Browse entries in the PDBbind-CN Database
HEADER 5DP6_COMPLEX COMPND 5DP6_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 178 SER LEU ASP PHE ALA LEU SER LEU LEU ARG ARG ASN VAL SEQRES 2 A 178 ARG GLN VAL GLN THR ASP GLN GLY HIS PHE THR MET LEU SEQRES 3 A 178 GLY VAL ARG ASP ARG LEU ALA VAL LEU PRO ARG HIS SER SEQRES 4 A 178 GLN PRO GLY LYS THR ILE TRP ILE GLU HIS LYS LEU VAL SEQRES 5 A 178 ASN ILE LEU ASP ALA VAL GLU LEU VAL ASP GLU GLN GLY SEQRES 6 A 178 VAL ASN LEU GLU LEU THR LEU ILE THR LEU ASP THR ASN SEQRES 7 A 178 GLU LYS PHE ARG ASP ILE THR LYS PHE ILE PRO GLU ASN SEQRES 8 A 178 ILE SER THR ALA SER ASP ALA THR LEU VAL ILE ASN THR SEQRES 9 A 178 GLU HIS MET PRO SER MET PHE VAL PRO VAL GLY ASP VAL SEQRES 10 A 178 VAL GLN TYR GLY PHE LEU ASN LEU SER GLY LYS PRO THR SEQRES 11 A 178 HIS ARG THR MET MET TYR ASN PHE PRO THR LYS ALA GLY SEQRES 12 A 178 GLN CYS GLY GLY VAL VAL THR SER VAL GLY LYS VAL ILE SEQRES 13 A 178 GLY ILE HIS ILE GLY GLY ASN GLY ARG GLN GLY PHE CYS SEQRES 14 A 178 ALA GLY LEU LYS ARG SER TYR PHE ALA HET UNN A 179 71 ATOM 1 N SER A 3 2.366 21.410 -20.876 1.00 96.31 N ATOM 2 CA SER A 3 0.938 21.096 -21.251 1.00 94.42 C ATOM 3 C SER A 3 -0.016 20.858 -20.093 1.00 95.52 C ATOM 4 O SER A 3 -0.936 21.612 -19.924 1.00 94.51 O ATOM 5 CB SER A 3 0.832 19.954 -22.221 1.00 98.57 C ATOM 6 OG SER A 3 0.914 20.511 -23.497 1.00100.77 O ATOM 7 HG SER A 3 0.848 19.792 -24.174 1.00 0.00 H ATOM 8 HN3 SER A 3 2.763 20.617 -20.332 1.00 0.00 H ATOM 9 HN2 SER A 3 2.389 22.275 -20.299 1.00 0.00 H ATOM 10 HN1 SER A 3 2.927 21.554 -21.740 1.00 0.00 H ATOM 11 N LEU A 4 0.112 19.767 -19.357 1.00 89.39 N ATOM 12 CA LEU A 4 -0.103 19.811 -17.925 1.00 79.02 C ATOM 13 C LEU A 4 -0.134 21.229 -17.295 1.00 69.83 C ATOM 14 O LEU A 4 -0.962 21.567 -16.467 1.00 66.70 O ATOM 15 CB LEU A 4 1.102 19.120 -17.426 1.00 83.46 C ATOM 16 CG LEU A 4 0.941 18.038 -16.419 1.00 93.68 C ATOM 17 CD1 LEU A 4 -0.494 17.646 -16.053 1.00 94.32 C ATOM 18 CD2 LEU A 4 1.750 16.905 -17.003 1.00 97.24 C ATOM 19 H LEU A 4 0.370 18.868 -19.811 1.00 0.00 H ATOM 20 N ASP A 5 0.828 22.035 -17.667 1.00 67.45 N ATOM 21 CA ASP A 5 0.901 23.370 -17.189 1.00 72.34 C ATOM 22 C ASP A 5 -0.286 24.236 -17.630 1.00 58.31 C ATOM 23 O ASP A 5 -0.937 24.910 -16.833 1.00 59.23 O ATOM 24 CB ASP A 5 2.194 23.982 -17.689 1.00 87.31 C ATOM 25 CG ASP A 5 2.327 25.403 -17.241 1.00115.38 C ATOM 26 OD1 ASP A 5 1.833 25.639 -16.114 1.00129.23 O ATOM 27 OD2 ASP A 5 2.867 26.268 -17.980 1.00125.59 O ATOM 28 H ASP A 5 1.554 21.690 -18.327 1.00 0.00 H ATOM 29 N PHE A 6 -0.560 24.211 -18.916 1.00 46.40 N ATOM 30 CA PHE A 6 -1.690 24.925 -19.472 1.00 41.62 C ATOM 31 C PHE A 6 -2.942 24.629 -18.638 1.00 42.15 C ATOM 32 O PHE A 6 -3.552 25.542 -18.031 1.00 46.36 O ATOM 33 CB PHE A 6 -1.875 24.529 -20.939 1.00 40.78 C ATOM 34 CG PHE A 6 -2.971 25.270 -21.650 1.00 40.23 C ATOM 35 CD1 PHE A 6 -2.853 26.607 -21.893 1.00 43.09 C ATOM 36 CD2 PHE A 6 -4.114 24.618 -22.084 1.00 41.59 C ATOM 37 CE1 PHE A 6 -3.861 27.311 -22.544 1.00 47.21 C ATOM 38 CE2 PHE A 6 -5.130 25.298 -22.735 1.00 41.86 C ATOM 39 CZ PHE A 6 -5.004 26.651 -22.971 1.00 46.01 C ATOM 40 H PHE A 6 0.053 23.662 -19.552 1.00 0.00 H ATOM 41 N ALA A 7 -3.278 23.341 -18.567 1.00 41.17 N ATOM 42 CA ALA A 7 -4.438 22.863 -17.817 1.00 39.53 C ATOM 43 C ALA A 7 -4.445 23.469 -16.442 1.00 38.31 C ATOM 44 O ALA A 7 -5.504 23.855 -15.944 1.00 37.56 O ATOM 45 CB ALA A 7 -4.440 21.340 -17.712 1.00 37.00 C ATOM 46 H ALA A 7 -2.689 22.645 -19.067 1.00 0.00 H ATOM 47 N LEU A 8 -3.273 23.513 -15.808 1.00 39.60 N ATOM 48 CA LEU A 8 -3.180 24.166 -14.515 1.00 42.51 C ATOM 49 C LEU A 8 -3.464 25.647 -14.540 1.00 43.74 C ATOM 50 O LEU A 8 -4.121 26.076 -13.598 1.00 40.81 O ATOM 51 CB LEU A 8 -1.826 24.016 -13.889 1.00 48.21 C ATOM 52 CG LEU A 8 -1.652 22.876 -12.927 1.00 55.84 C ATOM 53 CD1 LEU A 8 -0.331 23.027 -12.213 1.00 48.96 C ATOM 54 CD2 LEU A 8 -2.773 22.818 -11.913 1.00 60.92 C ATOM 55 H LEU A 8 -2.430 23.082 -16.238 1.00 0.00 H ATOM 56 N SER A 9 -2.969 26.408 -15.563 1.00 43.04 N ATOM 57 CA SER A 9 -3.215 27.896 -15.683 1.00 43.80 C ATOM 58 C SER A 9 -4.682 28.078 -15.915 1.00 42.45 C ATOM 59 O SER A 9 -5.265 28.947 -15.304 1.00 44.66 O ATOM 60 CB SER A 9 -2.409 28.613 -16.764 1.00 47.02 C ATOM 61 OG SER A 9 -2.343 30.028 -16.489 1.00 56.26 O ATOM 62 HG SER A 9 -1.818 30.477 -17.198 1.00 0.00 H ATOM 63 H SER A 9 -2.395 25.941 -16.294 1.00 0.00 H ATOM 64 N LEU A 10 -5.267 27.195 -16.738 1.00 41.79 N ATOM 65 CA LEU A 10 -6.708 27.185 -17.007 1.00 43.84 C ATOM 66 C LEU A 10 -7.485 26.981 -15.748 1.00 47.37 C ATOM 67 O LEU A 10 -8.288 27.804 -15.343 1.00 51.19 O ATOM 68 CB LEU A 10 -7.109 26.046 -17.927 1.00 44.79 C ATOM 69 CG LEU A 10 -7.249 26.314 -19.408 1.00 46.67 C ATOM 70 CD1 LEU A 10 -7.916 25.098 -20.041 1.00 46.70 C ATOM 71 CD2 LEU A 10 -8.060 27.563 -19.648 1.00 48.18 C ATOM 72 H LEU A 10 -4.670 26.484 -17.207 1.00 0.00 H ATOM 73 N LEU A 11 -7.215 25.867 -15.097 1.00 50.00 N ATOM 74 CA LEU A 11 -7.901 25.507 -13.862 1.00 49.40 C ATOM 75 C LEU A 11 -7.896 26.624 -12.885 1.00 50.66 C ATOM 76 O LEU A 11 -8.836 26.784 -12.126 1.00 61.70 O ATOM 77 CB LEU A 11 -7.142 24.426 -13.141 1.00 46.65 C ATOM 78 CG LEU A 11 -7.995 23.356 -12.525 1.00 48.07 C ATOM 79 CD1 LEU A 11 -7.094 22.638 -11.536 1.00 47.63 C ATOM 80 CD2 LEU A 11 -9.295 23.813 -11.880 1.00 48.10 C ATOM 81 H LEU A 11 -6.490 25.225 -15.476 1.00 0.00 H ATOM 82 N ARG A 12 -6.788 27.357 -12.872 1.00 50.78 N ATOM 83 CA ARG A 12 -6.501 28.322 -11.837 1.00 51.44 C ATOM 84 C ARG A 12 -7.130 29.654 -12.122 1.00 49.36 C ATOM 85 O ARG A 12 -7.473 30.360 -11.182 1.00 54.24 O ATOM 86 CB ARG A 12 -4.982 28.459 -11.646 1.00 54.55 C ATOM 87 CG ARG A 12 -4.511 29.621 -10.780 1.00 66.51 C ATOM 88 CD ARG A 12 -2.975 29.822 -10.807 1.00 74.52 C ATOM 89 NE ARG A 12 -2.493 30.677 -11.938 1.00 82.53 N ATOM 90 CZ ARG A 12 -1.699 30.305 -12.964 1.00 78.40 C ATOM 91 NH1 ARG A 12 -1.172 29.067 -12.977 1.00 75.18 N ATOM 92 NH2 ARG A 12 -1.355 31.176 -13.898 1.00 74.15 N ATOM 93 HE ARG A 12 -2.805 31.669 -11.932 1.00 0.00 H ATOM 94 HH12 ARG A 12 -0.559 28.771 -13.763 1.00 0.00 H ATOM 95 HH11 ARG A 12 -1.378 28.406 -12.201 1.00 0.00 H ATOM 96 HH22 ARG A 12 -0.743 30.880 -14.685 1.00 0.00 H ATOM 97 HH21 ARG A 12 -1.697 32.157 -13.846 1.00 0.00 H ATOM 98 H ARG A 12 -6.098 27.230 -13.640 1.00 0.00 H ATOM 99 N ARG A 13 -7.286 30.015 -13.391 1.00 46.58 N ATOM 100 CA ARG A 13 -7.776 31.343 -13.754 1.00 49.26 C ATOM 101 C ARG A 13 -9.032 31.405 -14.558 1.00 44.92 C ATOM 102 O ARG A 13 -9.535 32.487 -14.805 1.00 45.32 O ATOM 103 CB ARG A 13 -6.700 32.021 -14.555 1.00 58.17 C ATOM 104 CG ARG A 13 -5.462 32.123 -13.693 1.00 70.05 C ATOM 105 CD ARG A 13 -4.541 33.236 -13.944 1.00 83.65 C ATOM 106 NE ARG A 13 -3.422 32.903 -14.787 1.00 92.31 N ATOM 107 CZ ARG A 13 -3.472 32.258 -15.935 1.00103.89 C ATOM 108 NH1 ARG A 13 -4.551 32.134 -16.527 1.00113.53 N ATOM 109 NH2 ARG A 13 -2.365 31.914 -16.424 1.00113.95 N ATOM 110 HE ARG A 13 -2.482 33.201 -14.457 1.00 0.00 H ATOM 111 HH12 ARG A 13 -4.592 31.625 -17.433 1.00 0.00 H ATOM 112 HH11 ARG A 13 -5.418 32.539 -16.119 1.00 0.00 H ATOM 113 HH22 ARG A 13 -2.333 31.401 -17.328 1.00 0.00 H ATOM 114 HH21 ARG A 13 -1.482 32.142 -15.924 1.00 0.00 H ATOM 115 H ARG A 13 -7.054 29.336 -14.144 1.00 0.00 H ATOM 116 N ASN A 14 -9.528 30.260 -15.000 1.00 41.99 N ATOM 117 CA ASN A 14 -10.652 30.243 -15.922 1.00 38.52 C ATOM 118 C ASN A 14 -11.721 29.199 -15.656 1.00 38.11 C ATOM 119 O ASN A 14 -12.855 29.376 -16.071 1.00 41.82 O ATOM 120 CB ASN A 14 -10.123 30.098 -17.362 1.00 38.41 C ATOM 121 CG ASN A 14 -9.373 31.334 -17.837 1.00 37.48 C ATOM 122 OD1 ASN A 14 -8.150 31.416 -17.728 1.00 39.57 O ATOM 123 ND2 ASN A 14 -10.124 32.332 -18.308 1.00 35.40 N ATOM 124 HD22 ASN A 14 -11.155 32.217 -18.382 1.00 0.00 H ATOM 125 HD21 ASN A 14 -9.678 33.225 -18.601 1.00 0.00 H ATOM 126 H ASN A 14 -9.109 29.362 -14.684 1.00 0.00 H ATOM 127 N VAL A 15 -11.390 28.111 -14.976 1.00 38.03 N ATOM 128 CA VAL A 15 -12.374 27.053 -14.749 1.00 37.62 C ATOM 129 C VAL A 15 -12.886 27.178 -13.322 1.00 37.71 C ATOM 130 O VAL A 15 -12.106 27.209 -12.381 1.00 36.19 O ATOM 131 CB VAL A 15 -11.773 25.651 -15.003 1.00 39.01 C ATOM 132 CG1 VAL A 15 -12.858 24.611 -14.974 1.00 39.18 C ATOM 133 CG2 VAL A 15 -11.074 25.578 -16.348 1.00 38.94 C ATOM 134 H VAL A 15 -10.425 28.009 -14.602 1.00 0.00 H ATOM 135 N ARG A 16 -14.199 27.240 -13.165 1.00 41.00 N ATOM 136 CA ARG A 16 -14.811 27.492 -11.852 1.00 47.35 C ATOM 137 C ARG A 16 -15.897 26.495 -11.514 1.00 46.39 C ATOM 138 O ARG A 16 -16.541 25.934 -12.405 1.00 46.46 O ATOM 139 CB ARG A 16 -15.441 28.872 -11.832 1.00 50.86 C ATOM 140 CG ARG A 16 -14.485 29.964 -12.252 1.00 56.44 C ATOM 141 CD ARG A 16 -13.502 30.242 -11.142 1.00 63.03 C ATOM 142 NE ARG A 16 -13.025 31.623 -11.209 1.00 74.48 N ATOM 143 CZ ARG A 16 -11.801 31.979 -11.565 1.00 81.04 C ATOM 144 NH1 ARG A 16 -10.912 31.035 -11.898 1.00 83.63 N ATOM 145 NH2 ARG A 16 -11.469 33.268 -11.606 1.00 81.20 N ATOM 146 HE ARG A 16 -13.695 32.378 -10.959 1.00 0.00 H ATOM 147 HH12 ARG A 16 -9.948 31.305 -12.179 1.00 0.00 H ATOM 148 HH11 ARG A 16 -11.186 30.032 -11.876 1.00 0.00 H ATOM 149 HH22 ARG A 16 -10.507 33.549 -11.886 1.00 0.00 H ATOM 150 HH21 ARG A 16 -12.171 33.994 -11.358 1.00 0.00 H ATOM 151 H ARG A 16 -14.814 27.107 -13.993 1.00 0.00 H ATOM 152 N GLN A 17 -16.136 26.327 -10.219 1.00 43.41 N ATOM 153 CA GLN A 17 -17.122 25.385 -9.731 1.00 39.13 C ATOM 154 C GLN A 17 -18.428 26.123 -9.632 1.00 37.21 C ATOM 155 O GLN A 17 -18.472 27.163 -8.995 1.00 33.43 O ATOM 156 CB GLN A 17 -16.722 24.889 -8.353 1.00 41.21 C ATOM 157 CG GLN A 17 -15.232 24.674 -8.139 1.00 42.74 C ATOM 158 CD GLN A 17 -14.905 24.220 -6.731 1.00 43.01 C ATOM 159 OE1 GLN A 17 -15.718 24.367 -5.829 1.00 44.15 O ATOM 160 NE2 GLN A 17 -13.735 23.621 -6.542 1.00 46.09 N ATOM 161 HE22 GLN A 17 -13.071 23.516 -7.335 1.00 0.00 H ATOM 162 HE21 GLN A 17 -13.483 23.257 -5.601 1.00 0.00 H ATOM 163 H GLN A 17 -15.597 26.891 -9.531 1.00 0.00 H ATOM 164 N VAL A 18 -19.485 25.614 -10.266 1.00 35.48 N ATOM 165 CA VAL A 18 -20.770 26.271 -10.186 1.00 35.78 C ATOM 166 C VAL A 18 -21.923 25.324 -9.804 1.00 37.02 C ATOM 167 O VAL A 18 -21.791 24.101 -9.763 1.00 33.38 O ATOM 168 CB VAL A 18 -21.110 26.978 -11.490 1.00 37.74 C ATOM 169 CG1 VAL A 18 -19.961 27.845 -11.933 1.00 39.22 C ATOM 170 CG2 VAL A 18 -21.450 25.960 -12.565 1.00 43.77 C ATOM 171 H VAL A 18 -19.384 24.740 -10.821 1.00 0.00 H ATOM 172 N GLN A 19 -23.062 25.941 -9.517 1.00 37.49 N ATOM 173 CA GLN A 19 -24.275 25.234 -9.226 1.00 39.96 C ATOM 174 C GLN A 19 -25.477 25.943 -9.820 1.00 39.73 C ATOM 175 O GLN A 19 -25.630 27.142 -9.682 1.00 40.21 O ATOM 176 CB GLN A 19 -24.431 25.134 -7.719 1.00 43.20 C ATOM 177 CG GLN A 19 -23.955 23.815 -7.191 1.00 48.66 C ATOM 178 CD GLN A 19 -24.113 23.680 -5.708 1.00 47.45 C ATOM 179 OE1 GLN A 19 -25.042 23.035 -5.265 1.00 58.89 O ATOM 180 NE2 GLN A 19 -23.220 24.252 -4.941 1.00 46.65 N ATOM 181 HE22 GLN A 19 -22.441 24.795 -5.365 1.00 0.00 H ATOM 182 HE21 GLN A 19 -23.289 24.164 -3.907 1.00 0.00 H ATOM 183 H GLN A 19 -23.076 26.981 -9.503 1.00 0.00 H ATOM 184 N THR A 20 -26.343 25.187 -10.460 1.00 39.10 N ATOM 185 CA THR A 20 -27.614 25.705 -10.869 1.00 39.64 C ATOM 186 C THR A 20 -28.678 24.868 -10.185 1.00 43.42 C ATOM 187 O THR A 20 -28.377 24.003 -9.376 1.00 43.63 O ATOM 188 CB THR A 20 -27.784 25.597 -12.384 1.00 41.28 C ATOM 189 OG1 THR A 20 -27.886 24.219 -12.767 1.00 40.32 O ATOM 190 CG2 THR A 20 -26.620 26.269 -13.093 1.00 41.84 C ATOM 191 HG1 THR A 20 -27.996 24.158 -13.749 1.00 0.00 H ATOM 192 H THR A 20 -26.101 24.198 -10.672 1.00 0.00 H ATOM 193 N ASP A 21 -29.932 25.114 -10.532 1.00 47.45 N ATOM 194 CA ASP A 21 -31.027 24.345 -9.996 1.00 47.35 C ATOM 195 C ASP A 21 -30.934 22.905 -10.472 1.00 44.91 C ATOM 196 O ASP A 21 -31.650 22.055 -9.961 1.00 49.53 O ATOM 197 CB ASP A 21 -32.374 24.985 -10.392 1.00 52.44 C ATOM 198 CG ASP A 21 -32.685 26.301 -9.592 1.00 57.13 C ATOM 199 OD1 ASP A 21 -32.463 26.296 -8.372 1.00 60.07 O ATOM 200 OD2 ASP A 21 -33.164 27.334 -10.143 1.00 59.06 O ATOM 201 H ASP A 21 -30.131 25.880 -11.207 1.00 0.00 H ATOM 202 N GLN A 22 -30.047 22.632 -11.430 1.00 41.77 N ATOM 203 CA GLN A 22 -29.876 21.290 -12.004 1.00 40.35 C ATOM 204 C GLN A 22 -28.747 20.457 -11.370 1.00 39.70 C ATOM 205 O GLN A 22 -28.688 19.225 -11.535 1.00 38.76 O ATOM 206 CB GLN A 22 -29.577 21.408 -13.487 1.00 41.60 C ATOM 207 CG GLN A 22 -30.604 22.162 -14.309 1.00 41.66 C ATOM 208 CD GLN A 22 -31.908 21.437 -14.414 1.00 44.99 C ATOM 209 OE1 GLN A 22 -32.971 22.045 -14.393 1.00 46.78 O ATOM 210 NE2 GLN A 22 -31.838 20.126 -14.568 1.00 50.72 N ATOM 211 HE22 GLN A 22 -30.912 19.652 -14.580 1.00 0.00 H ATOM 212 HE21 GLN A 22 -32.709 19.568 -14.678 1.00 0.00 H ATOM 213 H GLN A 22 -29.449 23.404 -11.787 1.00 0.00 H ATOM 214 N GLY A 23 -27.834 21.129 -10.674 1.00 37.50 N ATOM 215 CA GLY A 23 -26.801 20.452 -9.915 1.00 35.06 C ATOM 216 C GLY A 23 -25.457 21.121 -10.025 1.00 36.44 C ATOM 217 O GLY A 23 -25.384 22.314 -10.189 1.00 35.06 O ATOM 218 H GLY A 23 -27.862 22.169 -10.674 1.00 0.00 H ATOM 219 N HIS A 24 -24.397 20.327 -9.908 1.00 41.50 N ATOM 