Browse entries in the PDBbind-CN Database
HEADER 6CJP_COMPLEX COMPND 6CJP_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 153 LEU TYR PHE GLN GLY GLU THR HIS GLU PHE THR ALA GLU SEQRES 2 A 153 ILE SER GLN LEU MET SER LEU ILE ILE ASN THR VAL TYR SEQRES 3 A 153 SER ASN LYS GLU ILE PHE LEU ARG GLU LEU ILE SER ASN SEQRES 4 A 153 ALA SER ASP ALA LEU ASP LYS ILE ARG TYR GLN ALA LEU SEQRES 5 A 153 SER ASP PRO SER GLN LEU GLU SER GLU PRO GLU LEU PHE SEQRES 6 A 153 ILE ARG ILE ILE PRO GLN LYS ASP GLN LYS VAL LEU GLU SEQRES 7 A 153 ILE ARG ASP SER GLY ILE GLY MET THR LYS ALA ASP LEU SEQRES 8 A 153 VAL ASN ASN LEU GLY THR ILE ALA LYS SER GLY THR LYS SEQRES 9 A 153 SER PHE MET GLU ALA LEU SER ALA GLY ALA ASP VAL SER SEQRES 10 A 153 MET ILE GLY GLN PHE GLY VAL GLY PHE TYR SER LEU PHE SEQRES 11 A 153 LEU VAL ALA ASP HIS VAL GLN VAL ILE SER LYS HIS ASN SEQRES 12 A 153 ASP ASP GLU GLN TYR VAL TRP GLU SER ASN SEQRES 1 A 61 GLY LYS PHE THR VAL THR LEU ASP GLU THR ASN GLU ARG SEQRES 2 A 61 LEU GLY ARG GLY THR MET LEU ARG LEU PHE LEU LYS GLU SEQRES 3 A 61 ASP GLN LEU GLU TYR LEU GLU GLU LYS ARG ILE LYS GLU SEQRES 4 A 61 VAL VAL LYS LYS HIS SER GLU PHE VAL ALA TYR PRO ILE SEQRES 5 A 61 GLN LEU VAL VAL THR LYS GLU VAL GLU HET F A 5S 61 ATOM 1 N LEU A 2 20.360 18.085 69.824 1.00 67.89 N ATOM 2 CA LEU A 2 20.855 19.269 69.133 1.00 80.80 C ATOM 3 C LEU A 2 19.700 20.080 68.556 1.00 93.14 C ATOM 4 O LEU A 2 19.801 21.300 68.415 1.00 86.58 O ATOM 5 CB LEU A 2 21.826 18.877 68.017 1.00 65.49 C ATOM 6 HN3 LEU A 2 19.832 17.489 69.154 1.00 0.00 H ATOM 7 HN2 LEU A 2 19.732 18.375 70.601 1.00 0.00 H ATOM 8 HN1 LEU A 2 21.164 17.548 70.209 1.00 0.00 H ATOM 9 N TYR A 3 18.605 19.398 68.221 1.00 99.17 N ATOM 10 CA TYR A 3 17.434 20.049 67.655 1.00 92.11 C ATOM 11 C TYR A 3 16.169 19.559 68.348 1.00104.99 C ATOM 12 O TYR A 3 16.166 18.533 69.030 1.00111.06 O ATOM 13 CB TYR A 3 17.338 19.810 66.141 1.00 83.75 C ATOM 14 H TYR A 3 18.587 18.369 68.369 1.00 0.00 H ATOM 15 N PHE A 4 15.086 20.313 68.161 1.00107.41 N ATOM 16 CA PHE A 4 13.842 20.041 68.868 1.00113.66 C ATOM 17 C PHE A 4 13.211 18.732 68.396 1.00115.66 C ATOM 18 O PHE A 4 13.375 18.311 67.248 1.00116.52 O ATOM 19 CB PHE A 4 12.855 21.198 68.689 1.00109.69 C ATOM 20 CG PHE A 4 12.603 21.980 69.951 1.00120.51 C ATOM 21 CD1 PHE A 4 11.762 21.484 70.933 1.00126.59 C ATOM 22 CD2 PHE A 4 13.206 23.209 70.157 1.00112.70 C ATOM 23 CE1 PHE A 4 11.531 22.197 72.095 1.00140.52 C ATOM 24 CE2 PHE A 4 12.975 23.927 71.319 1.00110.00 C ATOM 25 CZ PHE A 4 12.139 23.420 72.286 1.00136.19 C ATOM 26 H PHE A 4 15.130 21.112 67.497 1.00 0.00 H ATOM 27 N GLN A 5 12.465 18.100 69.303 1.00114.57 N ATOM 28 CA GLN A 5 11.945 16.744 69.114 1.00107.65 C ATOM 29 C GLN A 5 13.058 15.800 68.665 1.00114.62 C ATOM 30 O GLN A 5 12.899 15.008 67.731 1.00114.52 O ATOM 31 CB GLN A 5 10.786 16.713 68.110 1.00 95.74 C ATOM 32 CG GLN A 5 9.965 17.986 67.984 1.00 94.55 C ATOM 33 CD GLN A 5 9.229 18.355 69.253 1.00 91.38 C ATOM 34 OE1 GLN A 5 9.207 17.594 70.221 1.00 91.94 O ATOM 35 NE2 GLN A 5 8.613 19.531 69.252 1.00 85.84 N ATOM 36 HE22 GLN A 5 8.659 20.141 68.411 1.00 0.00 H ATOM 37 HE21 GLN A 5 8.085 19.842 70.092 1.00 0.00 H ATOM 38 H GLN A 5 12.241 18.595 70.190 1.00 0.00 H ATOM 39 N GLY A 6 14.191 15.872 69.351 1.00117.72 N ATOM 40 CA GLY A 6 15.369 15.170 68.870 1.00106.14 C ATOM 41 C GLY A 6 15.630 15.606 67.443 1.00115.65 C ATOM 42 O GLY A 6 15.915 16.778 67.168 1.00119.13 O ATOM 43 H GLY A 6 14.236 16.428 70.229 1.00 0.00 H ATOM 44 N GLU A 7 15.526 14.661 66.515 1.00112.91 N ATOM 45 CA GLU A 7 15.426 14.966 65.097 1.00108.17 C ATOM 46 C GLU A 7 14.042 14.657 64.547 1.00113.86 C ATOM 47 O GLU A 7 13.429 15.504 63.888 1.00100.31 O ATOM 48 CB GLU A 7 16.486 14.178 64.310 1.00 77.90 C ATOM 49 H GLU A 7 15.516 13.665 66.814 1.00 0.00 H ATOM 50 N THR A 8 13.535 13.454 64.822 1.00127.98 N ATOM 51 CA THR A 8 12.239 12.977 64.346 1.00115.17 C ATOM 52 C THR A 8 11.142 14.033 64.402 1.00110.49 C ATOM 53 O THR A 8 11.128 14.888 65.293 1.00111.21 O ATOM 54 CB THR A 8 11.805 11.759 65.164 1.00 85.44 C ATOM 55 H THR A 8 14.100 12.813 65.415 1.00 0.00 H ATOM 56 N HIS A 9 10.207 13.961 63.453 1.00100.29 N ATOM 57 CA HIS A 9 9.067 14.874 63.371 1.00 99.70 C ATOM 58 C HIS A 9 7.802 14.034 63.212 1.00101.15 C ATOM 59 O HIS A 9 7.416 13.684 62.094 1.00 80.31 O ATOM 60 CB HIS A 9 9.241 15.859 62.217 1.00 95.77 C ATOM 61 H HIS A 9 10.293 13.216 62.733 1.00 0.00 H ATOM 62 N GLU A 10 7.162 13.710 64.335 1.00105.47 N ATOM 63 CA GLU A 10 5.916 12.956 64.347 1.00105.84 C ATOM 64 C GLU A 10 4.852 13.725 65.119 1.00103.04 C ATOM 65 O GLU A 10 5.147 14.370 66.130 1.00 91.92 O ATOM 66 CB GLU A 10 6.115 11.570 64.972 1.00102.58 C ATOM 67 H GLU A 10 7.571 14.009 65.243 1.00 0.00 H ATOM 68 N PHE A 11 3.612 13.636 64.634 1.00110.72 N ATOM 69 CA PHE A 11 2.455 14.327 65.202 1.00105.42 C ATOM 70 C PHE A 11 2.808 15.695 65.777 1.00104.46 C ATOM 71 O PHE A 11 2.476 15.992 66.929 1.00 85.56 O ATOM 72 CB PHE A 11 1.801 13.470 66.293 1.00 96.06 C ATOM 73 CG PHE A 11 0.383 13.879 66.637 1.00 96.82 C ATOM 74 CD1 PHE A 11 -0.290 14.842 65.894 1.00 85.81 C ATOM 75 CD2 PHE A 11 -0.273 13.297 67.711 1.00 99.42 C ATOM 76 CE1 PHE A 11 -1.583 15.207 66.212 1.00 80.08 C ATOM 77 CE2 PHE A 11 -1.569 13.664 68.033 1.00 81.89 C ATOM 78 CZ PHE A 11 -2.222 14.619 67.282 1.00 79.33 C ATOM 79 H PHE A 11 3.458 13.037 63.798 1.00 0.00 H ATOM 80 N THR A 12 3.473 16.538 64.982 1.00103.89 N ATOM 81 CA THR A 12 3.818 17.888 65.415 1.00 85.05 C ATOM 82 C THR A 12 3.563 18.905 64.307 1.00 80.45 C ATOM 83 O THR A 12 4.290 19.899 64.190 1.00 74.89 O ATOM 84 CB THR A 12 5.276 17.961 65.877 1.00 83.60 C ATOM 85 OG1 THR A 12 6.102 17.189 64.996 1.00 86.60 O ATOM 86 CG2 THR A 12 5.412 17.436 67.299 1.00 76.90 C ATOM 87 HG1 THR A 12 5.801 16.246 65.006 1.00 0.00 H ATOM 88 H THR A 12 3.752 16.224 64.031 1.00 0.00 H ATOM 89 N ALA A 13 2.538 18.671 63.485 1.00 82.08 N ATOM 90 CA ALA A 13 2.157 19.652 62.476 1.00 81.26 C ATOM 91 C ALA A 13 1.747 20.973 63.112 1.00 84.34 C ATOM 92 O ALA A 13 1.985 22.041 62.535 1.00 82.25 O ATOM 93 CB ALA A 13 1.018 19.102 61.616 1.00 91.19 C ATOM 94 H ALA A 13 2.006 17.781 63.565 1.00 0.00 H ATOM 95 N GLU A 14 1.121 20.919 64.290 1.00 85.57 N ATOM 96 CA GLU A 14 0.684 22.136 64.967 1.00 78.26 C ATOM 97 C GLU A 14 1.838 23.110 65.168 1.00 72.71 C ATOM 98 O GLU A 14 1.661 24.327 65.038 1.00 66.03 O ATOM 99 CB GLU A 14 0.042 21.783 66.309 1.00 59.06 C ATOM 100 H GLU A 14 0.942 19.995 64.732 1.00 0.00 H ATOM 101 N ILE A 15 3.028 22.597 65.486 1.00 76.10 N ATOM 102 CA ILE A 15 4.167 23.473 65.756 1.00 78.16 C ATOM 103 C ILE A 15 4.505 24.304 64.525 1.00 75.17 C ATOM 104 O ILE A 15 4.815 25.497 64.631 1.00 71.52 O ATOM 105 CB ILE A 15 5.378 22.650 66.233 1.00 75.17 C ATOM 106 CG1 ILE A 15 5.060 21.937 67.552 1.00 88.57 C ATOM 107 CG2 ILE A 15 6.612 23.542 66.391 1.00 70.93 C ATOM 108 CD1 ILE A 15 4.780 22.865 68.726 1.00 94.05 C ATOM 109 H ILE A 15 3.146 21.565 65.542 1.00 0.00 H ATOM 110 N SER A 16 4.457 23.693 63.340 1.00 71.82 N ATOM 111 CA SER A 16 4.790 24.431 62.127 1.00 68.88 C ATOM 112 C SER A 16 3.866 25.626 61.949 1.00 64.52 C ATOM 113 O SER A 16 4.289 26.682 61.464 1.00 66.93 O ATOM 114 CB SER A 16 4.711 23.507 60.913 1.00 68.78 C ATOM 115 OG SER A 16 4.903 24.230 59.710 1.00 74.82 O ATOM 116 HG SER A 16 4.201 24.923 59.628 1.00 0.00 H ATOM 117 H SER A 16 4.182 22.692 63.281 1.00 0.00 H ATOM 118 N GLN A 17 2.597 25.479 62.332 1.00 67.10 N ATOM 119 CA GLN A 17 1.657 26.590 62.220 1.00 70.14 C ATOM 120 C GLN A 17 2.076 27.749 63.115 1.00 63.69 C ATOM 121 O GLN A 17 2.049 28.912 62.694 1.00 66.57 O ATOM 122 CB GLN A 17 0.244 26.125 62.578 1.00 74.78 C ATOM 123 CG GLN A 17 -0.164 24.794 61.958 1.00 81.92 C ATOM 124 CD GLN A 17 -0.029 24.780 60.449 1.00 81.71 C ATOM 125 OE1 GLN A 17 0.063 25.829 59.811 1.00 88.55 O ATOM 126 NE2 GLN A 17 -0.015 23.585 59.868 1.00 79.86 N ATOM 127 HE22 GLN A 17 -0.095 22.725 60.447 1.00 0.00 H ATOM 128 HE21 GLN A 17 0.076 23.510 58.835 1.00 0.00 H ATOM 129 H GLN A 17 2.275 24.566 62.713 1.00 0.00 H ATOM 130 N LEU A 18 2.469 27.451 64.355 1.00 61.47 N ATOM 131 CA LEU A 18 2.838 28.506 65.294 1.00 66.75 C ATOM 132 C LEU A 18 4.101 29.228 64.841 1.00 58.13 C ATOM 133 O LEU A 18 4.126 30.462 64.764 1.00 55.24 O ATOM 134 CB LEU A 18 3.024 27.919 66.693 1.00 64.29 C ATOM 135 CG LEU A 18 1.867 27.063 67.212 1.00 64.60 C ATOM 136 CD1 LEU A 18 2.100 26.685 68.666 1.00 58.09 C ATOM 137 CD2 LEU A 18 0.530 27.775 67.047 1.00 67.07 C ATOM 138 H LEU A 18 2.513 26.456 64.656 1.00 0.00 H ATOM 139 N MET A 19 5.165 28.476 64.545 1.00 59.43 N ATOM 140 CA MET A 19 6.378 29.097 64.022 1.00 62.47 C ATOM 141 C MET A 19 6.064 29.945 62.798 1.00 52.91 C ATOM 142 O MET A 19 6.555 31.072 62.668 1.00 52.02 O ATOM 143 CB MET A 19 7.417 28.028 63.680 1.00 68.20 C ATOM 144 CG MET A 19 7.881 27.196 64.869 1.00 72.58 C ATOM 145 SD MET A 19 8.538 28.187 66.229 1.00 62.17 S ATOM 146 CE MET A 19 9.955 28.959 65.451 1.00 52.21 C ATOM 147 H MET A 19 5.129 27.446 64.687 1.00 0.00 H ATOM 148 N SER A 20 5.244 29.418 61.887 1.00 56.20 N ATOM 149 CA SER A 20 4.792 30.217 60.755 1.00 56.36 C ATOM 150 C SER A 20 4.041 31.453 61.232 1.00 51.93 C ATOM 151 O SER A 20 4.269 32.560 60.730 1.00 51.38 O ATOM 152 CB SER A 20 3.912 29.374 59.834 1.00 58.29 C ATOM 153 OG SER A 20 4.612 28.229 59.375 1.00 72.06 O ATOM 154 HG SER A 20 4.883 27.677 60.150 1.00 0.00 H ATOM 155 H SER A 20 4.926 28.433 61.985 