HG1 THR A 127 30.097 34.079 27.112 1.00 0.00 H ATOM 875 H THR A 127 31.357 32.618 27.983 1.00 0.00 H ATOM 876 N TRP A 128 28.635 31.564 28.646 1.00 31.64 N ATOM 877 CA TRP A 128 27.371 30.867 28.419 1.00 42.09 C ATOM 878 C TRP A 128 27.369 29.612 29.275 1.00 55.04 C ATOM 879 O TRP A 128 28.145 28.683 29.032 1.00 66.30 O ATOM 880 CB TRP A 128 27.186 30.506 26.946 1.00 42.25 C ATOM 881 CG TRP A 128 27.155 31.664 26.032 1.00 38.29 C ATOM 882 CD1 TRP A 128 28.215 32.211 25.382 1.00 40.33 C ATOM 883 CD2 TRP A 128 26.006 32.433 25.646 1.00 30.29 C ATOM 884 NE1 TRP A 128 27.807 33.274 24.622 1.00 38.69 N ATOM 885 CE2 TRP A 128 26.458 33.437 24.764 1.00 45.09 C ATOM 886 CE3 TRP A 128 24.648 32.379 25.967 1.00 44.75 C ATOM 887 CZ2 TRP A 128 25.605 34.371 24.193 1.00 45.38 C ATOM 888 CZ3 TRP A 128 23.800 33.309 25.394 1.00 48.89 C ATOM 889 CH2 TRP A 128 24.281 34.289 24.516 1.00 46.53 C ATOM 890 HE1 TRP A 128 28.426 33.864 24.030 1.00 0.00 H ATOM 891 H TRP A 128 29.476 31.255 28.119 1.00 0.00 H ATOM 892 N TYR A 129 26.491 29.575 30.258 1.00 63.95 N ATOM 893 CA TYR A 129 26.414 28.408 31.114 1.00 76.54 C ATOM 894 C TYR A 129 25.550 27.338 30.457 1.00 56.68 C ATOM 895 O TYR A 129 24.611 27.636 29.712 1.00 44.09 O ATOM 896 CB TYR A 129 25.909 28.821 32.493 1.00 95.21 C ATOM 897 CG TYR A 129 26.900 29.778 33.121 1.00102.66 C ATOM 898 CD1 TYR A 129 28.034 29.303 33.771 1.00102.10 C ATOM 899 CD2 TYR A 129 26.740 31.156 33.004 1.00105.92 C ATOM 900 CE1 TYR A 129 28.959 30.170 34.318 1.00103.10 C ATOM 901 CE2 TYR A 129 27.660 32.032 33.549 1.00104.66 C ATOM 902 CZ TYR A 129 28.768 31.534 34.204 1.00102.16 C ATOM 903 OH TYR A 129 29.687 32.401 34.748 1.00 99.00 O ATOM 904 HH TYR A 129 30.413 31.883 35.177 1.00 0.00 H ATOM 905 H TYR A 129 25.855 30.382 30.419 1.00 0.00 H ATOM 906 N LYS A 130 25.950 26.088 30.653 1.00 47.59 N ATOM 907 CA LYS A 130 25.417 24.946 29.917 1.00 57.01 C ATOM 908 C LYS A 130 25.564 25.086 28.398 1.00 59.40 C ATOM 909 O LYS A 130 24.854 24.408 27.652 1.00 59.76 O ATOM 910 CB LYS A 130 23.941 24.702 30.254 1.00 53.01 C ATOM 911 CG LYS A 130 23.638 24.525 31.730 1.00 48.79 C ATOM 912 CD LYS A 130 22.299 23.815 31.918 1.00 45.29 C ATOM 913 CE LYS A 130 21.570 24.244 33.187 1.00 45.56 C ATOM 914 NZ LYS A 130 21.647 23.224 34.269 1.00 47.02 N ATOM 915 HZ1 LYS A 130 21.216 22.337 33.939 1.00 0.00 H ATOM 916 HZ2 LYS A 130 22.643 23.056 34.515 1.00 0.00 H ATOM 917 HZ3 LYS A 130 21.135 23.569 35.106 1.00 0.00 H ATOM 918 H LYS A 130 26.683 25.913 31.370 1.00 0.00 H ATOM 919 N SER A 131 26.496 25.974 28.001 1.00 61.33 N ATOM 920 CA SER A 131 26.937 26.212 26.625 1.00 58.66 C ATOM 921 C SER A 131 27.000 24.928 25.821 1.00 57.06 C ATOM 922 O SER A 131 26.384 24.795 24.757 1.00 62.84 O ATOM 923 CB SER A 131 28.328 26.888 26.663 1.00 46.63 C ATOM 924 OG SER A 131 29.098 26.735 25.462 1.00 40.28 O ATOM 925 HG SER A 131 28.605 27.134 24.702 1.00 0.00 H ATOM 926 H SER A 131 26.946 26.546 28.744 1.00 0.00 H ATOM 927 N GLY A 132 27.760 23.988 26.336 1.00 34.68 N ATOM 928 CA GLY A 132 28.004 22.668 25.747 1.00 28.25 C ATOM 929 C GLY A 132 29.053 22.586 24.645 1.00 23.19 C ATOM 930 O GLY A 132 29.911 21.695 24.678 1.00 25.85 O ATOM 931 H GLY A 132 28.229 24.199 27.240 1.00 0.00 H ATOM 932 N TYR A 133 28.980 23.476 23.665 1.00 21.79 N ATOM 933 CA TYR A 133 29.882 23.432 22.509 1.00 21.33 C ATOM 934 C TYR A 133 30.326 24.818 22.097 1.00 22.04 C ATOM 935 O TYR A 133 29.546 25.760 22.108 1.00 20.88 O ATOM 936 CB TYR A 133 29.191 22.768 21.311 1.00 23.38 C ATOM 937 CG TYR A 133 28.810 21.333 21.583 1.00 22.56 C ATOM 938 CD1 TYR A 133 29.738 20.310 21.402 1.00 25.82 C ATOM 939 CD2 TYR A 133 27.539 20.999 22.062 1.00 25.97 C ATOM 940 CE1 TYR A 133 29.405 18.994 21.657 1.00 29.66 C ATOM 941 CE2 TYR A 133 27.207 19.694 22.308 1.00 27.56 C ATOM 942 CZ TYR A 133 28.148 18.694 22.115 1.00 27.38 C ATOM 943 OH TYR A 133 27.755 17.386 22.393 1.00 34.32 O ATOM 944 HH TYR A 133 28.511 16.771 22.217 1.00 0.00 H ATOM 945 H TYR A 133 28.263 24.227 23.717 1.00 0.00 H ATOM 946 N ASN A 134 31.583 24.919 21.653 1.00 18.01 N ATOM 947 CA ASN A 134 32.125 26.127 21.027 1.00 16.93 C ATOM 948 C ASN A 134 32.394 25.785 19.562 1.00 19.09 C ATOM 949 O ASN A 134 33.310 25.017 19.260 1.00 18.76 O ATOM 950 CB ASN A 134 33.400 26.564 21.744 1.00 18.46 C ATOM 951 CG ASN A 134 33.803 27.966 21.418 1.00 21.61 C ATOM 952 OD1 ASN A 134 32.964 28.861 21.218 1.00 17.59 O ATOM 953 ND2 ASN A 134 35.131 28.189 21.317 1.00 18.42 N ATOM 954 HD22 ASN A 134 35.803 27.415 21.492 1.00 0.00 H ATOM 955 HD21 ASN A 134 35.482 29.135 21.064 1.00 0.00 H ATOM 956 H ASN A 134 32.210 24.096 21.758 1.00 0.00 H ATOM 957 N TYR A 135 31.539 26.276 18.677 1.00 18.29 N ATOM 958 CA TYR A 135 31.682 26.080 17.239 1.00 18.94 C ATOM 959 C TYR A 135 32.603 27.116 16.613 1.00 18.05 C ATOM 960 O TYR A 135 32.595 28.290 16.985 1.00 16.09 O ATOM 961 CB TYR A 135 30.305 26.133 16.573 1.00 18.99 C ATOM 962 CG TYR A 135 29.461 24.905 16.852 1.00 19.61 C ATOM 963 CD1 TYR A 135 29.528 23.793 16.020 1.00 19.24 C ATOM 964 CD2 TYR A 135 28.612 24.846 17.941 1.00 18.49 C ATOM 965 CE1 TYR A 135 28.794 22.669 16.261 1.00 20.76 C ATOM 966 CE2 TYR A 135 27.828 23.706 18.183 1.00 19.81 C ATOM 967 CZ TYR A 135 27.936 22.626 17.346 1.00 22.21 C ATOM 968 OH TYR A 135 27.215 21.482 17.567 1.00 23.96 O ATOM 969 HH TYR A 135 26.248 21.693 17.545 1.00 0.00 H ATOM 970 H TYR A 135 30.728 26.827 19.024 1.00 0.00 H ATOM 971 N TYR A 136 33.360 26.654 15.621 1.00 17.43 N ATOM 972 CA TYR A 136 34.321 27.422 14.856 1.00 17.68 C ATOM 973 C TYR A 136 33.763 27.604 13.450 1.00 16.35 C ATOM 974 O TYR A 136 33.366 26.623 12.804 1.00 19.10 O ATOM 975 CB TYR A 136 35.663 26.679 14.814 1.00 17.93 C ATOM 976 CG TYR A 136 36.403 26.583 16.125 1.00 16.11 C ATOM 977 CD1 TYR A 136 35.808 26.072 17.279 1.00 17.40 C ATOM 978 CD2 TYR A 136 37.684 27.059 16.237 1.00 14.96 C ATOM 979 CE1 TYR A 136 36.508 25.985 18.464 1.00 19.03 C ATOM 980 CE2 TYR A 136 38.383 26.995 17.421 1.00 15.97 C ATOM 981 CZ TYR A 136 37.778 26.459 18.545 1.00 17.07 C ATOM 982 OH TYR A 136 38.450 26.375 19.733 1.00 18.02 O ATOM 983 HH TYR A 136 37.861 25.968 20.416 1.00 0.00 H ATOM 984 H TYR A 136 33.252 25.650 15.372 1.00 0.00 H ATOM 985 N ILE A 137 33.709 28.861 12.988 1.00 17.43 N ATOM 986 CA ILE A 137 32.976 29.240 11.785 1.00 17.57 C ATOM 987 C ILE A 137 33.891 30.039 10.859 1.00 19.52 C ATOM 988 O ILE A 137 34.602 30.947 11.309 1.00 17.93 O ATOM 989 CB ILE A 137 31.724 30.061 12.149 1.00 17.66 C ATOM 990 CG1 ILE A 137 30.742 29.158 12.897 1.00 17.50 C ATOM 991 CG2 ILE A 137 31.067 30.673 10.894 1.00 18.66 C ATOM 992 CD1 ILE A 137 29.718 29.931 