220 CA HIS A 24 -23.010 20.805 -9.946 1.00 43.30 C ATOM 221 C HIS A 24 -22.355 20.655 -11.315 1.00 41.21 C ATOM 222 O HIS A 24 -22.463 19.629 -11.953 1.00 42.86 O ATOM 223 CB HIS A 24 -22.167 20.050 -8.935 1.00 47.42 C ATOM 224 CG HIS A 24 -22.527 20.345 -7.526 1.00 48.91 C ATOM 225 ND1 HIS A 24 -23.419 19.576 -6.821 1.00 54.58 N ATOM 226 CD2 HIS A 24 -22.156 21.345 -6.705 1.00 54.76 C ATOM 227 CE1 HIS A 24 -23.568 20.075 -5.611 1.00 61.37 C ATOM 228 NE2 HIS A 24 -22.816 21.156 -5.519 1.00 61.49 N ATOM 229 H HIS A 24 -24.560 19.308 -9.782 1.00 0.00 H ATOM 230 N PHE A 25 -21.685 21.713 -11.750 1.00 41.92 N ATOM 231 CA PHE A 25 -21.093 21.806 -13.066 1.00 37.93 C ATOM 232 C PHE A 25 -19.783 22.544 -12.980 1.00 37.71 C ATOM 233 O PHE A 25 -19.501 23.280 -12.055 1.00 37.59 O ATOM 234 CB PHE A 25 -21.995 22.583 -14.023 1.00 38.39 C ATOM 235 CG PHE A 25 -23.283 21.904 -14.325 1.00 39.03 C ATOM 236 CD1 PHE A 25 -24.373 22.059 -13.528 1.00 40.10 C ATOM 237 CD2 PHE A 25 -23.399 21.131 -15.406 1.00 40.51 C ATOM 238 CE1 PHE A 25 -25.570 21.428 -13.802 1.00 41.76 C ATOM 239 CE2 PHE A 25 -24.587 20.507 -15.707 1.00 42.88 C ATOM 240 CZ PHE A 25 -25.671 20.654 -14.897 1.00 45.89 C ATOM 241 H PHE A 25 -21.579 22.524 -11.107 1.00 0.00 H ATOM 242 N THR A 26 -18.983 22.348 -14.000 1.00 40.32 N ATOM 243 CA THR A 26 -17.777 23.098 -14.198 1.00 38.29 C ATOM 244 C THR A 26 -18.126 24.186 -15.224 1.00 39.33 C ATOM 245 O THR A 26 -18.735 23.919 -16.270 1.00 39.71 O ATOM 246 CB THR A 26 -16.696 22.175 -14.762 1.00 38.75 C ATOM 247 OG1 THR A 26 -16.579 21.000 -13.951 1.00 36.54 O ATOM 248 CG2 THR A 26 -15.375 22.894 -14.905 1.00 39.50 C ATOM 249 HG1 THR A 26 -15.877 20.411 -14.325 1.00 0.00 H ATOM 250 H THR A 26 -19.234 21.617 -14.696 1.00 0.00 H ATOM 251 N MET A 27 -17.734 25.409 -14.922 1.00 39.07 N ATOM 252 CA MET A 27 -17.910 26.509 -15.840 1.00 39.51 C ATOM 253 C MET A 27 -16.575 26.957 -16.377 1.00 36.03 C ATOM 254 O MET A 27 -15.604 26.971 -15.650 1.00 37.69 O ATOM 255 CB MET A 27 -18.600 27.671 -15.124 1.00 42.53 C ATOM 256 CG MET A 27 -19.113 28.729 -16.070 1.00 43.74 C ATOM 257 SD MET A 27 -19.702 30.179 -15.247 1.00 43.98 S ATOM 258 CE MET A 27 -18.290 30.646 -14.240 1.00 42.38 C ATOM 259 H MET A 27 -17.287 25.585 -14.000 1.00 0.00 H ATOM 260 N LEU A 28 -16.537 27.326 -17.652 1.00 35.90 N ATOM 261 CA LEU A 28 -15.344 27.906 -18.265 1.00 36.07 C ATOM 262 C LEU A 28 -15.528 29.381 -18.526 1.00 36.91 C ATOM 263 O LEU A 28 -16.438 29.769 -19.266 1.00 35.72 O ATOM 264 CB LEU A 28 -15.047 27.236 -19.587 1.00 37.50 C ATOM 265 CG LEU A 28 -13.894 27.797 -20.424 1.00 38.82 C ATOM 266 CD1 LEU A 28 -12.566 27.542 -19.729 1.00 40.54 C ATOM 267 CD2 LEU A 28 -13.875 27.138 -21.791 1.00 38.89 C ATOM 268 H LEU A 28 -17.388 27.197 -18.236 1.00 0.00 H ATOM 269 N GLY A 29 -14.671 30.198 -17.916 1.00 35.35 N ATOM 270 CA GLY A 29 -14.666 31.620 -18.176 1.00 37.08 C ATOM 271 C GLY A 29 -13.785 31.916 -19.378 1.00 38.25 C ATOM 272 O GLY A 29 -12.598 31.636 -19.374 1.00 40.19 O ATOM 273 H GLY A 29 -13.989 29.804 -17.237 1.00 0.00 H ATOM 274 N VAL A 30 -14.360 32.513 -20.408 1.00 39.14 N ATOM 275 CA VAL A 30 -13.634 32.738 -21.641 1.00 39.93 C ATOM 276 C VAL A 30 -12.964 34.105 -21.677 1.00 39.05 C ATOM 277 O VAL A 30 -11.780 34.199 -21.957 1.00 38.74 O ATOM 278 CB VAL A 30 -14.576 32.588 -22.839 1.00 43.13 C ATOM 279 CG1 VAL A 30 -13.811 32.747 -24.140 1.00 45.90 C ATOM 280 CG2 VAL A 30 -15.232 31.221 -22.802 1.00 43.01 C ATOM 281 H VAL A 30 -15.349 32.826 -20.332 1.00 0.00 H ATOM 282 N ARG A 31 -13.726 35.164 -21.415 1.00 38.99 N ATOM 283 CA ARG A 31 -13.184 36.519 -21.388 1.00 40.52 C ATOM 284 C ARG A 31 -14.153 37.467 -20.721 1.00 42.47 C ATOM 285 O ARG A 31 -15.349 37.189 -20.669 1.00 40.60 O ATOM 286 CB ARG A 31 -12.894 37.025 -22.798 1.00 41.72 C ATOM 287 CG ARG A 31 -14.142 37.374 -23.591 1.00 42.41 C ATOM 288 CD ARG A 31 -13.838 37.849 -25.004 1.00 42.77 C ATOM 289 NE ARG A 31 -15.064 37.908 -25.766 1.00 41.86 N ATOM 290 CZ ARG A 31 -16.076 38.721 -25.489 1.00 49.56 C ATOM 291 NH1 ARG A 31 -16.019 39.594 -24.484 1.00 52.44 N ATOM 292 NH2 ARG A 31 -17.169 38.669 -26.239 1.00 54.82 N ATOM 293 HE ARG A 31 -15.160 37.273 -26.584 1.00 0.00 H ATOM 294 HH12 ARG A 31 -16.828 40.218 -24.291 1.00 0.00 H ATOM 295 HH11 ARG A 31 -15.165 39.651 -23.893 1.00 0.00 H ATOM 296 HH22 ARG A 31 -17.970 39.300 -26.035 1.00 0.00 H ATOM 297 HH21 ARG A 31 -17.224 37.998 -27.031 1.00 0.00 H ATOM 298 H ARG A 31 -14.738 35.022 -21.224 1.00 0.00 H ATOM 299 N ASP A 32 -13.640 38.592 -20.220 1.00 46.28 N ATOM 300 CA ASP A 32 -14.484 39.612 -19.598 1.00 50.38 C ATOM 301 C ASP A 32 -15.454 38.977 -18.613 1.00 50.14 C ATOM 302 O ASP A 32 -15.025 38.360 -17.638 1.00 47.49 O ATOM 303 CB ASP A 32 -15.223 40.416 -20.675 1.00 54.45 C ATOM 304 CG ASP A 32 -14.259 41.174 -21.581 1.00 60.87 C ATOM 305 OD1 ASP A 32 -13.499 42.034 -21.078 1.00 60.34 O ATOM 306 OD2 ASP A 32 -14.249 40.899 -22.793 1.00 67.20 O ATOM 307 H ASP A 32 -12.613 38.748 -20.273 1.00 0.00 H ATOM 308 N ARG A 33 -16.750 39.102 -18.872 1.00 52.52 N ATOM 309 CA ARG A 33 -17.753 38.507 -18.010 1.00 56.54 C ATOM 310 C ARG A 33 -18.504 37.413 -18.749 1.00 51.57 C ATOM 311 O ARG A 33 -19.678 37.166 -18.467 1.00 52.84 O ATOM 312 CB ARG A 33 -18.724 39.591 -17.539 1.00 64.51 C ATOM 313 CG ARG A 33 -18.190 40.455 -16.418 1.00 73.24 C ATOM 314 CD ARG A 33 -18.258 41.936 -16.704 1.00 84.07 C ATOM 315 NE ARG A 33 -17.447 42.605 -15.693 1.00 99.10 N ATOM 316 CZ ARG A 33 -16.433 43.424 -15.944 1.00106.86 C ATOM 317 NH1 ARG A 33 -16.091 43.748 -17.192 1.00112.75 N ATOM 318 NH2 ARG A 33 -15.758 43.953 -14.935 1.00106.89 N ATOM 319 HE ARG A 33 -17.682 42.426 -14.696 1.00 0.00 H ATOM 320 HH12 ARG A 33 -15.292 44.392 -17.362 1.00 0.00 H ATOM 321 HH11 ARG A 33 -16.623 43.357 -17.995 1.00 0.00 H ATOM 322 HH22 ARG A 33 -14.962 44.596 -15.122 1.00 0.00 H ATOM 323 HH21 ARG A 33 -16.024 43.726 -13.956 1.00 0.00 H ATOM 324 H ARG A 33 -17.052 39.638 -19.711 1.00 0.00 H ATOM 325 N LEU A 34 -17.830 36.768 -19.700 1.00 44.24 N ATOM 326 CA LEU A 34 -18.466 35.777 -20.570 1.00 38.31 C ATOM 327 C LEU A 34 -18.002 34.375 -20.195 1.00 35.99 C ATOM 328 O LEU A 34 -16.823 34.073 -20.223 1.00 38.09 O ATOM 329 CB LEU A 34 -18.149 36.084 -22.041 1.00 34.31 C ATOM 330 CG LEU A 34 -18.788 35.149 -23.053 1.00 33.46 C ATOM 331 CD1 LEU A 34 -20.253 35.432 -23.233 1.00 34.85 C ATOM 332 CD2 LEU A 34 -18.109 35.253 -24.387 1.00 32.91 C ATOM 333 H LEU A 34 -16.819 36.975 -19.829 1.00 0.00 H ATOM 334 N ALA A 35 -18.937 33.512 -19.863 1.00 33.04 N ATOM 335 CA ALA A 35 -18.595 32.148 -19.533 1.00 32.76 C ATOM 336 C ALA A 35 -19.476 31.210 -20.306 1.00 31.15 C ATOM 337 O ALA A 35 -20.564 31.577 -20.717 1.00 30.24 O ATOM 338 CB ALA A 35 -18.784 31.911 -18.047 1.00 33.94 C ATOM 339 H ALA A 35 -19.932 33.814 -19.838 1.00 0.00 H ATOM 340 N VAL A 36 -19.021 29.978 -20.459 1.00 29.54 N ATOM 341 CA VAL A 36 -19.779 29.009 -21.210 1.00 30.56 C ATOM 342 C VAL A 36 -20.150 27.793 -20.366 1.00 30.84 C ATOM 343 O VAL A 36 -19.333 27.287 -19.616 1.00 30.17 O ATOM 344 CB VAL A 36 -19.010 28.621 -22.477 1.00 30.04 C ATOM 345 CG1 VAL A 36 -17.670 28.029 -22.144 1.00 30.77 C ATOM 346 CG2 VAL A 36 -19.816 27.627 -23.284 1.00 32.24 C ATOM 347 H VAL A 36 -18.111 29.707 -20.035 1.00 0.00 H ATOM 348 N LEU A 37 -21.380 27.318 -20.505 1.00 33.26 N ATOM 349 CA LEU A 37 -21.884 26.175 -19.690 1.00 36.34 C ATOM 350 C LEU A 37 -22.628 25.188 -20.571 1.00 36.66 C ATOM 351 O LEU A 37 -23.103 25.583 -21.642 1.00 43.46 O ATOM 352 CB LEU A 37 -22.878 26.666 -18.637 1.00 36.70 C ATOM 353 CG LEU A 37 -22.314 27.115 -17.317 1.00 37.93 C ATOM 354 CD1 LEU A 37 -23.433 27.679 -16.507 1.00 38.60 C ATOM 355 CD2 LEU A 37 -21.721 25.921 -16.601 1.00 42.69 C ATOM 356 H LEU A 37 -22.013 27.756 -21.204 1.00 0.00 H ATOM 357 N PRO A 38 -22.767 23.917 -20.142 1.00 33.70 N ATOM 358 CA PRO A 38 -23.670 23.083 -20.908 1.00 34.45 C ATOM 359 C PRO A 38 -25.057 23.693 -20.914 1.00 37.05 C ATOM 360 O PRO A 38 -25.442 24.394 -19.992 1.00 40.00 O ATOM 361 CB PRO A 38 -23.667 21.760 -20.149 1.00 33.05 C ATOM 362 CG PRO A 38 -22.368 21.741 -19.445 1.00 31.57 C ATOM 363 CD PRO A 38 -22.168 23.169 -19.038 1.00 32.71 C ATOM 364 N ARG A 39 -25.794 23.452 -21.979 1.00 40.13 N ATOM 365 CA ARG A 39 -27.118 24.014 -22.107 1.00 41.63 C ATOM 366 C ARG A 39 -28.059 23.399 -21.078 1.00 43.78 C ATOM 367 O ARG A 39 -28.902 24.116 -20.569 1.00 43.60 O ATOM 368 CB ARG A 39 -27.681 23.819 -23.512 1.00 41.37 C ATOM 369 CG ARG A 39 -28.941 24.636 -23.799 1.00 42.72 C ATOM 370 CD ARG A 39 -29.889 23.886 -24.707 1.00 44.08 C ATOM 371 NE ARG A 39 -29.862 22.429 -24.466 1.00 48.37 N ATOM 372 CZ ARG A 39 -30.684 21.751 -23.663 1.00 49.13 C ATOM 373 NH1 ARG A 39 -31.630 22.357 -22.968 1.00 48.74 N ATOM 374 NH2 ARG A 39 -30.564 20.438 -23.561 1.00 52.27 N ATOM 375 HE ARG A 39 -29.135 21.881 -24.969 1.00 0.00 H ATOM 376 HH12 ARG A 39 -32.257 21.803 -22.350 1.00 0.00 H ATOM 377 HH11 ARG A 39 -31.748 23.388 -23.039 1.00 0.00 H ATOM 378 HH22 ARG A 39 -31.202 19.904 -22.937 1.00 0.00 H ATOM 379 HH21 ARG A 39 -29.832 19.939 -24.105 1.00 0.00 H ATOM 380 H ARG A 39 -25.417 22.849 -22.738 1.00 0.00 H ATOM 381 N HIS A 40 -27.900 22.103 -20.761 1.00 45.96 N ATOM 382 CA HIS A 40 -28.780 21.411 -19.801 1.00 45.86 C ATOM 383 C HIS A 40 -28.489 21.790 -18.362 1.00 46.39 C ATOM 384 O HIS A 40 -29.139 21.290 -17.475 1.00 47.09 O ATOM 385 CB HIS A 40 -28.706 19.892 -19.943 1.00 44.35 C ATOM 386 CG HIS A 40 -27.346 19.333 -19.698 1.00 49.75 C ATOM 387 ND1 HIS A 40 -26.461 19.051 -20.723 1.00 53.67 N ATOM 388 CD2 HIS A 40 -26.707 19.006 -18.552 1.00 50.33 C ATOM 389 CE1 HIS A 40 -25.338 18.565 -20.217 1.00 51.49 C ATOM 390 NE2 HIS A 40 -25.462 18.525 -18.902 1.00 54.70 N ATOM 391 H HIS A 40 -27.128 21.569 -21.209 1.00 0.00 H ATOM 392 N SER A 41 -27.513 22.662 -18.133 1.00 47.99 N ATOM 393 CA SER A 41 -27.240 23.185 -16.807 1.00 46.07 C ATOM 394 C SER A 41 -28.292 24.186 -16.389 1.00 48.98 C ATOM 395 O SER A 41 -28.494 24.404 -15.194 1.00 51.25 O ATOM 396 CB SER A 41 -25.869 23.830 -16.785 1.00 47.64 C ATOM 397 OG SER A 41 -25.668 24.657 -17.926 1.00 56.87 O ATOM 398 HG SER A 41 -25.746 24.109 -18.747 1.00 0.00 H ATOM 399 H SER A 41 -26.925 22.980 -18.930 1.00 0.00 H ATOM 400 N GLN A 42 -28.992 24.764 -17.368 1.00 49.90 N ATOM 401 CA GLN A 42 -30.120 25.646 -17.116 1.00 50.14 C ATOM 402 C GLN A 42 -29.787 26.775 -16.161 1.00 49.87 C ATOM 403 O GLN A 42 -30.426 26.954 -15.114 1.00 55.19 O ATOM 404 CB GLN A 42 -31.312 24.856 -16.564 1.00 55.94 C ATOM 405 CG GLN A 42 -31.941 23.920 -17.553 1.00 58.96 C ATOM 406 CD GLN A 42 -32.246 24.654 -18.817 1.00 62.13 C ATOM 407 OE1 GLN A 42 -32.456 25.853 -18.795 1.00 61.60 O ATOM 408 NE2 GLN A 42 -32.207 23.956 -19.934 1.00 72.50 N ATOM 409 HE22 GLN A 42 -32.024 22.933 -19.902 1.00 0.00 H ATOM 410 HE21 GLN A 42 -32.359 24.428 -20.848 1.00 0.00 H ATOM 411 H GLN A 42 -28.719 24.575 -18.353 1.00 0.00 H ATOM 412 N PRO A 43 -28.775 27.556 -16.508 1.00 48.36 N ATOM 413 CA PRO A 43 -28.508 28.740 -15.719 1.00 49.76 C ATOM 414 C PRO A 43 -29.592 29.758 -15.970 1.00 54.95 C ATOM 415 O PRO A 43 -29.716 30.288 -17.074 1.00 71.01 O ATOM 416 CB PRO A 43 -27.193 29.235 -16.297 1.00 51.49 C ATOM 417 CG PRO A 43 -27.204 28.779 -17.729 1.00 48.11 C ATOM 418 CD PRO A 43 -27.955 27.486 -17.734 1.00 48.18 C ATOM 419 N GLY A 44 -30.411 30.032 -14.985 1.00 57.48 N ATOM 420 CA GLY A 44 -31.526 30.945 -15.254 1.00 58.12 C ATOM 421 C GLY A 44 -31.070 32.389 -15.293 1.00 54.26 C ATOM 422 O GLY A 44 -30.248 32.758 -16.119 1.00 48.31 O ATOM 423 H GLY A 44 -30.275 29.615 -14.042 1.00 0.00 H ATOM 424 N LYS A 45 -31.608 33.188 -14.371 1.00 52.54 N ATOM 425 CA LYS A 45 -31.278 34.600 -14.220 1.00 51.17 C ATOM 426 C LYS A 45 -30.158 34.773 -13.194 1.00 51.27 C ATOM 427 O LYS A 45 -29.632 35.882 -12.979 1.00 56.18 O ATOM 428 CB LYS A 45 -32.511 35.349 -13.714 1.00 53.62 C ATOM 429 CG LYS A 45 -33.852 34.953 -14.324 1.00 57.49 C ATOM 430 CD LYS A 45 -34.249 35.870 -15.459 1.00 64.07 C ATOM 431 CE LYS A 45 -35.195 35.163 -16.399 1.00 69.89 C ATOM 432 NZ LYS A 45 -35.057 35.776 -17.745 1.00 80.10 N ATOM 433 HZ1 LYS A 45 -35.296 36.787 -17.690 1.00 0.00 H ATOM 434 HZ2 LYS A 45 -34.077 35.667 -18.075 1.00 0.00 H ATOM 435 HZ3 LYS A 45 -35.702 35.302 -18.408 1.00 0.00 H ATOM 436 H LYS A 45 -32.307 32.778 -13.719 1.00 0.00 H ATOM 437 N THR A 46 -29.851 33.678 -12.508 1.00 51.53 N ATOM 438 CA THR A 46 -28.811 33.664 -11.495 1.00 50.64 C ATOM 439 C THR A 46 -28.071 32.363 -11.553 1.00 46.43 C ATOM 440 O THR A 46 -28.530 31.379 -12.151 1.00 46.95 O ATOM 441 CB THR A 46 -29.368 33.813 -10.053 1.00 52.98 C ATOM 442 OG1 THR A 46 -29.972 32.589 -9.606 1.00 55.29 O ATOM 443 CG2 THR A 46 -30.368 34.947 -9.944 1.00 53.46 C ATOM 444 HG1 THR A 46 -30.318 32.710 -8.686 1.00 0.00 H ATOM 445 H THR A 46 -30.374 32.800 -12.703 1.00 0.00 H ATOM 446 N ILE A 47 -26.929 32.368 -10.898 1.00 42.30 N ATOM 447 CA ILE A 47 -26.121 31.188 -10.818 1.00 44.11 C ATOM 448 C ILE A 47 -25.210 31.301 -9.598 1.00 44.13 C ATOM 449 O ILE A 47 -24.822 32.380 -9.174 1.00 40.85 O ATOM 450 CB ILE A 47 -25.273 30.996 -12.099 1.00 46.92 C ATOM 451 CG1 ILE A 47 -24.646 29.615 -12.106 1.00 51.24 C ATOM 452 CG2 