1.00 0.00 H ATOM 156 N LEU A 21 3.145 31.285 62.207 1.00 61.13 N ATOM 157 CA LEU A 21 2.388 32.422 62.718 1.00 52.40 C ATOM 158 C LEU A 21 3.313 33.436 63.377 1.00 49.14 C ATOM 159 O LEU A 21 3.178 34.647 63.163 1.00 44.29 O ATOM 160 CB LEU A 21 1.332 31.939 63.711 1.00 66.26 C ATOM 161 CG LEU A 21 0.417 33.012 64.306 1.00 71.74 C ATOM 162 CD1 LEU A 21 -0.397 33.699 63.216 1.00 87.50 C ATOM 163 CD2 LEU A 21 -0.490 32.414 65.372 1.00 86.30 C ATOM 164 H LEU A 21 2.986 30.337 62.605 1.00 0.00 H ATOM 165 N ILE A 22 4.276 32.956 64.164 1.00 43.98 N ATOM 166 CA ILE A 22 5.223 33.851 64.821 1.00 44.00 C ATOM 167 C ILE A 22 6.024 34.611 63.774 1.00 45.93 C ATOM 168 O ILE A 22 6.133 35.842 63.813 1.00 43.91 O ATOM 169 CB ILE A 22 6.140 33.050 65.763 1.00 50.10 C ATOM 170 CG1 ILE A 22 5.342 32.577 66.978 1.00 45.30 C ATOM 171 CG2 ILE A 22 7.350 33.886 66.199 1.00 48.68 C ATOM 172 CD1 ILE A 22 6.074 31.584 67.840 1.00 59.51 C ATOM 173 H ILE A 22 4.353 31.929 64.312 1.00 0.00 H ATOM 174 N ILE A 23 6.609 33.879 62.828 1.00 42.87 N ATOM 175 CA ILE A 23 7.461 34.496 61.822 1.00 47.07 C ATOM 176 C ILE A 23 6.653 35.407 60.910 1.00 43.17 C ATOM 177 O ILE A 23 7.155 36.440 60.453 1.00 52.69 O ATOM 178 CB ILE A 23 8.190 33.379 61.055 1.00 48.59 C ATOM 179 CG1 ILE A 23 9.160 32.686 62.016 1.00 48.97 C ATOM 180 CG2 ILE A 23 8.888 33.913 59.810 1.00 37.46 C ATOM 181 CD1 ILE A 23 9.651 31.393 61.532 1.00 59.09 C ATOM 182 H ILE A 23 6.455 32.851 62.808 1.00 0.00 H ATOM 183 N ASN A 24 5.390 35.067 60.653 1.00 48.39 N ATOM 184 CA ASN A 24 4.555 35.931 59.829 1.00 45.95 C ATOM 185 C ASN A 24 4.193 37.212 60.568 1.00 53.33 C ATOM 186 O ASN A 24 4.048 38.269 59.943 1.00 49.99 O ATOM 187 CB ASN A 24 3.293 35.186 59.400 1.00 57.48 C ATOM 188 CG ASN A 24 2.661 35.779 58.161 1.00 68.07 C ATOM 189 OD1 ASN A 24 1.953 36.785 58.230 1.00 64.56 O ATOM 190 ND2 ASN A 24 2.912 35.153 57.013 1.00 62.34 N ATOM 191 HD22 ASN A 24 3.516 34.306 57.004 1.00 0.00 H ATOM 192 HD21 ASN A 24 2.504 35.511 56.126 1.00 0.00 H ATOM 193 H ASN A 24 5.000 34.184 61.041 1.00 0.00 H ATOM 194 N THR A 25 4.051 37.137 61.893 1.00 53.25 N ATOM 195 CA THR A 25 3.742 38.316 62.692 1.00 37.42 C ATOM 196 C THR A 25 4.980 39.178 62.919 1.00 43.21 C ATOM 197 O THR A 25 4.894 40.411 62.898 1.00 45.77 O ATOM 198 CB THR A 25 3.142 37.889 64.035 1.00 53.64 C ATOM 199 OG1 THR A 25 1.908 37.191 63.813 1.00 50.30 O ATOM 200 CG2 THR A 25 2.885 39.098 64.933 1.00 48.04 C ATOM 201 HG1 THR A 25 2.079 36.388 63.259 1.00 0.00 H ATOM 202 H THR A 25 4.163 36.217 62.365 1.00 0.00 H ATOM 203 N VAL A 26 6.135 38.548 63.133 1.00 47.63 N ATOM 204 CA VAL A 26 7.343 39.292 63.474 1.00 45.60 C ATOM 205 C VAL A 26 7.930 39.983 62.250 1.00 47.13 C ATOM 206 O VAL A 26 8.382 41.130 62.332 1.00 46.94 O ATOM 207 CB VAL A 26 8.368 38.351 64.134 1.00 46.64 C ATOM 208 CG1 VAL A 26 9.723 39.040 64.287 1.00 42.76 C ATOM 209 CG2 VAL A 26 7.856 37.883 65.486 1.00 46.60 C ATOM 210 H VAL A 26 6.176 37.512 63.056 1.00 0.00 H ATOM 211 N TYR A 27 7.935 39.311 61.101 1.00 51.52 N ATOM 212 CA TYR A 27 8.608 39.821 59.908 1.00 48.71 C ATOM 213 C TYR A 27 7.553 40.383 58.963 1.00 47.43 C ATOM 214 O TYR A 27 6.903 39.642 58.222 1.00 56.21 O ATOM 215 CB TYR A 27 9.423 38.711 59.255 1.00 41.61 C ATOM 216 CG TYR A 27 10.550 38.220 60.137 1.00 40.44 C ATOM 217 CD1 TYR A 27 11.726 38.944 60.266 1.00 39.53 C ATOM 218 CD2 TYR A 27 10.422 37.047 60.867 1.00 42.97 C ATOM 219 CE1 TYR A 27 12.749 38.503 61.082 1.00 41.47 C ATOM 220 CE2 TYR A 27 11.439 36.599 61.686 1.00 36.60 C ATOM 221 CZ TYR A 27 12.599 37.330 61.791 1.00 41.03 C ATOM 222 OH TYR A 27 13.613 36.883 62.607 1.00 44.19 O ATOM 223 HH TYR A 27 14.370 37.520 62.569 1.00 0.00 H ATOM 224 H TYR A 27 7.445 38.395 61.051 1.00 0.00 H ATOM 225 N SER A 28 7.405 41.709 58.980 1.00 52.68 N ATOM 226 CA SER A 28 6.457 42.376 58.097 1.00 57.81 C ATOM 227 C SER A 28 7.051 42.621 56.717 1.00 51.77 C ATOM 228 O SER A 28 6.307 42.714 55.735 1.00 53.25 O ATOM 229 CB SER A 28 5.996 43.689 58.730 1.00 49.77 C ATOM 230 OG SER A 28 7.083 44.377 59.323 1.00 60.49 O ATOM 231 HG SER A 28 6.758 45.222 59.725 1.00 0.00 H ATOM 232 H SER A 28 7.977 42.278 59.636 1.00 0.00 H ATOM 233 N ASN A 29 8.375 42.732 56.623 1.00 48.25 N ATOM 234 CA ASN A 29 9.058 42.818 55.335 1.00 50.11 C ATOM 235 C ASN A 29 9.338 41.386 54.900 1.00 43.82 C ATOM 236 O ASN A 29 10.287 40.753 55.367 1.00 42.67 O ATOM 237 CB ASN A 29 10.335 43.641 55.444 1.00 62.43 C ATOM 238 CG ASN A 29 11.063 43.762 54.122 1.00 64.37 C ATOM 239 OD1 ASN A 29 10.451 43.691 53.055 1.00 55.07 O ATOM 240 ND2 ASN A 29 12.377 43.951 54.184 1.00 52.09 N ATOM 241 HD22 ASN A 29 12.852 44.004 55.108 1.00 0.00 H ATOM 242 HD21 ASN A 29 12.931 44.045 53.309 1.00 0.00 H ATOM 243 H ASN A 29 8.941 42.758 57.495 1.00 0.00 H ATOM 244 N LYS A 30 8.509 40.874 53.995 1.00 43.67 N ATOM 245 CA LYS A 30 8.543 39.464 53.641 1.00 46.31 C ATOM 246 C LYS A 30 9.581 39.139 52.578 1.00 44.47 C ATOM 247 O LYS A 30 9.821 37.956 52.318 1.00 46.33 O ATOM 248 CB LYS A 30 7.152 39.028 53.175 1.00 44.64 C ATOM 249 CG LYS A 30 6.128 39.088 54.294 1.00 48.40 C ATOM 250 CD LYS A 30 4.711 38.810 53.825 1.00 50.28 C ATOM 251 CE LYS A 30 3.804 38.468 55.004 1.00 58.24 C ATOM 252 NZ LYS A 30 4.197 39.182 56.264 1.00 59.36 N ATOM 253 HZ1 LYS A 30 5.169 38.917 56.522 1.00 0.00 H ATOM 254 HZ2 LYS A 30 4.145 40.209 56.109 1.00 0.00 H ATOM 255 HZ3 LYS A 30 3.548 38.913 57.031 1.00 0.00 H ATOM 256 H LYS A 30 7.819 41.497 53.529 1.00 0.00 H ATOM 257 N GLU A 31 10.217 40.149 51.983 1.00 45.66 N ATOM 258 CA GLU A 31 11.203 39.904 50.939 1.00 47.40 C ATOM 259 C GLU A 31 12.438 39.185 51.465 1.00 48.39 C ATOM 260 O GLU A 31 13.206 38.634 50.669 1.00 50.27 O ATOM 261 CB GLU A 31 11.609 41.232 50.294 1.00 55.65 C ATOM 262 CG GLU A 31 12.679 41.993 51.066 1.00 59.42 C ATOM 263 CD GLU A 31 12.806 43.438 50.628 1.00 58.64 C ATOM 264 OE1 GLU A 31 12.059 43.856 49.719 1.00 59.45 O ATOM 265 OE2 GLU A 31 13.660 44.155 51.191 1.00 75.56 O ATOM 266 H GLU A 31 10.006 41.126 52.269 1.00 0.00 H ATOM 267 N ILE A 32 12.647 39.172 52.784 1.00 48.28 N ATOM 268 CA ILE A 32 13.854 38.582 53.355 1.00 46.78 C ATOM 269 C ILE A 32 13.936 37.079 53.142 1.00 38.09 C ATOM 270 O ILE A 32 14.994 36.489 53.382 1.00 39.04 O ATOM 271 CB ILE A 32 13.946 38.936 54.856 1.00 43.50 C ATOM 272 CG1 ILE A 32 12.852 38.226 55.661 1.00 54.76 C ATOM 273 CG2 ILE A 32 13.892 40.442 55.061 1.00 57.68 C ATOM 274 CD1 ILE A 32 13.388 37.244 56.677 1.00 55.59 C ATOM 275 H ILE A 32 11.936 39.591 53.417 1.00 0.00 H ATOM 276 N PHE A 33 12.849 36.438 52.705 1.00 40.34 N ATOM 277 CA PHE A 33 12.933 35.023 52.362 1.00 39.52 C ATOM 278 C PHE A 33 13.914 34.812 51.217 1.00 38.87 C ATOM 279 O PHE A 33 14.649 33.817 51.188 1.00 31.15 O ATOM 280 CB PHE A 33 11.554 34.485 51.981 1.00 43.73 C ATOM 281 CG PHE A 33 11.196 34.705 50.537 1.00 38.99 C ATOM 282 CD1 PHE A 33 10.724 35.932 50.102 1.00 40.96 C ATOM 283 CD2 PHE A 33 11.352 33.686 49.609 1.00 46.69 C ATOM 284 CE1 PHE A 33 10.400 36.136 48.769 1.00 43.93 C ATOM 285 CE2 PHE A 33 11.032 33.884 48.276 1.00 39.64 C ATOM 286 CZ PHE A 33 10.558 35.110 47.855 1.00 33.75 C ATOM 287 H PHE A 33 11.946 36.946 52.610 1.00 0.00 H ATOM 288 N LEU A 34 13.949 35.751 50.270 1.00 38.03 N ATOM 289 CA LEU A 34 14.829 35.612 49.118 1.00 42.88 C ATOM 290 C LEU A 34 16.282 35.807 49.524 1.00 39.25 C ATOM 291 O LEU A 34 17.173 35.109 49.025 1.00 39.39 O ATOM 292 CB LEU A 34 14.428 36.609 48.032 1.00 44.03 C ATOM 293 CG LEU A 34 15.046 36.426 46.644 1.00 42.75 C ATOM 294 CD1 LEU A 34 14.856 35.011 46.113 1.00 41.22 C ATOM 295 CD2 LEU A 34 14.441 37.437 45.686 1.00 46.19 C ATOM 296 H LEU A 34 13.342 36.591 50.355 1.00 0.00 H ATOM 297 N ARG A 35 16.537 36.750 50.431 1.00 34.64 N ATOM 298 CA ARG A 35 17.890 36.943 50.934 1.00 40.16 C ATOM 299 C ARG A 35 18.421 35.664 51.566 1.00 37.67 C ATOM 300 O ARG A 35 19.574 35.280 51.340 1.00 42.62 O ATOM 301 CB ARG A 35 17.905 38.085 51.948 1.00 37.29 C ATOM 302 CG ARG A 35 19.216 38.242 52.705 1.00 49.98 C ATOM 303 CD ARG A 35 19.056 39.217 53.847 1.00 44.17 C ATOM 304 NE ARG A 35 18.394 38.591 54.986 1.00 56.08 N ATOM 305 CZ ARG A 35 17.856 39.258 56.002 1.00 59.85 C ATOM 306 NH1 ARG A 35 17.888 40.583 56.024 1.00 65.25 N ATOM 307 NH2 ARG A 35 17.278 38.597 56.994 1.00 61.30 N ATOM 308 HE ARG A 35 18.339 37.553 55.004 1.00 0.00 H ATOM 309 HH12 ARG A 35 17.466 41.100 56.821 1.00 0.00 H ATOM 310 HH11 ARG A 35 18.336 41.105 55.244 1.00 0.00 H ATOM 311 HH22 ARG A 35 16.857 39.117 57.790 1.00 0.00 H ATOM 312 HH21 ARG A 35 17.246 37.558 56.977 1.00 0.00 H ATOM 313 H ARG A 35 15.765 37.352 50.782 1.00 0.00 H ATOM 314 N GLU A 36 17.591 34.991 52.364 1.00 37.58 N ATOM 315 CA GLU A 36 18.027 33.770 53.032 1.00 37.64 C ATOM 316 C GLU A 36 18.287 32.652 52.029 1.00 38.66 C ATOM 317 O GLU A 36 19.250 31.891 52.177 1.00 41.13 O ATOM 318 CB GLU A 36 16.979 33.345 54.060 1.00 39.63 C ATOM 319 CG GLU A 36 16.762 34.368 55.162 1.00 42.82 C ATOM 320 CD GLU A 36 17.919 34.425 56.141 1.00 45.96 C ATOM 321 OE1 GLU A 36 18.649 33.420 56.262 1.00 44.19 O ATOM 322 OE2 GLU A 36 18.101 35.477 56.787 1.00 53.76 O ATOM 323 H GLU A 36 16.623 35.341 52.512 1.00 0.00 H ATOM 324 N LEU A 37 17.442 32.536 51.002 1.00 33.59 N ATOM 325 CA LEU A 37 17.688 31.558 49.945 1.00 36.23 C ATOM 326 C LEU A 37 19.045 31.786 49.290 1.00 33.59 C ATOM 327 O LEU A 37 19.832 30.848 49.119 1.00 29.33 O ATOM 328 CB LEU A 37 16.579 31.634 48.896 1.00 28.68 C ATOM 329 CG LEU A 37 