13.684 1.00 21.03 C ATOM 993 H ILE A 137 34.215 29.603 13.513 1.00 0.00 H ATOM 994 N ASP A 138 33.866 29.711 9.570 1.00 19.50 N ATOM 995 CA ASP A 138 34.638 30.445 8.559 1.00 19.04 C ATOM 996 C ASP A 138 33.657 30.784 7.455 1.00 19.95 C ATOM 997 O ASP A 138 33.464 29.993 6.543 1.00 20.05 O ATOM 998 CB ASP A 138 35.798 29.595 8.054 1.00 18.88 C ATOM 999 CG ASP A 138 36.587 30.237 6.932 1.00 22.41 C ATOM 1000 OD1 ASP A 138 36.559 31.478 6.812 1.00 22.93 O ATOM 1001 OD2 ASP A 138 37.291 29.493 6.184 1.00 23.45 O ATOM 1002 H ASP A 138 33.280 28.907 9.268 1.00 0.00 H ATOM 1003 N ALA A 139 32.976 31.918 7.584 1.00 19.44 N ATOM 1004 CA ALA A 139 31.873 32.266 6.708 1.00 20.63 C ATOM 1005 C ALA A 139 32.017 33.707 6.261 1.00 19.55 C ATOM 1006 O ALA A 139 32.462 34.557 7.051 1.00 21.28 O ATOM 1007 CB ALA A 139 30.526 32.141 7.441 1.00 21.12 C ATOM 1008 H ALA A 139 33.243 32.580 8.340 1.00 0.00 H ATOM 1009 N PRO A 140 31.627 34.016 5.021 1.00 23.36 N ATOM 1010 CA PRO A 140 31.671 35.401 4.541 1.00 24.24 C ATOM 1011 C PRO A 140 30.506 36.193 5.093 1.00 26.50 C ATOM 1012 O PRO A 140 29.419 35.663 5.318 1.00 27.49 O ATOM 1013 CB PRO A 140 31.547 35.255 3.019 1.00 26.51 C ATOM 1014 CG PRO A 140 30.704 34.026 2.844 1.00 27.38 C ATOM 1015 CD PRO A 140 31.076 33.105 4.000 1.00 27.17 C ATOM 1016 N GLY A 141 30.750 37.478 5.315 1.00 25.80 N ATOM 1017 CA GLY A 141 29.654 38.389 5.592 1.00 26.16 C ATOM 1018 C GLY A 141 29.208 38.408 7.037 1.00 25.25 C ATOM 1019 O GLY A 141 30.037 38.383 7.949 1.00 22.48 O ATOM 1020 H GLY A 141 31.727 37.833 5.291 1.00 0.00 H ATOM 1021 N GLY A 142 27.900 38.463 7.249 1.00 25.46 N ATOM 1022 CA GLY A 142 27.346 38.728 8.572 1.00 22.32 C ATOM 1023 C GLY A 142 27.248 40.210 8.861 1.00 22.83 C ATOM 1024 O GLY A 142 27.991 41.039 8.333 1.00 24.81 O ATOM 1025 H GLY A 142 27.251 38.313 6.450 1.00 0.00 H ATOM 1026 N VAL A 143 26.297 40.556 9.714 1.00 23.08 N ATOM 1027 CA VAL A 143 26.126 41.932 10.160 1.00 24.15 C ATOM 1028 C VAL A 143 26.963 42.143 11.411 1.00 24.00 C ATOM 1029 O VAL A 143 26.762 41.454 12.417 1.00 22.62 O ATOM 1030 CB VAL A 143 24.660 42.244 10.451 1.00 25.71 C ATOM 1031 CG1 VAL A 143 24.559 43.674 10.987 1.00 26.91 C ATOM 1032 CG2 VAL A 143 23.784 42.021 9.211 1.00 28.32 C ATOM 1033 H VAL A 143 25.653 39.824 10.076 1.00 0.00 H ATOM 1034 N ASP A 144 27.878 43.113 11.364 1.00 23.34 N ATOM 1035 CA ASP A 144 28.693 43.428 12.535 1.00 22.78 C ATOM 1036 C ASP A 144 27.815 44.249 13.478 1.00 24.12 C ATOM 1037 O ASP A 144 27.463 45.392 13.174 1.00 24.83 O ATOM 1038 CB ASP A 144 29.963 44.167 12.119 1.00 24.22 C ATOM 1039 CG ASP A 144 30.908 44.409 13.290 1.00 22.66 C ATOM 1040 OD1 ASP A 144 30.438 44.897 14.331 1.00 23.05 O ATOM 1041 OD2 ASP A 144 32.120 44.193 13.148 1.00 23.98 O ATOM 1042 H ASP A 144 28.013 43.651 10.484 1.00 0.00 H ATOM 1043 N VAL A 145 27.438 43.654 14.612 1.00 20.40 N ATOM 1044 CA VAL A 145 26.423 44.267 15.457 1.00 22.11 C ATOM 1045 C VAL A 145 26.918 45.602 16.001 1.00 22.88 C ATOM 1046 O VAL A 145 26.206 46.612 15.947 1.00 24.99 O ATOM 1047 CB VAL A 145 26.016 43.306 16.587 1.00 23.42 C ATOM 1048 CG1 VAL A 145 25.198 44.042 17.666 1.00 24.20 C ATOM 1049 CG2 VAL A 145 25.206 42.153 16.021 1.00 22.15 C ATOM 1050 H VAL A 145 27.870 42.751 14.893 1.00 0.00 H ATOM 1051 N ASN A 146 28.120 45.624 16.578 1.00 22.69 N ATOM 1052 CA ASN A 146 28.567 46.858 17.210 1.00 23.90 C ATOM 1053 C ASN A 146 28.796 47.974 16.197 1.00 28.81 C ATOM 1054 O ASN A 146 28.616 49.148 16.533 1.00 28.16 O ATOM 1055 CB ASN A 146 29.812 46.604 18.034 1.00 24.45 C ATOM 1056 CG ASN A 146 29.533 45.801 19.269 1.00 25.57 C ATOM 1057 OD1 ASN A 146 28.382 45.473 19.576 1.00 24.39 O ATOM 1058 ND2 ASN A 146 30.591 45.496 20.007 1.00 25.18 N ATOM 1059 HD22 ASN A 146 31.540 45.796 19.705 1.00 0.00 H ATOM 1060 HD21 ASN A 146 30.472 44.957 20.888 1.00 0.00 H ATOM 1061 H ASN A 146 28.725 44.778 16.577 1.00 0.00 H ATOM 1062 N LYS A 147 29.181 47.642 14.958 1.00 26.03 N ATOM 1063 CA LYS A 147 29.297 48.671 13.926 1.00 26.59 C ATOM 1064 C LYS A 147 27.930 49.170 13.473 1.00 30.53 C ATOM 1065 O LYS A 147 27.804 50.301 12.979 1.00 31.60 O ATOM 1066 CB LYS A 147 30.077 48.134 12.721 1.00 30.33 C ATOM 1067 CG LYS A 147 31.535 47.862 12.987 1.00 34.43 C ATOM 1068 CD LYS A 147 32.211 47.366 11.694 1.00 51.12 C ATOM 1069 CE LYS A 147 33.682 47.068 11.896 1.00 62.35 C ATOM 1070 NZ LYS A 147 34.412 48.289 12.316 1.00 68.98 N ATOM 1071 HZ1 LYS A 147 34.314 49.019 11.582 1.00 0.00 H ATOM 1072 HZ2 LYS A 147 34.014 48.639 13.211 1.00 0.00 H ATOM 1073 HZ3 LYS A 147 35.418 48.062 12.449 1.00 0.00 H ATOM 1074 H LYS A 147 29.398 46.651 14.730 1.00 0.00 H ATOM 1075 N THR A 148 26.902 48.339 13.619 1.00 27.00 N ATOM 1076 CA THR A 148 25.550 48.677 13.205 1.00 28.32 C ATOM 1077 C THR A 148 24.778 49.432 14.285 1.00 29.76 C ATOM 1078 O THR A 148 24.102 50.411 13.965 1.00 31.92 O ATOM 1079 CB THR A 148 24.802 47.395 12.811 1.00 27.60 C ATOM 1080 OG1 THR A 148 25.501 46.768 11.730 1.00 25.69 O ATOM 1081 CG2 THR A 148 23.383 47.686 12.342 1.00 29.05 C ATOM 1082 HG1 THR A 148 26.421 46.545 12.019 1.00 0.00 H ATOM 1083 H THR A 148 27.073 47.407 14.048 1.00 0.00 H ATOM 1084 N ILE A 149 24.851 49.016 15.557 1.00 27.26 N ATOM 1085 CA ILE A 149 24.079 49.660 16.619 1.00 32.51 C ATOM 1086 C ILE A 149 24.968 50.372 17.641 1.00 34.27 C ATOM 1087 O ILE A 149 24.454 50.897 18.640 1.00 35.88 O ATOM 1088 CB ILE A 149 23.132 48.667 17.316 1.00 27.86 C ATOM 1089 CG1 ILE A 149 23.907 47.635 18.151 1.00 30.49 C ATOM 1090 CG2 ILE A 149 22.212 47.980 16.280 1.00 28.82 C ATOM 1091 CD1 ILE A 149 22.995 46.802 19.109 1.00 27.66 C ATOM 1092 H ILE A 149 25.472 48.216 15.794 1.00 0.00 H ATOM 1093 N GLY A 150 26.280 50.439 17.410 1.00 32.14 N ATOM 1094 CA GLY A 150 27.182 51.063 18.356 1.00 36.81 C ATOM 1095 C GLY A 150 27.789 50.076 19.342 1.00 33.27 C ATOM 1096 O GLY A 150 27.374 48.919 19.459 1.00 31.60 O ATOM 1097 H GLY A 150 26.663 50.035 16.532 1.00 0.00 H ATOM 1098 N ASP A 151 28.803 50.550 20.071 1.00 34.50 N ATOM 1099 CA ASP A 151 29.533 49.699 21.008 1.00 37.97 C ATOM 1100 C ASP A 151 29.295 50.093 22.458 1.00 41.06 C ATOM 1101 O ASP A 151 30.097 49.746 23.334 1.00 35.57 O ATOM 1102 CB ASP A 151 31.037 49.697 20.698 1.00 41.54 C ATOM 1103 CG ASP A 151 31.676 51.080 20.769 1.00 48.38 C ATOM 1104 OD1 ASP A 151 31.084 52.015 21.348 1.00 45.10 O ATOM 1105 OD2 ASP A 151 32.803 51.223 20.246 1.00 61.22 O ATOM 1106 H ASP A 151 29.079 51.547 19.969 1.00 0.00 H ATOM 1107 N ARG A 152 28.194 50.793 22.733 1.00 39.26 N ATOM 1108 CA ARG A 152 27.885 51.263 24.073 1.00 45.59 C ATOM 1109 C ARG A 152 26.685 50.552 24.679 1.00 39.32 C ATOM 1110 O