ILE A 47 -24.146 32.040 -12.209 1.00 46.29 C ATOM 453 CD1 ILE A 47 -23.758 29.293 -13.285 1.00 54.67 C ATOM 454 H ILE A 47 -26.609 33.241 -10.432 1.00 0.00 H ATOM 455 N TRP A 48 -24.861 30.153 -9.084 1.00 45.37 N ATOM 456 CA TRP A 48 -23.948 30.034 -8.039 1.00 45.56 C ATOM 457 C TRP A 48 -22.512 29.742 -8.428 1.00 42.60 C ATOM 458 O TRP A 48 -22.206 28.638 -8.810 1.00 45.53 O ATOM 459 CB TRP A 48 -24.536 28.873 -7.295 1.00 51.70 C ATOM 460 CG TRP A 48 -24.850 29.204 -6.085 1.00 57.58 C ATOM 461 CD1 TRP A 48 -23.951 29.421 -5.182 1.00 71.12 C ATOM 462 CD2 TRP A 48 -26.103 29.508 -5.512 1.00 58.49 C ATOM 463 NE1 TRP A 48 -24.475 29.721 -4.050 1.00 85.16 N ATOM 464 CE2 TRP A 48 -25.795 29.900 -4.221 1.00 68.90 C ATOM 465 CE3 TRP A 48 -27.415 29.396 -5.893 1.00 54.56 C ATOM 466 CZ2 TRP A 48 -26.646 30.141 -3.299 1.00 73.02 C ATOM 467 CZ3 TRP A 48 -28.341 29.748 -4.926 1.00 59.73 C ATOM 468 CH2 TRP A 48 -27.911 30.160 -3.642 1.00 68.13 C ATOM 469 HE1 TRP A 48 -23.963 29.811 -3.149 1.00 0.00 H ATOM 470 H TRP A 48 -25.285 29.287 -9.473 1.00 0.00 H ATOM 471 N ILE A 49 -21.635 30.701 -8.196 1.00 41.91 N ATOM 472 CA ILE A 49 -20.248 30.572 -8.553 1.00 43.06 C ATOM 473 C ILE A 49 -19.396 30.490 -7.331 1.00 49.27 C ATOM 474 O ILE A 49 -18.962 31.502 -6.813 1.00 51.64 O ATOM 475 CB ILE A 49 -19.764 31.763 -9.380 1.00 40.49 C ATOM 476 CG1 ILE A 49 -20.601 31.839 -10.645 1.00 42.13 C ATOM 477 CG2 ILE A 49 -18.287 31.617 -9.685 1.00 37.66 C ATOM 478 CD1 ILE A 49 -20.422 33.115 -11.409 1.00 44.58 C ATOM 479 H ILE A 49 -21.958 31.578 -7.740 1.00 0.00 H ATOM 480 N GLU A 50 -19.095 29.260 -6.936 1.00 61.21 N ATOM 481 CA GLU A 50 -18.235 28.964 -5.802 1.00 65.14 C ATOM 482 C GLU A 50 -18.756 29.534 -4.519 1.00 66.69 C ATOM 483 O GLU A 50 -18.076 30.242 -3.869 1.00 77.03 O ATOM 484 CB GLU A 50 -16.838 29.525 -6.018 1.00 74.11 C ATOM 485 CG GLU A 50 -15.760 28.469 -6.195 1.00 88.82 C ATOM 486 CD GLU A 50 -14.833 28.819 -7.320 1.00105.16 C ATOM 487 OE1 GLU A 50 -14.940 29.981 -7.753 1.00129.72 O ATOM 488 OE2 GLU A 50 -14.047 27.949 -7.776 1.00106.82 O ATOM 489 H GLU A 50 -19.497 28.462 -7.468 1.00 0.00 H ATOM 490 N HIS A 51 -19.997 29.334 -4.195 1.00 67.97 N ATOM 491 CA HIS A 51 -20.481 29.614 -2.869 1.00 70.64 C ATOM 492 C HIS A 51 -21.144 31.008 -2.888 1.00 66.71 C ATOM 493 O HIS A 51 -21.782 31.389 -1.892 1.00 78.54 O ATOM 494 CB HIS A 51 -19.346 29.584 -1.817 1.00 81.37 C ATOM 495 CG HIS A 51 -18.525 28.316 -1.823 1.00 90.78 C ATOM 496 ND1 HIS A 51 -19.037 27.028 -1.731 1.00 87.84 N ATOM 497 CD2 HIS A 51 -17.188 28.180 -1.967 1.00104.85 C ATOM 498 CE1 HIS A 51 -18.046 26.148 -1.843 1.00 98.38 C ATOM 499 NE2 HIS A 51 -16.908 26.833 -1.933 1.00110.61 N ATOM 500 H HIS A 51 -20.656 28.963 -4.909 1.00 0.00 H ATOM 501 N LYS A 52 -21.074 31.762 -3.988 1.00 50.32 N ATOM 502 CA LYS A 52 -21.771 33.028 -4.006 1.00 52.45 C ATOM 503 C LYS A 52 -22.710 33.191 -5.196 1.00 50.10 C ATOM 504 O LYS A 52 -22.357 32.911 -6.324 1.00 48.15 O ATOM 505 CB LYS A 52 -20.809 34.219 -3.894 1.00 54.82 C ATOM 506 CG LYS A 52 -20.175 34.612 -5.193 1.00 63.45 C ATOM 507 CD LYS A 52 -20.365 36.091 -5.476 1.00 72.11 C ATOM 508 CE LYS A 52 -19.126 36.922 -5.183 1.00 75.13 C ATOM 509 NZ LYS A 52 -18.522 37.434 -6.452 1.00 72.75 N ATOM 510 HZ1 LYS A 52 -18.254 36.631 -7.056 1.00 0.00 H ATOM 511 HZ2 LYS A 52 -19.216 38.027 -6.950 1.00 0.00 H ATOM 512 HZ3 LYS A 52 -17.677 37.999 -6.229 1.00 0.00 H ATOM 513 H LYS A 52 -20.529 31.445 -4.815 1.00 0.00 H ATOM 514 N LEU A 53 -23.913 33.683 -4.912 1.00 48.08 N ATOM 515 CA LEU A 53 -24.887 34.013 -5.933 1.00 46.46 C ATOM 516 C LEU A 53 -24.483 35.137 -6.842 1.00 46.07 C ATOM 517 O LEU A 53 -24.264 36.241 -6.403 1.00 48.29 O ATOM 518 CB LEU A 53 -26.242 34.399 -5.322 1.00 47.18 C ATOM 519 CG LEU A 53 -27.401 34.264 -6.302 1.00 51.91 C ATOM 520 CD1 LEU A 53 -27.453 32.834 -6.832 1.00 51.48 C ATOM 521 CD2 LEU A 53 -28.719 34.635 -5.619 1.00 57.79 C ATOM 522 H LEU A 53 -24.165 33.837 -3.915 1.00 0.00 H ATOM 523 N VAL A 54 -24.476 34.855 -8.137 1.00 48.22 N ATOM 524 CA VAL A 54 -24.131 35.827 -9.152 1.00 46.98 C ATOM 525 C VAL A 54 -25.266 35.889 -10.135 1.00 49.16 C ATOM 526 O VAL A 54 -25.877 34.862 -10.501 1.00 44.97 O ATOM 527 CB VAL A 54 -22.863 35.425 -9.918 1.00 46.32 C ATOM 528 CG1 VAL A 54 -22.577 36.409 -11.054 1.00 45.44 C ATOM 529 CG2 VAL A 54 -21.698 35.325 -8.942 1.00 43.23 C ATOM 530 H VAL A 54 -24.730 33.892 -8.437 1.00 0.00 H ATOM 531 N ASN A 55 -25.540 37.119 -10.562 1.00 54.40 N ATOM 532 CA ASN A 55 -26.614 37.400 -11.513 1.00 51.02 C ATOM 533 C ASN A 55 -26.162 37.237 -12.916 1.00 49.80 C ATOM 534 O ASN A 55 -25.060 37.665 -13.290 1.00 54.94 O ATOM 535 CB ASN A 55 -27.125 38.835 -11.400 1.00 54.79 C ATOM 536 CG ASN A 55 -28.387 38.930 -10.610 1.00 57.77 C ATOM 537 OD1 ASN A 55 -29.218 38.026 -10.646 1.00 65.01 O ATOM 538 ND2 ASN A 55 -28.563 40.062 -9.919 1.00 58.90 N ATOM 539 HD22 ASN A 55 -27.825 40.795 -9.924 1.00 0.00 H ATOM 540 HD21 ASN A 55 -29.438 40.209 -9.377 1.00 0.00 H ATOM 541 H ASN A 55 -24.968 37.911 -10.205 1.00 0.00 H ATOM 542 N ILE A 56 -27.031 36.657 -13.724 1.00 45.94 N ATOM 543 CA ILE A 56 -26.740 36.530 -15.129 1.00 43.16 C ATOM 544 C ILE A 56 -27.455 37.648 -15.876 1.00 43.26 C ATOM 545 O ILE A 56 -28.671 37.798 -15.791 1.00 41.84 O ATOM 546 CB ILE A 56 -27.170 35.165 -15.633 1.00 46.14 C ATOM 547 CG1 ILE A 56 -26.241 34.095 -15.061 1.00 45.60 C ATOM 548 CG2 ILE A 56 -27.126 35.119 -17.155 1.00 50.69 C ATOM 549 CD1 ILE A 56 -26.724 32.683 -15.352 1.00 47.58 C ATOM 550 H ILE A 56 -27.928 36.291 -13.345 1.00 0.00 H ATOM 551 N LEU A 57 -26.688 38.442 -16.607 1.00 45.60 N ATOM 552 CA LEU A 57 -27.248 39.545 -17.378 1.00 48.29 C ATOM 553 C LEU A 57 -27.847 39.113 -18.709 1.00 51.51 C ATOM 554 O LEU A 57 -28.821 39.693 -19.142 1.00 57.21 O ATOM 555 CB LEU A 57 -26.189 40.600 -17.609 1.00 47.73 C ATOM 556 CG LEU A 57 -25.610 41.122 -16.294 1.00 50.84 C ATOM 557 CD1 LEU A 57 -24.444 42.033 -16.620 1.00 54.17 C ATOM 558 CD2 LEU A 57 -26.656 41.847 -15.438 1.00 47.68 C ATOM 559 H LEU A 57 -25.662 38.275 -16.632 1.00 0.00 H ATOM 560 N ASP A 58 -27.275 38.104 -19.356 1.00 57.52 N ATOM 561 CA ASP A 58 -27.801 37.586 -20.625 1.00 61.07 C ATOM 562 C ASP A 58 -27.335 36.163 -20.866 1.00 61.83 C ATOM 563 O ASP A 58 -26.181 35.835 -20.594 1.00 70.17 O ATOM 564 CB ASP A 58 -27.338 38.442 -21.802 1.00 62.60 C ATOM 565 CG ASP A 58 -28.205 38.256 -23.033 1.00 72.92 C ATOM 566 OD1 ASP A 58 -29.434 38.143 -22.873 1.00 86.97 O ATOM 567 OD2 ASP A 58 -27.685 38.228 -24.167 1.00 86.74 O ATOM 568 H ASP A 58 -26.424 37.665 -18.949 1.00 0.00 H ATOM 569 N ALA A 59 -28.224 35.322 -21.383 1.00 57.06 N ATOM 570 CA ALA A 59 -27.892 33.939 -21.706 1.00 51.00 C ATOM 571 C ALA A 59 -28.277 33.703 -23.160 1.00 50.19 C ATOM 572 O ALA A 59 -29.270 34.249 -23.655 1.00 49.21 O ATOM 573 CB ALA A 59 -28.625 32.967 -20.781 1.00 48.88 C ATOM 574 H ALA A 59 -29.190 35.662 -21.564 1.00 0.00 H ATOM 575 N VAL A 60 -27.484 32.886 -23.840 1.00 46.05 N ATOM 576 CA VAL A 60 -27.713 32.575 -25.221 1.00 45.31 C ATOM 577 C VAL A 60 -27.475 31.100 -25.439 1.00 47.15 C ATOM 578 O VAL A 60 -26.366 30.617 -25.247 1.00 50.28 O ATOM 579 CB VAL A 60 -26.742 33.370 -26.108 1.00 48.45 C ATOM 580 CG1 VAL A 60 -26.917 32.999 -27.578 1.00 49.61 C ATOM 581 CG2 VAL A 60 -26.957 34.865 -25.919 1.00 49.88 C ATOM 582 H VAL A 60 -26.670 32.457 -23.356 1.00 0.00 H ATOM 583 N GLU A 61 -28.509 30.372 -25.842 1.00 50.39 N ATOM 584 CA GLU A 61 -28.366 28.937 -26.130 1.00 54.16 C ATOM 585 C GLU A 61 -27.978 28.780 -27.576 1.00 52.62 C ATOM 586 O GLU A 61 -28.737 29.121 -28.454 1.00 55.89 O ATOM 587 CB GLU A 61 -29.650 28.147 -25.856 1.00 58.77 C ATOM 588 CG GLU A 61 -30.066 28.120 -24.391 1.00 66.13 C ATOM 589 CD GLU A 61 -31.344 27.338 -24.137 1.00 78.24 C ATOM 590 OE1 GLU A 61 -31.889 26.731 -25.102 1.00 84.41 O ATOM 591 OE2 GLU A 61 -31.823 27.381 -22.967 1.00 75.64 O ATOM 592 H GLU A 61 -29.438 30.825 -25.956 1.00 0.00 H ATOM 593 N LEU A 62 -26.790 28.243 -27.817 1.00 54.50 N ATOM 594 CA LEU A 62 -26.242 28.144 -29.163 1.00 50.04 C ATOM 595 C LEU A 62 -26.869 27.001 -29.922 1.00 49.39 C ATOM 596 O LEU A 62 -26.911 25.860 -29.457 1.00 52.50 O ATOM 597 CB LEU A 62 -24.735 27.941 -29.121 1.00 47.89 C ATOM 598 CG LEU A 62 -23.951 29.006 -28.371 1.00 48.58 C ATOM 599 CD1 LEU A 62 -22.467 28.691 -28.458 1.00 49.81 C ATOM 600 CD2 LEU A 62 -24.242 30.392 -28.910 1.00 48.45 C ATOM 601 H LEU A 62 -26.231 27.880 -27.019 1.00 0.00 H ATOM 602 N VAL A 63 -27.355 27.335 -31.105 1.00 50.62 N ATOM 603 CA VAL A 63 -27.844 26.355 -32.065 1.00 52.01 C ATOM 604 C VAL A 63 -27.144 26.582 -33.400 1.00 50.09 C ATOM 605 O VAL A 63 -26.651 27.652 -33.662 1.00 46.25 O ATOM 606 CB VAL A 63 -29.364 26.474 -32.260 1.00 51.16 C ATOM 607 CG1 VAL A 63 -30.065 26.306 -30.928 1.00 53.41 C ATOM 608 CG2 VAL A 63 -29.733 27.808 -32.899 1.00 51.85 C ATOM 609 H VAL A 63 -27.390 28.342 -31.362 1.00 0.00 H ATOM 610 N ASP A 64 -27.097 25.564 -34.240 1.00 53.50 N ATOM 611 CA ASP A 64 -26.439 25.690 -35.522 1.00 55.13 C ATOM 612 C ASP A 64 -27.380 26.264 -36.586 1.00 58.09 C ATOM 613 O ASP A 64 -28.554 26.524 -36.324 1.00 52.41 O ATOM 614 CB ASP A 64 -25.881 24.341 -35.967 1.00 57.09 C ATOM 615 CG ASP A 64 -26.929 23.441 -36.553 1.00 57.84 C ATOM 616 OD1 ASP A 64 -28.146 23.697 -36.339 1.00 57.30 O ATOM 617 OD2 ASP A 64 -26.507 22.470 -37.214 1.00 53.29 O ATOM 618 H ASP A 64 -27.539 24.660 -33.976 1.00 0.00 H ATOM 619 N GLU A 65 -26.843 26.439 -37.787 1.00 62.69 N ATOM 620 CA GLU A 65 -27.557 27.080 -38.871 1.00 70.19 C ATOM 621 C GLU A 65 -28.957 26.501 -39.060 1.00 70.63 C ATOM 622 O GLU A 65 -29.916 27.241 -39.243 1.00 74.42 O ATOM 623 CB GLU A 65 -26.753 26.973 -40.175 1.00 78.49 C ATOM 624 CG GLU A 65 -26.877 25.640 -40.933 1.00 85.38 C ATOM 625 CD GLU A 65 -25.895 24.566 -40.460 1.00 90.78 C ATOM 626 OE1 GLU A 65 -24.847 24.913 -39.879 1.00 91.69 O ATOM 627 OE2 GLU A 65 -26.144 23.370 -40.700 1.00 87.42 O ATOM 628 H GLU A 65 -25.873 26.103 -37.956 1.00 0.00 H ATOM 629 N GLN A 66 -29.083 25.184 -38.968 1.00 67.45 N ATOM 630 CA GLN A 66 -30.369 24.533 -39.168 1.00 64.94 C ATOM 631 C GLN A 66 -31.272 24.665 -37.937 1.00 60.10 C ATOM 632 O GLN A 66 -32.357 24.096 -37.902 1.00 56.82 O ATOM 633 CB GLN A 66 -30.162 23.052 -39.453 1.00 72.16 C ATOM 634 CG GLN A 66 -29.101 22.757 -40.500 1.00 85.94 C ATOM 635 CD GLN A 66 -28.724 21.276 -40.524 1.00100.68 C ATOM 636 OE1 GLN A 66 -29.588 20.402 -40.390 1.00112.06 O ATOM 637 NE2 GLN A 66 -27.428 20.989 -40.655 1.00103.89 N ATOM 638 HE22 GLN A 66 -26.734 21.756 -40.765 1.00 0.00 H ATOM 639 HE21 GLN A 66 -27.111 19.998 -40.647 1.00 0.00 H ATOM 640 H GLN A 66 -28.247 24.606 -38.749 1.00 0.00 H ATOM 641 N GLY A 67 -30.806 25.371 -36.912 1.00 58.50 N ATOM 642 CA GLY A 67 -31.525 25.479 -35.658 1.00 55.33 C ATOM 643 C GLY A 67 -31.347 24.292 -34.725 1.00 51.08 C ATOM 644 O GLY A 67 -32.115 24.149 -33.784 1.00 51.35 O ATOM 645 H GLY A 67 -29.895 25.862 -37.013 1.00 0.00 H ATOM 646 N VAL A 68 -30.342 23.451 -34.959 1.00 46.35 N ATOM 647 CA VAL A 68 -30.142 22.271 -34.117 1.00 47.64 C ATOM 648 C VAL A 68 -29.307 22.614 -32.894 1.00 51.38 C ATOM 649 O VAL A 68 -28.298 23.307 -32.990 1.00 51.06 O ATOM 650 CB VAL A 68 -29.461 21.141 -34.882 1.00 45.29 C ATOM 651 CG1 VAL A 68 -29.223 19.939 -33.989 1.00 45.20 C ATOM 652 CG2 VAL A 68 -30.325 20.752 -36.062 1.00 46.24 C ATOM 653 H VAL A 68 -29.691 23.635 -35.749 1.00 0.00 H ATOM 654 N ASN A 69 -29.738 22.117 -31.740 1.00 51.19 N ATOM 655 CA ASN A 69 -29.023 22.331 -30.491 1.00 49.66 C ATOM 656 C ASN A 69 -27.526 22.084 -30.628 1.00 44.92 C ATOM 657 O ASN A 69 -27.102 21.176 -31.333 1.00 46.14 O ATOM 658 CB ASN A 69 -29.595 21.413 -29.411 1.00 52.75 C ATOM 659 CG ASN A 69 -28.801 21.460 -28.136 1.00 56.15 C ATOM 660 OD1 ASN A 69 -28.358 22.534 -27.721 1.00 58.49 O ATOM 661 ND2 ASN A 69 -28.569 20.295 -27.530 1.00 56.70 N ATOM 662 HD22 ASN A 69 -28.966 19.417 -27.921 1.00 0.00 H ATOM 663 HD21 ASN A 69 -27.991 20.264 -26.666 1.00 0.00 H ATOM 664 H ASN A 69 -30.614 21.557 -31.729 1.00 0.00 H ATOM 665 N LEU A 70 -26.727 22.909 -29.968 1.00 40.48 N ATOM 666 CA LEU A 70 -25.295 22.674 -29.883 1.00 36.70 C ATOM 667 C LEU A 70 -24.836 22.329 -28.479 1.00 37.60 C ATOM 668 O LEU A 70 -23.652 22.033 -28.302 1.00 33.25 O ATOM 669 CB LEU A 70 -24.529 23.882 -30.372 1.00 35.56 C ATOM 670 CG LEU A 70 -24.583 24.153 -31.874 1.00 35.57 C ATOM 671 CD1 LEU A 70 -23.687 25.336 -32.229 1.00 36.39 C ATOM 672 CD2 LEU A 70 -24.139 22.950 -32.675 1.00 33.67 C ATOM 673 H LEU A 70 -27.134 23.744 -29.500 1.00 0.00 H ATOM 674 N GLU A 71 -25.768 22.382 -27.511 1.00 37.70 N ATOM 675 CA GLU A 71 -25.542 21.967 -26.147 1.00 38.53 C ATOM 676 C GLU A 71 -24.617 22.930 -25.382 1.00 40.04 C ATOM 677 O GLU A 71 -23.899 22.568 -24.460 1.00 39.75 O ATOM 678 CB GLU A 71 -25.003 20.536 -26.132 1.00 41.14 C ATOM 679 CG GLU A 71 -25.214 19.850 -24.811 1.00 47.62 C ATOM 680 CD GLU A 71 -26.633 20.061 -24.306 1.00 54.02 C ATOM 681 OE1 GLU A 71 -27.546 20.367 -25.125 1.00 59.25 O ATOM 682 OE2 GLU A 71 -26.843 19.898 -23.080 1.00 55.97 O ATOM 683 H GLU A 71 -26.710 22.745 -27.761 1.00 0.00 H ATOM 684 N LEU A 72 -24.648 24.189 -25.775 1.00 42.39 N ATOM 685 CA LEU A 72 -23.823 25.203 -25.147 1.00 40.48 C ATOM 686 C LEU A 72 -24.665 26.428 -24.904 1.00 37.75 C ATOM 687 O LEU A 72 -25.504 26.802 -25.707 1.00 33.77 O ATOM 688 CB LEU A 72 -22.644 25.583 -26.044 1.00 42.57 C ATOM 689 CG LEU A 72 -21.582 24.510 -26.242 1.00 42.54 C ATOM 690 CD1 LEU A 72 -20.558 24.943 -27.270 1.00 41.51 C ATOM 691 CD2 LEU A 72 -20.892 24.231 -24.931 1.00 45.87 C ATOM 692 H LEU A 72 -25.280 24.461 -26.555 1.00 0.00 H ATOM 693 N THR A 73 -24.405 27.067 -23.784 1.00 37.85 N ATOM 694 CA THR A 73 -25.060 28.304 -23.443 1.00 38.08 C ATOM 695 C THR A 73 -24.012 29.326 -23.054 1.00 36.96 C ATOM 696 O THR A 73 -23.158 29.058 -22.215 1.00 37.91 O ATOM 697 CB THR A 73 -26.024 28.085 -22.276 1.00 39.57 C ATOM 698 OG1 THR A 73 -27.068 27.205 -22.702 1.00 40.71 O ATOM 699 CG2 THR A 73 -26.640 29.380 -21.817 1.00 39.30 C ATOM 700 HG1 THR A 73 -27.699 27.056 -21.953 1.00 0.00 H ATOM 701 H THR A 73 -23.706 26.668 -23.125 1.00 0.00 H ATOM 702 N LEU A 74 -24.090 30.496 -23.668 1.00 35.13 N ATOM 703 CA LEU A 74 -23.232 31.605 -23.317 1.00 38.17 C ATOM 704 C LEU A 74 -23.963 32.448 -22.302 1.00 39.19 C ATOM 705 O LEU A 74 -25.105 32.837 -22.534 1.00 44.37 O ATOM 706 CB LEU A 74 -22.930 32.466 -24.541 1.00 42.08 C ATOM 707 CG LEU A 74 -21.667 32.130 -25.318 1.00 46.48 C ATOM 708 CD1 LEU A 74 -21.467 30.628 -25.483 1.00 48.80 C ATOM 709 CD2 LEU A 74 -21.733 32.812 -26.676 1.00 47.44 C ATOM 710 H LEU A 74 -24.790 30.621 -24.427 1.00 0.00 H ATOM 711 N ILE A 75 -23.296 32.775 -21.197 1.00 37.54 N ATOM 712 CA ILE A 75 -23.898 33.617 -20.170 1.00 37.15 C ATOM 713 C ILE A 75 -23.009 34.782 -19.853 1.00 36.52 C ATOM 714 O ILE A 75 -21.795 34.635 -19.855 1.00 35.05 O ATOM 715 CB ILE A 75 -24.202 32.822 -18.886 1.00 38.74 C ATOM 716 CG1 ILE A 75 -22.921 32.349 -18.212 1.00 39.18 C ATOM 717 CG2 ILE A 75 -25.089 31.630 -19.238 1.00 39.70 C ATOM 718 CD1 ILE A 75 -23.173 31.411 -17.065 1.00 38.90 C ATOM 719 H ILE A 75 -22.327 32.423 -21.064 1.00 0.00 H ATOM 720 N THR A 76 -23.617 35.941 -19.594 1.00 39.87 N ATOM 721 CA THR A 76 -22.872 37.138 -19.156 1.00 42.99 C ATOM 722 C THR A 76 -23.160 37.435 -17.682 1.00 42.73 C ATOM 723 O THR A 76 -24.299 37.723 -17.306 1.00 41.69 O ATOM 724 CB THR A 76 -23.198 38.359 -20.036 1.00 43.31 C ATOM 725 OG1 THR A 76 -23.075 37.991 -21.419 1.00 43.55 O ATOM 726 CG2 THR A 76 -22.243 39.514 -19.751 1.00 43.17 C ATOM 727 HG1 THR A 76 -23.284 38.774 -21.987 1.00 0.00 H ATOM 728 H THR A 76 -24.649 36.003 -19.704 1.00 0.00 H ATOM 729 N LEU A 77 -22.111 37.385 -16.867 1.00 43.92 N ATOM 730 CA LEU A 77 -22.251 37.507 -15.421 1.00 49.02 C ATOM 731 C LEU A 77 -22.171 38.936 -14.984 1.00 52.32 C ATOM 732 O LEU A 77 -21.506 39.744 -15.619 1.00 56.63 O ATOM 733 CB LEU A 77 -21.138 36.749 -14.701 1.00 50.64 C ATOM 734 CG LEU A 77 -20.887 35.337 -15.217 1.00 49.52 C ATOM 735 CD1 LEU A 77 -19.671 34.760 -14.533 1.00 49.30 C ATOM 736 CD2 LEU A 77 -22.089 34.450 -14.995 1.00 48.25 C ATOM 737 H LEU A 77 -21.162 37.255 -17.273 1.00 0.00 H ATOM 738 N ASP A 78 -22.823 39.230 -13.868 1.00 57.09 N ATOM 739 CA ASP A 78 -22.775 40.543 -13.268 1.00 61.07 C ATOM 740 C ASP A 78 -21.766 40.536 -12.143 1.00 59.86 C ATOM 741 O ASP A 78 -22.108 40.281 -10.995 1.00 51.58 O ATOM 742 CB ASP A 78 -24.155 40.929 -12.759 1.00 68.08 C ATOM 743 CG ASP A 78 -24.217 42.349 -12.240 1.00 73.19 C ATOM 744 OD1 ASP A 78 -23.373 43.192 -12.605 1.00 79.95 O ATOM 745 OD2 ASP A 78 -25.149 42.631 -11.467 1.00 75.81 O ATOM 746 H ASP A 78 -23.389 38.489 -13.408 1.00 0.00 H ATOM 747 N THR A 79 -20.516 40.822 -12.499 1.00 63.15 N ATOM 748 CA THR A 79 -19.461 41.003 -11.509 1.00 70.05 C ATOM 749 C THR A 79 -18.414 42.037 -11.863 1.00 69.43 C ATOM 750 O THR A 79 -18.411 42.611 -12.937 1.00 72.98 O ATOM 751 CB THR A 79 -18.704 39.706 -11.233 1.00 68.97 C ATOM 752 OG1 THR A 79 -18.010 39.289 -12.410 1.00 59.37 O ATOM 753 CG2 THR A 79 -19.641 38.665 -10.645 1.00 75.36 C ATOM 754 HG1 THR A 79 -17.367 39.992 -12.679 1.00 0.00 H ATOM 755 H THR A 79 -20.286 40.919 -13.509 1.00 0.00 H ATOM 756 N ASN A 80 -17.522 42.264 -10.918 1.00 70.92 N ATOM 757 CA ASN A 80 -16.423 43.171 -11.107 1.00 73.09 C ATOM 758 C ASN A 80 -15.202 42.415 -11.440 1.00 67.03 C ATOM 759 O ASN A 80 -14.205 43.038 -11.694 1.00 71.43 O ATOM 760 CB ASN A 80 -16.158 43.958 -9.832 1.00 81.78 C ATOM 761 CG ASN A 80 -17.409 44.615 -9.288 1.00 92.18 C ATOM 762 OD1 ASN A 80 -17.596 44.711 -8.068 1.00112.03 O ATOM 763 ND2 ASN A 80 -18.280 45.075 -10.191 1.00 90.44 N ATOM 764 HD22 ASN A 80 -18.080 44.972 -11.206 1.00 0.00 H ATOM 765 HD21 ASN A 80 -19.158 45.536 -9.878 1.00 0.00 H ATOM 766 H ASN A 80 -17.617 41.771 -10.007 1.00 0.00 H ATOM 767 N GLU A 81 -15.261 41.082 -11.386 1.00 71.51 N ATOM 768 CA GLU A 81 -14.160 40.236 -11.847 1.00 72.13 C ATOM 769 C GLU A 81 -14.212 40.051 -13.369 1.00 64.90 C ATOM 770 O GLU A 81 -15.279 40.000 -13.982 1.00 60.26 O ATOM 771 CB GLU A 81 -14.139 38.871 -11.151 1.00 79.78 C ATOM 772 CG GLU A 81 -12.862 38.069 -11.458 1.00 90.70 C ATOM 773 CD GLU A 81 -13.081 36.568 -11.684 1.00 95.06 C ATOM 774 OE1 GLU A 81 -12.077 35.820 -11.831 1.00 87.37 O ATOM 775 OE2 GLU A 81 -14.247 36.110 -11.711 1.00 92.59 O ATOM 776 H GLU A 81 -16.117 40.631 -11.004 1.00 0.00 H ATOM 777 N LYS A 82 -13.028 40.012 -13.967 1.00 61.63 N ATOM 778 CA LYS A 82 -12.880 39.734 -15.371 1.00 57.57 C ATOM 779 C LYS A 82 -12.094 38.461 -15.533 1.00 49.53 C ATOM 780 O LYS A 82 -11.125 38.229 -14.810 1.00 52.33 O ATOM 781 CB LYS A 82 -12.201 40.901 -16.089 1.00 63.48 C ATOM 782 CG LYS A 82 -13.214 41.936 -16.592 1.00 73.29 C ATOM 783 CD LYS A 82 -12.770 42.647 -17.882 1.00 81.70 C ATOM 784 CE LYS A 82 -12.081 43.986 -17.605 1.00 90.36 C ATOM 785 NZ LYS A 82 -12.941 45.199 -17.762 1.00 91.85 N ATOM 786 HZ1 LYS A 82 -13.295 45.248 -18.739 1.00 0.00 H ATOM 787 HZ2 LYS A 82 -13.744 45.141 -17.104 1.00 0.00 H ATOM 788 HZ3 LYS A 82 -12.380 46.049 -17.552 1.00 0.00 H ATOM 789 H LYS A 82 -12.175 40.189 -13.399 1.00 0.00 H ATOM 790 N PHE A 83 -12.529 37.629 -16.468 1.00 41.83 N ATOM 791 CA PHE A 83 -11.775 36.428 -16.835 1.00 41.20 C ATOM 792 C PHE A 83 -10.571 36.768 -17.712 1.00 39.14 C ATOM 793 O PHE A 83 -10.636 37.648 -18.545 1.00 40.17 O ATOM 794 CB PHE A 83 -12.655 35.416 -17.585 1.00 39.33 C ATOM 795 CG PHE A 83 -13.697 34.773 -16.741 1.00 38.14 C ATOM 796 CD1 PHE A 83 -13.353 34.015 -15.651 1.00 38.08 C ATOM 797 CD2 PHE A 83 -15.032 34.924 -17.049 1.00 39.25 C ATOM 798 CE1 PHE A 83 -14.332 33.438 -14.867 1.00 38.36 C ATOM 799 CE2 PHE A 83 -16.012 34.359 -16.270 1.00 38.46 C ATOM 800 CZ PHE A 83 -15.664 33.611 -15.180 1.00 37.83 C ATOM 801 H PHE A 83 -13.426 37.833 -16.952 1.00 0.00 H ATOM 802 N ARG A 84 -9.468 36.077 -17.500 1.00 40.06 N ATOM 803 CA ARG A 84 -8.376 36.134 -18.426 1.00 43.48 C ATOM 804 C ARG A 84 -8.839 35.676 -19.840 1.00 45.56 C ATOM 805 O ARG A 84 -9.452 34.634 -20.004 1.00 46.76 O ATOM 806 CB ARG A 84 -7.219 35.278 -17.917 1.00 45.34 C ATOM 807 CG ARG A 84 -6.139 35.187 -18.953 1.00 52.71 C ATOM 808 CD ARG A 84 -5.131 34.105 -18.737 1.00 57.36 C ATOM 809 NE ARG A 84 -5.737 32.815 -18.507 1.00 58.41 N ATOM 810 CZ ARG A 84 -5.042 31.694 -18.532 1.00 59.07 C ATOM 811 NH1 ARG A 84 -3.750 31.692 -18.769 1.00 60.49 N ATOM 812 NH2 ARG A 84 -5.647 30.556 -18.303 1.00 61.43 N ATOM 813 HE ARG A 84 -6.758 32.768 -18.315 1.00 0.00 H ATOM 814 HH12 ARG A 84 -3.225 30.794 -18.783 1.00 0.00 H ATOM 815 HH11 ARG A 84 -3.252 32.588 -18.942 1.00 0.00 H ATOM 816 HH22 ARG A 84 -5.107 29.667 -18.321 1.00 0.00 H ATOM 817 HH21 ARG A 84 -6.668 30.541 -18.103 1.00 0.00 H ATOM 818 H ARG A 84 -9.390 35.483 -16.650 1.00 0.00 H ATOM 819 N ASP A 85 -8.506 36.453 -20.861 1.00 50.88 N ATOM 820 CA ASP A 85 -8.903 36.137 -22.239 1.00 50.77 C ATOM 821 C ASP A 85 -8.176 34.885 -22.776 1.00 49.50 C ATOM 822 O ASP A 85 -6.979 34.905 -23.024 1.00 58.66 O ATOM 823 CB ASP A 85 -8.643 37.348 -23.136 1.00 49.55 C ATOM 824 CG ASP A 85 -9.402 37.292 -24.435 1.00 52.50 C ATOM 825 OD1 ASP A 85 -9.630 36.195 -24.949 1.00 59.94 O ATOM 826 OD2 ASP A 85 -9.780 38.354 -24.961 1.00 52.88 O ATOM 827 H ASP A 85 -7.947 37.311 -20.681 1.00 0.00 H ATOM 828 N ILE A 86 -8.920 33.806 -22.957 1.00 42.40 N ATOM 829 CA ILE A 86 -8.369 32.564 -23.461 1.00 39.91 C ATOM 830 C ILE A 86 -8.963 32.207 -24.826 1.00 38.33 C ATOM 831 O ILE A 86 -8.857 31.066 -25.280 1.00 34.59 O ATOM 832 CB ILE A 86 -8.663 31.418 -22.491 1.00 43.32 C ATOM 833 CG1 ILE A 86 -10.174 31.257 -22.288 1.00 45.56 C ATOM 834 CG2 ILE A 86 -7.950 31.641 -21.166 1.00 43.64 C ATOM 835 CD1 ILE A 86 -10.551 29.905 -21.742 1.00 47.44 C ATOM 836 H ILE A 86 -9.934 33.851 -22.730 1.00 0.00 H ATOM 837 N THR A 87 -9.602 33.187 -25.472 1.00 38.42 N ATOM 838 CA THR A 87 -10.166 33.019 -26.814 1.00 35.63 C ATOM 839 C THR A 87 -9.106 32.592 -27.799 1.00 36.25 C ATOM 840 O THR A 87 -9.412 31.907 -28.749 1.00 35.82 O ATOM 841 CB THR A 87 -10.793 34.323 -27.366 1.00 36.22 C ATOM 842 OG1 THR A 87 -10.101 35.467 -26.879 1.00 38.77 O ATOM 843 CG2 THR A 87 -12.173 34.506 -26.901 1.00 39.29 C ATOM 844 HG1 THR A 87 -10.149 35.484 -25.890 1.00 0.00 H ATOM 845 H THR A 87 -9.703 34.109 -25.002 1.00 0.00 H ATOM 846 N LYS A 88 -7.859 32.993 -27.572 1.00 39.48 N ATOM 847 CA LYS A 88 -6.758 32.626 -28.454 1.00 41.24 C ATOM 848 C LYS A 88 -6.361 31.181 -28.309 1.00 38.39 C ATOM 849 O LYS A 88 -5.630 30.679 -29.140 1.00 39.97 O ATOM 850 CB LYS A 88 -5.527 33.487 -28.180 1.00 45.32 C ATOM 851 CG LYS A 88 -4.863 33.231 -26.836 1.00 51.14 C ATOM 852 CD LYS A 88 -4.843 34.478 -25.980 1.00 57.32 C ATOM 853 CE LYS A 88 -3.606 34.460 -25.107 1.00 65.28 C ATOM 854 NZ LYS A 88 -3.404 35.758 -24.394 1.00 73.81 N ATOM 855 HZ1 LYS A 88 -3.299 36.522 -25.091 1.00 0.00 H ATOM 856 HZ2 LYS A 88 -4.227 35.951 -23.788 1.00 0.00 H ATOM 857 HZ3 LYS A 88 -2.546 35.701 -23.808 1.00 0.00 H ATOM 858 H LYS A 88 -7.663 33.586 -26.740 1.00 0.00 H ATOM 859 N PHE A 89 -6.790 30.530 -27.236 1.00 37.57 N ATOM 860 CA PHE A 89 -6.488 29.124 -27.044 1.00 39.38 C ATOM 861 C PHE A 89 -7.547 28.245 -27.678 1.00 39.62 C ATOM 862 O PHE A 89 -7.331 27.053 -27.876 1.00 38.28 O ATOM 863 CB PHE A 89 -6.344 28.783 -25.574 1.00 38.65 C ATOM 864 CG PHE A 89 -5.288 29.563 -24.884 1.00 40.11 C ATOM 865 CD1 PHE A 89 -4.049 29.683 -25.442 1.00 41.91 C ATOM 866 CD2 PHE A 89 -5.539 30.180 -23.668 1.00 42.74 C ATOM 867 CE1 PHE A 89 -3.066 30.399 -24.819 1.00 43.25 C ATOM 868 CE2 PHE A 89 -4.568 30.912 -23.035 1.00 42.09 C ATOM 869 CZ PHE A 89 -3.327 31.015 -23.614 1.00 44.16 C ATOM 870 H PHE A 89 -7.352 31.035 -26.521 1.00 0.00 H ATOM 871 N ILE A 90 -8.672 28.850 -28.024 1.00 39.97 N ATOM 872 CA ILE A 90 -9.741 28.150 -28.708 1.00 41.05 C ATOM 873 C ILE A 90 -9.454 28.265 -30.192 1.00 43.21 C ATOM 874 O ILE A 90 -9.166 29.352 -30.675 1.00 48.05 O ATOM 875 CB ILE A 90 -11.097 28.778 -28.380 1.00 38.63 C ATOM 876 CG1 ILE A 90 -11.263 28.848 -26.877 1.00 42.09 C ATOM 877 CG2 ILE A 90 -12.203 27.913 -28.896 1.00 39.94 C ATOM 878 CD1 ILE A 90 -12.567 29.429 -26.384 1.00 43.85 C ATOM 879 H ILE A 90 -8.793 29.858 -27.798 1.00 0.00 H ATOM 880 N PRO A 91 -9.536 27.154 -30.925 1.00 43.46 N ATOM 881 CA PRO A 91 -9.280 27.196 -32.362 1.00 44.53 C ATOM 882 C PRO A 91 -10.421 27.793 -33.153 1.00 44.34 C ATOM 883 O PRO A 91 -11.508 27.943 -32.620 1.00 43.90 O ATOM 884 CB PRO A 91 -9.040 25.726 -32.728 1.00 45.30 C ATOM 885 CG PRO A 91 -9.737 24.950 -31.696 1.00 46.65 C ATOM 886 CD PRO A 91 -9.803 25.792 -30.442 1.00 45.82 C ATOM 887 N GLU A 92 -10.158 28.153 -34.409 1.00 48.46 N ATOM 888 CA GLU A 92 -11.211 28.683 -35.290 1.00 49.98 C ATOM 889 C GLU A 92 -12.115 27.616 -35.841 1.00 49.02 C ATOM 890 O GLU A 92 -13.255 27.912 -36.171 1.00 51.62 O ATOM 891 CB GLU A 92 -10.620 29.422 -36.460 1.00 56.22 C ATOM 892 CG GLU A 92 -9.590 30.447 -36.050 1.00 63.87 C ATOM 893 CD GLU A 92 -9.580 31.608 -37.003 1.00 67.67 C ATOM 894 OE1 GLU A 92 -10.152 32.660 -36.636 1.00 71.80 O ATOM 895 OE2 GLU A 92 -9.032 31.441 -38.119 1.00 65.42 O ATOM 896 H GLU A 92 -9.189 28.057 -34.774 1.00 0.00 H ATOM 897 N ASN A 93 -11.612 26.384 -35.941 1.00 49.42 N ATOM 898 CA ASN A 93 -12.398 25.247 -36.423 1.00 47.16 C ATOM 899 C ASN A 93 -12.413 24.120 -35.420 1.00 44.11 C ATOM 900 O ASN A 93 -11.384 23.803 -34.846 1.00 39.92 O ATOM 901 CB ASN A 93 -11.802 24.693 -37.707 1.00 49.31 C ATOM 902 CG ASN A 93 -11.660 25.733 -38.780 1.00 49.29 C ATOM 903 OD1 ASN A 93 -10.538 26.095 -39.138 1.00 52.65 O ATOM 904 ND2 ASN A 93 -12.790 26.224 -39.301 1.00 46.80 N ATOM 905 HD22 ASN A 93 -13.711 25.882 -38.961 1.00 0.00 H ATOM 906 HD21 ASN A 93 -12.747 26.948 -40.046 1.00 0.00 H ATOM 907 H ASN A 93 -10.622 26.225 -35.665 1.00 0.00 H ATOM 908 N ILE A 94 -13.571 23.479 -35.261 1.00 46.45 N ATOM 909 CA ILE A 94 -13.722 22.388 -34.294 1.00 46.17 C ATOM 910 C ILE A 94 -12.694 21.332 -34.598 1.00 43.89 C ATOM 911 O ILE A 94 -12.691 20.769 -35.643 1.00 44.61 O ATOM 912 CB ILE A 94 -15.154 21.824 -34.286 1.00 46.52 C ATOM 913 CG1 ILE A 94 -16.054 22.862 -33.590 1.00 50.92 C ATOM 914 CG2 ILE A 94 -15.207 20.461 -33.589 1.00 46.14 C ATOM 915 CD1 ILE A 94 -17.539 22.652 -33.768 1.00 52.83 C ATOM 916 H ILE A 94 -14.389 23.761 -35.838 1.00 0.00 H ATOM 917 N SER A 95 -11.816 21.086 -33.653 1.00 48.96 N ATOM 918 CA SER A 95 -10.627 