15.215 31.084 49.290 1.00 38.04 C ATOM 330 CD1 LEU A 37 14.180 31.406 48.244 1.00 43.22 C ATOM 331 CD2 LEU A 37 15.314 29.582 49.460 1.00 39.28 C ATOM 332 H LEU A 37 16.602 33.147 50.954 1.00 0.00 H ATOM 333 N ILE A 38 19.327 33.030 48.898 1.00 31.77 N ATOM 334 CA ILE A 38 20.592 33.333 48.239 1.00 31.54 C ATOM 335 C ILE A 38 21.754 33.074 49.185 1.00 38.55 C ATOM 336 O ILE A 38 22.807 32.568 48.778 1.00 34.50 O ATOM 337 CB ILE A 38 20.584 34.785 47.723 1.00 34.72 C ATOM 338 CG1 ILE A 38 19.539 34.936 46.616 1.00 38.46 C ATOM 339 CG2 ILE A 38 21.971 35.189 47.213 1.00 51.24 C ATOM 340 CD1 ILE A 38 19.223 36.366 46.257 1.00 50.95 C ATOM 341 H ILE A 38 18.638 33.791 49.064 1.00 0.00 H ATOM 342 N SER A 39 21.580 33.402 50.466 1.00 39.18 N ATOM 343 CA SER A 39 22.640 33.153 51.435 1.00 33.18 C ATOM 344 C SER A 39 22.857 31.659 51.629 1.00 32.96 C ATOM 345 O SER A 39 24.000 31.202 51.738 1.00 36.88 O ATOM 346 CB SER A 39 22.306 33.831 52.764 1.00 37.97 C ATOM 347 OG SER A 39 23.208 33.429 53.780 1.00 38.58 O ATOM 348 HG SER A 39 22.971 33.881 54.628 1.00 0.00 H ATOM 349 H SER A 39 20.687 33.836 50.774 1.00 0.00 H ATOM 350 N ASN A 40 21.773 30.882 51.680 1.00 32.00 N ATOM 351 CA ASN A 40 21.915 29.431 51.740 1.00 32.56 C ATOM 352 C ASN A 40 22.628 28.905 50.502 1.00 37.87 C ATOM 353 O ASN A 40 23.530 28.064 50.603 1.00 31.51 O ATOM 354 CB ASN A 40 20.547 28.770 51.876 1.00 33.50 C ATOM 355 CG ASN A 40 19.894 29.044 53.214 1.00 40.30 C ATOM 356 OD1 ASN A 40 20.561 29.408 54.183 1.00 41.43 O ATOM 357 ND2 ASN A 40 18.580 28.861 53.276 1.00 29.32 N ATOM 358 HD22 ASN A 40 18.057 28.553 52.431 1.00 0.00 H ATOM 359 HD21 ASN A 40 18.074 29.026 54.169 1.00 0.00 H ATOM 360 H ASN A 40 20.826 31.311 51.677 1.00 0.00 H ATOM 361 N ALA A 41 22.247 29.403 49.323 1.00 34.61 N ATOM 362 CA ALA A 41 22.850 28.920 48.088 1.00 36.77 C ATOM 363 C ALA A 41 24.329 29.273 48.028 1.00 34.94 C ATOM 364 O ALA A 41 25.150 28.455 47.598 1.00 35.85 O ATOM 365 CB ALA A 41 22.110 29.499 46.882 1.00 27.71 C ATOM 366 H ALA A 41 21.515 30.141 49.286 1.00 0.00 H ATOM 367 N SER A 42 24.688 30.484 48.464 1.00 31.60 N ATOM 368 CA SER A 42 26.091 30.884 48.475 1.00 35.63 C ATOM 369 C SER A 42 26.920 29.952 49.347 1.00 40.71 C ATOM 370 O SER A 42 28.033 29.563 48.972 1.00 40.26 O ATOM 371 CB SER A 42 26.222 32.327 48.964 1.00 31.98 C ATOM 372 OG SER A 42 27.582 32.683 49.117 1.00 45.85 O ATOM 373 HG SER A 42 28.007 32.081 49.778 1.00 0.00 H ATOM 374 H SER A 42 23.960 31.148 48.799 1.00 0.00 H ATOM 375 N ASP A 43 26.400 29.589 50.520 1.00 38.21 N ATOM 376 CA ASP A 43 27.110 28.652 51.382 1.00 39.95 C ATOM 377 C ASP A 43 27.256 27.292 50.709 1.00 38.21 C ATOM 378 O ASP A 43 28.309 26.652 50.806 1.00 39.96 O ATOM 379 CB ASP A 43 26.384 28.514 52.721 1.00 49.50 C ATOM 380 CG ASP A 43 26.441 29.785 53.554 1.00 46.95 C ATOM 381 OD1 ASP A 43 26.968 30.805 53.061 1.00 42.96 O ATOM 382 OD2 ASP A 43 25.959 29.761 54.706 1.00 55.39 O ATOM 383 H ASP A 43 25.483 29.976 50.821 1.00 0.00 H ATOM 384 N ALA A 44 26.203 26.830 50.029 1.00 37.84 N ATOM 385 CA ALA A 44 26.269 25.550 49.331 1.00 38.26 C ATOM 386 C ALA A 44 27.341 25.568 48.252 1.00 38.87 C ATOM 387 O ALA A 44 28.067 24.584 48.070 1.00 35.64 O ATOM 388 CB ALA A 44 24.906 25.215 48.726 1.00 31.12 C ATOM 389 H ALA A 44 25.326 27.389 49.997 1.00 0.00 H ATOM 390 N LEU A 45 27.461 26.680 47.531 1.00 29.49 N ATOM 391 CA LEU A 45 28.486 26.778 46.501 1.00 35.42 C ATOM 392 C LEU A 45 29.881 26.818 47.117 1.00 39.49 C ATOM 393 O LEU A 45 30.825 26.241 46.566 1.00 42.51 O ATOM 394 CB LEU A 45 28.232 28.015 45.642 1.00 30.71 C ATOM 395 CG LEU A 45 26.921 27.979 44.853 1.00 33.13 C ATOM 396 CD1 LEU A 45 26.540 29.362 44.351 1.00 40.98 C ATOM 397 CD2 LEU A 45 27.026 27.005 43.694 1.00 35.11 C ATOM 398 H LEU A 45 26.821 27.481 47.704 1.00 0.00 H ATOM 399 N ASP A 46 30.026 27.482 48.267 1.00 38.46 N ATOM 400 CA ASP A 46 31.318 27.513 48.946 1.00 41.02 C ATOM 401 C ASP A 46 31.799 26.109 49.286 1.00 41.88 C ATOM 402 O ASP A 46 32.986 25.798 49.134 1.00 47.95 O ATOM 403 CB ASP A 46 31.228 28.355 50.219 1.00 35.06 C ATOM 404 CG ASP A 46 31.123 29.839 49.935 1.00 37.69 C ATOM 405 OD1 ASP A 46 31.481 30.264 48.819 1.00 41.69 O ATOM 406 OD2 ASP A 46 30.689 30.586 50.838 1.00 47.68 O ATOM 407 H ASP A 46 29.213 27.980 48.682 1.00 0.00 H ATOM 408 N LYS A 47 30.894 25.248 49.754 1.00 42.87 N ATOM 409 CA LYS A 47 31.308 23.933 50.231 1.00 47.63 C ATOM 410 C LYS A 47 31.815 23.057 49.092 1.00 41.42 C ATOM 411 O LYS A 47 32.819 22.353 49.248 1.00 49.32 O ATOM 412 CB LYS A 47 30.152 23.257 50.967 1.00 42.49 C ATOM 413 CG LYS A 47 29.912 23.840 52.348 1.00 49.20 C ATOM 414 CD LYS A 47 29.107 22.904 53.232 1.00 65.79 C ATOM 415 CE LYS A 47 28.917 23.481 54.629 1.00117.94 C ATOM 416 NZ LYS A 47 28.465 24.899 54.610 1.00 87.78 N ATOM 417 HZ1 LYS A 47 29.173 25.481 54.119 1.00 0.00 H ATOM 418 HZ2 LYS A 47 27.555 24.965 54.112 1.00 0.00 H ATOM 419 HZ3 LYS A 47 28.352 25.239 55.586 1.00 0.00 H ATOM 420 H LYS A 47 29.889 25.515 49.779 1.00 0.00 H ATOM 421 N ILE A 48 31.142 23.081 47.940 1.00 41.75 N ATOM 422 CA ILE A 48 31.591 22.239 46.838 1.00 48.12 C ATOM 423 C ILE A 48 32.857 22.815 46.218 1.00 48.76 C ATOM 424 O ILE A 48 33.742 22.067 45.786 1.00 47.33 O ATOM 425 CB ILE A 48 30.471 22.065 45.792 1.00 37.94 C ATOM 426 CG1 ILE A 48 30.867 21.030 44.735 1.00 40.84 C ATOM 427 CG2 ILE A 48 30.148 23.388 45.111 1.00 37.22 C ATOM 428 CD1 ILE A 48 31.142 19.637 45.287 1.00 44.79 C ATOM 429 H ILE A 48 30.308 23.692 47.830 1.00 0.00 H ATOM 430 N ARG A 49 32.971 24.143 46.167 1.00 37.69 N ATOM 431 CA ARG A 49 34.204 24.759 45.693 1.00 43.33 C ATOM 432 C ARG A 49 35.380 24.368 46.576 1.00 50.35 C ATOM 433 O ARG A 49 36.474 24.083 46.076 1.00 45.20 O ATOM 434 CB ARG A 49 34.046 26.279 45.650 1.00 49.34 C ATOM 435 CG ARG A 49 35.236 27.016 45.046 1.00 43.10 C ATOM 436 CD ARG A 49 35.057 28.525 45.122 1.00 41.97 C ATOM 437 NE ARG A 49 34.957 28.994 46.502 1.00 67.12 N ATOM 438 CZ ARG A 49 34.679 30.245 46.853 1.00 70.74 C ATOM 439 NH1 ARG A 49 34.466 31.169 45.925 1.00 73.42 N ATOM 440 NH2 ARG A 49 34.610 30.576 48.136 1.00 83.09 N ATOM 441 HE ARG A 49 35.114 28.301 47.262 1.00 0.00 H ATOM 442 HH12 ARG A 49 34.249 32.147 46.205 1.00 0.00 H ATOM 443 HH11 ARG A 49 34.516 30.916 44.918 1.00 0.00 H ATOM 444 HH22 ARG A 49 34.392 31.556 48.409 1.00 0.00 H ATOM 445 HH21 ARG A 49 34.774 29.856 48.868 1.00 0.00 H ATOM 446 H ARG A 49 32.176 24.742 46.467 1.00 0.00 H ATOM 447 N TYR A 50 35.173 24.342 47.894 1.00 49.47 N ATOM 448 CA TYR A 50 36.256 23.998 48.810 1.00 51.47 C ATOM 449 C TYR A 50 36.704 22.556 48.612 1.00 54.95 C ATOM 450 O TYR A 50 37.885 22.288 48.363 1.00 53.35 O ATOM 451 CB TYR A 50 35.821 24.229 50.259 1.00 51.53 C ATOM 452 CG TYR A 50 36.900 23.890 51.264 1.00 57.60 C ATOM 453 CD1 TYR A 50 37.777 24.861 51.726 1.00 58.86 C ATOM 454 CD2 TYR A 50 37.048 22.595 51.742 1.00 62.42 C ATOM 455 CE1 TYR A 50 38.767 24.552 52.640 1.00 60.93 C ATOM 456 CE2 TYR A 50 38.034 22.277 52.654 1.00 68.95 C ATOM 457 CZ TYR A 50 38.891 23.259 53.100 1.00 69.93 C ATOM 458 OH TYR A 50 39.875 22.947 54.010 1.00 80.19 O ATOM 459 HH TYR A 50 40.397 23.761 54.222 1.00 0.00 H ATOM 460 H TYR A 50 34.231 24.569 48.272 1.00 0.00 H ATOM 461 N GLN A 51 35.773 21.606 48.721 1.00 54.50 N ATOM 462 CA GLN A 51 36.152 20.205 48.602 1.00 58.60 C ATOM 463 C GLN A 51 36.508 19.817 47.174 1.00 54.18 C ATOM 464 O GLN A 51 36.992 18.701 46.958 1.00 56.54 O ATOM 465 CB GLN A 51 35.029 19.302 49.121 1.00 56.47 C ATOM 466 CG GLN A 51 33.756 19.308 48.281 1.00 66.62 C ATOM 467 CD GLN A 51 32.935 18.044 48.459 1.00 78.20 C ATOM 468 OE1 GLN A 51 31.760 18.099 48.822 1.00 78.87 O ATOM 469 NE2 GLN A 51 33.550 16.896 48.193 1.00 73.69 N ATOM 470 HE22 GLN A 51 34.545 16.897 47.889 1.00 0.00 H ATOM 471 HE21 GLN A 51 33.037 15.997 48.289 1.00 0.00 H ATOM 472 H GLN A 51 34.780 21.865 48.890 1.00 0.00 H ATOM 473 N ALA A 52 36.276 20.698 46.200 1.00 50.11 N ATOM 474 CA ALA A 52 36.772 20.484 44.849 1.00 51.81 C ATOM 475 C ALA A 52 38.217 20.933 44.683 1.00 59.67 C ATOM 476 O ALA A 52 38.844 20.589 43.675 1.00 53.40 O ATOM 477 CB ALA A 52 35.886 21.217 43.841 1.00 46.08 C ATOM 478 H ALA A 52 35.729 21.557 46.411 1.00 0.00 H ATOM 479 N LEU A 53 38.755 21.690 45.641 1.00 58.37 N ATOM 480 CA LEU A 53 40.175 22.022 45.614 1.00 58.79 C ATOM 481 C LEU A 53 41.030 20.777 45.804 1.00 62.19 C ATOM 482 O LEU A 53 42.019 20.580 45.089 1.00 52.46 O ATOM 483 CB LEU A 53 40.490 23.061 46.691 1.00 54.49 C ATOM 484 CG LEU A 53 39.758 24.400 46.572 1.00 41.76 C ATOM 485 CD1 LEU A 53 40.040 25.271 47.780 1.00 39.18 C ATOM 486 CD2 LEU A 53 40.151 25.124 45.297 1.00 46.96 C ATOM 487 H LEU A 53 38.157 22.046 46.413 1.00 0.00 H ATOM 488 N SER A 54 40.663 19.925 46.764 1.00 60.40 N ATOM 489 CA SER A 54 41.394 18.681 46.979 1.00 52.85 C ATOM 490 C SER A 54 41.076 17.658 45.895 1.00 64.62 C ATOM 491 O SER A 54 41.976 16.971 45.400 1.00 70.92 O ATOM 492 CB SER A 54 41.061 18.113 48.359 1.00 64.04 C ATOM 493 OG SER A 54 41.072 19.128 49.349 1.00 70.62 O ATOM 494 HG SER A 54 40.854 18.731 50.229 1.00 0.00 H ATOM 495 H SER A 54 39.846 20.151 47.366 1.00 0.00 H ATOM 496 N ASP A 55 39.802 17.542 45.517 1.00 70.07 N ATOM 497 CA ASP A 55 39.337 16.523 44.576 1.00 71.56 C ATOM 498 C ASP A 55 38.494 17.197 43.502 1.00 64.75 C ATOM 499 O ASP A 55 37.265 17.286 43.626 1.00 63.58 O ATOM 500 CB ASP A 55 38.547 15.437 45.304 1.00 85.92 C ATOM 501 CG ASP A 55 38.063 14.345 44.375 