ARG A 152 26.355 50.806 25.840 1.00 44.15 O ATOM 1111 CB ARG A 152 27.633 52.776 24.058 1.00 52.81 C ATOM 1112 CG ARG A 152 28.762 53.591 23.433 1.00 64.72 C ATOM 1113 CD ARG A 152 30.062 53.469 24.218 1.00 83.69 C ATOM 1114 NE ARG A 152 31.187 54.078 23.507 1.00 96.65 N ATOM 1115 CZ ARG A 152 31.568 55.348 23.632 1.00 97.76 C ATOM 1116 NH1 ARG A 152 30.920 56.174 24.448 1.00101.83 N ATOM 1117 NH2 ARG A 152 32.605 55.794 22.936 1.00 91.10 N ATOM 1118 HE ARG A 152 31.729 53.474 22.856 1.00 0.00 H ATOM 1119 HH12 ARG A 152 31.227 57.164 24.537 1.00 0.00 H ATOM 1120 HH11 ARG A 152 30.106 55.830 24.997 1.00 0.00 H ATOM 1121 HH22 ARG A 152 32.907 56.785 23.030 1.00 0.00 H ATOM 1122 HH21 ARG A 152 33.116 55.153 22.296 1.00 0.00 H ATOM 1123 H ARG A 152 27.532 51.011 21.961 1.00 0.00 H ATOM 1124 N HIS A 153 26.026 49.672 23.933 1.00 38.97 N ATOM 1125 CA HIS A 153 24.883 48.962 24.487 1.00 33.31 C ATOM 1126 C HIS A 153 25.344 47.879 25.460 1.00 36.59 C ATOM 1127 O HIS A 153 26.528 47.524 25.552 1.00 32.45 O ATOM 1128 CB HIS A 153 24.034 48.353 23.374 1.00 32.45 C ATOM 1129 CG HIS A 153 24.763 47.330 22.561 1.00 27.89 C ATOM 1130 ND1 HIS A 153 24.684 45.979 22.819 1.00 26.25 N ATOM 1131 CD2 HIS A 153 25.619 47.468 21.516 1.00 30.53 C ATOM 1132 CE1 HIS A 153 25.444 45.323 21.955 1.00 30.33 C ATOM 1133 NE2 HIS A 153 26.014 46.204 21.150 1.00 26.44 N ATOM 1134 H HIS A 153 26.327 49.491 22.954 1.00 0.00 H ATOM 1135 N LYS A 154 24.363 47.333 26.176 1.00 33.03 N ATOM 1136 CA LYS A 154 24.640 46.471 27.311 1.00 33.06 C ATOM 1137 C LYS A 154 25.486 45.269 26.924 1.00 30.36 C ATOM 1138 O LYS A 154 26.266 44.777 27.746 1.00 33.11 O ATOM 1139 CB LYS A 154 23.320 46.000 27.924 1.00 39.49 C ATOM 1140 CG LYS A 154 23.452 45.206 29.203 1.00 52.79 C ATOM 1141 CD LYS A 154 22.062 44.876 29.773 1.00 65.12 C ATOM 1142 CE LYS A 154 22.072 44.728 31.298 1.00 78.49 C ATOM 1143 NZ LYS A 154 22.940 43.616 31.783 1.00 80.06 N ATOM 1144 HZ1 LYS A 154 22.603 42.716 31.385 1.00 0.00 H ATOM 1145 HZ2 LYS A 154 23.920 43.786 31.480 1.00 0.00 H ATOM 1146 HZ3 LYS A 154 22.899 43.574 32.821 1.00 0.00 H ATOM 1147 H LYS A 154 23.375 47.529 25.916 1.00 0.00 H ATOM 1148 N TRP A 155 25.322 44.768 25.700 1.00 27.61 N ATOM 1149 CA TRP A 155 25.934 43.510 25.297 1.00 27.54 C ATOM 1150 C TRP A 155 27.069 43.715 24.302 1.00 26.95 C ATOM 1151 O TRP A 155 27.447 42.779 23.579 1.00 27.56 O ATOM 1152 CB TRP A 155 24.858 42.580 24.727 1.00 26.52 C ATOM 1153 CG TRP A 155 23.888 42.181 25.762 1.00 30.57 C ATOM 1154 CD1 TRP A 155 22.580 42.522 25.821 1.00 30.98 C ATOM 1155 CD2 TRP A 155 24.154 41.383 26.920 1.00 31.27 C ATOM 1156 NE1 TRP A 155 21.995 41.999 26.961 1.00 38.63 N ATOM 1157 CE2 TRP A 155 22.944 41.288 27.648 1.00 35.78 C ATOM 1158 CE3 TRP A 155 25.294 40.743 27.420 1.00 33.09 C ATOM 1159 CZ2 TRP A 155 22.844 40.569 28.835 1.00 51.64 C ATOM 1160 CZ3 TRP A 155 25.194 40.028 28.606 1.00 41.12 C ATOM 1161 CH2 TRP A 155 23.978 39.948 29.299 1.00 53.60 C ATOM 1162 HE1 TRP A 155 21.003 42.124 27.248 1.00 0.00 H ATOM 1163 H TRP A 155 24.741 45.290 25.014 1.00 0.00 H ATOM 1164 N ALA A 156 27.650 44.918 24.278 1.00 26.53 N ATOM 1165 CA ALA A 156 28.713 45.204 23.312 1.00 24.72 C ATOM 1166 C ALA A 156 29.893 44.274 23.492 1.00 25.89 C ATOM 1167 O ALA A 156 30.553 43.929 22.503 1.00 25.91 O ATOM 1168 CB ALA A 156 29.169 46.660 23.447 1.00 27.15 C ATOM 1169 H ALA A 156 27.346 45.654 24.947 1.00 0.00 H ATOM 1170 N ASP A 157 30.160 43.840 24.729 1.00 26.89 N ATOM 1171 CA ASP A 157 31.313 42.958 24.915 1.00 26.80 C ATOM 1172 C ASP A 157 31.104 41.562 24.338 1.00 28.50 C ATOM 1173 O ASP A 157 32.050 40.761 24.384 1.00 28.98 O ATOM 1174 CB ASP A 157 31.670 42.845 26.398 1.00 32.68 C ATOM 1175 CG ASP A 157 32.481 44.023 26.904 1.00 39.01 C ATOM 1176 OD1 ASP A 157 32.984 44.828 26.083 1.00 33.93 O ATOM 1177 OD2 ASP A 157 32.620 44.131 28.139 1.00 45.18 O ATOM 1178 H ASP A 157 29.566 44.121 25.535 1.00 0.00 H ATOM 1179 N GLN A 158 29.957 41.275 23.717 1.00 22.07 N ATOM 1180 CA GLN A 158 29.757 40.020 23.012 1.00 20.70 C ATOM 1181 C GLN A 158 30.351 40.054 21.611 1.00 20.82 C ATOM 1182 O GLN A 158 30.433 38.993 20.973 1.00 18.84 O ATOM 1183 CB GLN A 158 28.280 39.679 22.869 1.00 23.43 C ATOM 1184 CG GLN A 158 27.529 39.430 24.170 1.00 27.31 C ATOM 1185 CD GLN A 158 26.124 38.895 23.877 1.00 27.16 C ATOM 1186 OE1 GLN A 158 25.340 39.514 23.112 1.00 28.80 O ATOM 1187 NE2 GLN A 158 25.805 37.748 24.459 1.00 40.21 N ATOM 1188 HE22 GLN A 158 26.488 37.274 25.084 1.00 0.00 H ATOM 1189 HE21 GLN A 158 24.871 37.322 24.291 1.00 0.00 H ATOM 1190 H GLN A 158 29.184 41.970 23.739 1.00 0.00 H ATOM 1191 N VAL A 159 30.752 41.247 21.150 1.00 20.28 N ATOM 1192 CA VAL A 159 31.365 41.506 19.844 1.00 21.38 C ATOM 1193 C VAL A 159 30.752 40.583 18.792 1.00 19.40 C ATOM 1194 O VAL A 159 31.422 39.751 18.138 1.00 18.37 O ATOM 1195 CB VAL A 159 32.903 41.434 19.934 1.00 21.54 C ATOM 1196 CG1 VAL A 159 33.419 42.610 20.746 1.00 19.34 C ATOM 1197 CG2 VAL A 159 33.391 40.122 20.539 1.00 19.90 C ATOM 1198 H VAL A 159 30.615 42.065 21.777 1.00 0.00 H ATOM 1199 N GLU A 160 29.451 40.761 18.613 1.00 19.57 N ATOM 1200 CA GLU A 160 28.613 39.846 17.871 1.00 17.63 C ATOM 1201 C GLU A 160 28.643 40.139 16.377 1.00 20.27 C ATOM 1202 O GLU A 160 28.707 41.297 15.949 1.00 21.98 O ATOM 1203 CB GLU A 160 27.168 39.950 18.379 1.00 19.55 C ATOM 1204 CG GLU A 160 26.215 39.008 17.705 1.00 20.72 C ATOM 1205 CD GLU A 160 24.778 39.124 18.191 1.00 28.46 C ATOM 1206 OE1 GLU A 160 24.544 39.739 19.247 1.00 25.85 O ATOM 1207 OE2 GLU A 160 23.904 38.563 17.496 1.00 29.79 O ATOM 1208 H GLU A 160 29.009 41.605 19.029 1.00 0.00 H ATOM 1209 N VAL A 161 28.554 39.070 15.591 1.00 20.69 N ATOM 1210 CA VAL A 161 28.271 39.125 14.165 1.00 19.30 C ATOM 1211 C VAL A 161 27.001 38.303 13.954 1.00 20.77 C ATOM 1212 O VAL A 161 26.949 37.123 14.326 1.00 19.72 O ATOM 1213 CB VAL A 161 29.446 38.592 13.318 1.00 18.14 C ATOM 1214 CG1 VAL A 161 29.072 38.594 11.826 1.00 22.61 C ATOM 1215 CG2 VAL A 161 30.705 39.418 13.584 1.00 20.11 C ATOM 1216 H VAL A 161 28.696 38.135 16.023 1.00 0.00 H ATOM 1217 N ALA A 162 25.983 38.922 13.375 1.00 20.90 N ATOM 1218 CA ALA A 162 24.676 38.299 13.228 1.00 18.60 C ATOM 1219 C ALA A 162 24.482 37.886 11.776 1.00 22.35 C ATOM 1220 O ALA A 162 24.568 38.731 10.874 1.00 23.33 O ATOM 1221 CB ALA A 162 23.576 39.265 13.652 1.00 21.46 C ATOM 1222 H ALA A 162 26.123 39.887 13.013 1.00 0.00 H ATOM 1223 N PHE A 163 24.184 36.604 11.547 1.00 20.15 N ATOM 1224 CA PHE A 163 24.083 36.089 10.186 1.00 24.26 C ATOM 1225 C PHE A 163 22.617 35.990 9.778 1.00 23.13 C ATOM 1226 O PHE A 163 21.897 35.083 