20.301 -33.888 1.00 51.25 C ATOM 919 C SER A 95 -10.632 18.993 -33.118 1.00 45.77 C ATOM 920 O SER A 95 -11.082 18.929 -31.988 1.00 44.28 O ATOM 921 CB SER A 95 -9.395 21.135 -33.481 1.00 54.92 C ATOM 922 OG SER A 95 -9.424 22.413 -34.123 1.00 56.92 O ATOM 923 HG SER A 95 -10.245 22.897 -33.855 1.00 0.00 H ATOM 924 H SER A 95 -11.983 21.470 -32.701 1.00 0.00 H ATOM 925 N THR A 96 -10.053 17.966 -33.728 1.00 43.14 N ATOM 926 CA THR A 96 -9.760 16.727 -33.009 1.00 41.49 C ATOM 927 C THR A 96 -8.470 16.889 -32.204 1.00 40.36 C ATOM 928 O THR A 96 -7.896 17.972 -32.145 1.00 39.77 O ATOM 929 CB THR A 96 -9.602 15.551 -33.952 1.00 41.90 C ATOM 930 OG1 THR A 96 -8.374 15.686 -34.662 1.00 43.06 O ATOM 931 CG2 THR A 96 -10.760 15.497 -34.916 1.00 45.10 C ATOM 932 HG1 THR A 96 -8.265 14.920 -35.280 1.00 0.00 H ATOM 933 H THR A 96 -9.803 18.044 -34.735 1.00 0.00 H ATOM 934 N ALA A 97 -8.042 15.832 -31.541 1.00 39.69 N ATOM 935 CA ALA A 97 -6.863 15.921 -30.690 1.00 46.20 C ATOM 936 C ALA A 97 -6.513 14.557 -30.183 1.00 50.61 C ATOM 937 O ALA A 97 -7.368 13.688 -30.072 1.00 47.58 O ATOM 938 CB ALA A 97 -7.083 16.842 -29.493 1.00 48.89 C ATOM 939 H ALA A 97 -8.550 14.929 -31.626 1.00 0.00 H ATOM 940 N SER A 98 -5.228 14.385 -29.877 1.00 57.04 N ATOM 941 CA SER A 98 -4.715 13.162 -29.242 1.00 64.19 C ATOM 942 C SER A 98 -4.339 13.465 -27.833 1.00 64.39 C ATOM 943 O SER A 98 -3.768 14.513 -27.567 1.00 61.03 O ATOM 944 CB SER A 98 -3.423 12.656 -29.866 1.00 67.39 C ATOM 945 OG SER A 98 -3.000 13.511 -30.871 1.00 73.73 O ATOM 946 HG SER A 98 -2.160 13.166 -31.264 1.00 0.00 H ATOM 947 H SER A 98 -4.558 15.149 -30.097 1.00 0.00 H ATOM 948 N ASP A 99 -4.581 12.503 -26.948 1.00 61.93 N ATOM 949 CA ASP A 99 -4.157 12.616 -25.577 1.00 64.53 C ATOM 950 C ASP A 99 -4.729 13.863 -24.924 1.00 57.15 C ATOM 951 O ASP A 99 -4.030 14.622 -24.260 1.00 58.69 O ATOM 952 CB ASP A 99 -2.619 12.631 -25.512 1.00 73.45 C ATOM 953 CG ASP A 99 -2.044 11.276 -25.202 1.00 84.50 C ATOM 954 OD1 ASP A 99 -2.151 10.403 -26.089 1.00 88.01 O ATOM 955 OD2 ASP A 99 -1.489 11.095 -24.080 1.00 93.79 O ATOM 956 H ASP A 99 -5.089 11.648 -27.253 1.00 0.00 H ATOM 957 N ALA A 100 -6.016 14.071 -25.104 1.00 52.19 N ATOM 958 CA ALA A 100 -6.667 15.205 -24.496 1.00 46.66 C ATOM 959 C ALA A 100 -6.776 14.986 -23.004 1.00 42.86 C ATOM 960 O ALA A 100 -6.554 13.897 -22.500 1.00 45.01 O ATOM 961 CB ALA A 100 -8.048 15.408 -25.095 1.00 47.12 C ATOM 962 H ALA A 100 -6.568 13.412 -25.690 1.00 0.00 H ATOM 963 N THR A 101 -7.104 16.050 -22.300 1.00 39.24 N ATOM 964 CA THR A 101 -7.276 15.992 -20.879 1.00 35.67 C ATOM 965 C THR A 101 -8.528 16.745 -20.530 1.00 35.62 C ATOM 966 O THR A 101 -8.771 17.856 -21.017 1.00 36.44 O ATOM 967 CB THR A 101 -6.093 16.643 -20.187 1.00 36.86 C ATOM 968 OG1 THR A 101 -4.924 15.848 -20.433 1.00 37.25 O ATOM 969 CG2 THR A 101 -6.347 16.784 -18.687 1.00 37.02 C ATOM 970 HG1 THR A 101 -4.144 16.263 -19.986 1.00 0.00 H ATOM 971 H THR A 101 -7.242 16.957 -22.789 1.00 0.00 H ATOM 972 N LEU A 102 -9.340 16.132 -19.690 1.00 35.04 N ATOM 973 CA LEU A 102 -10.605 16.716 -19.329 1.00 34.92 C ATOM 974 C LEU A 102 -10.426 17.386 -17.959 1.00 34.55 C ATOM 975 O LEU A 102 -10.143 16.716 -16.954 1.00 37.01 O ATOM 976 CB LEU A 102 -11.655 15.615 -19.333 1.00 35.45 C ATOM 977 CG LEU A 102 -13.103 16.015 -19.129 1.00 38.13 C ATOM 978 CD1 LEU A 102 -13.510 16.983 -20.207 1.00 41.67 C ATOM 979 CD2 LEU A 102 -14.034 14.815 -19.108 1.00 36.84 C ATOM 980 H LEU A 102 -9.063 15.216 -19.284 1.00 0.00 H ATOM 981 N VAL A 103 -10.539 18.711 -17.931 1.00 31.57 N ATOM 982 CA VAL A 103 -10.313 19.496 -16.701 1.00 30.67 C ATOM 983 C VAL A 103 -11.631 19.741 -16.028 1.00 31.06 C ATOM 984 O VAL A 103 -12.462 20.491 -16.526 1.00 29.97 O ATOM 985 CB VAL A 103 -9.725 20.874 -17.006 1.00 31.53 C ATOM 986 CG1 VAL A 103 -9.609 21.735 -15.755 1.00 31.62 C ATOM 987 CG2 VAL A 103 -8.379 20.723 -17.671 1.00 32.42 C ATOM 988 H VAL A 103 -10.795 19.211 -18.806 1.00 0.00 H ATOM 989 N ILE A 104 -11.823 19.109 -14.887 1.00 34.45 N ATOM 990 CA ILE A 104 -13.058 19.248 -14.155 1.00 38.25 C ATOM 991 C ILE A 104 -12.820 20.051 -12.877 1.00 38.81 C ATOM 992 O ILE A 104 -11.819 19.874 -12.209 1.00 40.04 O ATOM 993 CB ILE A 104 -13.620 17.861 -13.826 1.00 42.79 C ATOM 994 CG1 ILE A 104 -14.069 17.178 -15.107 1.00 45.48 C ATOM 995 CG2 ILE A 104 -14.807 17.941 -12.856 1.00 48.02 C ATOM 996 CD1 ILE A 104 -13.710 15.713 -15.112 1.00 51.81 C ATOM 997 H ILE A 104 -11.071 18.499 -14.508 1.00 0.00 H ATOM 998 N ASN A 105 -13.759 20.915 -12.531 1.00 38.75 N ATOM 999 CA ASN A 105 -13.673 21.646 -11.286 1.00 40.60 C ATOM 1000 C ASN A 105 -15.037 21.889 -10.674 1.00 42.50 C ATOM 1001 O ASN A 105 -15.595 22.975 -10.760 1.00 44.69 O ATOM 1002 CB ASN A 105 -12.976 22.976 -11.530 1.00 43.02 C ATOM 1003 CG ASN A 105 -12.569 23.667 -10.251 1.00 40.12 C ATOM 1004 OD1 ASN A 105 -12.507 23.049 -9.203 1.00 33.97 O ATOM 1005 ND2 ASN A 105 -12.315 24.973 -10.337 1.00 42.56 N ATOM 1006 HD22 ASN A 105 -12.381 25.456 -11.255 1.00 0.00 H ATOM 1007 HD21 ASN A 105 -12.050 25.508 -9.486 1.00 0.00 H ATOM 1008 H ASN A 105 -14.570 21.071 -13.163 1.00 0.00 H ATOM 1009 N THR A 106 -15.547 20.855 -10.034 1.00 46.38 N ATOM 1010 CA THR A 106 -16.842 20.871 -9.384 1.00 44.86 C ATOM 1011 C THR A 106 -16.594 20.856 -7.891 1.00 44.80 C ATOM 1012 O THR A 106 -15.486 20.567 -7.399 1.00 43.08 O ATOM 1013 CB THR A 106 -17.622 19.629 -9.811 1.00 48.73 C ATOM 1014 OG1 THR A 106 -18.038 19.784 -11.161 1.00 66.93 O ATOM 1015 CG2 THR A 106 -18.837 19.388 -9.039 1.00 52.66 C ATOM 1016 HG1 THR A 106 -18.544 18.981 -11.443 1.00 0.00 H ATOM 1017 H THR A 106 -14.988 19.979 -9.993 1.00 0.00 H ATOM 1018 N GLU A 107 -17.633 21.199 -7.158 1.00 48.97 N ATOM 1019 CA GLU A 107 -17.589 21.137 -5.711 1.00 47.47 C ATOM 1020 C GLU A 107 -17.470 19.704 -5.236 1.00 46.66 C ATOM 1021 O GLU A 107 -16.809 19.468 -4.268 1.00 47.20 O ATOM 1022 CB GLU A 107 -18.824 21.777 -5.120 1.00 55.78 C ATOM 1023 CG GLU A 107 -18.567 22.477 -3.790 1.00 62.70 C ATOM 1024 CD GLU A 107 -19.759 22.416 -2.866 1.00 68.94 C ATOM 1025 OE1 GLU A 107 -20.819 22.976 -3.225 1.00 79.33 O ATOM 1026 OE2 GLU A 107 -19.695 21.677 -1.858 1.00 69.30 O ATOM 1027 H GLU A 107 -18.503 21.521 -7.628 1.00 0.00 H ATOM 1028 N HIS A 108 -18.078 18.740 -5.928 1.00 48.11 N ATOM 1029 CA HIS A 108 -17.853 17.302 -5.626 1.00 48.55 C ATOM 1030 C HIS A 108 -16.588 16.685 -6.258 1.00 45.26 C ATOM 1031 O HIS A 108 -16.092 15.668 -5.795 1.00 43.23 O ATOM 1032 CB HIS A 108 -19.077 16.475 -6.007 1.00 54.48 C ATOM 1033 CG HIS A 108 -20.311 16.841 -5.238 1.00 64.40 C ATOM 1034 ND1 HIS A 108 -20.274 17.493 -4.019 1.00 60.25 N ATOM 1035 CD2 HIS A 108 -21.624 16.642 -5.523 1.00 67.87 C ATOM 1036 CE1 HIS A 108 -21.510 17.699 -3.600 1.00 62.26 C ATOM 1037 NE2 HIS A 108 -22.345 17.184 -4.488 1.00 69.14 N ATOM 1038 H HIS A 108 -18.726 19.001 -6.699 1.00 0.00 H ATOM 1039 N MET A 109 -16.067 17.303 -7.309 1.00 41.97 N ATOM 1040 CA MET A 109 -14.849 16.850 -7.962 1.00 39.62 C ATOM 1041 C MET A 109 -13.984 18.056 -8.309 1.00 36.58 C ATOM 1042 O MET A 109 -13.967 18.513 -9.468 1.00 35.38 O ATOM 1043 CB MET A 109 -15.191 16.063 -9.236 1.00 44.64 C ATOM 1044 CG MET A 109 -15.658 14.634 -9.003 1.00 47.45 C ATOM 1045 SD MET A 109 -16.343 13.946 -10.511 1.00 53.57 S ATOM 1046 CE MET A 109 -17.933 14.735 -10.522 1.00 60.08 C ATOM 1047 H MET A 109 -16.549 18.146 -7.682 1.00 0.00 H ATOM 1048 N PRO A 110 -13.253 18.594 -7.319 1.00 34.37 N ATOM 1049 CA PRO A 110 -12.456 19.766 -7.566 1.00 33.30 C ATOM 1050 C PRO A 110 -11.051 19.463 -8.093 1.00 33.17 C ATOM 1051 O PRO A 110 -10.407 18.535 -7.666 1.00 33.22 O ATOM 1052 CB PRO A 110 -12.368 20.379 -6.195 1.00 31.58 C ATOM 1053 CG PRO A 110 -12.254 19.189 -5.309 1.00 31.63 C ATOM 1054 CD PRO A 110 -12.997 18.086 -5.969 1.00 33.69 C ATOM 1055 N SER A 111 -10.615 20.260 -9.055 1.00 37.16 N ATOM 1056 CA SER A 111 -9.315 20.127 -9.683 1.00 37.64 C ATOM 1057 C SER A 111 -8.994 18.716 -10.101 1.00 36.71 C ATOM 1058 O SER A 111 -8.046 18.116 -9.636 1.00 39.33 O ATOM 1059 CB SER A 111 -8.272 20.630 -8.746 1.00 38.37 C ATOM 1060 OG SER A 111 -8.690 21.887 -8.272 1.00 42.80 O ATOM 1061 HG SER A 111 -8.012 22.244 -7.645 1.00 0.00 H ATOM 1062 H SER A 111 -11.240 21.025 -9.379 1.00 0.00 H ATOM 1063 N MET A 112 -9.811 18.198 -11.001 1.00 36.53 N ATOM 1064 CA MET A 112 -9.719 16.826 -11.439 1.00 37.42 C ATOM 1065 C MET A 112 -9.278 16.816 -12.879 1.00 35.11 C ATOM 1066 O MET A 112 -9.905 17.476 -13.716 1.00 31.28 O ATOM 1067 CB MET A 112 -11.092 16.164 -11.308 1.00 40.14 C ATOM 1068 CG MET A 112 -11.107 14.705 -11.673 1.00 43.30 C ATOM 1069 SD MET A 112 -12.745 13.995 -11.568 1.00 46.47 S ATOM 1070 CE MET A 112 -12.286 12.255 -11.417 1.00 48.36 C ATOM 1071 H MET A 112 -10.551 18.804 -11.410 1.00 0.00 H ATOM 1072 N PHE A 113 -8.197 16.085 -13.165 1.00 34.64 N ATOM 1073 CA PHE A 113 -7.759 15.893 -14.525 1.00 36.81 C ATOM 1074 C PHE A 113 -7.991 14.440 -14.913 1.00 37.91 C ATOM 1075 O PHE A 113 -7.599 13.519 -14.196 1.00 36.29 O ATOM 1076 CB PHE A 113 -6.299 16.212 -14.719 1.00 38.20 C ATOM 1077 CG PHE A 113 -5.914 17.663 -14.547 1.00 44.69 C ATOM 1078 CD1 PHE A 113 -6.779 18.765 -14.559 1.00 47.83 C ATOM 1079 CD2 PHE A 113 -4.592 17.916 -14.475 1.00 54.59 C ATOM 1080 CE1 PHE A 113 -6.324 20.043 -14.384 1.00 50.08 C ATOM 1081 CE2 PHE A 113 -4.130 19.187 -14.294 1.00 59.65 C ATOM 1082 CZ PHE A 113 -5.003 20.242 -14.211 1.00 55.98 C ATOM 1083 H PHE A 113 -7.660 15.645 -12.390 1.00 0.00 H ATOM 1084 N VAL A 114 -8.598 14.255 -16.084 1.00 38.07 N ATOM 1085 CA VAL A 114 -8.955 12.951 -16.579 1.00 36.58 C ATOM 1086 C VAL A 114 -8.380 12.833 -17.957 1.00 38.78 C ATOM 1087 O VAL A 114 -8.632 13.697 -18.799 1.00 42.44 O ATOM 1088 CB VAL A 114 -10.455 12.836 -16.705 1.00 38.79 C ATOM 1089 CG1 VAL A 114 -10.860 11.444 -17.174 1.00 39.28 C ATOM 1090 CG2 VAL A 114 -11.090 13.174 -15.371 1.00 42.89 C ATOM 1091 H VAL A 114 -8.824 15.087 -16.665 1.00 0.00 H ATOM 1092 N PRO A 115 -7.600 11.764 -18.202 1.00 40.52 N ATOM 1093 CA PRO A 115 -6.997 11.530 -19.493 1.00 37.73 C ATOM 1094 C PRO A 115 -7.964 10.818 -20.374 1.00 35.38 C ATOM 1095 O PRO A 115 -7.957 9.600 -20.459 1.00 37.71 O ATOM 1096 CB PRO A 115 -5.797 10.659 -19.173 1.00 38.52 C ATOM 1097 CG PRO A 115 -6.217 9.875 -17.989 1.00 40.32 C ATOM 1098 CD PRO A 115 -7.171 10.754 -17.216 1.00 42.51 C ATOM 1099 N VAL A 116 -8.799 11.592 -21.043 1.00 34.59 N ATOM 1100 CA VAL A 116 -9.781 11.018 -21.936 1.00 34.49 C ATOM 1101 C VAL A 116 -9.149 10.396 -23.171 1.00 35.05 C ATOM 1102 O VAL A 116 -9.762 9.576 -23.819 1.00 34.46 O ATOM 1103 CB VAL A 116 -10.838 12.038 -22.358 1.00 32.72 C ATOM 1104 CG1 VAL A 116 -11.610 12.474 -21.138 1.00 33.27 C ATOM 1105 CG2 VAL A 116 -10.216 13.217 -23.080 1.00 32.28 C ATOM 1106 H VAL A 116 -8.750 12.624 -20.927 1.00 0.00 H ATOM 1107 N GLY A 117 -7.933 10.797 -23.497 1.00 38.01 N ATOM 1108 CA GLY A 117 -7.261 10.262 -24.663 1.00 43.02 C ATOM 1109 C GLY A 117 -7.562 11.025 -25.942 1.00 46.83 C ATOM 1110 O GLY A 117 -7.564 12.267 -25.956 1.00 45.85 O ATOM 1111 H GLY A 117 -7.452 11.507 -22.908 1.00 0.00 H ATOM 1112 N ASP A 118 -7.817 10.267 -27.019 1.00 49.68 N ATOM 1113 CA ASP A 118 -8.043 10.847 -28.339 1.00 46.83 C ATOM 1114 C ASP A 118 -9.468 11.300 -28.485 1.00 44.56 C ATOM 1115 O ASP A 118 -10.403 10.626 -28.062 1.00 45.41 O ATOM 1116 CB ASP A 118 -7.664 9.886 -29.463 1.00 48.83 C ATOM 1117 CG ASP A 118 -6.146 9.639 -29.552 1.00 59.43 C ATOM 1118 OD1 ASP A 118 -5.370 10.119 -28.677 1.00 60.91 O ATOM 1119 OD2 ASP A 118 -5.728 8.927 -30.495 1.00 65.75 O ATOM 1120 H ASP A 118 -7.855 9.233 -26.910 1.00 0.00 H ATOM 1121 N VAL A 119 -9.616 12.476 -29.076 1.00 43.29 N ATOM 1122 CA VAL A 119 -10.921 13.088 -29.302 1.00 40.83 C ATOM 1123 C VAL A 119 -11.124 13.131 -30.806 1.00 37.24 C ATOM 1124 O VAL A 119 -10.336 13.757 -31.520 1.00 35.60 O ATOM 1125 CB VAL A 119 -10.974 14.537 -28.730 1.00 39.09 C ATOM 1126 CG1 VAL A 119 -12.339 15.155 -28.936 1.00 38.06 C ATOM 1127 CG2 VAL A 119 -10.609 14.558 -27.261 1.00 38.00 C ATOM 1128 H VAL A 119 -8.766 12.985 -29.392 1.00 0.00 H ATOM 1129 N VAL A 120 -12.174 12.480 -31.283 1.00 37.38 N ATOM 1130 CA VAL A 120 -12.415 12.361 -32.727 1.00 39.96 C ATOM 1131 C VAL A 120 -13.721 13.001 -33.099 1.00 44.70 C ATOM 1132 O VAL A 120 -14.540 13.251 -32.228 1.00 53.05 O ATOM 1133 CB VAL A 120 -12.445 10.902 -33.194 1.00 37.43 C ATOM 1134 CG1 VAL A 120 -11.138 10.218 -32.843 1.00 36.55 C ATOM 1135 CG2 VAL A 120 -13.614 10.169 -32.581 1.00 37.29 C ATOM 1136 H VAL A 120 -12.844 12.042 -30.619 1.00 0.00 H ATOM 1137 N GLN A 121 -13.927 13.257 -34.388 1.00 49.05 N ATOM 1138 CA GLN A 121 -15.191 13.828 -34.857 1.00 52.06 C ATOM 1139 C GLN A 121 -16.261 12.802 -34.655 1.00 46.71 C ATOM 1140 O GLN A 121 -16.032 11.626 -34.844 1.00 43.14 O ATOM 1141 CB GLN A 121 -15.158 14.231 -36.349 1.00 58.29 C ATOM 1142 CG GLN A 121 -14.135 15.308 -36.726 1.00 70.68 C ATOM 1143 CD GLN A 121 -14.451 16.734 -36.222 1.00 80.23 C ATOM 1144 OE1 GLN A 121 -15.322 16.956 -35.362 1.00 94.79 O ATOM 1145 NE2 GLN A 121 -13.714 17.708 -36.751 1.00 78.62 N ATOM 1146 HE22 GLN A 121 -12.995 17.485 -37.468 1.00 0.00 H ATOM 1147 HE21 GLN A 121 -13.858 18.692 -36.447 