1.00 86.63 C ATOM 502 OD1 ASP A 55 38.536 14.289 43.221 1.00 86.79 O ATOM 503 OD2 ASP A 55 37.211 13.537 44.802 1.00 98.43 O ATOM 504 H ASP A 55 39.106 18.208 45.910 1.00 0.00 H ATOM 505 N PRO A 56 39.119 17.678 42.421 1.00 67.91 N ATOM 506 CA PRO A 56 38.353 18.380 41.377 1.00 63.49 C ATOM 507 C PRO A 56 37.346 17.511 40.641 1.00 64.48 C ATOM 508 O PRO A 56 36.513 18.060 39.908 1.00 61.42 O ATOM 509 CB PRO A 56 39.443 18.882 40.421 1.00 55.22 C ATOM 510 CG PRO A 56 40.674 18.937 41.245 1.00 52.99 C ATOM 511 CD PRO A 56 40.569 17.788 42.198 1.00 54.21 C ATOM 512 N SER A 57 37.393 16.186 40.787 1.00 66.96 N ATOM 513 CA SER A 57 36.390 15.347 40.142 1.00 72.73 C ATOM 514 C SER A 57 34.999 15.542 40.731 1.00 68.75 C ATOM 515 O SER A 57 34.020 15.091 40.127 1.00 65.91 O ATOM 516 CB SER A 57 36.793 13.874 40.242 1.00 76.30 C ATOM 517 OG SER A 57 36.882 13.459 41.592 1.00 81.42 O ATOM 518 HG SER A 57 37.562 14.006 42.060 1.00 0.00 H ATOM 519 H SER A 57 38.144 15.752 41.360 1.00 0.00 H ATOM 520 N GLN A 58 34.886 16.204 41.885 1.00 68.23 N ATOM 521 CA GLN A 58 33.582 16.460 42.485 1.00 61.54 C ATOM 522 C GLN A 58 32.779 17.498 41.712 1.00 57.99 C ATOM 523 O GLN A 58 31.561 17.583 41.902 1.00 60.95 O ATOM 524 CB GLN A 58 33.753 16.909 43.937 1.00 64.63 C ATOM 525 CG GLN A 58 34.450 15.888 44.829 1.00 68.92 C ATOM 526 CD GLN A 58 33.556 14.713 45.180 1.00 74.89 C ATOM 527 OE1 GLN A 58 32.459 14.891 45.711 1.00 73.72 O ATOM 528 NE2 GLN A 58 34.022 13.504 44.886 1.00 74.01 N ATOM 529 HE22 GLN A 58 34.955 13.401 44.437 1.00 0.00 H ATOM 530 HE21 GLN A 58 33.454 12.661 45.104 1.00 0.00 H ATOM 531 H GLN A 58 35.744 16.543 42.365 1.00 0.00 H ATOM 532 N LEU A 59 33.425 18.289 40.854 1.00 55.91 N ATOM 533 CA LEU A 59 32.740 19.302 40.061 1.00 54.19 C ATOM 534 C LEU A 59 32.255 18.786 38.714 1.00 54.86 C ATOM 535 O LEU A 59 31.564 19.521 38.001 1.00 60.90 O ATOM 536 CB LEU A 59 33.662 20.504 39.818 1.00 48.73 C ATOM 537 CG LEU A 59 33.886 21.493 40.961 1.00 60.28 C ATOM 538 CD1 LEU A 59 34.901 22.543 40.539 1.00 64.84 C ATOM 539 CD2 LEU A 59 32.581 22.159 41.373 1.00 54.33 C ATOM 540 H LEU A 59 34.454 18.179 40.747 1.00 0.00 H ATOM 541 N GLU A 60 32.598 17.552 38.346 1.00 61.39 N ATOM 542 CA GLU A 60 32.236 17.040 37.030 1.00 63.18 C ATOM 543 C GLU A 60 30.733 16.836 36.872 1.00 58.40 C ATOM 544 O GLU A 60 30.236 16.841 35.741 1.00 55.61 O ATOM 545 CB GLU A 60 32.982 15.731 36.771 1.00 67.57 C ATOM 546 CG GLU A 60 34.486 15.912 36.599 1.00 73.49 C ATOM 547 CD GLU A 60 35.209 14.611 36.316 1.00 72.01 C ATOM 548 OE1 GLU A 60 34.773 13.871 35.410 1.00 75.66 O ATOM 549 OE2 GLU A 60 36.216 14.330 37.000 1.00 67.81 O ATOM 550 H GLU A 60 33.130 16.948 39.005 1.00 0.00 H ATOM 551 N SER A 61 29.996 16.666 37.973 1.00 53.23 N ATOM 552 CA SER A 61 28.550 16.490 37.875 1.00 53.05 C ATOM 553 C SER A 61 27.868 17.754 37.365 1.00 52.65 C ATOM 554 O SER A 61 26.940 17.680 36.551 1.00 50.68 O ATOM 555 CB SER A 61 27.981 16.087 39.234 1.00 58.52 C ATOM 556 OG SER A 61 28.475 16.926 40.264 1.00 52.90 O ATOM 557 HG SER A 61 28.091 16.643 41.131 1.00 0.00 H ATOM 558 H SER A 61 30.455 16.659 38.906 1.00 0.00 H ATOM 559 N GLU A 62 28.305 18.918 37.838 1.00 57.14 N ATOM 560 CA GLU A 62 27.817 20.206 37.345 1.00 61.46 C ATOM 561 C GLU A 62 28.998 21.168 37.378 1.00 63.34 C ATOM 562 O GLU A 62 29.294 21.761 38.428 1.00 69.84 O ATOM 563 CB GLU A 62 26.650 20.731 38.176 1.00 58.77 C ATOM 564 CG GLU A 62 26.205 22.134 37.788 1.00 59.70 C ATOM 565 CD GLU A 62 25.868 22.256 36.315 1.00 66.55 C ATOM 566 OE1 GLU A 62 24.756 21.840 35.925 1.00 69.60 O ATOM 567 OE2 GLU A 62 26.718 22.757 35.547 1.00 62.56 O ATOM 568 H GLU A 62 29.024 18.912 38.590 1.00 0.00 H ATOM 569 N PRO A 63 29.703 21.343 36.256 1.00 71.29 N ATOM 570 CA PRO A 63 30.970 22.096 36.309 1.00 66.37 C ATOM 571 C PRO A 63 30.820 23.530 36.783 1.00 66.58 C ATOM 572 O PRO A 63 31.662 24.014 37.550 1.00 59.42 O ATOM 573 CB PRO A 63 31.473 22.037 34.857 1.00 70.49 C ATOM 574 CG PRO A 63 30.698 20.941 34.203 1.00 78.56 C ATOM 575 CD PRO A 63 29.380 20.903 34.888 1.00 65.41 C ATOM 576 N GLU A 64 29.778 24.228 36.346 1.00 64.65 N ATOM 577 CA GLU A 64 29.638 25.637 36.669 1.00 70.35 C ATOM 578 C GLU A 64 29.028 25.816 38.056 1.00 63.76 C ATOM 579 O GLU A 64 28.283 24.962 38.547 1.00 53.17 O ATOM 580 CB GLU A 64 28.774 26.332 35.619 1.00 75.95 C ATOM 581 CG GLU A 64 29.451 26.416 34.257 1.00106.51 C ATOM 582 CD GLU A 64 30.657 27.333 34.237 1.00127.88 C ATOM 583 OE1 GLU A 64 30.697 28.294 35.030 1.00147.71 O ATOM 584 OE2 GLU A 64 31.573 27.079 33.426 1.00190.16 O ATOM 585 H GLU A 64 29.053 23.760 35.765 1.00 0.00 H ATOM 586 N LEU A 65 29.356 26.941 38.689 1.00 58.07 N ATOM 587 CA LEU A 65 28.834 27.297 40.004 1.00 44.44 C ATOM 588 C LEU A 65 27.984 28.550 39.858 1.00 43.25 C ATOM 589 O LEU A 65 28.504 29.614 39.503 1.00 46.59 O ATOM 590 CB LEU A 65 29.970 27.534 41.002 1.00 39.73 C ATOM 591 CG LEU A 65 30.908 26.351 41.260 1.00 41.88 C ATOM 592 CD1 LEU A 65 32.032 26.760 42.197 1.00 41.58 C ATOM 593 CD2 LEU A 65 30.148 25.159 41.827 1.00 44.66 C ATOM 594 H LEU A 65 30.016 27.597 38.224 1.00 0.00 H ATOM 595 N PHE A 66 26.686 28.433 40.140 1.00 47.66 N ATOM 596 CA PHE A 66 25.763 29.519 39.845 1.00 47.30 C ATOM 597 C PHE A 66 24.563 29.473 40.782 1.00 46.38 C ATOM 598 O PHE A 66 24.255 28.445 41.393 1.00 36.20 O ATOM 599 CB PHE A 66 25.281 29.453 38.390 1.00 44.64 C ATOM 600 CG PHE A 66 24.594 28.162 38.040 1.00 47.04 C ATOM 601 CD1 PHE A 66 25.329 27.036 37.710 1.00 52.57 C ATOM 602 CD2 PHE A 66 23.212 28.074 38.044 1.00 45.06 C ATOM 603 CE1 PHE A 66 24.698 25.849 37.392 1.00 51.33 C ATOM 604 CE2 PHE A 66 22.578 26.890 37.726 1.00 44.70 C ATOM 605 CZ PHE A 66 23.321 25.777 37.399 1.00 39.98 C ATOM 606 H PHE A 66 26.330 27.558 40.575 1.00 0.00 H ATOM 607 N ILE A 67 23.891 30.619 40.883 1.00 39.33 N ATOM 608 CA ILE A 67 22.568 30.734 41.485 1.00 41.20 C ATOM 609 C ILE A 67 21.617 31.204 40.393 1.00 38.20 C ATOM 610 O ILE A 67 21.947 32.127 39.639 1.00 41.44 O ATOM 611 CB ILE A 67 22.560 31.716 42.673 1.00 37.00 C ATOM 612 CG1 ILE A 67 23.544 31.267 43.753 1.00 30.03 C ATOM 613 CG2 ILE A 67 21.157 31.834 43.262 1.00 34.37 C ATOM 614 CD1 ILE A 67 23.767 32.300 44.845 1.00 38.02 C ATOM 615 H ILE A 67 24.336 31.482 40.511 1.00 0.00 H ATOM 616 N ARG A 68 20.449 30.569 40.300 1.00 37.61 N ATOM 617 CA ARG A 68 19.506 30.866 39.228 1.00 38.37 C ATOM 618 C ARG A 68 18.094 30.975 39.783 1.00 41.36 C ATOM 619 O ARG A 68 17.632 30.081 40.499 1.00 35.49 O ATOM 620 CB ARG A 68 19.564 29.789 38.142 1.00 41.54 C ATOM 621 CG ARG A 68 18.871 30.169 36.843 1.00 47.12 C ATOM 622 CD ARG A 68 19.257 29.200 35.743 1.00 50.40 C ATOM 623 NE ARG A 68 20.683 29.283 35.443 1.00 51.91 N ATOM 624 CZ ARG A 68 21.398 28.304 34.897 1.00 54.94 C ATOM 625 NH1 ARG A 68 20.829 27.147 34.589 1.00 56.76 N ATOM 626 NH2 ARG A 68 22.692 28.482 34.667 1.00 54.13 N ATOM 627 HE ARG A 68 21.174 30.170 35.672 1.00 0.00 H ATOM 628 HH12 ARG A 68 21.395 26.386 34.162 1.00 0.00 H ATOM 629 HH11 ARG A 68 19.816 27.000 34.774 1.00 0.00 H ATOM 630 HH22 ARG A 68 23.254 27.718 34.240 1.00 0.00 H ATOM 631 HH21 ARG A 68 23.145 29.385 34.914 1.00 0.00 H ATOM 632 H ARG A 68 20.205 29.846 41.007 1.00 0.00 H ATOM 633 N ILE A 69 17.411 32.063 39.434 1.00 40.41 N ATOM 634 CA ILE A 69 16.043 32.330 39.865 1.00 34.30 C ATOM 635 C ILE A 69 15.153 32.254 38.631 1.00 40.17 C ATOM 636 O ILE A 69 15.369 32.988 37.657 1.00 44.43 O ATOM 637 CB ILE A 69 15.925 33.701 40.547 1.00 32.19 C ATOM 638 CG1 ILE A 69 16.873 33.779 41.750 1.00 31.77 C ATOM 639 CG2 ILE A 69 14.483 33.958 40.984 1.00 30.22 C ATOM 640 CD1 ILE A 69 16.985 35.163 42.358 1.00 37.32 C ATOM 641 H ILE A 69 17.878 32.761 38.821 1.00 0.00 H ATOM 642 N ILE A 70 14.167 31.366 38.660 1.00 39.56 N ATOM 643 CA ILE A 70 13.281 31.126 37.529 1.00 36.70 C ATOM 644 C ILE A 70 11.841 31.314 37.988 1.00 37.93 C ATOM 645 O ILE A 70 11.232 30.400 38.542 1.00 38.81 O ATOM 646 CB ILE A 70 13.485 29.720 36.940 1.00 43.75 C ATOM 647 CG1 ILE A 70 14.975 29.425 36.744 1.00 41.57 C ATOM 648 CG2 ILE A 70 12.739 29.592 35.621 1.00 41.23 C ATOM 649 CD1 ILE A 70 15.594 28.645 37.891 1.00 45.63 C ATOM 650 H ILE A 70 14.020 30.816 39.530 1.00 0.00 H ATOM 651 N PRO A 71 11.262 32.497 37.789 1.00 36.10 N ATOM 652 CA PRO A 71 9.822 32.665 38.054 1.00 37.58 C ATOM 653 C PRO A 71 8.989 31.915 37.024 1.00 42.62 C ATOM 654 O PRO A 71 9.129 32.130 35.817 1.00 50.21 O ATOM 655 CB PRO A 71 9.613 34.183 37.954 1.00 39.91 C ATOM 656 CG PRO A 71 10.751 34.678 37.151 1.00 37.52 C ATOM 657 CD PRO A 71 11.908 33.781 37.455 1.00 38.32 C ATOM 658 N GLN A 72 8.115 31.037 37.504 1.00 44.68 N ATOM 659 CA GLN A 72 7.155 30.331 36.656 1.00 53.67 C ATOM 660 C GLN A 72 5.808 31.030 36.811 1.00 44.28 C ATOM 661 O GLN A 72 5.077 30.784 37.773 1.00 56.47 O ATOM 662 CB GLN A 72 7.068 28.856 37.036 1.00 46.90 C ATOM 663 CG GLN A 72 8.404 28.127 37.018 1.00 46.87 C ATOM 664 CD GLN A 72 8.959 27.955 35.616 1.00 54.08 C ATOM 665 OE1 GLN A 72 8.319 28.329 34.633 1.00 61.08 O ATOM 666 NE2 GLN A 72 10.156 27.387 35.517 1.00 48.10 N ATOM 667 HE22 GLN A 72 10.661 27.086 36.375 1.00 0.00 H ATOM 668 HE21 GLN A 72 10.588 27.243 34.582 1.00 0.00 H ATOM 669 H GLN A 72 8.113 30.844 38.526 1.00 0.00 H ATOM 670 N LYS A 73 5.481 31.909 35.861 1.00 47.45 N ATOM 671 CA LYS A 73 4.249 32.685 35.965 1.00 53.53 C ATOM 672 C LYS A 73 3.019 31.802 35.785 1.00 57.07 C ATOM 673 O LYS A 73 2.018 31.974 36.491 1.00 53.49 O ATOM 674 