10.252 1.00 23.30 O ATOM 1227 CB PHE A 163 24.787 34.731 10.053 1.00 20.44 C ATOM 1228 CG PHE A 163 26.266 34.874 9.830 1.00 19.05 C ATOM 1229 CD1 PHE A 163 26.809 34.970 8.555 1.00 21.72 C ATOM 1230 CD2 PHE A 163 27.095 34.977 10.932 1.00 18.59 C ATOM 1231 CE1 PHE A 163 28.153 35.149 8.392 1.00 25.89 C ATOM 1232 CE2 PHE A 163 28.466 35.147 10.771 1.00 19.21 C ATOM 1233 CZ PHE A 163 28.996 35.227 9.512 1.00 22.03 C ATOM 1234 H PHE A 163 24.022 35.964 12.351 1.00 0.00 H ATOM 1235 N PRO A 164 22.110 36.896 8.936 1.00 23.32 N ATOM 1236 CA PRO A 164 20.713 36.786 8.490 1.00 23.31 C ATOM 1237 C PRO A 164 20.532 35.562 7.605 1.00 29.72 C ATOM 1238 O PRO A 164 21.269 35.354 6.639 1.00 28.49 O ATOM 1239 CB PRO A 164 20.463 38.092 7.725 1.00 26.40 C ATOM 1240 CG PRO A 164 21.679 38.945 7.937 1.00 27.85 C ATOM 1241 CD PRO A 164 22.818 37.991 8.247 1.00 26.38 C ATOM 1242 N GLY A 165 19.582 34.723 7.976 1.00 24.83 N ATOM 1243 CA GLY A 165 19.357 33.464 7.302 1.00 26.71 C ATOM 1244 C GLY A 165 20.267 32.345 7.771 1.00 24.65 C ATOM 1245 O GLY A 165 20.220 31.245 7.206 1.00 28.84 O ATOM 1246 H GLY A 165 18.975 34.977 8.781 1.00 0.00 H ATOM 1247 N GLY A 166 21.049 32.568 8.794 1.00 24.29 N ATOM 1248 CA GLY A 166 21.911 31.531 9.329 1.00 24.24 C ATOM 1249 C GLY A 166 23.137 31.273 8.477 1.00 25.38 C ATOM 1250 O GLY A 166 23.610 32.126 7.733 1.00 25.69 O ATOM 1251 H GLY A 166 21.053 33.510 9.235 1.00 0.00 H ATOM 1252 N ILE A 167 23.648 30.048 8.606 1.00 22.75 N ATOM 1253 CA ILE A 167 24.987 29.701 8.118 1.00 19.59 C ATOM 1254 C ILE A 167 24.967 28.268 7.612 1.00 25.53 C ATOM 1255 O ILE A 167 24.677 27.336 8.383 1.00 24.16 O ATOM 1256 CB ILE A 167 26.035 29.845 9.239 1.00 20.33 C ATOM 1257 CG1 ILE A 167 25.959 31.228 9.929 1.00 24.87 C ATOM 1258 CG2 ILE A 167 27.443 29.527 8.690 1.00 21.80 C ATOM 1259 CD1 ILE A 167 26.846 31.329 11.146 1.00 23.97 C ATOM 1260 H ILE A 167 23.077 29.313 9.069 1.00 0.00 H ATOM 1261 N ARG A 168 25.257 28.071 6.320 1.00 23.48 N ATOM 1262 CA ARG A 168 25.308 26.729 5.754 1.00 24.37 C ATOM 1263 C ARG A 168 26.441 25.914 6.378 1.00 26.11 C ATOM 1264 O ARG A 168 27.464 26.450 6.826 1.00 24.32 O ATOM 1265 CB ARG A 168 25.503 26.795 4.236 1.00 31.04 C ATOM 1266 CG ARG A 168 24.304 27.353 3.506 1.00 30.66 C ATOM 1267 CD ARG A 168 24.299 26.961 2.048 1.00 40.18 C ATOM 1268 NE ARG A 168 25.394 27.591 1.327 1.00 40.67 N ATOM 1269 CZ ARG A 168 25.393 28.855 0.914 1.00 60.36 C ATOM 1270 NH1 ARG A 168 24.349 29.643 1.162 1.00 57.13 N ATOM 1271 NH2 ARG A 168 26.443 29.334 0.256 1.00 74.50 N ATOM 1272 HE ARG A 168 26.234 27.014 1.121 1.00 0.00 H ATOM 1273 HH12 ARG A 168 24.354 30.631 0.836 1.00 0.00 H ATOM 1274 HH11 ARG A 168 23.528 29.271 1.681 1.00 0.00 H ATOM 1275 HH22 ARG A 168 26.447 30.322 -0.069 1.00 0.00 H ATOM 1276 HH21 ARG A 168 27.261 28.721 0.066 1.00 0.00 H ATOM 1277 H ARG A 168 25.449 28.890 5.709 1.00 0.00 H ATOM 1278 N THR A 169 26.263 24.592 6.371 1.00 26.60 N ATOM 1279 CA THR A 169 27.232 23.723 7.027 1.00 25.96 C ATOM 1280 C THR A 169 28.623 23.833 6.400 1.00 26.20 C ATOM 1281 O THR A 169 29.618 23.666 7.116 1.00 24.87 O ATOM 1282 CB THR A 169 26.753 22.273 7.005 1.00 27.20 C ATOM 1283 OG1 THR A 169 27.709 21.441 7.672 1.00 26.57 O ATOM 1284 CG2 THR A 169 26.560 21.777 5.587 1.00 28.39 C ATOM 1285 HG1 THR A 169 27.396 20.502 7.656 1.00 0.00 H ATOM 1286 H THR A 169 25.433 24.181 5.898 1.00 0.00 H ATOM 1287 N GLU A 170 28.705 24.170 5.108 1.00 25.15 N ATOM 1288 CA GLU A 170 30.013 24.287 4.449 1.00 26.19 C ATOM 1289 C GLU A 170 30.874 25.394 5.073 1.00 26.93 C ATOM 1290 O GLU A 170 32.080 25.459 4.767 1.00 26.57 O ATOM 1291 CB GLU A 170 29.840 24.549 2.943 1.00 29.84 C ATOM 1292 CG GLU A 170 29.329 25.928 2.615 1.00 45.67 C ATOM 1293 CD GLU A 170 28.702 26.016 1.242 1.00 60.17 C ATOM 1294 OE1 GLU A 170 29.417 26.387 0.281 1.00 61.27 O ATOM 1295 OE2 GLU A 170 27.494 25.711 1.130 1.00 51.20 O ATOM 1296 H GLU A 170 27.836 24.351 4.566 1.00 0.00 H ATOM 1297 N PHE A 171 30.291 26.294 5.856 1.00 24.26 N ATOM 1298 CA PHE A 171 31.034 27.375 6.514 1.00 20.73 C ATOM 1299 C PHE A 171 31.293 27.112 7.979 1.00 24.57 C ATOM 1300 O PHE A 171 31.847 27.977 8.664 1.00 22.48 O ATOM 1301 CB PHE A 171 30.322 28.724 6.337 1.00 23.36 C ATOM 1302 CG PHE A 171 30.047 29.058 4.914 1.00 22.12 C ATOM 1303 CD1 PHE A 171 31.090 29.373 4.031 1.00 23.02 C ATOM 1304 CD2 PHE A 171 28.762 29.012 4.408 1.00 32.58 C ATOM 1305 CE1 PHE A 171 30.856 29.650 2.706 1.00 33.40 C ATOM 1306 CE2 PHE A 171 28.524 29.303 3.071 1.00 30.59 C ATOM 1307 CZ PHE A 171 29.572 29.623 2.218 1.00 33.06 C ATOM 1308 H PHE A 171 29.264 26.230 6.009 1.00 0.00 H ATOM 1309 N VAL A 172 30.909 25.946 8.490 1.00 25.84 N ATOM 1310 CA VAL A 172 31.178 25.575 9.866 1.00 21.78 C ATOM 1311 C VAL A 172 32.421 24.692 9.857 1.00 20.10 C ATOM 1312 O VAL A 172 32.411 23.571 9.332 1.00 21.87 O ATOM 1313 CB VAL A 172 29.978 24.866 10.511 1.00 21.81 C ATOM 1314 CG1 VAL A 172 30.327 24.457 11.956 1.00 22.92 C ATOM 1315 CG2 VAL A 172 28.734 25.785 10.489 1.00 24.34 C ATOM 1316 H VAL A 172 30.397 25.276 7.881 1.00 0.00 H ATOM 1317 N ILE A 173 33.497 25.196 10.465 1.00 21.53 N ATOM 1318 CA ILE A 173 34.766 24.466 10.462 1.00 22.67 C ATOM 1319 C ILE A 173 34.663 23.191 11.293 1.00 22.31 C ATOM 1320 O ILE A 173 35.148 22.122 10.889 1.00 21.39 O ATOM 1321 CB ILE A 173 35.892 25.352 11.016 1.00 19.98 C ATOM 1322 CG1 ILE A 173 36.018 26.669 10.261 1.00 22.53 C ATOM 1323 CG2 ILE A 173 37.204 24.592 10.961 1.00 20.73 C ATOM 1324 CD1 ILE A 173 36.817 27.677 11.037 1.00 20.98 C ATOM 1325 H ILE A 173 33.433 26.116 10.946 1.00 0.00 H ATOM 1326 N GLY A 174 34.095 23.299 12.491 1.00 20.65 N ATOM 1327 CA GLY A 174 34.210 22.234 13.474 1.00 22.38 C ATOM 1328 C GLY A 174 33.738 22.740 14.817 1.00 20.69 C ATOM 1329 O GLY A 174 33.103 23.783 14.892 1.00 21.59 O ATOM 1330 H GLY A 174 33.560 24.159 12.728 1.00 0.00 H ATOM 1331 N VAL A 175 34.074 21.996 15.868 1.00 20.25 N ATOM 1332 CA VAL A 175 33.518 22.274 17.189 1.00 19.13 C ATOM 1333 C VAL A 175 34.446 21.704 18.237 1.00 20.29 C ATOM 1334 O VAL A 175 35.130 20.698 18.007 1.00 21.31 O ATOM 1335 CB VAL A 175 32.091 21.679 17.297 1.00 18.82 C ATOM 1336 CG1 VAL A 175 32.124 20.152 17.317 1.00 23.58 C ATOM 1337 CG2 VAL A 175 31.379 22.158 18.548 1.00 22.99 C ATOM 1338 H VAL A 175 34.741 21.207 15.747 1.00 0.00 H ATOM 1339 N CYS A 176 34.475 22.351 19.401 1.00 21.18 N ATOM 1340 CA CYS A 176 35.065 21.773 20.586 1.00 18.49 C ATOM 1341 C CYS A 176 34.010 21.713 21.682 1.00 19.35 C ATOM 1342 O CYS A 176 33.365 22.739 21.955 1.00 20.33 O ATOM 1343 CB CYS A 176 36.250 22.593 21.092 1.00 18.39 C ATOM 1344 SG CYS A 176 37.661 22.631 