1.00 0.00 H ATOM 1148 H GLN A 121 -13.176 13.048 -35.076 1.00 0.00 H ATOM 1149 N TYR A 122 -17.429 13.254 -34.251 1.00 47.20 N ATOM 1150 CA TYR A 122 -18.573 12.382 -34.132 1.00 46.46 C ATOM 1151 C TYR A 122 -19.768 12.982 -34.857 1.00 44.87 C ATOM 1152 O TYR A 122 -20.496 12.271 -35.509 1.00 46.74 O ATOM 1153 CB TYR A 122 -18.895 12.149 -32.665 1.00 48.15 C ATOM 1154 CG TYR A 122 -19.704 10.903 -32.418 1.00 51.94 C ATOM 1155 CD1 TYR A 122 -19.119 9.636 -32.499 1.00 49.58 C ATOM 1156 CD2 TYR A 122 -21.056 10.991 -32.087 1.00 55.94 C ATOM 1157 CE1 TYR A 122 -19.861 8.497 -32.266 1.00 52.29 C ATOM 1158 CE2 TYR A 122 -21.808 9.855 -31.858 1.00 59.16 C ATOM 1159 CZ TYR A 122 -21.213 8.610 -31.954 1.00 58.87 C ATOM 1160 OH TYR A 122 -21.984 7.491 -31.715 1.00 59.46 O ATOM 1161 HH TYR A 122 -21.427 6.679 -31.820 1.00 0.00 H ATOM 1162 H TYR A 122 -17.530 14.261 -34.012 1.00 0.00 H ATOM 1163 N GLY A 123 -19.999 14.273 -34.701 1.00 43.40 N ATOM 1164 CA GLY A 123 -21.061 14.943 -35.410 1.00 45.80 C ATOM 1165 C GLY A 123 -22.370 14.818 -34.660 1.00 47.31 C ATOM 1166 O GLY A 123 -22.457 15.227 -33.524 1.00 46.61 O ATOM 1167 H GLY A 123 -19.400 14.820 -34.050 1.00 0.00 H ATOM 1168 N PHE A 124 -23.392 14.243 -35.296 1.00 50.02 N ATOM 1169 CA PHE A 124 -24.715 14.161 -34.685 1.00 48.23 C ATOM 1170 C PHE A 124 -24.679 13.262 -33.450 1.00 52.27 C ATOM 1171 O PHE A 124 -23.923 12.273 -33.433 1.00 54.25 O ATOM 1172 CB PHE A 124 -25.701 13.583 -35.670 1.00 44.22 C ATOM 1173 CG PHE A 124 -27.027 13.277 -35.074 1.00 44.71 C ATOM 1174 CD1 PHE A 124 -27.276 12.046 -34.481 1.00 47.62 C ATOM 1175 CD2 PHE A 124 -28.041 14.214 -35.116 1.00 45.09 C ATOM 1176 CE1 PHE A 124 -28.524 11.768 -33.925 1.00 50.69 C ATOM 1177 CE2 PHE A 124 -29.290 13.942 -34.583 1.00 46.56 C ATOM 1178 CZ PHE A 124 -29.530 12.725 -33.973 1.00 50.02 C ATOM 1179 H PHE A 124 -23.243 13.846 -36.245 1.00 0.00 H ATOM 1180 N LEU A 125 -25.495 13.583 -32.438 1.00 46.62 N ATOM 1181 CA LEU A 125 -25.648 12.706 -31.292 1.00 46.07 C ATOM 1182 C LEU A 125 -26.972 12.916 -30.620 1.00 49.29 C ATOM 1183 O LEU A 125 -27.402 14.043 -30.460 1.00 50.58 O ATOM 1184 CB LEU A 125 -24.552 12.976 -30.296 1.00 48.09 C ATOM 1185 CG LEU A 125 -24.668 12.263 -28.947 1.00 48.37 C ATOM 1186 CD1 LEU A 125 -24.006 10.896 -28.964 1.00 49.60 C ATOM 1187 CD2 LEU A 125 -23.993 13.133 -27.914 1.00 49.45 C ATOM 1188 H LEU A 125 -26.028 14.475 -32.474 1.00 0.00 H ATOM 1189 N ASN A 126 -27.623 11.817 -30.241 1.00 58.05 N ATOM 1190 CA ASN A 126 -28.899 11.879 -29.526 1.00 61.03 C ATOM 1191 C ASN A 126 -28.647 11.940 -28.036 1.00 59.99 C ATOM 1192 O ASN A 126 -28.408 10.930 -27.385 1.00 57.53 O ATOM 1193 CB ASN A 126 -29.805 10.687 -29.854 1.00 63.43 C ATOM 1194 CG ASN A 126 -31.128 10.685 -29.066 1.00 65.80 C ATOM 1195 OD1 ASN A 126 -31.869 9.682 -29.080 1.00 83.57 O ATOM 1196 ND2 ASN A 126 -31.464 11.806 -28.419 1.00 61.15 N ATOM 1197 HD22 ASN A 126 -30.822 12.624 -28.428 1.00 0.00 H ATOM 1198 HD21 ASN A 126 -32.367 11.860 -27.907 1.00 0.00 H ATOM 1199 H ASN A 126 -27.212 10.887 -30.460 1.00 0.00 H ATOM 1200 N LEU A 127 -28.740 13.142 -27.504 1.00 60.52 N ATOM 1201 CA LEU A 127 -28.432 13.358 -26.133 1.00 58.08 C ATOM 1202 C LEU A 127 -29.732 13.399 -25.361 1.00 55.86 C ATOM 1203 O LEU A 127 -30.380 14.438 -25.235 1.00 53.33 O ATOM 1204 CB LEU A 127 -27.664 14.640 -26.035 1.00 60.21 C ATOM 1205 CG LEU A 127 -27.009 14.931 -24.718 1.00 61.43 C ATOM 1206 CD1 LEU A 127 -25.534 14.582 -24.632 1.00 61.91 C ATOM 1207 CD2 LEU A 127 -27.152 16.417 -24.661 1.00 66.22 C ATOM 1208 H LEU A 127 -29.043 13.943 -28.095 1.00 0.00 H ATOM 1209 N SER A 128 -30.122 12.227 -24.873 1.00 54.96 N ATOM 1210 CA SER A 128 -31.251 12.095 -23.965 1.00 54.34 C ATOM 1211 C SER A 128 -32.463 12.739 -24.598 1.00 53.64 C ATOM 1212 O SER A 128 -33.111 13.564 -23.986 1.00 52.30 O ATOM 1213 CB SER A 128 -30.946 12.748 -22.596 1.00 58.36 C ATOM 1214 OG SER A 128 -29.972 12.029 -21.859 1.00 60.20 O ATOM 1215 HG SER A 128 -29.128 11.994 -22.376 1.00 0.00 H ATOM 1216 H SER A 128 -29.601 11.371 -25.150 1.00 0.00 H ATOM 1217 N GLY A 129 -32.762 12.382 -25.837 1.00 60.31 N ATOM 1218 CA GLY A 129 -33.945 12.909 -26.519 1.00 58.51 C ATOM 1219 C GLY A 129 -33.726 14.194 -27.267 1.00 56.80 C ATOM 1220 O GLY A 129 -34.533 14.544 -28.105 1.00 57.20 O ATOM 1221 H GLY A 129 -32.143 11.712 -26.337 1.00 0.00 H ATOM 1222 N LYS A 130 -32.635 14.895 -26.978 1.00 59.23 N ATOM 1223 CA LYS A 130 -32.318 16.136 -27.676 1.00 57.88 C ATOM 1224 C LYS A 130 -31.285 15.897 -28.793 1.00 57.96 C ATOM 1225 O LYS A 130 -30.139 15.512 -28.525 1.00 56.39 O ATOM 1226 CB LYS A 130 -31.768 17.142 -26.690 1.00 57.25 C ATOM 1227 CG LYS A 130 -31.792 18.562 -27.194 1.00 64.64 C ATOM 1228 CD LYS A 130 -32.827 19.405 -26.455 1.00 68.45 C ATOM 1229 CE LYS A 130 -32.820 20.860 -26.900 1.00 71.44 C ATOM 1230 NZ LYS A 130 -33.733 21.109 -28.057 1.00 74.54 N ATOM 1231 HZ1 LYS A 130 -33.435 20.525 -28.864 1.00 0.00 H ATOM 1232 HZ2 LYS A 130 -34.707 20.860 -27.789 1.00 0.00 H ATOM 1233 HZ3 LYS A 130 -33.691 22.114 -28.320 1.00 0.00 H ATOM 1234 H LYS A 130 -31.992 14.551 -26.237 1.00 0.00 H ATOM 1235 N PRO A 131 -31.678 16.114 -30.052 1.00 54.44 N ATOM 1236 CA PRO A 131 -30.695 15.954 -31.139 1.00 54.16 C ATOM 1237 C PRO A 131 -29.592 17.014 -31.044 1.00 51.76 C ATOM 1238 O PRO A 131 -29.891 18.173 -30.749 1.00 54.24 O ATOM 1239 CB PRO A 131 -31.528 16.119 -32.430 1.00 54.62 C ATOM 1240 CG PRO A 131 -32.956 16.319 -31.997 1.00 56.52 C ATOM 1241 CD PRO A 131 -32.979 16.619 -30.517 1.00 54.29 C ATOM 1242 N THR A 132 -28.342 16.619 -31.265 1.00 50.02 N ATOM 1243 CA THR A 132 -27.222 17.518 -31.077 1.00 52.43 C ATOM 1244 C THR A 132 -26.173 17.381 -32.167 1.00 52.81 C ATOM 1245 O THR A 132 -25.859 16.269 -32.608 1.00 55.06 O ATOM 1246 CB THR A 132 -26.566 17.299 -29.695 1.00 54.61 C ATOM 1247 OG1 THR A 132 -27.514 17.598 -28.665 1.00 55.27 O ATOM 1248 CG2 THR A 132 -25.360 18.213 -29.492 1.00 54.97 C ATOM 1249 HG1 THR A 132 -28.299 17.001 -28.757 1.00 0.00 H ATOM 1250 H THR A 132 -28.165 15.644 -31.580 1.00 0.00 H ATOM 1251 N HIS A 133 -25.629 18.529 -32.579 1.00 51.20 N ATOM 1252 CA HIS A 133 -24.607 18.569 -33.605 1.00 51.89 C ATOM 1253 C HIS A 133 -23.224 19.016 -33.116 1.00 51.17 C ATOM 1254 O HIS A 133 -23.042 19.531 -32.015 1.00 52.11 O ATOM 1255 CB HIS A 133 -25.049 19.477 -34.756 1.00 52.30 C ATOM 1256 CG HIS A 133 -26.076 18.869 -35.653 1.00 54.52 C ATOM 1257 ND1 HIS A 133 -26.767 19.606 -36.598 1.00 52.18 N ATOM 1258 CD2 HIS A 133 -26.529 17.596 -35.760 1.00 55.21 C ATOM 1259 CE1 HIS A 133 -27.603 18.812 -37.242 1.00 51.81 C ATOM 1260 NE2 HIS A 133 -27.476 17.589 -36.757 1.00 54.32 N ATOM 1261 H HIS A 133 -25.949 19.421 -32.150 1.00 0.00 H ATOM 1262 N ARG A 134 -22.247 18.801 -33.986 1.00 50.39 N ATOM 1263 CA ARG A 134 -20.886 19.262 -33.790 1.00 42.55 C ATOM 1264 C ARG A 134 -20.223 18.660 -32.574 1.00 40.89 C ATOM 1265 O ARG A 134 -19.336 19.254 -32.017 1.00 44.74 O ATOM 1266 CB ARG A 134 -20.870 20.763 -33.693 1.00 39.40 C ATOM 1267 CG ARG A 134 -21.389 21.454 -34.914 1.00 38.13 C ATOM 1268 CD ARG A 134 -20.830 22.842 -34.935 1.00 40.45 C ATOM 1269 NE ARG A 134 -21.581 23.710 -35.810 1.00 42.32 N ATOM 1270 CZ ARG A 134 -21.705 25.024 -35.663 1.00 45.53 C ATOM 1271 NH1 ARG A 134 -21.177 25.706 -34.651 1.00 48.86 N ATOM 1272 NH2 ARG A 134 -22.402 25.666 -36.571 1.00 51.54 N ATOM 1273 HE ARG A 134 -22.064 23.271 -36.620 1.00 0.00 H ATOM 1274 HH12 ARG A 134 -21.310 26.736 -34.592 1.00 0.00 H ATOM 1275 HH11 ARG A 134 -20.631 25.210 -33.918 1.00 0.00 H ATOM 1276 HH22 ARG A 134 -22.527 26.696 -36.499 1.00 0.00 H ATOM 1277 HH21 ARG A 134 -22.829 25.145 -37.363 1.00 0.00 H ATOM 1278 H ARG A 134 -22.468 18.274 -34.855 1.00 0.00 H ATOM 1279 N THR A 135 -20.624 17.457 -32.201 1.00 38.68 N ATOM 1280 CA THR A 135 -20.086 16.790 -31.051 1.00 38.72 C ATOM 1281 C THR A 135 -18.845 16.004 -31.410 1.00 40.71 C ATOM 1282 O THR A 135 -18.667 15.602 -32.550 1.00 40.49 O ATOM 1283 CB THR A 135 -21.106 15.810 -30.454 1.00 39.56 C ATOM 1284 OG1 THR A 135 -21.402 14.777 -31.404 1.00 45.19 O ATOM 1285 CG2 THR A 135 -22.389 16.531 -30.066 1.00 40.85 C ATOM 1286 HG1 THR A 135 -21.779 15.183 -32.224 1.00 0.00 H ATOM 1287 H THR A 135 -21.356 16.977 -32.762 1.00 0.00 H ATOM 1288 N MET A 136 -17.994 15.776 -30.411 1.00 44.05 N ATOM 1289 CA MET A 136 -16.809 14.945 -30.560 1.00 43.74 C ATOM 1290 C MET A 136 -16.879 13.862 -29.518 1.00 43.62 C ATOM 1291 O MET A 136 -17.660 13.957 -28.577 1.00 45.31 O ATOM 1292 CB MET A 136 -15.562 15.777 -30.387 1.00 48.07 C ATOM 1293 CG MET A 136 -15.581 16.964 -31.325 1.00 53.38 C ATOM 1294 SD MET A 136 -13.967 17.428 -31.930 1.00 59.70 S ATOM 1295 CE MET A 136 -13.353 18.304 -30.505 1.00 60.08 C ATOM 1296 H MET A 136 -18.185 16.210 -29.485 1.00 0.00 H ATOM 1297 N MET A 137 -16.085 12.814 -29.695 1.00 44.42 N ATOM 1298 CA MET A 137 -16.154 11.656 -28.817 1.00 45.86 C ATOM 1299 C MET A 137 -14.782 11.217 -28.363 1.00 45.15 C ATOM 1300 O MET A 137 -13.792 11.392 -29.067 1.00 46.40 O ATOM 1301 CB MET A 137 -16.790 10.495 -29.538 1.00 50.57 C ATOM 1302 CG MET A 137 -16.930 9.252 -28.688 1.00 52.58 C ATOM 1303 SD MET A 137 -16.357 7.735 -29.383 1.00 58.53 S ATOM 1304 CE MET A 137 -14.622 7.547 -29.589 1.00 54.75 C ATOM 1305 H MET A 137 -15.399 12.820 -30.477 1.00 0.00 H ATOM 1306 N TYR A 138 -14.732 10.665 -27.163 1.00 42.41 N ATOM 1307 CA TYR A 138 -13.534 10.052 -26.672 1.00 42.92 C ATOM 1308 C TYR A 138 -13.921 8.735 -26.062 1.00 43.61 C ATOM 1309 O TYR A 138 -14.963 8.604 -25.423 1.00 40.67 O ATOM 1310 CB TYR A 138 -12.817 10.959 -25.643 1.00 43.86 C ATOM 1311 CG TYR A 138 -13.689 12.021 -24.961 1.00 41.38 C ATOM 1312 CD1 TYR A 138 -13.900 13.260 -25.553 1.00 40.65 C ATOM 1313 CD2 TYR A 138 -14.280 11.789 -23.731 1.00 39.49 C ATOM 1314 CE1 TYR A 138 -14.683 14.226 -24.956 1.00 39.05 C ATOM 1315 CE2 TYR A 138 -15.059 12.761 -23.120 1.00 37.39 C ATOM 1316 CZ TYR A 138 -15.260 13.970 -23.745 1.00 37.91 C ATOM 1317 OH TYR A 138 -16.047 14.927 -23.151 1.00 37.11 O ATOM 1318 HH TYR A 138 -16.961 14.568 -23.023 1.00 0.00 H ATOM 1319 H TYR A 138 -15.581 10.676 -26.562 1.00 0.00 H ATOM 1320 N ASN A 139 -13.048 7.763 -26.220 1.00 47.04 N ATOM 1321 CA ASN A 139 -13.276 6.465 -25.587 1.00 54.10 C ATOM 1322 C ASN A 139 -12.836 6.420 -24.116 1.00 51.21 C ATOM 1323 O ASN A 139 -11.823 5.816 -23.774 1.00 55.18 O ATOM 1324 CB ASN A 139 -12.589 5.350 -26.391 1.00 58.89 C ATOM 1325 CG ASN A 139 -13.345 5.016 -27.660 1.00 64.25 C ATOM 1326 OD1 ASN A 139 -12.974 5.437 -28.748 1.00 69.62 O ATOM 1327 ND2 ASN A 139 -14.431 4.277 -27.508 1.00 66.80 N ATOM 1328 HD22 ASN A 139 -14.705 3.943 -26.562 1.00 0.00 H ATOM 1329 HD21 ASN A 139 -15.012 4.030 -28.335 1.00 0.00 H ATOM 1330 H ASN A 139 -12.196 7.918 -26.795 1.00 0.00 H ATOM 1331 N PHE A 140 -13.579 7.080 -23.242 1.00 47.16 N ATOM 1332 CA PHE A 140 -13.288 7.049 -21.800 1.00 44.32 C ATOM 1333 C PHE A 140 -14.607 7.039 -21.042 1.00 42.86 C ATOM 1334 O PHE A 140 -15.529 7.788 -21.415 1.00 46.03 O ATOM 1335 CB PHE A 140 -12.482 8.284 -21.358 1.00 46.84 C ATOM 1336 CG PHE A 140 -11.957 8.200 -19.931 1.00 47.42 C ATOM 1337 CD1 PHE A 140 -12.703 8.608 -18.869 1.00 44.92 C ATOM 1338 CD2 PHE A 140 -10.729 7.728 -19.674 1.00 45.32 C ATOM 1339 CE1 PHE A 140 -12.228 8.530 -17.580 1.00 42.68 C ATOM 1340 CE2 PHE A 140 -10.250 7.648 -18.379 1.00 46.16 C ATOM 1341 CZ PHE A 140 -11.006 8.044 -17.336 1.00 44.74 C ATOM 1342 H PHE A 140 -14.390 7.635 -23.583 1.00 0.00 H ATOM 1343 N PRO A 141 -14.722 6.217 -19.970 1.00 38.44 N ATOM 1344 CA PRO A 141 -16.010 6.151 -19.291 1.00 38.19 C ATOM 1345 C PRO A 141 -16.192 7.329 -18.372 1.00 39.81 C ATOM 1346 O PRO A 141 -15.886 7.237 -17.185 1.00 49.40 O ATOM 1347 CB PRO A 141 -15.905 4.863 -18.490 1.00 36.48 C ATOM 1348 CG PRO A 141 -14.459 4.788 -18.154 1.00 37.18 C ATOM 1349 CD PRO A 141 -13.771 5.250 -19.397 1.00 37.03 C ATOM 1350 N THR A 142 -16.686 8.432 -18.911 1.00 38.67 N ATOM 1351 CA THR A 142 -16.955 9.617 -18.100 1.00 38.99 C ATOM 1352 C THR A 142 -18.204 9.393 -17.254 1.00 39.53 C ATOM 1353 O THR A 142 -18.995 8.529 -17.555 1.00 36.40 O ATOM 1354 CB THR A 142 -17.161 10.844 -18.979 1.00 38.87 C ATOM 1355 OG1 THR A 142 -18.298 10.657 -19.822 1.00 37.61 O ATOM 1356 CG2 THR A 142 -15.943 11.084 -19.834 1.00 40.34 C ATOM 1357 HG1 THR A 142 -19.103 10.518 -19.263 1.00 0.00 H ATOM 1358 H THR A 142 -16.887 8.456 -19.931 1.00 0.00 H ATOM 1359 N LYS A 143 -18.376 10.162 -16.190 1.00 44.31 N ATOM 1360 CA LYS A 143 -19.476 9.910 -15.252 1.00 52.53 C ATOM 1361 C LYS A 143 -20.211 11.170 -14.892 1.00 47.14 C ATOM 1362 O LYS A 143 -19.802 12.245 -15.288 1.00 46.52 O ATOM 1363 CB LYS A 143 -18.984 9.173 -13.991 1.00 64.81 C ATOM 1364 CG LYS A 143 -17.700 9.702 -13.381 1.00 76.52 C ATOM 1365 CD LYS A 143 -17.000 8.650 -12.525 1.00 83.54 C ATOM 1366 CE LYS A 143 -17.438 8.713 -11.062 1.00 92.20 C ATOM 1367 NZ LYS A 143 -16.806 9.841 -10.309 1.00 91.67 N ATOM 1368 HZ1 LYS A 143 -15.772 9.730 -10.325 1.00 0.00 H ATOM 1369 HZ2 LYS A 143 -17.066 10.743 -10.756 1.00 0.00 H ATOM 1370 HZ3 LYS A 143 -17.142 9.831 -9.325 1.00 0.00 H ATOM 1371 H LYS A 143 -17.724 10.954 -16.017 1.00 0.00 H ATOM 1372 N ALA A 144 -21.308 11.026 -14.154 