CB LYS A 73 4.254 33.818 34.939 1.00 58.72 C ATOM 675 CG LYS A 73 5.216 34.951 35.273 1.00 60.16 C ATOM 676 CD LYS A 73 5.125 36.079 34.256 1.00 81.84 C ATOM 677 CE LYS A 73 5.852 37.329 34.733 1.00 77.82 C ATOM 678 NZ LYS A 73 7.120 37.580 33.987 1.00 73.32 N ATOM 679 HZ1 LYS A 73 7.761 36.771 34.113 1.00 0.00 H ATOM 680 HZ2 LYS A 73 6.908 37.701 32.976 1.00 0.00 H ATOM 681 HZ3 LYS A 73 7.572 38.442 34.353 1.00 0.00 H ATOM 682 H LYS A 73 6.108 32.042 35.042 1.00 0.00 H ATOM 683 N ASP A 74 3.073 30.851 34.851 1.00 62.71 N ATOM 684 CA ASP A 74 1.926 29.980 34.614 1.00 64.16 C ATOM 685 C ASP A 74 1.556 29.212 35.875 1.00 62.85 C ATOM 686 O ASP A 74 0.388 29.177 36.280 1.00 69.87 O ATOM 687 CB ASP A 74 2.236 29.006 33.474 1.00 65.01 C ATOM 688 CG ASP A 74 2.348 29.695 32.128 1.00 79.26 C ATOM 689 OD1 ASP A 74 1.646 30.706 31.913 1.00 81.82 O ATOM 690 OD2 ASP A 74 3.138 29.222 31.283 1.00 76.85 O ATOM 691 H ASP A 74 3.939 30.729 34.288 1.00 0.00 H ATOM 692 N GLN A 75 2.544 28.588 36.508 1.00 53.30 N ATOM 693 CA GLN A 75 2.329 27.742 37.672 1.00 55.28 C ATOM 694 C GLN A 75 2.288 28.520 38.981 1.00 46.93 C ATOM 695 O GLN A 75 2.105 27.909 40.039 1.00 44.40 O ATOM 696 CB GLN A 75 3.430 26.678 37.735 1.00 66.74 C ATOM 697 CG GLN A 75 3.657 25.952 36.411 1.00 74.61 C ATOM 698 CD GLN A 75 4.988 25.231 36.358 1.00 78.96 C ATOM 699 OE1 GLN A 75 5.245 24.315 37.139 1.00 84.55 O ATOM 700 NE2 GLN A 75 5.845 25.644 35.429 1.00 64.44 N ATOM 701 HE22 GLN A 75 5.584 26.422 34.790 1.00 0.00 H ATOM 702 HE21 GLN A 75 6.776 25.189 35.341 1.00 0.00 H ATOM 703 H GLN A 75 3.515 28.710 36.155 1.00 0.00 H ATOM 704 N LYS A 76 2.444 29.843 38.939 1.00 50.84 N ATOM 705 CA LYS A 76 2.506 30.659 40.152 1.00 46.52 C ATOM 706 C LYS A 76 3.559 30.116 41.116 1.00 46.20 C ATOM 707 O LYS A 76 3.344 30.033 42.326 1.00 38.31 O ATOM 708 CB LYS A 76 1.135 30.728 40.824 1.00 52.06 C ATOM 709 CG LYS A 76 0.101 31.526 40.043 1.00 52.56 C ATOM 710 CD LYS A 76 -1.275 31.441 40.688 1.00 64.02 C ATOM 711 CE LYS A 76 -2.366 31.924 39.743 1.00 72.59 C ATOM 712 NZ LYS A 76 -3.715 31.440 40.145 1.00 70.98 N ATOM 713 HZ1 LYS A 76 -3.723 30.400 40.144 1.00 0.00 H ATOM 714 HZ2 LYS A 76 -3.937 31.788 41.099 1.00 0.00 H ATOM 715 HZ3 LYS A 76 -4.424 31.795 39.472 1.00 0.00 H ATOM 716 H LYS A 76 2.524 30.311 38.014 1.00 0.00 H ATOM 717 N VAL A 77 4.715 29.747 40.568 1.00 44.04 N ATOM 718 CA VAL A 77 5.800 29.145 41.331 1.00 39.58 C ATOM 719 C VAL A 77 7.070 29.945 41.088 1.00 43.00 C ATOM 720 O VAL A 77 7.340 30.373 39.960 1.00 32.14 O ATOM 721 CB VAL A 77 6.005 27.660 40.955 1.00 41.94 C ATOM 722 CG1 VAL A 77 7.395 27.161 41.377 1.00 42.56 C ATOM 723 CG2 VAL A 77 4.924 26.805 41.594 1.00 42.34 C ATOM 724 H VAL A 77 4.850 29.896 39.547 1.00 0.00 H ATOM 725 N LEU A 78 7.851 30.140 42.148 1.00 37.97 N ATOM 726 CA LEU A 78 9.165 30.759 42.055 1.00 36.15 C ATOM 727 C LEU A 78 10.214 29.701 42.353 1.00 39.45 C ATOM 728 O LEU A 78 10.195 29.085 43.425 1.00 35.06 O ATOM 729 CB LEU A 78 9.310 31.931 43.023 1.00 34.95 C ATOM 730 CG LEU A 78 10.675 32.626 42.960 1.00 34.69 C ATOM 731 CD1 LEU A 78 10.953 33.164 41.561 1.00 25.94 C ATOM 732 CD2 LEU A 78 10.767 33.736 43.994 1.00 43.45 C ATOM 733 H LEU A 78 7.508 29.837 43.082 1.00 0.00 H ATOM 734 N GLU A 79 11.120 29.493 41.407 1.00 30.73 N ATOM 735 CA GLU A 79 12.156 28.482 41.520 1.00 32.00 C ATOM 736 C GLU A 79 13.504 29.148 41.763 1.00 31.33 C ATOM 737 O GLU A 79 13.860 30.107 41.070 1.00 32.31 O ATOM 738 CB GLU A 79 12.195 27.637 40.252 1.00 37.70 C ATOM 739 CG GLU A 79 10.884 26.894 39.984 1.00 42.49 C ATOM 740 CD GLU A 79 10.862 26.165 38.652 1.00 47.39 C ATOM 741 OE1 GLU A 79 10.059 25.219 38.507 1.00 47.05 O ATOM 742 OE2 GLU A 79 11.646 26.533 37.752 1.00 48.27 O ATOM 743 H GLU A 79 11.087 30.079 40.548 1.00 0.00 H ATOM 744 N ILE A 80 14.240 28.651 42.754 1.00 34.08 N ATOM 745 CA ILE A 80 15.593 29.110 43.059 1.00 37.35 C ATOM 746 C ILE A 80 16.502 27.894 43.049 1.00 34.62 C ATOM 747 O ILE A 80 16.351 27.000 43.891 1.00 37.93 O ATOM 748 CB ILE A 80 15.677 29.825 44.420 1.00 41.90 C ATOM 749 CG1 ILE A 80 14.596 30.896 44.559 1.00 40.91 C ATOM 750 CG2 ILE A 80 17.061 30.449 44.610 1.00 48.58 C ATOM 751 CD1 ILE A 80 13.245 30.368 45.024 1.00 45.34 C ATOM 752 H ILE A 80 13.831 27.897 43.342 1.00 0.00 H ATOM 753 N ARG A 81 17.458 27.867 42.125 1.00 33.31 N ATOM 754 CA ARG A 81 18.353 26.730 41.991 1.00 31.78 C ATOM 755 C ARG A 81 19.800 27.168 42.153 1.00 31.18 C ATOM 756 O ARG A 81 20.187 28.270 41.752 1.00 33.16 O ATOM 757 CB ARG A 81 18.205 26.025 40.635 1.00 43.00 C ATOM 758 CG ARG A 81 18.886 24.655 40.625 1.00 36.47 C ATOM 759 CD ARG A 81 19.556 24.295 39.318 1.00 46.30 C ATOM 760 NE ARG A 81 20.647 23.357 39.575 1.00 51.11 N ATOM 761 CZ ARG A 81 21.205 22.568 38.665 1.00 47.53 C ATOM 762 NH1 ARG A 81 20.775 22.575 37.410 1.00 57.83 N ATOM 763 NH2 ARG A 81 22.194 21.760 39.021 1.00 56.67 N ATOM 764 HE ARG A 81 21.015 23.304 40.546 1.00 0.00 H ATOM 765 HH12 ARG A 81 21.219 21.953 36.705 1.00 0.00 H ATOM 766 HH11 ARG A 81 19.994 23.203 37.131 1.00 0.00 H ATOM 767 HH22 ARG A 81 22.637 21.138 38.315 1.00 0.00 H ATOM 768 HH21 ARG A 81 22.527 21.748 40.006 1.00 0.00 H ATOM 769 H ARG A 81 17.568 28.678 41.484 1.00 0.00 H ATOM 770 N ASP A 82 20.594 26.280 42.744 1.00 29.08 N ATOM 771 CA ASP A 82 22.025 26.474 42.883 1.00 41.95 C ATOM 772 C ASP A 82 22.720 25.158 42.564 1.00 45.61 C ATOM 773 O ASP A 82 22.133 24.078 42.668 1.00 36.42 O ATOM 774 CB ASP A 82 22.400 26.954 44.294 1.00 27.63 C ATOM 775 CG ASP A 82 22.151 25.901 45.359 1.00 32.73 C ATOM 776 OD1 ASP A 82 22.873 24.882 45.370 1.00 34.06 O ATOM 777 OD2 ASP A 82 21.245 26.099 46.200 1.00 37.99 O ATOM 778 H ASP A 82 20.171 25.409 43.123 1.00 0.00 H ATOM 779 N SER A 83 23.989 25.262 42.168 1.00 43.86 N ATOM 780 CA SER A 83 24.811 24.106 41.833 1.00 38.70 C ATOM 781 C SER A 83 25.753 23.725 42.971 1.00 40.38 C ATOM 782 O SER A 83 26.815 23.142 42.732 1.00 44.29 O ATOM 783 CB SER A 83 25.595 24.378 40.552 1.00 34.92 C ATOM 784 OG SER A 83 26.201 25.651 40.605 1.00 45.47 O ATOM 785 HG SER A 83 26.704 25.811 39.768 1.00 0.00 H ATOM 786 H SER A 83 24.411 26.210 42.095 1.00 0.00 H ATOM 787 N GLY A 84 25.386 24.056 44.206 1.00 41.91 N ATOM 788 CA GLY A 84 26.229 23.771 45.349 1.00 36.00 C ATOM 789 C GLY A 84 26.411 22.296 45.648 1.00 38.69 C ATOM 790 O GLY A 84 26.185 21.437 44.790 1.00 35.86 O ATOM 791 H GLY A 84 24.473 24.530 44.354 1.00 0.00 H ATOM 792 N ILE A 85 26.829 22.000 46.882 1.00 33.93 N ATOM 793 CA ILE A 85 27.180 20.638 47.270 1.00 35.11 C ATOM 794 C ILE A 85 25.971 19.711 47.276 1.00 39.44 C ATOM 795 O ILE A 85 26.136 18.487 47.220 1.00 40.52 O ATOM 796 CB ILE A 85 27.865 20.656 48.651 1.00 40.35 C ATOM 797 CG1 ILE A 85 28.426 19.274 48.996 1.00 46.72 C ATOM 798 CG2 ILE A 85 26.888 21.122 49.729 1.00 37.96 C ATOM 799 CD1 ILE A 85 29.288 19.258 50.248 1.00 47.94 C ATOM 800 H ILE A 85 26.906 22.762 47.586 1.00 0.00 H ATOM 801 N GLY A 86 24.761 20.256 47.344 1.00 49.43 N ATOM 802 CA GLY A 86 23.560 19.441 47.372 1.00 43.42 C ATOM 803 C GLY A 86 23.342 18.776 48.721 1.00 37.44 C ATOM 804 O GLY A 86 24.087 18.965 49.681 1.00 42.57 O ATOM 805 H GLY A 86 24.672 21.292 47.378 1.00 0.00 H ATOM 806 N MET A 87 22.288 17.964 48.776 1.00 40.97 N ATOM 807 CA MET A 87 21.854 17.338 50.018 1.00 45.40 C ATOM 808 C MET A 87 21.489 15.884 49.767 1.00 41.89 C ATOM 809 O MET A 87 20.761 15.581 48.818 1.00 46.49 O ATOM 810 CB MET A 87 20.648 18.084 50.594 1.00 43.93 C ATOM 811 CG MET A 87 20.953 19.512 50.997 1.00 46.46 C ATOM 812 SD MET A 87 19.464 20.441 51.386 1.00 40.62 S ATOM 813 CE MET A 87 19.625 20.602 53.151 1.00 39.41 C ATOM 814 H MET A 87 21.757 17.770 47.903 1.00 0.00 H ATOM 815 N THR A 88 21.996 14.990 50.612 1.00 42.44 N ATOM 816 CA THR A 88 21.554 13.606 50.587 1.00 48.24 C ATOM 817 C THR A 88 20.142 13.518 51.166 1.00 51.85 C ATOM 818 O THR A 88 19.526 14.524 51.530 1.00 47.94 O ATOM 819 CB THR A 88 22.516 12.717 51.374 1.00 60.33 C ATOM 820 OG1 THR A 88 22.425 13.024 52.770 1.00 48.65 O ATOM 821 CG2 THR A 88 23.954 12.930 50.911 1.00 53.13 C ATOM 822 HG1 THR A 88 22.663 13.974 52.914 1.00 0.00 H ATOM 823 H THR A 88 22.718 15.286 51.299 1.00 0.00 H ATOM 824 N LYS A 89 19.616 12.296 51.261 1.00 52.07 N ATOM 825 CA LYS A 89 18.325 12.121 51.917 1.00 51.96 C ATOM 826 C LYS A 89 18.417 12.477 53.395 1.00 53.40 C ATOM 827 O LYS A 89 17.522 13.133 53.940 1.00 46.89 O ATOM 828 CB LYS A 89 17.824 10.686 51.750 1.00 60.18 C ATOM 829 CG LYS A 89 16.345 10.541 52.073 1.00 61.72 C ATOM 830 CD LYS A 89 15.960 9.158 52.574 1.00 68.38 C ATOM 831 CE LYS A 89 15.044 9.250 53.795 1.00 79.45 C ATOM 832 NZ LYS A 89 15.819 9.397 55.063 1.00 80.42 N ATOM 833 HZ1 LYS A 89 16.442 8.573 55.184 1.00 0.00 H ATOM 834 HZ2 LYS A 89 16.392 10.264 55.019 1.00 0.00 H ATOM 835 HZ3 LYS A 89 15.160 9.456 55.866 1.00 0.00 H ATOM 836 H LYS A 89 20.122 11.475 50.871 1.00 0.00 H ATOM 837 N ALA A 90 19.496 12.053 54.059 1.00 55.31 N ATOM 838 CA ALA A 90 19.672 12.376 55.470 1.00 51.75 C ATOM 839 C ALA A 90 19.820 13.878 55.671 1.00 54.15 C ATOM 840 O ALA A 90 19.294 14.437 56.641 1.00 53.39 O ATOM 841 CB ALA A 90 20.888 11.638 56.026 1.00 46.72 C ATOM 842 H ALA A 90 20.216 11.488 53.565 1.00 0.00 H ATOM 843 N ASP A 91 20.536 14.548 54.766 1.00 51.90 N ATOM 844 CA ASP A 91 20.725 15.989 54.893 1.00 48.50 C ATOM 845 C ASP A 91 19.409 16.733 54.711 1.00 43.22 C ATOM 846 O ASP A 91 19.143 17.713 55.415 1.00 48.91 O ATOM 847 CB ASP A 91 21.762 16.474 