19.912 1.00 21.03 S ATOM 1345 H CYS A 176 34.060 23.303 19.458 1.00 0.00 H ATOM 1346 N PRO A 177 33.832 20.567 22.328 1.00 19.98 N ATOM 1347 CA PRO A 177 32.952 20.492 23.513 1.00 20.49 C ATOM 1348 C PRO A 177 33.553 21.268 24.669 1.00 25.96 C ATOM 1349 O PRO A 177 34.775 21.417 24.780 1.00 23.94 O ATOM 1350 CB PRO A 177 32.909 18.998 23.830 1.00 27.98 C ATOM 1351 CG PRO A 177 33.500 18.297 22.681 1.00 31.46 C ATOM 1352 CD PRO A 177 34.438 19.258 22.021 1.00 24.71 C ATOM 1353 N VAL A 178 32.681 21.739 25.549 1.00 25.75 N ATOM 1354 CA VAL A 178 33.063 22.581 26.675 1.00 25.57 C ATOM 1355 C VAL A 178 32.839 21.830 27.977 1.00 26.27 C ATOM 1356 O VAL A 178 31.739 21.315 28.217 1.00 31.23 O ATOM 1357 CB VAL A 178 32.270 23.898 26.663 1.00 24.35 C ATOM 1358 CG1 VAL A 178 32.519 24.702 27.959 1.00 25.68 C ATOM 1359 CG2 VAL A 178 32.627 24.710 25.441 1.00 29.19 C ATOM 1360 H VAL A 178 31.677 21.496 25.430 1.00 0.00 H ATOM 1361 N ASP A 179 33.871 21.789 28.818 1.00 28.97 N ATOM 1362 CA ASP A 179 33.727 21.243 30.162 1.00 31.96 C ATOM 1363 C ASP A 179 33.031 22.269 31.048 1.00 30.41 C ATOM 1364 O ASP A 179 33.577 23.348 31.306 1.00 29.29 O ATOM 1365 CB ASP A 179 35.068 20.874 30.779 1.00 35.14 C ATOM 1366 CG ASP A 179 34.895 20.320 32.188 1.00 43.50 C ATOM 1367 OD1 ASP A 179 33.932 19.555 32.393 1.00 42.46 O ATOM 1368 OD2 ASP A 179 35.659 20.698 33.098 1.00 47.70 O ATOM 1369 H ASP A 179 34.796 22.153 28.511 1.00 0.00 H ATOM 1370 N LYS A 180 31.845 21.920 31.517 1.00 38.63 N ATOM 1371 CA LYS A 180 31.008 22.869 32.243 1.00 46.83 C ATOM 1372 C LYS A 180 31.681 23.396 33.510 1.00 39.64 C ATOM 1373 O LYS A 180 31.620 24.601 33.789 1.00 41.97 O ATOM 1374 CB LYS A 180 29.675 22.212 32.570 1.00 61.52 C ATOM 1375 CG LYS A 180 28.664 23.186 33.116 1.00 78.14 C ATOM 1376 CD LYS A 180 27.354 22.511 33.438 1.00 92.24 C ATOM 1377 CE LYS A 180 26.372 23.513 33.991 1.00109.27 C ATOM 1378 NZ LYS A 180 25.055 22.889 34.291 1.00123.58 N ATOM 1379 HZ1 LYS A 180 24.656 22.488 33.418 1.00 0.00 H ATOM 1380 HZ2 LYS A 180 25.183 22.134 34.995 1.00 0.00 H ATOM 1381 HZ3 LYS A 180 24.409 23.611 34.669 1.00 0.00 H ATOM 1382 H LYS A 180 31.502 20.950 31.365 1.00 0.00 H ATOM 1383 N LYS A 181 32.332 22.532 34.293 1.00 36.73 N ATOM 1384 CA LYS A 181 32.751 22.965 35.626 1.00 44.77 C ATOM 1385 C LYS A 181 33.927 23.938 35.586 1.00 38.70 C ATOM 1386 O LYS A 181 34.029 24.809 36.456 1.00 41.27 O ATOM 1387 CB LYS A 181 33.080 21.753 36.503 1.00 57.73 C ATOM 1388 CG LYS A 181 31.865 21.228 37.267 1.00 75.13 C ATOM 1389 CD LYS A 181 32.257 20.410 38.488 1.00 84.43 C ATOM 1390 CE LYS A 181 31.044 20.078 39.344 1.00 92.33 C ATOM 1391 NZ LYS A 181 29.979 19.380 38.573 1.00 92.24 N ATOM 1392 HZ1 LYS A 181 29.664 19.988 37.791 1.00 0.00 H ATOM 1393 HZ2 LYS A 181 30.356 18.489 38.191 1.00 0.00 H ATOM 1394 HZ3 LYS A 181 29.175 19.176 39.201 1.00 0.00 H ATOM 1395 H LYS A 181 32.538 21.568 33.961 1.00 0.00 H ATOM 1396 N THR A 182 34.802 23.825 34.580 1.00 33.47 N ATOM 1397 CA THR A 182 35.956 24.708 34.422 1.00 32.13 C ATOM 1398 C THR A 182 35.789 25.736 33.312 1.00 30.91 C ATOM 1399 O THR A 182 36.632 26.641 33.197 1.00 30.52 O ATOM 1400 CB THR A 182 37.231 23.897 34.130 1.00 37.30 C ATOM 1401 OG1 THR A 182 37.048 23.103 32.945 1.00 33.33 O ATOM 1402 CG2 THR A 182 37.597 23.013 35.306 1.00 39.01 C ATOM 1403 HG1 THR A 182 36.289 22.481 33.080 1.00 0.00 H ATOM 1404 H THR A 182 34.654 23.073 33.877 1.00 0.00 H ATOM 1405 N ARG A 183 34.740 25.623 32.498 1.00 29.84 N ATOM 1406 CA ARG A 183 34.502 26.530 31.370 1.00 28.54 C ATOM 1407 C ARG A 183 35.707 26.528 30.437 1.00 25.88 C ATOM 1408 O ARG A 183 36.209 27.575 30.046 1.00 25.36 O ATOM 1409 CB ARG A 183 34.173 27.951 31.850 1.00 32.03 C ATOM 1410 CG ARG A 183 32.911 28.040 32.752 1.00 36.57 C ATOM 1411 CD ARG A 183 32.810 29.379 33.474 1.00 40.52 C ATOM 1412 NE ARG A 183 34.016 29.679 34.249 1.00 43.12 N ATOM 1413 CZ ARG A 183 34.312 29.150 35.433 1.00 47.65 C ATOM 1414 NH1 ARG A 183 33.471 28.298 36.023 1.00 47.97 N ATOM 1415 NH2 ARG A 183 35.452 29.484 36.036 1.00 49.86 N ATOM 1416 HE ARG A 183 34.692 30.357 33.843 1.00 0.00 H ATOM 1417 HH12 ARG A 183 33.710 27.889 36.949 1.00 0.00 H ATOM 1418 HH11 ARG A 183 32.577 28.043 35.557 1.00 0.00 H ATOM 1419 HH22 ARG A 183 35.690 29.074 36.962 1.00 0.00 H ATOM 1420 HH21 ARG A 183 36.104 30.154 35.581 1.00 0.00 H ATOM 1421 H ARG A 183 34.059 24.856 32.670 1.00 0.00 H ATOM 1422 N THR A 184 36.149 25.333 30.086 1.00 24.72 N ATOM 1423 CA THR A 184 37.275 25.142 29.174 1.00 22.91 C ATOM 1424 C THR A 184 36.873 24.224 28.031 1.00 25.69 C ATOM 1425 O THR A 184 35.940 23.440 28.137 1.00 28.63 O ATOM 1426 CB THR A 184 38.476 24.547 29.919 1.00 25.71 C ATOM 1427 OG1 THR A 184 38.111 23.297 30.498 1.00 27.21 O ATOM 1428 CG2 THR A 184 39.000 25.519 30.968 1.00 26.33 C ATOM 1429 HG1 THR A 184 37.365 23.435 31.134 1.00 0.00 H ATOM 1430 H THR A 184 35.675 24.493 30.475 1.00 0.00 H ATOM 1431 N GLU A 185 37.611 24.298 26.930 1.00 21.02 N ATOM 1432 CA GLU A 185 37.376 23.387 25.815 1.00 22.44 C ATOM 1433 C GLU A 185 38.058 22.049 26.068 1.00 26.61 C ATOM 1434 O GLU A 185 39.173 22.002 26.602 1.00 25.49 O ATOM 1435 CB GLU A 185 37.903 23.974 24.504 1.00 18.10 C ATOM 1436 CG GLU A 185 37.110 25.153 24.026 1.00 18.64 C ATOM 1437 CD GLU A 185 37.655 25.790 22.755 1.00 20.17 C ATOM 1438 OE1 GLU A 185 38.815 26.268 22.791 1.00 21.31 O ATOM 1439 OE2 GLU A 185 36.900 25.905 21.755 1.00 21.58 O ATOM 1440 H GLU A 185 38.364 25.012 26.862 1.00 0.00 H ATOM 1441 N LYS A 186 37.364 20.960 25.719 1.00 23.27 N ATOM 1442 CA LYS A 186 37.918 19.611 25.807 1.00 23.20 C ATOM 1443 C LYS A 186 38.618 19.350 24.476 1.00 27.90 C ATOM 1444 O LYS A 186 38.033 18.843 23.517 1.00 24.80 O ATOM 1445 CB LYS A 186 36.845 18.578 26.109 1.00 25.80 C ATOM 1446 CG LYS A 186 36.200 18.807 27.451 1.00 33.95 C ATOM 1447 CD LYS A 186 35.400 17.608 27.897 1.00 40.70 C ATOM 1448 CE LYS A 186 33.942 17.776 27.583 1.00 47.87 C ATOM 1449 NZ LYS A 186 33.107 16.825 28.379 1.00 53.27 N ATOM 1450 HZ1 LYS A 186 33.386 15.849 28.154 1.00 0.00 H ATOM 1451 HZ2 LYS A 186 33.252 17.003 29.393 1.00 0.00 H ATOM 1452 HZ3 LYS A 186 32.104 16.964 28.141 1.00 0.00 H ATOM 1453 H LYS A 186 36.391 21.078 25.371 1.00 0.00 H ATOM 1454 N MET A 187 39.876 19.762 24.393 1.00 23.99 N ATOM 1455 CA MET A 187 40.472 19.897 23.075 1.00 21.98 C ATOM 1456 C MET A 187 40.766 18.565 22.394 1.00 26.15 C ATOM 1457 O MET A 187 40.814 18.523 21.158 1.00 25.31 O ATOM 1458 CB MET A 187 41.729 20.761 23.172 1.00 24.12 C ATOM 1459 CG MET A 187 41.393 22.230 23.491 1.00 24.96 C ATOM 1460 SD MET A 187 42.677 23.385 23.036 1.00 25.42 S ATOM 1461 CE