1.00 43.99 N ATOM 1373 CA ALA A 144 -22.140 12.156 -13.754 1.00 45.98 C ATOM 1374 C ALA A 144 -21.334 13.085 -12.876 1.00 44.91 C ATOM 1375 O ALA A 144 -20.418 12.643 -12.196 1.00 49.27 O ATOM 1376 CB ALA A 144 -23.365 11.671 -12.985 1.00 47.08 C ATOM 1377 H ALA A 144 -21.584 10.070 -13.850 1.00 0.00 H ATOM 1378 N GLY A 145 -21.683 14.361 -12.891 1.00 42.37 N ATOM 1379 CA GLY A 145 -20.976 15.370 -12.119 1.00 43.42 C ATOM 1380 C GLY A 145 -19.757 15.938 -12.819 1.00 43.17 C ATOM 1381 O GLY A 145 -19.098 16.841 -12.287 1.00 41.48 O ATOM 1382 H GLY A 145 -22.492 14.653 -13.476 1.00 0.00 H ATOM 1383 N GLN A 146 -19.469 15.419 -14.015 1.00 40.36 N ATOM 1384 CA GLN A 146 -18.326 15.850 -14.813 1.00 37.69 C ATOM 1385 C GLN A 146 -18.716 16.787 -15.935 1.00 37.92 C ATOM 1386 O GLN A 146 -17.853 17.283 -16.641 1.00 40.04 O ATOM 1387 CB GLN A 146 -17.609 14.652 -15.417 1.00 38.01 C ATOM 1388 CG GLN A 146 -16.983 13.774 -14.362 1.00 41.97 C ATOM 1389 CD GLN A 146 -16.121 12.666 -14.921 1.00 40.61 C ATOM 1390 OE1 GLN A 146 -16.266 12.255 -16.067 1.00 36.14 O ATOM 1391 NE2 GLN A 146 -15.208 12.179 -14.092 1.00 41.25 N ATOM 1392 HE22 GLN A 146 -15.124 12.561 -13.128 1.00 0.00 H ATOM 1393 HE21 GLN A 146 -14.576 11.415 -14.405 1.00 0.00 H ATOM 1394 H GLN A 146 -20.087 14.674 -14.395 1.00 0.00 H ATOM 1395 N CYS A 147 -19.999 17.061 -16.118 1.00 38.10 N ATOM 1396 CA CYS A 147 -20.382 17.888 -17.252 1.00 39.41 C ATOM 1397 C CYS A 147 -19.805 19.273 -17.077 1.00 36.80 C ATOM 1398 O CYS A 147 -19.646 19.756 -15.968 1.00 35.64 O ATOM 1399 CB CYS A 147 -21.891 18.015 -17.453 1.00 45.02 C ATOM 1400 SG CYS A 147 -22.579 16.574 -18.240 1.00 53.82 S ATOM 1401 H CYS A 147 -20.718 16.692 -15.464 1.00 0.00 H ATOM 1402 N GLY A 148 -19.505 19.908 -18.200 1.00 35.36 N ATOM 1403 CA GLY A 148 -18.972 21.245 -18.195 1.00 33.72 C ATOM 1404 C GLY A 148 -17.478 21.225 -18.236 1.00 31.65 C ATOM 1405 O GLY A 148 -16.870 22.246 -18.492 1.00 35.23 O ATOM 1406 H GLY A 148 -19.659 19.428 -19.110 1.00 0.00 H ATOM 1407 N GLY A 149 -16.884 20.069 -17.988 1.00 30.38 N ATOM 1408 CA GLY A 149 -15.439 19.947 -18.002 1.00 31.09 C ATOM 1409 C GLY A 149 -14.889 20.438 -19.323 1.00 31.59 C ATOM 1410 O GLY A 149 -15.586 20.447 -20.337 1.00 33.48 O ATOM 1411 H GLY A 149 -17.465 19.232 -17.779 1.00 0.00 H ATOM 1412 N VAL A 150 -13.633 20.854 -19.313 1.00 31.61 N ATOM 1413 CA VAL A 150 -13.003 21.471 -20.466 1.00 29.65 C ATOM 1414 C VAL A 150 -12.039 20.486 -21.095 1.00 31.11 C ATOM 1415 O VAL A 150 -11.032 20.110 -20.488 1.00 35.53 O ATOM 1416 CB VAL A 150 -12.228 22.711 -20.051 1.00 29.41 C ATOM 1417 CG1 VAL A 150 -11.964 23.579 -21.254 1.00 32.34 C ATOM 1418 CG2 VAL A 150 -13.032 23.530 -19.079 1.00 31.37 C ATOM 1419 H VAL A 150 -13.075 20.734 -18.444 1.00 0.00 H ATOM 1420 N VAL A 151 -12.340 20.068 -22.317 1.00 30.91 N ATOM 1421 CA VAL A 151 -11.463 19.186 -23.041 1.00 31.54 C ATOM 1422 C VAL A 151 -10.275 20.024 -23.560 1.00 33.12 C ATOM 1423 O VAL A 151 -10.484 21.027 -24.270 1.00 33.20 O ATOM 1424 CB VAL A 151 -12.204 18.554 -24.229 1.00 32.77 C ATOM 1425 CG1 VAL A 151 -11.263 17.642 -24.999 1.00 34.64 C ATOM 1426 CG2 VAL A 151 -13.417 17.760 -23.777 1.00 31.42 C ATOM 1427 H VAL A 151 -13.226 20.383 -22.760 1.00 0.00 H ATOM 1428 N THR A 152 -9.044 19.629 -23.209 1.00 32.84 N ATOM 1429 CA THR A 152 -7.857 20.371 -23.640 1.00 34.21 C ATOM 1430 C THR A 152 -6.744 19.487 -24.175 1.00 33.42 C ATOM 1431 O THR A 152 -6.611 18.346 -23.765 1.00 30.90 O ATOM 1432 CB THR A 152 -7.271 21.193 -22.492 1.00 35.18 C ATOM 1433 OG1 THR A 152 -6.761 20.315 -21.488 1.00 39.03 O ATOM 1434 CG2 THR A 152 -8.326 22.031 -21.875 1.00 36.66 C ATOM 1435 HG1 THR A 152 -7.495 19.746 -21.145 1.00 0.00 H ATOM 1436 H THR A 152 -8.929 18.780 -22.620 1.00 0.00 H ATOM 1437 N SER A 153 -5.922 20.058 -25.050 1.00 35.17 N ATOM 1438 CA SER A 153 -4.784 19.347 -25.640 1.00 38.77 C ATOM 1439 C SER A 153 -3.782 20.308 -26.300 1.00 41.92 C ATOM 1440 O SER A 153 -4.145 21.119 -27.152 1.00 42.69 O ATOM 1441 CB SER A 153 -5.257 18.343 -26.684 1.00 39.58 C ATOM 1442 OG SER A 153 -4.161 17.586 -27.164 1.00 40.02 O ATOM 1443 HG SER A 153 -4.480 16.938 -27.841 1.00 0.00 H ATOM 1444 H SER A 153 -6.093 21.046 -25.326 1.00 0.00 H ATOM 1445 N VAL A 154 -2.518 20.206 -25.902 1.00 44.80 N ATOM 1446 CA VAL A 154 -1.463 21.051 -26.439 1.00 44.27 C ATOM 1447 C VAL A 154 -1.886 22.507 -26.532 1.00 43.96 C ATOM 1448 O VAL A 154 -2.002 23.075 -27.602 1.00 40.48 O ATOM 1449 CB VAL A 154 -0.909 20.525 -27.785 1.00 44.94 C ATOM 1450 CG1 VAL A 154 -0.301 19.144 -27.596 1.00 43.07 C ATOM 1451 CG2 VAL A 154 -1.972 20.484 -28.877 1.00 46.09 C ATOM 1452 H VAL A 154 -2.275 19.497 -25.181 1.00 0.00 H ATOM 1453 N GLY A 155 -2.128 23.097 -25.375 1.00 47.00 N ATOM 1454 CA GLY A 155 -2.434 24.511 -25.303 1.00 48.23 C ATOM 1455 C GLY A 155 -3.640 24.884 -26.132 1.00 47.86 C ATOM 1456 O GLY A 155 -3.687 25.964 -26.718 1.00 51.56 O ATOM 1457 H GLY A 155 -2.098 22.536 -24.500 1.00 0.00 H ATOM 1458 N LYS A 156 -4.621 23.992 -26.181 1.00 48.25 N ATOM 1459 CA LYS A 156 -5.851 24.265 -26.897 1.00 47.77 C ATOM 1460 C LYS A 156 -7.072 23.814 -26.109 1.00 43.03 C ATOM 1461 O LYS A 156 -7.071 22.767 -25.466 1.00 41.77 O ATOM 1462 CB LYS A 156 -5.818 23.607 -28.261 1.00 55.39 C ATOM 1463 CG LYS A 156 -5.022 24.383 -29.285 1.00 67.56 C ATOM 1464 CD LYS A 156 -5.728 24.383 -30.632 1.00 85.09 C ATOM 1465 CE LYS A 156 -5.184 25.469 -31.567 1.00 97.27 C ATOM 1466 NZ LYS A 156 -4.928 24.941 -32.940 1.00101.77 N ATOM 1467 HZ1 LYS A 156 -4.229 24.172 -32.890 1.00 0.00 H ATOM 1468 HZ2 LYS A 156 -5.816 24.578 -33.342 1.00 0.00 H ATOM 1469 HZ3 LYS A 156 -4.561 25.706 -33.541 1.00 0.00 H ATOM 1470 H LYS A 156 -4.505 23.079 -25.696 1.00 0.00 H ATOM 1471 N VAL A 157 -8.100 24.652 -26.154 1.00 38.53 N ATOM 1472 CA VAL A 157 -9.371 24.403 -25.519 1.00 34.63 C ATOM 1473 C VAL A 157 -10.304 24.037 -26.634 1.00 34.58 C ATOM 1474 O VAL A 157 -10.753 24.894 -27.413 1.00 37.50 O ATOM 1475 CB VAL A 157 -9.893 25.668 -24.822 1.00 33.43 C ATOM 1476 CG1 VAL A 157 -11.220 25.395 -24.158 1.00 34.46 C ATOM 1477 CG2 VAL A 157 -8.896 26.132 -23.785 1.00 33.43 C ATOM 1478 H VAL A 157 -7.982 25.542 -26.679 1.00 0.00 H ATOM 1479 N ILE A 158 -10.622 22.767 -26.717 1.00 34.48 N ATOM 1480 CA ILE A 158 -11.284 22.274 -27.898 1.00 37.34 C ATOM 1481 C ILE A 158 -12.748 21.945 -27.710 1.00 37.05 C ATOM 1482 O ILE A 158 -13.491 21.927 -28.684 1.00 41.64 O ATOM 1483 CB ILE A 158 -10.534 21.071 -28.486 1.00 39.95 C ATOM 1484 CG1 ILE A 158 -10.700 19.834 -27.609 1.00 43.91 C ATOM 1485 CG2 ILE A 158 -9.061 21.414 -28.640 1.00 38.10 C ATOM 1486 CD1 ILE A 158 -9.752 18.709 -28.025 1.00 47.99 C ATOM 1487 H ILE A 158 -10.398 22.120 -25.935 1.00 0.00 H ATOM 1488 N GLY A 159 -13.186 21.681 -26.494 1.00 36.52 N ATOM 1489 CA GLY A 159 -14.578 21.242 -26.311 1.00 37.59 C ATOM 1490 C GLY A 159 -15.053 21.285 -24.891 1.00 35.28 C ATOM 1491 O GLY A 159 -14.259 21.481 -24.003 1.00 38.37 O ATOM 1492 H GLY A 159 -12.554 21.782 -25.674 1.00 0.00 H ATOM 1493 N ILE A 160 -16.345 21.055 -24.683 1.00 33.90 N ATOM 1494 CA ILE A 160 -16.964 21.060 -23.345 1.00 30.60 C ATOM 1495 C ILE A 160 -17.761 19.786 -23.138 1.00 27.63 C ATOM 1496 O ILE A 160 -18.724 19.533 -23.822 1.00 26.58 O ATOM 1497 CB ILE A 160 -17.917 22.257 -23.205 1.00 30.76 C ATOM 1498 CG1 ILE A 160 -17.140 23.579 -23.336 1.00 31.74 C ATOM 1499 CG2 ILE A 160 -18.691 22.208 -21.893 1.00 30.57 C ATOM 1500 CD1 ILE A 160 -16.247 23.912 -22.138 1.00 32.95 C ATOM 1501 H ILE A 160 -16.951 20.862 -25.506 1.00 0.00 H ATOM 1502 N HIS A 161 -17.384 19.007 -22.152 1.00 27.54 N ATOM 1503 CA HIS A 161 -18.037 17.728 -21.918 1.00 28.34 C ATOM 1504 C HIS A 161 -19.509 17.906 -21.668 1.00 27.95 C ATOM 1505 O HIS A 161 -19.891 18.777 -20.946 1.00 24.99 O ATOM 1506 CB HIS A 161 -17.417 17.033 -20.724 1.00 29.49 C ATOM 1507 CG HIS A 161 -17.929 15.657 -20.502 1.00 30.52 C ATOM 1508 ND1 HIS A 161 -17.531 14.587 -21.266 1.00 31.64 N ATOM 1509 CD2 HIS A 161 -18.786 15.170 -19.581 1.00 32.85 C ATOM 1510 CE1 HIS A 161 -18.130 13.496 -20.831 1.00 34.92 C ATOM 1511 NE2 HIS A 161 -18.894 13.821 -19.805 1.00 35.58 N ATOM 1512 H HIS A 161 -16.608 19.308 -21.529 1.00 0.00 H ATOM 1513 N ILE A 162 -20.329 17.076 -22.295 1.00 32.07 N ATOM 1514 CA ILE A 162 -21.783 17.162 -22.162 1.00 35.82 C ATOM 1515 C ILE A 162 -22.493 15.825 -21.941 1.00 38.38 C ATOM 1516 O ILE A 162 -23.622 15.815 -21.487 1.00 38.61 O ATOM 1517 CB ILE A 162 -22.424 17.820 -23.387 1.00 38.60 C ATOM 1518 CG1 ILE A 162 -22.187 16.962 -24.630 1.00 41.61 C ATOM 1519 CG2 ILE A 162 -21.879 19.232 -23.563 1.00 39.14 C ATOM 1520 CD1 ILE A 162 -22.980 17.389 -25.843 1.00 44.66 C ATOM 1521 H ILE A 162 -19.924 16.336 -22.904 1.00 0.00 H ATOM 1522 N GLY A 163 -21.858 14.700 -22.240 1.00 41.33 N ATOM 1523 CA GLY A 163 -22.538 13.425 -22.090 1.00 43.91 C ATOM 1524 C GLY A 163 -21.649 12.213 -22.210 1.00 46.18 C ATOM 1525 O GLY A 163 -20.472 12.313 -22.542 1.00 45.13 O ATOM 1526 H GLY A 163 -20.876 14.730 -22.581 1.00 0.00 H ATOM 1527 N GLY A 164 -22.233 11.061 -21.894 1.00 49.29 N ATOM 1528 CA GLY A 164 -21.536 9.786 -21.945 1.00 49.96 C ATOM 1529 C GLY A 164 -22.468 8.620 -21.682 1.00 49.75 C ATOM 1530 O GLY A 164 -23.486 8.759 -20.991 1.00 46.45 O ATOM 1531 H GLY A 164 -23.230 11.072 -21.598 1.00 0.00 H ATOM 1532 N ASN A 165 -22.110 7.469 -22.251 1.00 50.50 N ATOM 1533 CA ASN A 165 -22.945 6.268 -22.220 1.00 46.43 C ATOM 1534 C ASN A 165 -22.349 5.156 -21.377 1.00 45.12 C ATOM 1535 O ASN A 165 -22.711 4.022 -21.542 1.00 50.76 O ATOM 1536 CB ASN A 165 -23.137 5.771 -23.640 1.00 44.70 C ATOM 1537 CG ASN A 165 -21.845 5.371 -24.290 1.00 47.27 C ATOM 1538 OD1 ASN A 165 -20.868 5.053 -23.623 1.00 48.34 O ATOM 1539 ND2 ASN A 165 -21.822 5.399 -25.610 1.00 51.69 N ATOM 1540 HD22 ASN A 165 -22.674 5.675 -26.139 1.00 0.00 H ATOM 1541 HD21 ASN A 165 -20.952 5.145 -26.120 1.00 0.00 H ATOM 1542 H ASN A 165 -21.193 7.422 -22.740 1.00 0.00 H ATOM 1543 N GLY A 166 -21.421 5.482 -20.489 1.00 46.02 N ATOM 1544 CA GLY A 166 -20.795 4.499 -19.623 1.00 46.83 C ATOM 1545 C GLY A 166 -19.502 3.964 -20.187 1.00 48.42 C ATOM 1546 O GLY A 166 -18.660 3.502 -19.443 1.00 47.63 O ATOM 1547 H GLY A 166 -21.131 6.478 -20.410 1.00 0.00 H ATOM 1548 N ARG A 167 -19.365 3.982 -21.509 1.00 54.31 N ATOM 1549 CA ARG A 167 -18.148 3.495 -22.172 1.00 59.14 C ATOM 1550 C ARG A 167 -17.443 4.559 -22.970 1.00 54.51 C ATOM 1551 O ARG A 167 -16.274 4.389 -23.303 1.00 52.58 O ATOM 1552 CB ARG A 167 -18.470 2.410 -23.189 1.00 71.08 C ATOM 1553 CG ARG A 167 -18.893 1.038 -22.648 1.00 85.92 C ATOM 1554 CD ARG A 167 -19.419 0.044 -23.743 1.00 97.37 C ATOM 1555 NE ARG A 167 -20.015 0.630 -24.996 1.00107.73 N ATOM 1556 CZ ARG A 167 -21.300 1.010 -25.223 1.00100.71 C ATOM 1557 NH1 ARG A 167 -22.248 0.939 -24.284 1.00 97.02 N ATOM 1558 NH2 ARG A 167 -21.623 1.507 -26.406 1.00 92.85 N ATOM 1559 HE ARG A 167 -19.358 0.761 -25.791 1.00 0.00 H ATOM 1560 HH12 ARG A 167 -23.219 1.241 -24.502 1.00 0.00 H ATOM 1561 HH11 ARG A 167 -22.015 0.582 -23.335 1.00 0.00 H ATOM 1562 HH22 ARG A 167 -22.602 1.803 -26.596 1.00 0.00 H ATOM 1563 HH21 ARG A 167 -20.898 1.602 -27.146 1.00 0.00 H ATOM 1564 H ARG A 167 -20.143 4.352 -22.092 1.00 0.00 H ATOM 1565 N GLN A 168 -18.180 5.594 -23.367 1.00 50.10 N ATOM 1566 CA GLN A 168 -17.599 6.706 -24.091 1.00 49.20 C ATOM 1567 C GLN A 168 -18.106 8.021 -23.560 1.00 47.34 C ATOM 1568 O GLN A 168 -19.127 8.042 -22.858 1.00 48.15 O ATOM 1569 CB GLN A 168 -17.951 6.618 -25.557 1.00 51.95 C ATOM 1570 CG GLN A 168 -17.628 5.290 -26.196 1.00 54.80 C ATOM 1571 CD GLN A 168 -18.059 5.244 -27.649 1.00 54.54 C ATOM 1572 OE1 GLN A 168 -19.257 5.210 -27.961 1.00 49.16 O ATOM 1573 NE2 GLN A 168 -17.068 5.256 -28.559 1.00 54.40 N ATOM 1574 HE22 GLN A 168 -16.076 5.285 -28.247 1.00 0.00 H ATOM 1575 HE21 GLN A 168 -17.294 5.236 -29.574 1.00 0.00 H ATOM 1576 H GLN A 168 -19.198 5.604 -23.152 1.00 0.00 H ATOM 1577 N GLY A 169 -17.379 9.098 -23.892 1.00 41.34 N ATOM 1578 CA GLY A 169 -17.765 10.448 -23.504 1.00 39.18 C ATOM 1579 C GLY A 169 -17.924 11.342 -24.705 1.00 36.43 C ATOM 1580 O GLY A 169 -17.248 11.163 -25.699 1.00 34.08 O ATOM 1581 H GLY A 169 -16.509 8.965 -24.446 1.00 0.00 H ATOM 1582 N PHE A 170 -18.799 12.328 -24.600 1.00 38.51 N ATOM 1583 CA PHE A 170 -19.029 13.271 -25.696 1.00 42.69 C ATOM 1584 C PHE A 170 -18.946 14.721 -25.258 1.00 41.42 C ATOM 1585 O PHE A 170 -19.517 15.096 -24.226 1.00 44.50 O ATOM 1586 CB PHE A 170 -20.405 13.034 -26.309 1.00 44.53 C ATOM 1587 CG PHE A 170 -20.598 11.641 -26.766 1.00 49.85 C ATOM 1588 CD1 PHE A 170 -20.092 11.235 -27.986 1.00 51.91 C ATOM 1589 CD2 PHE A 170 -21.242 10.713 -25.953 1.00 55.79 C ATOM 1590 CE1 PHE A 170 -20.243 9.934 -28.404 1.00 54.56 C ATOM 1591 CE2 PHE A 170 -21.386 9.410 -26.371 1.00 55.71 C ATOM 1592 CZ PHE A 170 -20.884 9.023 -27.594 1.00 54.56 C ATOM 1593 H PHE A 170 -19.337 12.436 -23.717 1.00 0.00 H ATOM 1594 N CYS A 171 -18.271 15.536 -26.066 1.00 37.46 N ATOM 1595 CA CYS A 171 -18.156 16.954 -25.790 1.00 36.68 C ATOM 1596 C CYS A 171 -18.753 17.762 -26.915 1.00 36.41 C ATOM 1597 O CYS A 171 -18.879 17.292 -28.025 1.00 37.27 O ATOM 1598 CB CYS A 171 -16.704 17.353 -25.612 1.00 37.22 C ATOM 