53.880 1.00 58.93 C ATOM 848 CG ASP A 91 23.147 15.918 54.150 1.00 55.23 C ATOM 849 OD1 ASP A 91 23.541 15.839 55.333 1.00 61.87 O ATOM 850 OD2 ASP A 91 23.844 15.564 53.176 1.00 52.67 O ATOM 851 H ASP A 91 20.962 14.040 53.965 1.00 0.00 H ATOM 852 N LEU A 92 18.576 16.286 53.769 1.00 45.55 N ATOM 853 CA LEU A 92 17.273 16.912 53.568 1.00 41.34 C ATOM 854 C LEU A 92 16.432 16.840 54.837 1.00 53.55 C ATOM 855 O LEU A 92 15.810 17.829 55.243 1.00 51.76 O ATOM 856 CB LEU A 92 16.545 16.239 52.404 1.00 43.32 C ATOM 857 CG LEU A 92 16.968 16.642 50.989 1.00 45.14 C ATOM 858 CD1 LEU A 92 16.344 15.704 49.968 1.00 40.72 C ATOM 859 CD2 LEU A 92 16.572 18.078 50.690 1.00 44.49 C ATOM 860 H LEU A 92 18.858 15.483 53.172 1.00 0.00 H ATOM 861 N VAL A 93 16.403 15.670 55.478 1.00 51.80 N ATOM 862 CA VAL A 93 15.587 15.490 56.676 1.00 57.56 C ATOM 863 C VAL A 93 16.081 16.391 57.800 1.00 54.35 C ATOM 864 O VAL A 93 15.286 16.934 58.576 1.00 54.79 O ATOM 865 CB VAL A 93 15.586 14.007 57.097 1.00 58.56 C ATOM 866 CG1 VAL A 93 15.033 13.835 58.511 1.00 59.02 C ATOM 867 CG2 VAL A 93 14.776 13.180 56.110 1.00 54.97 C ATOM 868 H VAL A 93 16.969 14.875 55.119 1.00 0.00 H ATOM 869 N ASN A 94 17.398 16.558 57.912 1.00 56.73 N ATOM 870 CA ASN A 94 17.957 17.342 59.008 1.00 52.50 C ATOM 871 C ASN A 94 17.662 18.825 58.831 1.00 53.43 C ATOM 872 O ASN A 94 17.114 19.479 59.724 1.00 59.14 O ATOM 873 CB ASN A 94 19.469 17.112 59.085 1.00 41.05 C ATOM 874 CG ASN A 94 19.829 15.694 59.477 1.00 58.44 C ATOM 875 OD1 ASN A 94 18.981 14.802 59.484 1.00 67.08 O ATOM 876 ND2 ASN A 94 21.102 15.473 59.786 1.00 69.16 N ATOM 877 HD22 ASN A 94 21.785 16.257 59.767 1.00 0.00 H ATOM 878 HD21 ASN A 94 21.415 14.516 60.047 1.00 0.00 H ATOM 879 H ASN A 94 18.034 16.125 57.212 1.00 0.00 H ATOM 880 N ASN A 95 18.034 19.374 57.677 1.00 60.43 N ATOM 881 CA ASN A 95 17.985 20.816 57.467 1.00 52.88 C ATOM 882 C ASN A 95 16.570 21.350 57.264 1.00 48.40 C ATOM 883 O ASN A 95 16.303 22.509 57.596 1.00 50.56 O ATOM 884 CB ASN A 95 18.850 21.162 56.264 1.00 46.80 C ATOM 885 CG ASN A 95 20.324 20.955 56.534 1.00 44.72 C ATOM 886 OD1 ASN A 95 20.970 20.128 55.891 1.00 60.38 O ATOM 887 ND2 ASN A 95 20.864 21.695 57.493 1.00 59.92 N ATOM 888 HD22 ASN A 95 20.280 22.382 58.011 1.00 0.00 H ATOM 889 HD21 ASN A 95 21.872 21.588 57.727 1.00 0.00 H ATOM 890 H ASN A 95 18.368 18.760 56.907 1.00 0.00 H ATOM 891 N LEU A 96 15.662 20.544 56.711 1.00 57.72 N ATOM 892 CA LEU A 96 14.360 21.022 56.251 1.00 53.55 C ATOM 893 C LEU A 96 13.264 20.689 57.258 1.00 64.41 C ATOM 894 O LEU A 96 12.975 19.513 57.506 1.00 63.70 O ATOM 895 CB LEU A 96 14.009 20.433 54.889 1.00 47.78 C ATOM 896 CG LEU A 96 15.001 20.790 53.780 1.00 55.62 C ATOM 897 CD1 LEU A 96 14.679 19.992 52.527 1.00 56.12 C ATOM 898 CD2 LEU A 96 15.069 22.290 53.500 1.00 47.21 C ATOM 899 H LEU A 96 15.890 19.535 56.603 1.00 0.00 H ATOM 900 N GLY A 97 12.671 21.726 57.849 1.00 67.75 N ATOM 901 CA GLY A 97 11.554 21.554 58.751 1.00 64.48 C ATOM 902 C GLY A 97 11.957 21.290 60.179 1.00 76.27 C ATOM 903 O GLY A 97 11.079 21.110 61.033 1.00 77.73 O ATOM 904 H GLY A 97 13.022 22.686 57.656 1.00 0.00 H ATOM 905 N THR A 98 13.252 21.268 60.463 1.00 76.33 N ATOM 906 CA THR A 98 13.759 20.978 61.790 1.00 74.82 C ATOM 907 C THR A 98 13.994 22.272 62.556 1.00 75.64 C ATOM 908 O THR A 98 14.297 23.319 61.978 1.00 75.77 O ATOM 909 CB THR A 98 15.060 20.176 61.696 1.00 66.94 C ATOM 910 OG1 THR A 98 14.794 18.914 61.069 1.00 61.85 O ATOM 911 CG2 THR A 98 15.671 19.935 63.072 1.00 72.41 C ATOM 912 HG1 THR A 98 15.634 18.394 61.007 1.00 0.00 H ATOM 913 H THR A 98 13.932 21.467 59.702 1.00 0.00 H ATOM 914 N ILE A 99 13.841 22.185 63.872 1.00 77.56 N ATOM 915 CA ILE A 99 14.048 23.308 64.773 1.00 76.69 C ATOM 916 C ILE A 99 15.145 22.932 65.756 1.00 81.01 C ATOM 917 O ILE A 99 15.234 21.776 66.186 1.00 91.55 O ATOM 918 CB ILE A 99 12.747 23.672 65.516 1.00 86.07 C ATOM 919 CG1 ILE A 99 11.682 24.157 64.526 1.00 82.49 C ATOM 920 CG2 ILE A 99 13.009 24.728 66.560 1.00 78.73 C ATOM 921 CD1 ILE A 99 12.052 25.427 63.777 1.00 79.47 C ATOM 922 H ILE A 99 13.560 21.270 64.278 1.00 0.00 H ATOM 923 N ALA A 100 15.979 23.907 66.107 1.00 77.70 N ATOM 924 CA ALA A 100 17.039 23.701 67.083 1.00 83.45 C ATOM 925 C ALA A 100 16.654 24.352 68.405 1.00 86.34 C ATOM 926 O ALA A 100 16.262 25.523 68.434 1.00 77.78 O ATOM 927 CB ALA A 100 18.371 24.260 66.580 1.00 83.01 C ATOM 928 H ALA A 100 15.870 24.845 65.671 1.00 0.00 H ATOM 929 N LYS A 101 16.767 23.589 69.496 1.00 90.81 N ATOM 930 CA LYS A 101 16.414 24.130 70.806 1.00 89.18 C ATOM 931 C LYS A 101 17.252 25.359 71.125 1.00 80.84 C ATOM 932 O LYS A 101 16.746 26.340 71.683 1.00 86.40 O ATOM 933 CB LYS A 101 16.583 23.073 71.908 1.00 92.42 C ATOM 934 CG LYS A 101 16.527 21.615 71.456 1.00 89.02 C ATOM 935 CD LYS A 101 16.181 20.671 72.606 1.00112.04 C ATOM 936 CE LYS A 101 14.679 20.625 72.858 1.00104.94 C ATOM 937 NZ LYS A 101 14.282 19.528 73.786 1.00114.73 N ATOM 938 HZ1 LYS A 101 14.565 18.613 73.380 1.00 0.00 H ATOM 939 HZ2 LYS A 101 14.754 19.663 74.703 1.00 0.00 H ATOM 940 HZ3 LYS A 101 13.251 19.545 73.920 1.00 0.00 H ATOM 941 H LYS A 101 17.106 22.610 69.412 1.00 0.00 H ATOM 942 N SER A 102 18.536 25.326 70.769 1.00 78.07 N ATOM 943 CA SER A 102 19.402 26.478 70.992 1.00 73.13 C ATOM 944 C SER A 102 18.884 27.708 70.256 1.00 72.38 C ATOM 945 O SER A 102 18.715 28.779 70.851 1.00 68.54 O ATOM 946 CB SER A 102 20.825 26.144 70.545 1.00 57.92 C ATOM 947 OG SER A 102 21.615 27.316 70.446 1.00 67.08 O ATOM 948 HG SER A 102 22.530 27.073 70.156 1.00 0.00 H ATOM 949 H SER A 102 18.925 24.469 70.327 1.00 0.00 H ATOM 950 N GLY A 103 18.622 27.571 68.955 1.00 76.13 N ATOM 951 CA GLY A 103 18.222 28.725 68.165 1.00 68.03 C ATOM 952 C GLY A 103 16.861 29.264 68.564 1.00 63.89 C ATOM 953 O GLY A 103 16.682 30.474 68.727 1.00 55.74 O ATOM 954 H GLY A 103 18.704 26.637 68.505 1.00 0.00 H ATOM 955 N THR A 104 15.880 28.373 68.723 1.00 59.58 N ATOM 956 CA THR A 104 14.537 28.813 69.088 1.00 66.18 C ATOM 957 C THR A 104 14.530 29.489 70.451 1.00 66.05 C ATOM 958 O THR A 104 13.904 30.541 70.625 1.00 59.33 O ATOM 959 CB THR A 104 13.576 27.628 69.077 1.00 69.47 C ATOM 960 OG1 THR A 104 13.688 26.954 67.823 1.00 71.62 O ATOM 961 CG2 THR A 104 12.137 28.093 69.263 1.00 55.99 C ATOM 962 HG1 THR A 104 14.617 26.634 67.704 1.00 0.00 H ATOM 963 H THR A 104 16.073 27.360 68.586 1.00 0.00 H ATOM 964 N LYS A 105 15.216 28.900 71.432 1.00 73.60 N ATOM 965 CA LYS A 105 15.282 29.526 72.747 1.00 71.70 C ATOM 966 C LYS A 105 15.876 30.924 72.652 1.00 67.05 C ATOM 967 O LYS A 105 15.387 31.860 73.295 1.00 66.86 O ATOM 968 CB LYS A 105 16.087 28.655 73.714 1.00 79.51 C ATOM 969 CG LYS A 105 16.080 29.188 75.144 1.00 82.32 C ATOM 970 CD LYS A 105 15.921 28.089 76.196 1.00 88.68 C ATOM 971 CE LYS A 105 17.249 27.453 76.586 1.00 90.79 C ATOM 972 NZ LYS A 105 17.535 26.204 75.829 1.00 83.29 N ATOM 973 HZ1 LYS A 105 16.783 25.509 76.012 1.00 0.00 H ATOM 974 HZ2 LYS A 105 17.571 26.417 74.812 1.00 0.00 H ATOM 975 HZ3 LYS A 105 18.450 25.816 76.136 1.00 0.00 H ATOM 976 H LYS A 105 15.702 27.997 71.259 1.00 0.00 H ATOM 977 N SER A 106 16.919 31.093 71.838 1.00 67.92 N ATOM 978 CA SER A 106 17.486 32.422 71.641 1.00 61.66 C ATOM 979 C SER A 106 16.534 33.313 70.852 1.00 57.21 C ATOM 980 O SER A 106 16.398 34.504 71.155 1.00 55.75 O ATOM 981 CB SER A 106 18.834 32.315 70.931 1.00 63.58 C ATOM 982 OG SER A 106 19.441 33.590 70.806 1.00 63.81 O ATOM 983 HG SER A 106 20.311 33.496 70.344 1.00 0.00 H ATOM 984 H SER A 106 17.329 30.275 71.343 1.00 0.00 H ATOM 985 N PHE A 107 15.867 32.754 69.838 1.00 61.99 N ATOM 986 CA PHE A 107 14.903 33.529 69.062 1.00 58.99 C ATOM 987 C PHE A 107 13.758 34.011 69.945 1.00 50.76 C ATOM 988 O PHE A 107 13.457 35.209 69.997 1.00 50.10 O ATOM 989 CB PHE A 107 14.374 32.689 67.897 1.00 51.47 C ATOM 990 CG PHE A 107 13.352 33.397 67.051 1.00 49.94 C ATOM 991 CD1 PHE A 107 13.679 34.557 66.372 1.00 48.87 C ATOM 992 CD2 PHE A 107 12.065 32.896 66.929 1.00 55.72 C ATOM 993 CE1 PHE A 107 12.742 35.211 65.593 1.00 51.20 C ATOM 994 CE2 PHE A 107 11.123 33.545 66.150 1.00 51.96 C ATOM 995 CZ PHE A 107 11.463 34.704 65.481 1.00 49.16 C ATOM 996 H PHE A 107 16.036 31.756 69.599 1.00 0.00 H ATOM 997 N MET A 108 13.113 33.088 70.660 1.00 54.80 N ATOM 998 CA MET A 108 12.007 33.464 71.534 1.00 65.88 C ATOM 999 C MET A 108 12.451 34.492 72.567 1.00 65.29 C ATOM 1000 O MET A 108 11.766 35.495 72.799 1.00 60.32 O ATOM 1001 CB MET A 108 11.440 32.218 72.217 1.00 59.82 C ATOM 1002 CG MET A 108 10.872 31.194 71.253 1.00 63.27 C ATOM 1003 SD MET A 108 9.479 31.819 70.293 1.00 58.02 S ATOM 1004 CE MET A 108 9.340 30.528 69.061 1.00 70.00 C ATOM 1005 H MET A 108 13.401 32.091 70.594 1.00 0.00 H ATOM 1006 N GLU A 109 13.607 34.264 73.196 1.00 66.43 N ATOM 1007 CA GLU A 109 14.089 35.194 74.212 1.00 67.91 C ATOM 1008 C GLU A 109 14.424 36.550 73.603 1.00 63.21 C ATOM 1009 O GLU A 109 14.212 37.590 74.237 1.00 70.26 O ATOM 1010 CB GLU A 109 15.303 34.604 74.927 1.00 67.20 C ATOM 1011 CG GLU A 109 14.966 33.412 75.810 1.00 76.04 C ATOM 1012 CD GLU A 109 16.195 32.747 76.392 1.00 80.20 C ATOM 1013 OE1 GLU A 109 17.299 33.317 76.262 1.00 85.75 O ATOM 1014 OE2 GLU A 109 16.057 31.652 76.977 1.00 80.98 O ATOM 1015 H GLU A 109 14.166 33.419 72.961 1.00 0.00 H ATOM 1016 N ALA A 110 14.946 36.562 72.375 1.00 65.16 N ATOM 1017 CA ALA A 110 15.206 37.831 71.703 1.00 66.26 C