MET A 187 42.547 23.332 21.229 1.00 33.93 C ATOM 1462 H MET A 187 40.422 19.983 25.250 1.00 0.00 H ATOM 1463 N SER A 188 40.952 17.468 23.140 1.00 24.47 N ATOM 1464 CA SER A 188 41.083 16.170 22.504 1.00 25.68 C ATOM 1465 C SER A 188 39.759 15.642 21.967 1.00 29.23 C ATOM 1466 O SER A 188 39.745 14.587 21.326 1.00 30.27 O ATOM 1467 CB SER A 188 41.669 15.168 23.487 1.00 28.74 C ATOM 1468 OG SER A 188 42.979 15.520 23.891 1.00 29.58 O ATOM 1469 HG SER A 188 43.320 14.843 24.528 1.00 0.00 H ATOM 1470 H SER A 188 41.003 17.547 24.176 1.00 0.00 H ATOM 1471 N GLU A 189 38.654 16.344 22.217 1.00 26.42 N ATOM 1472 CA GLU A 189 37.343 15.941 21.728 1.00 24.22 C ATOM 1473 C GLU A 189 36.799 16.907 20.680 1.00 22.88 C ATOM 1474 O GLU A 189 35.626 16.764 20.294 1.00 27.34 O ATOM 1475 CB GLU A 189 36.343 15.807 22.891 1.00 26.98 C ATOM 1476 CG GLU A 189 36.779 14.782 23.914 1.00 28.78 C ATOM 1477 CD GLU A 189 35.810 14.663 25.096 1.00 41.07 C ATOM 1478 OE1 GLU A 189 34.583 14.822 24.896 1.00 40.65 O ATOM 1479 OE2 GLU A 189 36.292 14.420 26.219 1.00 43.17 O ATOM 1480 H GLU A 189 38.731 17.213 22.783 1.00 0.00 H ATOM 1481 N CYS A 190 37.614 17.870 20.198 1.00 20.46 N ATOM 1482 CA CYS A 190 37.181 18.698 19.080 1.00 18.60 C ATOM 1483 C CYS A 190 36.995 17.808 17.862 1.00 23.27 C ATOM 1484 O CYS A 190 37.629 16.749 17.734 1.00 26.05 O ATOM 1485 CB CYS A 190 38.184 19.818 18.777 1.00 21.51 C ATOM 1486 SG CYS A 190 38.660 20.869 20.160 1.00 21.19 S ATOM 1487 H CYS A 190 38.550 18.021 20.625 1.00 0.00 H ATOM 1488 N VAL A 191 36.049 18.175 17.009 1.00 24.84 N ATOM 1489 CA VAL A 191 35.804 17.412 15.782 1.00 25.08 C ATOM 1490 C VAL A 191 35.666 18.381 14.617 1.00 24.99 C ATOM 1491 O VAL A 191 35.023 19.430 14.733 1.00 24.34 O ATOM 1492 CB VAL A 191 34.553 16.505 15.892 1.00 31.55 C ATOM 1493 CG1 VAL A 191 34.629 15.609 17.145 1.00 39.02 C ATOM 1494 CG2 VAL A 191 33.291 17.302 15.924 1.00 39.35 C ATOM 1495 H VAL A 191 35.473 19.016 17.213 1.00 0.00 H ATOM 1496 N GLY A 192 36.288 18.041 13.486 1.00 25.12 N ATOM 1497 CA GLY A 192 36.072 18.807 12.291 1.00 25.37 C ATOM 1498 C GLY A 192 34.799 18.400 11.569 1.00 26.90 C ATOM 1499 O GLY A 192 34.377 17.238 11.586 1.00 26.47 O ATOM 1500 H GLY A 192 36.929 17.222 13.470 1.00 0.00 H ATOM 1501 N ASN A 193 34.182 19.397 10.931 1.00 24.26 N ATOM 1502 CA ASN A 193 32.983 19.181 10.141 1.00 27.74 C ATOM 1503 C ASN A 193 33.369 18.608 8.785 1.00 21.93 C ATOM 1504 O ASN A 193 34.096 19.268 8.029 1.00 27.11 O ATOM 1505 CB ASN A 193 32.244 20.502 9.973 1.00 25.08 C ATOM 1506 CG ASN A 193 31.047 20.399 9.063 1.00 22.51 C ATOM 1507 OD1 ASN A 193 30.563 19.310 8.729 1.00 25.95 O ATOM 1508 ND2 ASN A 193 30.508 21.564 8.692 1.00 24.93 N ATOM 1509 HD22 ASN A 193 30.945 22.458 8.993 1.00 0.00 H ATOM 1510 HD21 ASN A 193 29.652 21.576 8.102 1.00 0.00 H ATOM 1511 H ASN A 193 34.572 20.358 11.002 1.00 0.00 H ATOM 1512 N PRO A 194 32.938 17.396 8.433 1.00 24.09 N ATOM 1513 CA PRO A 194 33.324 16.857 7.112 1.00 27.93 C ATOM 1514 C PRO A 194 32.813 17.687 5.952 1.00 33.33 C ATOM 1515 O PRO A 194 33.348 17.578 4.837 1.00 33.66 O ATOM 1516 CB PRO A 194 32.727 15.446 7.106 1.00 34.49 C ATOM 1517 CG PRO A 194 31.657 15.460 8.145 1.00 35.74 C ATOM 1518 CD PRO A 194 32.112 16.446 9.193 1.00 27.44 C ATOM 1519 N HIS A 195 31.817 18.527 6.170 1.00 28.65 N ATOM 1520 CA HIS A 195 31.233 19.341 5.116 1.00 28.47 C ATOM 1521 C HIS A 195 31.907 20.697 4.959 1.00 25.54 C ATOM 1522 O HIS A 195 31.561 21.430 4.024 1.00 26.99 O ATOM 1523 CB HIS A 195 29.736 19.533 5.380 1.00 32.16 C ATOM 1524 CG HIS A 195 28.956 18.265 5.312 1.00 38.07 C ATOM 1525 ND1 HIS A 195 28.359 17.684 6.412 1.00 39.97 N ATOM 1526 CD2 HIS A 195 28.685 17.455 4.263 1.00 38.60 C ATOM 1527 CE1 HIS A 195 27.749 16.574 6.039 1.00 36.53 C ATOM 1528 NE2 HIS A 195 27.932 16.411 4.742 1.00 57.91 N ATOM 1529 H HIS A 195 31.435 18.609 7.134 1.00 0.00 H ATOM 1530 N TYR A 196 32.874 21.037 5.818 1.00 23.71 N ATOM 1531 CA TYR A 196 33.560 22.322 5.716 1.00 23.91 C ATOM 1532 C TYR A 196 34.270 22.430 4.375 1.00 25.61 C ATOM 1533 O TYR A 196 34.982 21.504 3.952 1.00 28.22 O ATOM 1534 CB TYR A 196 34.567 22.484 6.850 1.00 25.75 C ATOM 1535 CG TYR A 196 35.442 23.719 6.765 1.00 22.84 C ATOM 1536 CD1 TYR A 196 34.915 24.989 6.524 1.00 22.32 C ATOM 1537 CD2 TYR A 196 36.820 23.612 6.944 1.00 27.00 C ATOM 1538 CE1 TYR A 196 35.772 26.125 6.461 1.00 23.20 C ATOM 1539 CE2 TYR A 196 37.647 24.730 6.895 1.00 25.18 C ATOM 1540 CZ TYR A 196 37.115 25.972 6.659 1.00 23.38 C ATOM 1541 OH TYR A 196 37.997 27.057 6.609 1.00 25.89 O ATOM 1542 HH TYR A 196 37.487 27.887 6.433 1.00 0.00 H ATOM 1543 H TYR A 196 33.142 20.374 6.573 1.00 0.00 H ATOM 1544 N GLU A 197 34.046 23.552 3.689 1.00 26.27 N ATOM 1545 CA GLU A 197 34.694 23.831 2.409 1.00 25.11 C ATOM 1546 C GLU A 197 35.488 25.125 2.489 1.00 31.44 C ATOM 1547 O GLU A 197 34.919 26.225 2.363 1.00 26.52 O ATOM 1548 CB GLU A 197 33.667 23.889 1.279 1.00 31.74 C ATOM 1549 CG GLU A 197 32.977 22.543 1.070 1.00 38.20 C ATOM 1550 CD GLU A 197 32.050 22.518 -0.120 1.00 60.33 C ATOM 1551 OE1 GLU A 197 32.014 23.510 -0.878 1.00 64.10 O ATOM 1552 OE2 GLU A 197 31.357 21.495 -0.300 1.00 73.06 O ATOM 1553 H GLU A 197 33.386 24.254 4.080 1.00 0.00 H ATOM 1554 N PRO A 198 36.806 25.047 2.679 1.00 30.06 N ATOM 1555 CA PRO A 198 37.633 26.255 2.636 1.00 31.17 C ATOM 1556 C PRO A 198 37.375 27.051 1.366 1.00 27.28 C ATOM 1557 O PRO A 198 37.269 26.499 0.263 1.00 34.01 O ATOM 1558 CB PRO A 198 39.064 25.702 2.655 1.00 39.57 C ATOM 1559 CG PRO A 198 38.966 24.385 3.292 1.00 37.08 C ATOM 1560 CD PRO A 198 37.605 23.839 2.931 1.00 30.69 C ATOM 1561 N TRP A 199 37.375 28.374 1.514 1.00 32.23 N ATOM 1562 CA TRP A 199 37.096 29.276 0.412 1.00 32.64 C ATOM 1563 C TRP A 199 38.068 30.452 0.351 1.00 28.80 C ATOM 1564 O TRP A 199 37.915 31.324 -0.510 1.00 31.90 O ATOM 1565 CB TRP A 199 35.645 29.784 0.506 1.00 28.53 C ATOM 1566 CG TRP A 199 35.295 30.400 1.861 1.00 27.95 C ATOM 1567 CD1 TRP A 199 34.923 29.733 3.020 1.00 27.97 C ATOM 1568 CD2 TRP A 199 35.269 31.796 2.185 1.00 25.94 C ATOM 1569 NE1 TRP A 199 34.687 30.638 4.023 1.00 24.85 N ATOM 1570 CE2 TRP A 199 34.860 31.908 3.540 1.00 25.71 C ATOM 1571 CE3 TRP A 199 35.517 32.966 1.462 1.00 33.03 C ATOM 1572 CZ2 TRP A 199 34.793 33.125 4.190 1.00 26.58 C ATOM 1573 CZ3 TRP A 199 35.407 34.185 2.109 1.00 31.77 C ATOM 1574 CH2 TRP A 199 35.036 34.254 3.456 1.00 30.85 C ATOM 1575 HE1 TRP A 199 34.418 30.397 4.999 1.00 0.00 H ATOM 1576 H TRP A 199 37.582 28.775 2.451 1.00 0.00 H ATOM 1577 N HIS A 200 39.044 30.513 1.244 1.00 30.48 N ATOM 1578 CA HIS A 200 40.110 31.507 1.128 1.00 32.14 C ATOM 