1599 SG CYS A 171 -15.734 17.436 -27.139 1.00 40.01 S ATOM 1600 H CYS A 171 -17.815 15.146 -26.916 1.00 0.00 H ATOM 1601 N ALA A 172 -19.145 18.985 -26.601 1.00 37.53 N ATOM 1602 CA ALA A 172 -19.581 19.945 -27.600 1.00 37.08 C ATOM 1603 C ALA A 172 -18.369 20.717 -28.057 1.00 35.58 C ATOM 1604 O ALA A 172 -17.709 21.356 -27.275 1.00 36.41 O ATOM 1605 CB ALA A 172 -20.595 20.896 -27.000 1.00 39.27 C ATOM 1606 H ALA A 172 -19.141 19.270 -25.601 1.00 0.00 H ATOM 1607 N GLY A 173 -18.060 20.647 -29.335 1.00 35.89 N ATOM 1608 CA GLY A 173 -16.852 21.277 -29.854 1.00 34.66 C ATOM 1609 C GLY A 173 -16.876 22.765 -29.615 1.00 34.11 C ATOM 1610 O GLY A 173 -17.946 23.360 -29.570 1.00 34.53 O ATOM 1611 H GLY A 173 -18.688 20.133 -29.985 1.00 0.00 H ATOM 1612 N LEU A 174 -15.700 23.356 -29.437 1.00 35.55 N ATOM 1613 CA LEU A 174 -15.555 24.806 -29.278 1.00 38.97 C ATOM 1614 C LEU A 174 -14.842 25.448 -30.463 1.00 44.21 C ATOM 1615 O LEU A 174 -13.793 24.951 -30.920 1.00 48.30 O ATOM 1616 CB LEU A 174 -14.738 25.131 -28.028 1.00 38.74 C ATOM 1617 CG LEU A 174 -15.391 24.920 -26.667 1.00 38.80 C ATOM 1618 CD1 LEU A 174 -14.466 25.529 -25.645 1.00 41.13 C ATOM 1619 CD2 LEU A 174 -16.771 25.541 -26.585 1.00 37.43 C ATOM 1620 H LEU A 174 -14.845 22.764 -29.409 1.00 0.00 H ATOM 1621 N LYS A 175 -15.395 26.560 -30.941 1.00 45.85 N ATOM 1622 CA LYS A 175 -14.776 27.344 -32.007 1.00 47.29 C ATOM 1623 C LYS A 175 -14.856 28.855 -31.700 1.00 46.32 C ATOM 1624 O LYS A 175 -15.889 29.385 -31.225 1.00 45.92 O ATOM 1625 CB LYS A 175 -15.428 27.052 -33.357 1.00 49.75 C ATOM 1626 CG LYS A 175 -16.827 27.632 -33.445 1.00 54.65 C ATOM 1627 CD LYS A 175 -17.615 26.875 -34.478 1.00 60.84 C ATOM 1628 CE LYS A 175 -16.954 26.980 -35.844 1.00 63.30 C ATOM 1629 NZ LYS A 175 -17.872 26.452 -36.898 1.00 71.12 N ATOM 1630 HZ1 LYS A 175 -18.090 25.455 -36.698 1.00 0.00 H ATOM 1631 HZ2 LYS A 175 -18.752 27.007 -36.899 1.00 0.00 H ATOM 1632 HZ3 LYS A 175 -17.411 26.528 -37.827 1.00 0.00 H ATOM 1633 H LYS A 175 -16.300 26.882 -30.542 1.00 0.00 H ATOM 1634 N ARG A 176 -13.759 29.543 -32.003 1.00 41.43 N ATOM 1635 CA ARG A 176 -13.584 30.916 -31.577 1.00 39.75 C ATOM 1636 C ARG A 176 -14.719 31.832 -32.000 1.00 37.92 C ATOM 1637 O ARG A 176 -15.091 32.745 -31.273 1.00 41.11 O ATOM 1638 CB ARG A 176 -12.265 31.458 -32.100 1.00 39.39 C ATOM 1639 CG ARG A 176 -11.578 32.463 -31.172 1.00 37.80 C ATOM 1640 CD ARG A 176 -10.280 32.975 -31.784 1.00 36.93 C ATOM 1641 NE ARG A 176 -9.253 31.942 -31.841 1.00 36.16 N ATOM 1642 CZ ARG A 176 -8.200 31.961 -32.643 1.00 36.18 C ATOM 1643 NH1 ARG A 176 -8.022 32.950 -33.500 1.00 38.56 N ATOM 1644 NH2 ARG A 176 -7.338 30.959 -32.604 1.00 36.70 N ATOM 1645 HE ARG A 176 -9.355 31.127 -31.203 1.00 0.00 H ATOM 1646 HH12 ARG A 176 -7.191 32.953 -34.125 1.00 0.00 H ATOM 1647 HH11 ARG A 176 -8.713 33.725 -33.550 1.00 0.00 H ATOM 1648 HH22 ARG A 176 -6.507 30.963 -33.229 1.00 0.00 H ATOM 1649 HH21 ARG A 176 -7.491 30.167 -31.948 1.00 0.00 H ATOM 1650 H ARG A 176 -13.009 29.084 -32.559 1.00 0.00 H ATOM 1651 N SER A 177 -15.301 31.566 -33.150 1.00 37.42 N ATOM 1652 CA SER A 177 -16.373 32.405 -33.646 1.00 39.26 C ATOM 1653 C SER A 177 -17.539 32.472 -32.682 1.00 41.18 C ATOM 1654 O SER A 177 -18.317 33.412 -32.747 1.00 41.92 O ATOM 1655 CB SER A 177 -16.887 31.887 -34.979 1.00 43.85 C ATOM 1656 OG SER A 177 -17.725 30.741 -34.784 1.00 53.05 O ATOM 1657 HG SER A 177 -18.050 30.418 -35.662 1.00 0.00 H ATOM 1658 H SER A 177 -14.988 30.746 -33.708 1.00 0.00 H ATOM 1659 N TYR A 178 -17.679 31.481 -31.795 1.00 43.77 N ATOM 1660 CA TYR A 178 -18.757 31.495 -30.804 1.00 42.66 C ATOM 1661 C TYR A 178 -18.629 32.620 -29.787 1.00 46.66 C ATOM 1662 O TYR A 178 -19.638 33.002 -29.185 1.00 53.77 O ATOM 1663 CB TYR A 178 -18.804 30.193 -30.000 1.00 43.16 C ATOM 1664 CG TYR A 178 -19.201 28.918 -30.742 1.00 41.38 C ATOM 1665 CD1 TYR A 178 -19.935 28.958 -31.898 1.00 37.46 C ATOM 1666 CD2 TYR A 178 -18.862 27.671 -30.232 1.00 39.35 C ATOM 1667 CE1 TYR A 178 -20.324 27.805 -32.530 1.00 36.22 C ATOM 1668 CE2 TYR A 178 -19.239 26.514 -30.875 1.00 39.43 C ATOM 1669 CZ TYR A 178 -19.980 26.583 -32.030 1.00 37.81 C ATOM 1670 OH TYR A 178 -20.357 25.421 -32.675 1.00 40.16 O ATOM 1671 HH TYR A 178 -20.881 25.649 -33.483 1.00 0.00 H ATOM 1672 H TYR A 178 -17.010 30.685 -31.809 1.00 0.00 H ATOM 1673 N PHE A 179 -17.423 33.155 -29.578 1.00 44.61 N ATOM 1674 CA PHE A 179 -17.222 34.116 -28.517 1.00 42.67 C ATOM 1675 C PHE A 179 -16.934 35.533 -28.970 1.00 44.73 C ATOM 1676 O PHE A 179 -16.134 36.190 -28.366 1.00 47.50 O ATOM 1677 CB PHE A 179 -16.095 33.621 -27.631 1.00 42.69 C ATOM 1678 CG PHE A 179 -16.251 32.208 -27.200 1.00 39.99 C ATOM 1679 CD1 PHE A 179 -17.017 31.904 -26.099 1.00 38.38 C ATOM 1680 CD2 PHE A 179 -15.642 31.192 -27.896 1.00 39.89 C ATOM 1681 CE1 PHE A 179 -17.167 30.605 -25.686 1.00 39.02 C ATOM 1682 CE2 PHE A 179 -15.795 29.877 -27.494 1.00 41.61 C ATOM 1683 CZ PHE A 179 -16.554 29.584 -26.381 1.00 39.83 C ATOM 1684 H PHE A 179 -16.623 32.878 -30.183 1.00 0.00 H ATOM 1685 N ALA A 180 -17.635 36.043 -29.971 1.00 49.04 N ATOM 1686 CA ALA A 180 -17.404 37.399 -30.457 1.00 46.30 C ATOM 1687 C ALA A 180 -18.545 38.308 -30.089 1.00 48.13 C ATOM 1688 O ALA A 180 -18.316 39.449 -29.688 1.00 54.92 O ATOM 1689 CB ALA A 180 -17.239 37.370 -31.952 1.00 49.61 C ATOM 1690 H ALA A 180 -18.370 35.462 -30.423 1.00 0.00 H TER 1691 ALA A 180 HETATM 1692 C2 UNN A 1 -26.007 14.012 -19.716 1.00 0.14 C HETATM 1693 C3 UNN A 1 -27.505 14.152 -19.497 1.00 0.02 C HETATM 1694 C4 UNN A 1 -28.160 15.114 -20.445 1.00 -0.04 C HETATM 1695 C5 UNN A 1 -27.527 15.630 -21.531 1.00 -0.06 C HETATM 1696 C6 UNN A 1 -28.238 16.519 -22.319 1.00 -0.07 C HETATM 1697 C7 UNN A 1 -29.549 16.898 -22.139 1.00 -0.07 C HETATM 1698 C8 UNN A 1 -30.202 16.370 -21.059 1.00 -0.07 C HETATM 1699 C9 UNN A 1 -29.497 15.488 -20.227 1.00 -0.06 C HETATM 1700 H19 UNN A 1 -30.012 15.072 -19.369 1.00 0.06 H HETATM 1701 H9 UNN A 1 -31.235 16.626 -20.852 1.00 0.06 H HETATM 1702 H6 UNN A 1 -30.041 17.582 -22.821 1.00 0.06 H HETATM 1703 H5 UNN A 1 -27.712 16.959 -23.158 1.00 0.06 H HETATM 1704 H4 UNN A 1 -26.506 15.357 -21.771 1.00 0.06 H HETATM 1705 H2 UNN A 1 -27.675 14.505 -18.469 1.00 0.05 H HETATM 1706 H3 UNN A 1 -27.970 13.164 -19.627 1.00 0.05 H HETATM 1707 N2 UNN A 1 -25.749 12.745 -20.375 1.00 -0.26 N HETATM 1708 C20 UNN A 1 -26.317 12.254 -21.391 1.00 0.18 C HETATM 1709 O21 UNN A 1 -27.238 12.811 -21.962 1.00 -0.40 O HETATM 1710 C22 UNN A 1 -25.724 10.926 -21.744 1.00 0.04 C HETATM 1711 C23 UNN A 1 -26.742 10.075 -22.419 1.00 -0.03 C HETATM 1712 C27 UNN A 1 -26.402 9.759 -23.858 1.00 -0.04 C HETATM 1713 C21 UNN A 1 -24.945 9.587 -24.260 1.00 -0.05 C HETATM 1714 C24 UNN A 1 -25.720 10.857 -24.648 1.00 -0.05 C HETATM 1715 H17 UNN A 1 -25.482 11.816 -24.165 1.00 0.03 H HETATM 1716 H18 UNN A 1 -25.997 11.034 -25.698 1.00 0.03 H HETATM 1717 H15 UNN A 1 -24.668 8.852 -25.031 1.00 0.03 H HETATM 1718 H16 UNN A 1 -24.153 9.635 -23.498 1.00 0.03 H HETATM 1719 H14 UNN A 1 -27.182 9.130 -24.311 1.00 0.03 H HETATM 1720 H12 UNN A 1 -27.707 10.602 -22.396 1.00 0.03 H HETATM 1721 H13 UNN A 1 -26.828 9.129 -21.865 1.00 0.03 H HETATM 1722 H10 UNN A 1 -25.381 10.425 -20.827 1.00 0.05 H HETATM 1723 H11 UNN A 1 -24.870 11.077 -22.420 1.00 0.05 H HETATM 1724 H8 UNN A 1 -25.025 12.186 -19.971 1.00 0.19 H HETATM 1725 C17 UNN A 1 -25.299 13.920 -18.429 1.00 0.20 C HETATM 1726 O4 UNN A 1 -25.897 13.524 -17.447 1.00 -0.39 O HETATM 1727 N UNN A 1 -24.085 14.242 -18.439 1.00 -0.28 N HETATM 1728 C10 UNN A 1 -23.269 14.141 -17.243 1.00 0.05 C HETATM 1729 C14 UNN A 1 -22.716 15.490 -16.890 1.00 -0.01 C HETATM 1730 C15 UNN A 1 -23.711 16.352 -16.229 1.00 0.05 C HETATM 1731 C16 UNN A 1 -24.417 15.729 -15.095 1.00 0.23 C HETATM 1732 O2 UNN A 1 -25.654 15.121 -15.395 1.00 -0.28 O HETATM 1733 C18 UNN A 1 -26.878 15.741 -14.903 1.00 0.07 C HETATM 1734 C19 UNN A 1 -26.757 16.344 -13.495 1.00 -0.04 C HETATM 1735 H28 UNN A 1 -27.720 16.788 -13.203 1.00 0.03 H HETATM 1736 H29 UNN A 1 -25.979 17.122 -13.495 1.00 0.03 H HETATM 1737 H30 UNN A 1 -26.486 15.554 -12.780 1.00 0.03 H HETATM 1738 H26 UNN A 1 -27.668 14.976 -14.884 1.00 0.06 H HETATM 1739 H27 UNN A 1 -27.162 16.544 -15.599 1.00 0.06 H HETATM 1740 O3 UNN A 1 -24.041 15.762 -13.951 1.00 -0.37 O HETATM 1741 H24 UNN A 1 -24.461 16.645 -16.979 1.00 0.05 H HETATM 1742 H25 UNN A 1 -23.193 17.249 -15.858 1.00 0.05 H HETATM 1743 H22 UNN A 1 -22.378 15.985 -17.812 1.00 0.03 H HETATM 1744 H23 UNN A 1 -21.861 15.354 -16.212 1.00 0.03 H HETATM 1745 C11 UNN A 1 -22.100 13.256 -17.646 1.00 -0.01 C HETATM 1746 C12 UNN A 1 -22.544 11.994 -18.352 1.00 0.05 C HETATM 1747 C26 UNN A 1 -23.728 11.344 -17.645 1.00 -0.01 C HETATM 1748 C25 UNN A 1 -23.233 9.961 -17.210 1.00 0.03 C HETATM 1749 N1 UNN A 1 -21.873 9.876 -17.740 1.00 -0.29 N HETATM 1750 C13 UNN A 1 -21.440 10.973 -18.322 1.00 0.18 C HETATM 1751 O1 UNN A 1 -20.317 11.177 -18.757 1.00 -0.40 O HETATM 1752 H7 UNN A 1 -21.316 9.049 -17.666 1.00 0.19 H HETATM 1753 H36 UNN A 1 -23.229 9.877 -16.113 1.00 0.05 H HETATM 1754 H37 UNN A 1 -23.867 9.169 -17.636 1.00 0.05 H HETATM 1755 H34 UNN A 1 -24.581 11.249 -18.332 1.00 0.03 H HETATM 1756 H35 UNN A 1 -24.027 11.939 -16.769 1.00 0.03 H HETATM 1757 H33 UNN A 1 -22.812 12.236 -19.391 1.00 0.05 H HETATM 1758 H31 UNN A 1 -21.541 12.976 -16.741 1.00 0.03 H HETATM 1759 H32 UNN A 1 -21.443 13.825 -18.321 1.00 0.03 H HETATM 1760 H21 UNN A 1 -23.836 13.716 -16.402 1.00 0.06 H HETATM 1761 H20 UNN A 1 -23.673 14.574 -19.287 1.00 0.19 H HETATM 1762 H1 UNN A 1 -25.631 14.857 -20.312 1.00 0.08 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1692 1693 1707 1725 1762 CONECT 1693 1692 1694 1705 1706 CONECT 1694 1693 1695 1699 CONECT 1695 1694 1696 1704 CONECT 1696 1695 1697 1703 CONECT 1697 1696 1698 1702 CONECT 1698 1697 1699 1701 CONECT 1699 1694 1698 1700 CONECT 1700 1699 CONECT 1701 1698 CONECT 1702 1697 CONECT 1703 1696 CONECT 1704 1695 CONECT 1705 1693 CONECT 1706 1693 CONECT 1707 1692 1708 1724 CONECT 1708 1707 1709 1710 CONECT 1709 1708 CONECT 1710 1708 1711 1722 1723 CONECT 1711 1710 1712 1720 1721 CONECT 1712 1711 1713 1714 1719 CONECT 1713 1712 1714 1717 1718 CONECT 1714 1712 1713 1715 1716 CONECT 1715 1714 CONECT 1716 1714 CONECT 1717 1713 CONECT 1718 1713 CONECT 1719 1712 CONECT 1720 1711 CONECT 1721 1711 CONECT 1722 1710 CONECT 1723 1710 CONECT 1724 1707 CONECT 1725 1692 1726 1727 CONECT 1726 1725 CONECT 1727 1725 1728 1761 CONECT 1728 1727 1729 1745 1760 CONECT 1729 1728 1730 1743 1744 CONECT 1730 1729 1731 1741 1742 CONECT 1731 1730 1732 1740 CONECT 1732 1731 1733 CONECT 1733 1732 1734 1738 1739 CONECT 1734 1733 1735 1736 1737 CONECT 1735 1734 CONECT 1736 1734 CONECT 1737 1734 CONECT 1738 1733 CONECT 1739 1733 CONECT 1740 1731 CONECT 1741 1730 CONECT 1742 1730 CONECT 1743 1729 CONECT 1744 1729 CONECT 1745 1728 1746 1758 1759 CONECT 1746 1745 1747 1750 1757 CONECT 1747 1746 1748 1755 1756 CONECT 1748 1747 1749 1753 1754 CONECT 1749 1748 1750 1752 CONECT 1750 1746 1749 1751 CONECT 1751 1750 CONECT 1752 1749 CONECT 1753 1748 CONECT 1754 1748 CONECT 1755 1747 CONECT 1756 1747 CONECT 1757 1746 CONECT 1758 1745 CONECT 1759 1745 CONECT 1760 1728 CONECT 1761 1727 CONECT 1762 1692 MASTER 0 0 0 0 0 0 0 0 1761 1 75 14 END
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Related entries of code: 5dp6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
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PDBbind
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5c1y
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PDBbind
192aa, >5C1Y_1|Chain... at 94%
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PDBbind
192aa, >5C20_1|Chain... at 94%
5dp4
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PDBbind
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5dp5
RCSB PDB
PDBbind
181aa, >5DP5_1|Chain... at 98%
5dp7
RCSB PDB
PDBbind
192aa, >5DP7_1|Chain... at 94%
5dp8
RCSB PDB
PDBbind
192aa, >5DP8_1|Chain... at 94%
5dp9
RCSB PDB
PDBbind
192aa, >5DP9_1|Chain... at 94%
5dpa
RCSB PDB
PDBbind
192aa, >5DPA_1|Chain... at 94%
5gso
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5dp6
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
EV71 3C Proteinase
Ligand Name
5EB
EC.Number
E.C.-.-.-.-
Resolution
3.01(Å)
Affinity (Kd/Ki/IC50)
IC50=14.71uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Biochim.Biophys.Acta Vol. 1860: pp. 1299-1307
Ligand Properties
Formula
C
2
6
H
3
7
N
3
O
5
Molecular Weight
471.589
Exact Mass
471.273
No. of atoms
71
No. of bonds
73
Polar Surface Area
113.6
LOGP Value
2.67 (
Computed with XLOGP3
)
3.37 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 17
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 3
Canonical SMILES
CCOC(=O)CC[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCC1CC1
InChI String
InChI=1S/C26H37N3O5/c1-2-34-24(31)13-11-21(17-20-14-15-27-25(20)32)28-26(33)22(16-19-6-4-3-5-7-19)29-23(30)12-10-18-8-9-18/h3-7,18,20-22H,2,8-17H2,1H3,(H,27,32)(H,28,33)(H,29,30)/t20-,21+,22-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A9XG43
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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