ATOM 1018 C ALA A 110 13.908 38.583 71.440 1.00 60.76 C ATOM 1019 O ALA A 110 13.863 39.815 71.543 1.00 68.57 O ATOM 1020 CB ALA A 110 15.964 37.591 70.398 1.00 62.84 C ATOM 1021 H ALA A 110 15.168 35.666 71.896 1.00 0.00 H ATOM 1022 N LEU A 111 12.840 37.860 71.096 1.00 60.12 N ATOM 1023 CA LEU A 111 11.539 38.500 70.922 1.00 65.89 C ATOM 1024 C LEU A 111 11.050 39.113 72.228 1.00 73.17 C ATOM 1025 O LEU A 111 10.428 40.182 72.227 1.00 77.71 O ATOM 1026 CB LEU A 111 10.516 37.490 70.403 1.00 56.71 C ATOM 1027 CG LEU A 111 10.782 36.838 69.046 1.00 64.16 C ATOM 1028 CD1 LEU A 111 9.682 35.833 68.736 1.00 61.08 C ATOM 1029 CD2 LEU A 111 10.889 37.879 67.940 1.00 55.42 C ATOM 1030 H LEU A 111 12.935 36.835 70.951 1.00 0.00 H ATOM 1031 N SER A 112 11.317 38.446 73.354 1.00 82.44 N ATOM 1032 CA SER A 112 10.842 38.942 74.642 1.00 83.53 C ATOM 1033 C SER A 112 11.380 40.336 74.931 1.00 80.35 C ATOM 1034 O SER A 112 10.634 41.219 75.370 1.00 82.08 O ATOM 1035 CB SER A 112 11.247 37.977 75.756 1.00 79.40 C ATOM 1036 OG SER A 112 10.594 36.733 75.607 1.00 68.89 O ATOM 1037 HG SER A 112 10.840 36.335 74.735 1.00 0.00 H ATOM 1038 H SER A 112 11.868 37.565 73.313 1.00 0.00 H ATOM 1039 N ALA A 113 12.670 40.554 74.691 1.00 75.98 N ATOM 1040 CA ALA A 113 13.317 41.821 74.993 1.00 87.38 C ATOM 1041 C ALA A 113 13.306 42.788 73.816 1.00 88.79 C ATOM 1042 O ALA A 113 13.986 43.818 73.872 1.00104.28 O ATOM 1043 CB ALA A 113 14.758 41.576 75.444 1.00100.92 C ATOM 1044 H ALA A 113 13.237 39.790 74.272 1.00 0.00 H ATOM 1045 N GLY A 114 12.552 42.490 72.763 1.00 78.96 N ATOM 1046 CA GLY A 114 12.549 43.361 71.594 1.00 77.79 C ATOM 1047 C GLY A 114 13.931 43.607 71.035 1.00 91.77 C ATOM 1048 O GLY A 114 14.248 44.730 70.622 1.00 90.84 O ATOM 1049 H GLY A 114 11.963 41.633 72.773 1.00 0.00 H ATOM 1050 N ALA A 115 14.771 42.576 71.018 1.00 90.93 N ATOM 1051 CA ALA A 115 16.125 42.704 70.509 1.00 94.26 C ATOM 1052 C ALA A 115 16.141 42.538 68.991 1.00 97.43 C ATOM 1053 O ALA A 115 15.158 42.127 68.369 1.00 95.46 O ATOM 1054 CB ALA A 115 17.044 41.675 71.164 1.00 78.49 C ATOM 1055 H ALA A 115 14.450 41.655 71.378 1.00 0.00 H ATOM 1056 N ASP A 116 17.285 42.866 68.392 1.00112.81 N ATOM 1057 CA ASP A 116 17.442 42.749 66.949 1.00117.71 C ATOM 1058 C ASP A 116 17.343 41.293 66.513 1.00103.19 C ATOM 1059 O ASP A 116 18.247 40.494 66.778 1.00 91.92 O ATOM 1060 CB ASP A 116 18.781 43.341 66.501 1.00128.53 C ATOM 1061 CG ASP A 116 18.983 43.252 65.001 1.00120.67 C ATOM 1062 OD1 ASP A 116 20.095 42.879 64.570 1.00121.36 O ATOM 1063 OD2 ASP A 116 18.032 43.559 64.252 1.00120.30 O ATOM 1064 H ASP A 116 18.081 43.212 68.966 1.00 0.00 H ATOM 1065 N VAL A 117 16.240 40.940 65.855 1.00 96.28 N ATOM 1066 CA VAL A 117 16.071 39.631 65.241 1.00 84.28 C ATOM 1067 C VAL A 117 16.113 39.721 63.721 1.00 77.55 C ATOM 1068 O VAL A 117 15.752 38.758 63.036 1.00 74.00 O ATOM 1069 CB VAL A 117 14.769 38.957 65.710 1.00 68.63 C ATOM 1070 CG1 VAL A 117 14.756 38.816 67.227 1.00 68.30 C ATOM 1071 CG2 VAL A 117 13.553 39.740 65.228 1.00 50.06 C ATOM 1072 H VAL A 117 15.466 41.630 65.776 1.00 0.00 H ATOM 1073 N SER A 118 16.547 40.861 63.177 1.00 84.15 N ATOM 1074 CA SER A 118 16.526 41.069 61.733 1.00 80.98 C ATOM 1075 C SER A 118 17.200 39.916 60.998 1.00 78.29 C ATOM 1076 O SER A 118 16.675 39.405 60.002 1.00 65.58 O ATOM 1077 CB SER A 118 17.204 42.397 61.391 1.00 75.76 C ATOM 1078 OG SER A 118 16.606 43.473 62.094 1.00 84.31 O ATOM 1079 HG SER A 118 16.690 43.316 63.068 1.00 0.00 H ATOM 1080 H SER A 118 16.907 41.616 63.795 1.00 0.00 H ATOM 1081 N MET A 119 18.371 39.497 61.472 1.00 72.29 N ATOM 1082 CA MET A 119 19.067 38.349 60.898 1.00 75.91 C ATOM 1083 C MET A 119 18.377 37.081 61.386 1.00 71.14 C ATOM 1084 O MET A 119 18.679 36.569 62.466 1.00 75.56 O ATOM 1085 CB MET A 119 20.541 38.358 61.286 1.00 81.44 C ATOM 1086 CG MET A 119 21.316 39.582 60.815 1.00 81.85 C ATOM 1087 SD MET A 119 21.184 39.886 59.041 1.00 91.47 S ATOM 1088 CE MET A 119 19.997 41.229 59.014 1.00 73.67 C ATOM 1089 H MET A 119 18.802 40.001 62.273 1.00 0.00 H ATOM 1090 N ILE A 120 17.446 36.567 60.582 1.00 60.11 N ATOM 1091 CA ILE A 120 16.680 35.394 60.989 1.00 61.47 C ATOM 1092 C ILE A 120 17.507 34.119 60.861 1.00 61.43 C ATOM 1093 O ILE A 120 17.328 33.180 61.645 1.00 53.26 O ATOM 1094 CB ILE A 120 15.376 35.293 60.174 1.00 57.74 C ATOM 1095 CG1 ILE A 120 14.595 34.037 60.578 1.00 52.41 C ATOM 1096 CG2 ILE A 120 15.669 35.281 58.670 1.00 56.45 C ATOM 1097 CD1 ILE A 120 13.230 33.916 59.932 1.00 48.52 C ATOM 1098 H ILE A 120 17.264 37.006 59.657 1.00 0.00 H ATOM 1099 N GLY A 121 18.420 34.061 59.890 1.00 56.60 N ATOM 1100 CA GLY A 121 19.125 32.820 59.619 1.00 54.09 C ATOM 1101 C GLY A 121 19.927 32.305 60.798 1.00 52.12 C ATOM 1102 O GLY A 121 20.071 31.091 60.970 1.00 60.64 O ATOM 1103 H GLY A 121 18.628 34.908 59.324 1.00 0.00 H ATOM 1104 N GLN A 122 20.455 33.204 61.625 1.00 56.39 N ATOM 1105 CA GLN A 122 21.346 32.799 62.704 1.00 59.75 C ATOM 1106 C GLN A 122 20.606 32.273 63.929 1.00 65.13 C ATOM 1107 O GLN A 122 21.259 31.914 64.915 1.00 60.32 O ATOM 1108 CB GLN A 122 22.251 33.968 63.101 1.00 72.85 C ATOM 1109 CG GLN A 122 21.539 35.128 63.772 1.00 83.15 C ATOM 1110 CD GLN A 122 22.418 36.359 63.872 1.00110.60 C ATOM 1111 OE1 GLN A 122 23.374 36.516 63.112 1.00108.53 O ATOM 1112 NE2 GLN A 122 22.104 37.237 64.817 1.00139.16 N ATOM 1113 HE22 GLN A 122 21.287 37.064 65.437 1.00 0.00 H ATOM 1114 HE21 GLN A 122 22.675 38.098 64.937 1.00 0.00 H ATOM 1115 H GLN A 122 20.228 34.211 61.499 1.00 0.00 H ATOM 1116 N PHE A 123 19.274 32.217 63.896 1.00 58.76 N ATOM 1117 CA PHE A 123 18.495 31.550 64.931 1.00 56.42 C ATOM 1118 C PHE A 123 18.082 30.139 64.527 1.00 61.05 C ATOM 1119 O PHE A 123 17.305 29.502 65.246 1.00 58.47 O ATOM 1120 CB PHE A 123 17.248 32.368 65.274 1.00 55.50 C ATOM 1121 CG PHE A 123 17.544 33.735 65.823 1.00 47.21 C ATOM 1122 CD1 PHE A 123 17.894 33.904 67.152 1.00 46.71 C ATOM 1123 CD2 PHE A 123 17.459 34.853 65.011 1.00 56.51 C ATOM 1124 CE1 PHE A 123 18.162 35.163 67.658 1.00 49.88 C ATOM 1125 CE2 PHE A 123 17.726 36.114 65.511 1.00 61.52 C ATOM 1126 CZ PHE A 123 18.077 36.269 66.836 1.00 51.47 C ATOM 1127 H PHE A 123 18.773 32.666 63.103 1.00 0.00 H ATOM 1128 N GLY A 124 18.577 29.640 63.397 1.00 58.42 N ATOM 1129 CA GLY A 124 18.223 28.316 62.923 1.00 52.81 C ATOM 1130 C GLY A 124 16.761 28.170 62.549 1.00 55.12 C ATOM 1131 O GLY A 124 16.274 27.053 62.360 1.00 53.26 O ATOM 1132 H GLY A 124 19.237 30.217 62.837 1.00 0.00 H ATOM 1133 N VAL A 125 16.055 29.294 62.424 1.00 58.73 N ATOM 1134 CA VAL A 125 14.615 29.297 62.191 1.00 52.31 C ATOM 1135 C VAL A 125 14.254 29.752 60.785 1.00 48.98 C ATOM 1136 O VAL A 125 13.074 29.696 60.410 1.00 45.94 O ATOM 1137 CB VAL A 125 13.897 30.153 63.258 1.00 55.77 C ATOM 1138 CG1 VAL A 125 13.139 31.353 62.659 1.00 52.79 C ATOM 1139 CG2 VAL A 125 12.973 29.284 64.100 1.00 46.85 C ATOM 1140 H VAL A 125 16.551 30.205 62.495 1.00 0.00 H ATOM 1141 N GLY A 126 15.238 30.146 59.974 1.00 46.18 N ATOM 1142 CA GLY A 126 14.968 30.770 58.689 1.00 43.10 C ATOM 1143 C GLY A 126 14.097 29.959 57.749 1.00 45.57 C ATOM 1144 O GLY A 126 13.517 30.528 56.818 1.00 42.62 O ATOM 1145 H GLY A 126 16.225 30.003 60.269 1.00 0.00 H ATOM 1146 N PHE A 127 13.990 28.644 57.957 1.00 46.93 N ATOM 1147 CA PHE A 127 13.195 27.823 57.047 1.00 46.62 C ATOM 1148 C PHE A 127 11.785 28.374 56.883 1.00 50.89 C ATOM 1149 O PHE A 127 11.252 28.420 55.768 1.00 51.58 O ATOM 1150 CB PHE A 127 13.130 26.379 57.541 1.00 49.79 C ATOM 1151 CG PHE A 127 12.133 25.543 56.795 1.00 49.55 C ATOM 1152 CD1 PHE A 127 10.862 25.335 57.305 1.00 56.99 C ATOM 1153 CD2 PHE A 127 12.456 24.989 55.569 1.00 53.13 C ATOM 1154 CE1 PHE A 127 9.939 24.577 56.613 1.00 58.49 C ATOM 1155 CE2 PHE A 127 11.538 24.229 54.873 1.00 58.40 C ATOM 1156 CZ PHE A 127 10.278 24.025 55.395 1.00 60.03 C ATOM 1157 H PHE A 127 14.473 28.205 58.767 1.00 0.00 H ATOM 1158 N TYR A 128 11.164 28.792 57.978 1.00 37.63 N ATOM 1159 CA TYR A 128 9.768 29.197 57.943 1.00 49.02 C ATOM 1160 C TYR A 128 9.569 30.593 57.368 1.00 46.35 C ATOM 1161 O TYR A 128 8.420 31.019 57.213 1.00 60.04 O ATOM 1162 CB TYR A 128 9.187 29.123 59.351 1.00 51.40 C ATOM 1163 CG TYR A 128 9.009 27.718 59.861 1.00 50.85 C ATOM 1164 CD1 TYR A 128 7.805 27.043 59.719 1.00 60.91 C ATOM 1165 CD2 TYR A 128 10.057 27.062 60.485 1.00 55.18 C ATOM 1166 CE1 TYR A 128 7.656 25.752 60.190 1.00 64.06 C ATOM 1167 CE2 TYR A 128 9.918 25.777 60.953 1.00 54.65 C ATOM 1168 CZ TYR A 128 8.718 25.125 60.806 1.00 62.68 C ATOM 1169 OH TYR A 128 8.585 23.841 61.279 1.00 73.90 O ATOM 1170 HH TYR A 128 7.668 23.517 61.096 1.00 0.00 H ATOM 1171 H TYR A 128 11.685 28.831 58.877 1.00 0.00 H ATOM 1172 N SER A 129 10.646 31.319 57.055 1.00 46.69 N ATOM 1173 CA SER A 129 10.499 32.535 56.264 1.00 46.70 C ATOM 1174 C SER A 129 9.971 32.224 54.872 1.00 41.05 C ATOM 1175 O SER A 129 9.406 33.108 54.219 1.00 41.03 O ATOM 1176 CB SER A 129 11.832 33.278 56.164 1.00 39.29 C ATOM 1177 OG SER A 129 12.831 32.464 55.582 1.00 49.42 O ATOM 1178 HG SER A 129 12.961 31.655 56.138 1.00 0.00 H ATOM 1179 H SER A 129 11.588 31.017 57.375 1.00 0.00 H ATOM 1180 N LEU A 130 10.143 30.985 54.408 1.00 39.61 N ATOM 1181 CA LEU A 130 9.547 30.575 53.143 1.00 40.93 C ATOM 1182 C LEU A 130 8.038 30.749 53.165 1.00 42.98 C ATOM 1183 O LEU A 130 7.433 31.126 52.155 1.00 41.89 O ATOM 1184 CB LEU A 130 9.905 29.118 52.844 1.00 47.39 C