1579 C HIS A 200 41.319 31.046 1.939 1.00 28.65 C ATOM 1580 O HIS A 200 41.277 30.052 2.673 1.00 40.17 O ATOM 1581 CB HIS A 200 39.634 32.872 1.632 1.00 32.80 C ATOM 1582 CG HIS A 200 39.299 32.862 3.085 1.00 25.98 C ATOM 1583 ND1 HIS A 200 40.160 33.319 4.061 1.00 32.26 N ATOM 1584 CD2 HIS A 200 38.214 32.372 3.732 1.00 31.30 C ATOM 1585 CE1 HIS A 200 39.592 33.152 5.247 1.00 34.45 C ATOM 1586 NE2 HIS A 200 38.429 32.554 5.073 1.00 25.02 N ATOM 1587 OXT HIS A 200 42.363 31.698 1.877 1.00 34.80 O ATOM 1588 H HIS A 200 39.052 29.844 2.040 1.00 0.00 H TER 1589 HIS A 200 HETATM 1590 O HOH 1 8.882 40.492 11.376 1.00 53.05 O HETATM 1591 O HOH 2 17.238 37.085 20.640 1.00 47.56 O HETATM 1592 O HOH 3 27.897 27.967 -0.926 1.00 59.15 O HETATM 1593 O HOH 4 31.596 27.087 35.369 1.00 36.78 O HETATM 1594 O HOH 5 32.524 15.625 26.442 1.00 39.51 O HETATM 1595 O HOH 6 33.220 14.222 22.985 1.00 40.76 O HETATM 1596 O HOH 7 20.700 24.048 12.706 1.00 33.97 O HETATM 1597 O HOH 8 26.859 23.878 2.799 1.00 31.88 O HETATM 1598 O HOH 9 15.271 28.654 8.862 1.00 42.59 O HETATM 1599 O HOH 10 34.483 39.939 24.476 1.00 37.55 O HETATM 1600 O HOH 11 40.999 23.088 28.104 1.00 27.30 O HETATM 1601 O HOH 12 49.689 40.953 2.657 1.00 49.32 O HETATM 1602 O HOH 13 38.714 29.176 4.005 1.00 27.10 O HETATM 1603 O HOH 14 40.892 26.065 24.388 1.00 22.53 O HETATM 1604 O HOH 15 39.240 36.367 24.060 1.00 44.29 O HETATM 1605 O HOH 16 17.917 32.349 15.362 1.00 25.86 O HETATM 1606 O HOH 17 33.672 15.002 20.519 1.00 40.99 O HETATM 1607 O HOH 18 37.916 14.162 18.237 1.00 35.07 O HETATM 1608 O HOH 19 30.063 20.762 1.920 1.00 40.31 O HETATM 1609 O HOH 20 39.928 32.730 8.471 1.00 25.54 O HETATM 1610 O HOH 21 36.731 19.504 7.625 1.00 34.61 O HETATM 1611 O HOH 22 44.131 13.088 23.835 1.00 42.62 O HETATM 1612 O HOH 23 11.873 45.499 9.516 1.00 38.05 O HETATM 1613 O HOH 24 37.358 21.300 9.569 1.00 25.57 O HETATM 1614 O HOH 25 19.792 22.936 6.433 1.00 38.04 O HETATM 1615 O HOH 26 26.305 42.336 -9.475 1.00 35.69 O HETATM 1616 O HOH 27 20.502 26.712 20.589 1.00 44.05 O HETATM 1617 O HOH 28 21.266 33.186 17.428 1.00 23.97 O HETATM 1618 O HOH 29 30.665 27.845 29.632 1.00 43.98 O HETATM 1619 O HOH 30 35.349 42.890 10.917 1.00 26.21 O HETATM 1620 O HOH 31 11.063 46.048 19.214 1.00 30.53 O HETATM 1621 O HOH 32 33.826 44.984 15.129 1.00 29.75 O HETATM 1622 O HOH 33 40.309 14.028 18.704 1.00 27.86 O HETATM 1623 O HOH 34 27.263 35.737 3.627 1.00 27.45 O HETATM 1624 O HOH 35 20.829 28.661 15.055 1.00 27.77 O HETATM 1625 O HOH 36 36.359 24.212 -0.951 1.00 37.08 O HETATM 1626 O HOH 37 30.194 43.526 16.703 1.00 21.52 O HETATM 1627 O HOH 38 30.618 46.828 5.119 1.00 38.97 O HETATM 1628 O HOH 39 19.207 38.023 22.977 1.00 56.14 O HETATM 1629 O HOH 40 23.956 34.821 6.358 1.00 24.94 O HETATM 1630 O HOH 41 38.884 14.984 26.967 1.00 45.84 O HETATM 1631 O HOH 42 22.434 38.588 20.597 1.00 28.86 O HETATM 1632 O HOH 43 33.288 38.754 5.066 1.00 32.22 O HETATM 1633 O HOH 44 21.747 48.206 26.031 1.00 36.25 O HETATM 1634 O HOH 45 39.348 34.278 15.245 1.00 21.55 O HETATM 1635 O HOH 46 41.750 35.780 2.288 1.00 47.55 O HETATM 1636 O HOH 47 32.914 31.537 21.923 1.00 18.04 O HETATM 1637 O HOH 48 10.032 37.577 17.371 1.00 37.59 O HETATM 1638 O HOH 49 38.248 37.599 15.926 1.00 34.38 O HETATM 1639 O HOH 50 35.347 33.674 8.259 1.00 24.36 O HETATM 1640 O HOH 51 40.231 21.487 30.620 1.00 46.27 O HETATM 1641 O HOH 52 30.777 19.357 31.234 1.00 39.56 O HETATM 1642 O HOH 53 37.021 19.921 5.014 1.00 33.74 O HETATM 1643 O HOH 54 29.904 52.044 12.371 1.00 46.74 O HETATM 1644 O HOH 55 34.460 44.280 8.815 1.00 32.00 O HETATM 1645 O HOH 56 34.263 19.176 2.566 1.00 41.35 O HETATM 1646 O HOH 57 34.736 35.054 28.138 1.00 33.89 O HETATM 1647 O HOH 58 36.396 38.127 10.856 1.00 20.24 O HETATM 1648 O HOH 59 8.692 39.339 15.681 1.00 43.49 O HETATM 1649 O HOH 60 25.613 41.617 21.040 1.00 26.60 O HETATM 1650 O HOH 61 38.846 30.357 9.484 1.00 20.11 O HETATM 1651 O HOH 62 32.522 46.173 8.656 1.00 47.29 O HETATM 1652 O HOH 63 28.043 42.742 20.175 1.00 22.22 O HETATM 1653 O HOH 64 39.897 28.595 25.466 1.00 26.22 O HETATM 1654 O HOH 65 30.207 32.281 22.377 1.00 20.07 O HETATM 1655 O HOH 66 39.794 27.905 8.612 1.00 19.83 O HETATM 1656 O HOH 67 19.410 52.870 9.608 1.00 55.39 O HETATM 1657 O HOH 68 27.897 40.280 3.499 1.00 46.77 O HETATM 1658 O HOH 69 21.225 26.423 16.647 1.00 25.22 O HETATM 1659 O HOH 70 26.015 14.670 11.185 1.00 42.45 O HETATM 1660 O HOH 71 42.526 34.855 3.799 1.00 43.55 O HETATM 1661 O HOH 72 15.592 49.501 18.173 1.00 33.23 O HETATM 1662 O HOH 73 16.349 34.055 19.511 1.00 51.67 O HETATM 1663 O HOH 74 25.449 37.381 5.977 1.00 30.80 O HETATM 1664 O HOH 75 37.823 29.203 32.256 1.00 41.96 O HETATM 1665 O HOH 76 33.178 46.317 19.164 1.00 30.39 O HETATM 1666 O HOH 77 24.805 20.884 25.131 1.00 37.76 O HETATM 1667 O HOH 78 10.926 44.810 13.691 1.00 42.37 O HETATM 1668 O HOH 79 40.309 16.556 18.704 1.00 26.40 O HETATM 1669 O HOH 80 15.688 19.752 13.128 1.00 39.24 O HETATM 1670 O HOH 81 25.645 51.324 21.216 1.00 38.12 O HETATM 1671 O HOH 82 23.523 24.069 5.682 1.00 32.73 O HETATM 1672 O HOH 83 16.423 33.978 17.002 1.00 29.81 O HETATM 1673 O HOH 84 30.930 18.605 27.663 1.00 42.64 O HETATM 1674 O HOH 85 12.459 46.125 12.014 1.00 40.66 O HETATM 1675 O HOH 86 28.559 37.544 1.777 1.00 34.90 O HETATM 1676 O HOH 87 16.456 50.618 14.970 1.00 40.19 O HETATM 1677 O HOH 88 10.757 42.387 12.581 1.00 40.73 O HETATM 1678 O HOH 89 39.001 35.632 19.398 1.00 25.52 O HETATM 1679 O HOH 90 23.572 51.479 11.312 1.00 48.24 O HETATM 1680 O HOH 91 40.171 25.701 27.060 1.00 22.34 O HETATM 1681 O HOH 92 30.969 38.318 1.191 1.00 38.46 O HETATM 1682 O HOH 93 18.237 46.908 5.380 1.00 47.09 O HETATM 1683 O HOH 94 29.456 15.282 21.225 1.00 51.45 O HETATM 1684 O HOH 95 29.465 18.925 25.587 1.00 30.84 O HETATM 1685 O HOH 96 40.577 17.129 26.051 1.00 38.19 O HETATM 1686 O HOH 97 41.495 19.563 26.859 1.00 40.14 O HETATM 1687 O HOH 98 21.997 45.630 24.006 1.00 36.87 O HETATM 1688 O HOH 99 34.208 47.599 15.186 1.00 46.60 O HETATM 1689 O HOH 100 54.175 35.239 9.720 1.00 44.86 O HETATM 1690 O HOH 101 29.331 22.947 28.773 1.00 34.49 O HETATM 1691 O HOH 102 37.404 36.986 13.132 1.00 24.69 O HETATM 1692 O HOH 103 24.417 18.023 4.887 1.00 53.09 O HETATM 1693 O HOH 104 40.274 39.098 7.858 1.00 26.51 O HETATM 1694 O HOH 105 20.415 46.580 22.064 1.00 40.48 O HETATM 1695 O HOH 106 16.726 27.005 14.871 1.00 58.02 O HETATM 1696 O HOH 107 28.371 47.746 5.133 1.00 34.15 O HETATM 1697 O HOH 108 32.363 27.192 0.632 1.00 42.90 O HETATM 1698 O HOH 109 17.527 39.207 0.804 1.00 48.88 O HETATM 1699 O HOH 110 38.858 36.650 26.455 1.00 45.09 O HETATM 1700 O HOH 111 25.363 50.847 6.245 1.00 56.37 O HETATM 1701 O HOH 112 25.228 17.575 24.182 1.00 44.87 O HETATM 1702 O HOH 113 31.189 50.884 16.851 1.00 53.71 O HETATM 1703 O HOH 114 33.353 45.793 23.102 1.00 61.85 O HETATM 1704 O HOH 115 19.685 39.493 25.887 1.00 48.90 O HETATM 1705 O HOH 116 30.255 16.449 24.348 1.00 39.83 O HETATM 1706 O HOH 117 29.304 25.701 30.020 1.00 41.38 O HETATM 1707 O HOH 118 39.709 36.957 21.636 1.00 41.83 O HETATM 1708 O HOH 119 32.168 29.914 -0.740 1.00 48.55 O HETATM 1709 O HOH 120 33.296 48.567 17.680 1.00 46.71 O HETATM 1710 O HOH 121 23.683 52.441 22.927 1.00 50.63 O HETATM 1711 O HOH 122 32.982 44.054 17.467 1.00 24.98 O HETATM 1712 O HOH 123 40.309 11.892 18.704 1.00 44.16 O HETATM 1713 O HOH 124 42.177 34.412 8.448 1.00 36.61 O HETATM 1714 O HOH 125 40.133 19.288 29.339 1.00 55.11 O HETATM 1715 O HOH 126 19.021 26.883 17.869 1.00 52.18 O HETATM 1716 O HOH 127 26.680 18.832 25.967 1.00 39.55 O HETATM 1717 O HOH 128 43.044 12.171 21.238 1.00 53.65 O HETATM 1718 O HOH 129 30.242 40.130 2.206 1.00 50.02 O HETATM 1719 O HOH 130 27.921 50.498 5.821 1.00 53.63 O HETATM 1720 O HOH 131 36.448 43.872 14.464 1.00 52.69 O HETATM 1721 O HOH 132 27.040 13.079 12.185 1.00 52.31 O HETATM 1722 O HOH 133 39.245 20.989 4.490 1.00 48.32 O HETATM 1723 O HOH 134 21.782 53.649 12.102 1.00 55.89 O HETATM 1724 O HOH 135 27.237 21.333 2.035 1.00 50.40 O HETATM 1725 O HOH 136 34.725 46.143 21.524 1.00 53.57 O HETATM 1726 O HOH 137 24.246 20.094 2.830 1.00 57.67 O HETATM 1727 O HOH 138 32.834 48.728 7.920 1.00 46.71 O HETATM 1728 O HOH 139 34.877 34.862 30.837 1.00 45.82 O HETATM 1729 O HOH 140 33.387 12.736 19.335 1.00 46.97 O HETATM 1730 O HOH 141 41.308 41.422 7.070 1.00 41.11 O HETATM 1731 O HOH 142 35.902 42.955 17.960 1.00 52.72 O HETATM 1732 O HOH 143 36.858 44.763 19.750 1.00 56.56 O HETATM 1733 CAA P A 34 19.499 30.887 17.558 1.00 -0.04 C HETATM 1734 N P A 34 19.090 30.914 18.958 1.00 0.25 N HETATM 1735 CAB P A 34 19.169 29.576 19.475 1.00 -0.04 C HETATM 1736 H5 P A 34 18.864 29.573 20.532 1.00 0.08 H HETATM 1737 H6 P A 34 20.203 29.211 19.390 1.00 0.08 H HETATM 1738 H7 P A 34 18.500 28.920 18.899 1.00 0.08 H HETATM 1739 CA P A 34 19.982 31.759 19.719 1.00 0.06 C HETATM 1740 C P A 34 19.494 32.565 20.944 1.00 0.25 C HETATM 1741 O P A 34 18.285 32.756 21.127 1.00 -0.38 O HETATM 1742 NAM P A 34 20.458 33.095 21.769 1.00 -0.24 N HETATM 1743 CAP P A 34 21.846 32.870 21.576 1.00 0.05 C HETATM 1744 CAK P A 34 22.734 33.931 21.376 1.00 -0.04 C HETATM 1745 CAU P A 34 24.105 33.625 21.166 1.00 -0.00 C HETATM 1746 CAT P A 34 25.152 34.636 20.956 1.00 -0.01 C HETATM 1747 CAI P A 34 24.869 36.000 20.919 1.00 -0.05 C HETATM 1748 CAF P A 34 25.884 36.912 20.722 1.00 -0.06 C HETATM 1749 CAE P A 34 27.203 36.496 20.498 1.00 -0.06 C HETATM 1750 CAH P A 34 27.493 35.128 20.521 1.00 -0.04 C HETATM 1751 CAS P A 34 26.477 34.212 20.736 1.00 0.06 C HETATM 1752 CAQ P A 34 26.855 32.797 20.795 1.00 0.22 C HETATM 1753 OAD P A 34 28.008 32.390 20.619 1.00 -0.39 O HETATM 1754 NAN P A 34 25.859 31.906 20.993 1.00 -0.24 N HETATM 1755 CAR P A 34 24.503 32.292 21.192 1.00 0.07 C HETATM 1756 CAJ P A 34 23.594 31.249 21.389 1.00 -0.05 C HETATM 1757 CAG P A 34 22.288 31.567 21.605 1.00 -0.05 C HETATM 1758 H18 P A 34 21.578 30.773 21.805 1.00 0.05 H HETATM 1759 H17 P A 34 23.920 30.215 21.370 1.00 0.05 H HETATM 1760 H16 P A 34 26.084 30.932 21.000 1.00 0.23 H HETATM 1761 H15 P A 34 28.511 34.786 20.371 1.00 0.07 H HETATM 1762 H14 P A 34 27.985 37.222 20.310 1.00 0.06 H HETATM 1763 H13 P A 34 25.657 37.972 20.741 1.00 0.06 H HETATM 1764 H12 P A 34 23.849 36.345 21.045 1.00 0.06 H HETATM 1765 H11 P A 34 22.386 34.958 21.381 1.00 0.05 H HETATM 1766 H10 P A 34 20.168 33.664 22.539 1.00 0.22 H HETATM 1767 H8 P A 34 20.392 32.493 19.010 1.00 0.11 H HETATM 1768 H9 P A 34 20.791 31.107 20.081 1.00 0.11 H HETATM 1769 H4 P A 34 18.146 31.260 19.033 1.00 0.20 H HETATM 1770 H1 P A 34 18.814 30.242 16.988 1.00 0.08 H HETATM 1771 H2 P A 34 20.523 30.492 17.483 1.00 0.08 H HETATM 1772 H3 P A 34 19.468 31.907 17.147 1.00 0.08 H CONECT 1 2 13 14 15 CONECT 13 1 CONECT 14 1 CONECT 15 1 CONECT 52 51 342 CONECT 342 52 341 CONECT 1344 1343 1486 CONECT 1486 1344 1485 CONECT 1733 1734 1770 1771 1772 CONECT 1734 1733 1735 1739 1769 CONECT 1735 1734 1736 1737 1738 CONECT 1736 1735 CONECT 1737 1735 CONECT 1738 1735 CONECT 1739 1734 1740 1767 1768 CONECT 1740 1739 1741 1742 CONECT 1741 1740 CONECT 1742 1740 1743 1766 CONECT 1743 1742 1744 1757 CONECT 1744 1743 1745 1765 CONECT 1745 1744 1746 1755 CONECT 1746 1745 1747 1751 CONECT 1747 1746 1748 1764 CONECT 1748 1747 1749 1763 CONECT 1749 1748 1750 1762 CONECT 1750 1749 1751 1761 CONECT 1751 1746 1750 1752 CONECT 1752 1751 1753 1754 CONECT 1753 1752 CONECT 1754 1752 1755 1760 CONECT 1755 1745 1754 1756 CONECT 1756 1755 1757 1759 CONECT 1757 1743 1756 1758 CONECT 1758 1757 CONECT 1759 1756 CONECT 1760 1754 CONECT 1761 1750 CONECT 1762 1749 CONECT 1763 1748 CONECT 1764 1747 CONECT 1765 1744 CONECT 1766 1742 CONECT 1767 1739 CONECT 1768 1739 CONECT 1769 1734 CONECT 1770 1733 CONECT 1771 1733 CONECT 1772 1733 MASTER 0 0 0 0 0 0 0 0 1771 1 48 13 END
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Structure:
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Protein
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Related entries of code: 5ewk
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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RCSB PDB
PDBbind
200aa, >5EWY_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
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Ligand Name
1xk9
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PDBbind
P34
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RCSB PDB
PDBbind
P34
Entry Information
PDB ID
5ewk
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Scabin toxin from Streptomyces Scabies
Ligand Name
P34
EC.Number
E.C.2.4.2.31
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Kd=14uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) J.Biol.Chem. Vol. 291: pp. 11198-11215
Ligand Properties
Formula
C
1
7
H
1
8
N
3
O
2
Molecular Weight
296.344
Exact Mass
296.140
No. of atoms
40
No. of bonds
42
Polar Surface Area
66.4
LOGP Value
1.71 (
Computed with XLOGP3
)
0.84 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 3
Canonical SMILES
C[NH+](CC(=O)Nc1ccc2c(c1)c1ccccc1c(=O)[nH]2)C
InChI String
InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22)/p+1
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
C9Z6T8
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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