ATOM 1185 CG LEU A 130 11.340 28.846 52.401 1.00 34.19 C ATOM 1186 CD1 LEU A 130 11.570 27.353 52.264 1.00 38.73 C ATOM 1187 CD2 LEU A 130 11.615 29.556 51.091 1.00 42.49 C ATOM 1188 H LEU A 130 10.708 30.305 54.955 1.00 0.00 H ATOM 1189 N PHE A 131 7.413 30.479 54.308 1.00 42.90 N ATOM 1190 CA PHE A 131 5.965 30.553 54.425 1.00 44.49 C ATOM 1191 C PHE A 131 5.458 31.981 54.561 1.00 43.67 C ATOM 1192 O PHE A 131 4.240 32.188 54.610 1.00 42.95 O ATOM 1193 CB PHE A 131 5.506 29.699 55.608 1.00 42.50 C ATOM 1194 CG PHE A 131 5.787 28.234 55.426 1.00 46.81 C ATOM 1195 CD1 PHE A 131 5.228 27.539 54.365 1.00 50.13 C ATOM 1196 CD2 PHE A 131 6.615 27.556 56.302 1.00 50.01 C ATOM 1197 CE1 PHE A 131 5.487 26.195 54.185 1.00 46.71 C ATOM 1198 CE2 PHE A 131 6.875 26.209 56.127 1.00 48.51 C ATOM 1199 CZ PHE A 131 6.310 25.529 55.066 1.00 49.81 C ATOM 1200 H PHE A 131 7.975 30.208 55.140 1.00 0.00 H ATOM 1201 N LEU A 132 6.354 32.968 54.615 1.00 38.30 N ATOM 1202 CA LEU A 132 5.926 34.356 54.492 1.00 47.62 C ATOM 1203 C LEU A 132 5.282 34.605 53.135 1.00 50.11 C ATOM 1204 O LEU A 132 4.306 35.358 53.031 1.00 49.70 O ATOM 1205 CB LEU A 132 7.116 35.294 54.689 1.00 52.51 C ATOM 1206 CG LEU A 132 7.777 35.319 56.068 1.00 53.80 C ATOM 1207 CD1 LEU A 132 9.046 36.157 56.031 1.00 43.67 C ATOM 1208 CD2 LEU A 132 6.816 35.859 57.109 1.00 47.09 C ATOM 1209 H LEU A 132 7.362 32.746 54.745 1.00 0.00 H ATOM 1210 N VAL A 133 5.815 33.983 52.082 1.00 44.31 N ATOM 1211 CA VAL A 133 5.334 34.211 50.723 1.00 41.48 C ATOM 1212 C VAL A 133 4.700 32.982 50.087 1.00 36.62 C ATOM 1213 O VAL A 133 4.069 33.118 49.026 1.00 40.83 O ATOM 1214 CB VAL A 133 6.460 34.740 49.809 1.00 40.36 C ATOM 1215 CG1 VAL A 133 6.983 36.074 50.321 1.00 37.14 C ATOM 1216 CG2 VAL A 133 7.591 33.721 49.701 1.00 40.54 C ATOM 1217 H VAL A 133 6.597 33.315 52.234 1.00 0.00 H ATOM 1218 N ALA A 134 4.830 31.799 50.685 1.00 34.25 N ATOM 1219 CA ALA A 134 4.477 30.560 50.005 1.00 40.08 C ATOM 1220 C ALA A 134 3.518 29.726 50.841 1.00 43.30 C ATOM 1221 O ALA A 134 3.561 29.740 52.074 1.00 46.48 O ATOM 1222 CB ALA A 134 5.728 29.728 49.691 1.00 42.03 C ATOM 1223 H ALA A 134 5.192 31.759 51.659 1.00 0.00 H ATOM 1224 N ASP A 135 2.652 28.989 50.141 1.00 43.34 N ATOM 1225 CA ASP A 135 1.734 28.037 50.754 1.00 50.30 C ATOM 1226 C ASP A 135 2.236 26.601 50.685 1.00 49.55 C ATOM 1227 O ASP A 135 1.698 25.738 51.387 1.00 38.93 O ATOM 1228 CB ASP A 135 0.359 28.115 50.079 1.00 42.41 C ATOM 1229 CG ASP A 135 -0.403 29.375 50.442 1.00 52.02 C ATOM 1230 OD1 ASP A 135 -0.987 30.000 49.531 1.00 53.11 O ATOM 1231 OD2 ASP A 135 -0.424 29.735 51.638 1.00 48.82 O ATOM 1232 H ASP A 135 2.631 29.100 49.107 1.00 0.00 H ATOM 1233 N HIS A 136 3.239 26.327 49.855 1.00 46.19 N ATOM 1234 CA HIS A 136 3.787 24.987 49.711 1.00 46.99 C ATOM 1235 C HIS A 136 5.210 25.113 49.186 1.00 47.30 C ATOM 1236 O HIS A 136 5.537 26.063 48.470 1.00 41.47 O ATOM 1237 CB HIS A 136 2.935 24.134 48.765 1.00 48.12 C ATOM 1238 CG HIS A 136 3.324 22.688 48.735 1.00 48.92 C ATOM 1239 ND1 HIS A 136 3.412 21.917 49.875 1.00 50.63 N ATOM 1240 CD2 HIS A 136 3.646 21.873 47.703 1.00 47.67 C ATOM 1241 CE1 HIS A 136 3.770 20.689 49.545 1.00 48.29 C ATOM 1242 NE2 HIS A 136 3.918 20.636 48.234 1.00 54.13 N ATOM 1243 H HIS A 136 3.646 27.099 49.289 1.00 0.00 H ATOM 1244 N VAL A 137 6.048 24.143 49.545 1.00 43.82 N ATOM 1245 CA VAL A 137 7.463 24.171 49.195 1.00 39.02 C ATOM 1246 C VAL A 137 7.881 22.781 48.739 1.00 41.91 C ATOM 1247 O VAL A 137 7.571 21.784 49.400 1.00 31.56 O ATOM 1248 CB VAL A 137 8.341 24.630 50.379 1.00 39.02 C ATOM 1249 CG1 VAL A 137 9.825 24.530 50.030 1.00 42.41 C ATOM 1250 CG2 VAL A 137 7.995 26.052 50.782 1.00 40.05 C ATOM 1251 H VAL A 137 5.681 23.339 50.093 1.00 0.00 H ATOM 1252 N GLN A 138 8.588 22.720 47.613 1.00 41.72 N ATOM 1253 CA GLN A 138 9.259 21.512 47.154 1.00 42.27 C ATOM 1254 C GLN A 138 10.751 21.797 47.098 1.00 35.23 C ATOM 1255 O GLN A 138 11.168 22.818 46.541 1.00 37.56 O ATOM 1256 CB GLN A 138 8.766 21.076 45.771 1.00 48.65 C ATOM 1257 CG GLN A 138 7.346 20.548 45.727 1.00 46.04 C ATOM 1258 CD GLN A 138 6.855 20.343 44.304 1.00 56.02 C ATOM 1259 OE1 GLN A 138 7.570 20.630 43.341 1.00 38.99 O ATOM 1260 NE2 GLN A 138 5.630 19.844 44.164 1.00 56.89 N ATOM 1261 HE22 GLN A 138 5.062 19.616 45.005 1.00 0.00 H ATOM 1262 HE21 GLN A 138 5.240 19.682 43.214 1.00 0.00 H ATOM 1263 H GLN A 138 8.665 23.579 47.031 1.00 0.00 H ATOM 1264 N VAL A 139 11.549 20.899 47.665 1.00 34.94 N ATOM 1265 CA VAL A 139 13.002 21.016 47.646 1.00 38.34 C ATOM 1266 C VAL A 139 13.544 19.824 46.872 1.00 36.09 C ATOM 1267 O VAL A 139 13.421 18.676 47.318 1.00 33.30 O ATOM 1268 CB VAL A 139 13.601 21.079 49.057 1.00 37.51 C ATOM 1269 CG1 VAL A 139 15.121 21.149 48.983 1.00 39.20 C ATOM 1270 CG2 VAL A 139 13.057 22.279 49.810 1.00 41.40 C ATOM 1271 H VAL A 139 11.120 20.080 48.141 1.00 0.00 H ATOM 1272 N ILE A 140 14.146 20.095 45.718 1.00 34.83 N ATOM 1273 CA ILE A 140 14.803 19.081 44.903 1.00 33.36 C ATOM 1274 C ILE A 140 16.304 19.235 45.101 1.00 35.66 C ATOM 1275 O ILE A 140 16.845 20.338 44.947 1.00 31.95 O ATOM 1276 CB ILE A 140 14.426 19.232 43.419 1.00 40.35 C ATOM 1277 CG1 ILE A 140 12.904 19.313 43.259 1.00 38.38 C ATOM 1278 CG2 ILE A 140 14.994 18.075 42.600 1.00 49.00 C ATOM 1279 CD1 ILE A 140 12.447 19.650 41.854 1.00 44.24 C ATOM 1280 H ILE A 140 14.148 21.079 45.380 1.00 0.00 H ATOM 1281 N SER A 141 16.981 18.135 45.424 1.00 38.99 N ATOM 1282 CA SER A 141 18.398 18.181 45.757 1.00 46.32 C ATOM 1283 C SER A 141 19.102 16.941 45.228 1.00 49.76 C ATOM 1284 O SER A 141 18.527 15.850 45.185 1.00 42.50 O ATOM 1285 CB SER A 141 18.607 18.284 47.275 1.00 39.00 C ATOM 1286 OG SER A 141 19.943 18.641 47.580 1.00 44.12 O ATOM 1287 HG SER A 141 20.151 19.518 47.170 1.00 0.00 H ATOM 1288 H SER A 141 16.486 17.221 45.439 1.00 0.00 H ATOM 1289 N LYS A 142 20.361 17.122 44.827 1.00 41.43 N ATOM 1290 CA LYS A 142 21.192 16.023 44.340 1.00 47.25 C ATOM 1291 C LYS A 142 22.594 16.201 44.904 1.00 43.86 C ATOM 1292 O LYS A 142 23.282 17.170 44.569 1.00 42.74 O ATOM 1293 CB LYS A 142 21.220 15.982 42.811 1.00 43.24 C ATOM 1294 CG LYS A 142 22.172 14.944 42.223 1.00 42.53 C ATOM 1295 CD LYS A 142 21.667 13.529 42.465 1.00 47.09 C ATOM 1296 CE LYS A 142 22.516 12.492 41.743 1.00 48.28 C ATOM 1297 NZ LYS A 142 23.835 12.274 42.399 1.00 49.55 N ATOM 1298 HZ1 LYS A 142 24.366 13.168 42.413 1.00 0.00 H ATOM 1299 HZ2 LYS A 142 23.686 11.943 43.373 1.00 0.00 H ATOM 1300 HZ3 LYS A 142 24.371 11.559 41.867 1.00 0.00 H ATOM 1301 H LYS A 142 20.766 18.079 44.862 1.00 0.00 H ATOM 1302 N HIS A 143 23.015 15.270 45.753 1.00 49.98 N ATOM 1303 CA HIS A 143 24.369 15.245 46.287 1.00 53.30 C ATOM 1304 C HIS A 143 25.181 14.203 45.527 1.00 53.85 C ATOM 1305 O HIS A 143 24.653 13.158 45.137 1.00 62.24 O ATOM 1306 CB HIS A 143 24.354 14.922 47.783 1.00 47.31 C ATOM 1307 CG HIS A 143 25.655 15.186 48.477 1.00 52.18 C ATOM 1308 ND1 HIS A 143 26.763 14.383 48.313 1.00 48.66 N ATOM 1309 CD2 HIS A 143 26.018 16.152 49.354 1.00 55.33 C ATOM 1310 CE1 HIS A 143 27.755 14.848 49.049 1.00 53.47 C ATOM 1311 NE2 HIS A 143 27.330 15.921 49.691 1.00 54.45 N ATOM 1312 H HIS A 143 22.349 14.528 46.049 1.00 0.00 H ATOM 1313 N ASN A 144 26.468 14.493 45.315 1.00 56.34 N ATOM 1314 CA ASN A 144 27.306 13.593 44.526 1.00 59.87 C ATOM 1315 C ASN A 144 27.290 12.173 45.075 1.00 54.95 C ATOM 1316 O ASN A 144 27.434 11.212 44.312 1.00 59.43 O ATOM 1317 CB ASN A 144 28.745 14.110 44.477 1.00 58.84 C ATOM 1318 CG ASN A 144 28.946 15.193 43.435 1.00 51.72 C ATOM 1319 OD1 ASN A 144 28.109 15.390 42.555 1.00 51.12 O ATOM 1320 ND2 ASN A 144 30.077 15.888 43.517 1.00 57.26 N ATOM 1321 HD22 ASN A 144 30.757 15.687 44.278 1.00 0.00 H ATOM 1322 HD21 ASN A 144 30.282 16.632 42.820 1.00 0.00 H ATOM 1323 H ASN A 144 26.875 15.363 45.713 1.00 0.00 H ATOM 1324 N ASP A 145 27.113 12.019 46.384 1.00 56.42 N ATOM 1325 CA ASP A 145 27.171 10.722 47.043 1.00 57.69 C ATOM 1326 C ASP A 145 25.798 10.086 47.221 1.00 58.01 C ATOM 1327 O ASP A 145 25.681 9.087 47.937 1.00 60.99 O ATOM 1328 CB ASP A 145 27.858 10.863 48.402 1.00 67.24 C ATOM 1329 CG ASP A 145 29.273 11.392 48.287 1.00 76.22 C ATOM 1330 OD1 ASP A 145 29.898 11.192 47.224 1.00 73.06 O ATOM 1331 OD2 ASP A 145 29.760 12.012 49.257 1.00 79.59 O ATOM 1332 H ASP A 145 26.925 12.862 46.963 1.00 0.00 H ATOM 1333 N ASP A 146 24.759 10.639 46.598 1.00 55.90 N ATOM 1334 CA ASP A 146 23.415 10.093 46.724 1.00 49.15 C ATOM 1335 C ASP A 146 22.630 10.431 45.461 1.00 50.58 C ATOM 1336 O ASP A 146 23.133 11.097 44.552 1.00 56.88 O ATOM 1337 CB ASP A 146 22.727 10.631 47.983 1.00 62.33 C ATOM 1338 CG ASP A 146 21.612 9.728 48.471 1.00 57.03 C ATOM 1339 OD1 ASP A 146 21.082 8.939 47.661 1.00 54.58 O ATOM 1340 OD2 ASP A 146 21.270 9.805 49.670 1.00 61.56 O ATOM 1341 H ASP A 146 24.911 11.481 46.007 1.00 0.00 H ATOM 1342 N GLU A 147 21.386 9.959 45.409 1.00 54.17 N ATOM 1343 CA GLU A 147 20.507 10.200 44.277 1.00 57.18 C ATOM 1344 C GLU A 147 19.661 11.452 44.509 1.00 54.54 C ATOM 1345 O GLU A 147 19.697 12.076 45.572 1.00 60.26 O ATOM 1346 CB GLU A 147 19.621 8.978 44.025 1.00 55.37 C ATOM 1347 CG GLU A 147 20.296 7.869 43.229 1.00 60.34 C ATOM 1348 CD GLU A 147 20.664 8.307 41.824 1.00 74.89 C ATOM 1349 OE1 GLU A 147 19.915 9.121 41.242 1.00 73.78 O ATOM 1350 OE2 GLU A 147 21.699 7.842 41.301 1.00 81.59 O ATOM 1351 H GLU A 147 21.030 9.397 46.208 1.00 0.00 H ATOM 1352 N GLN A 148 18.888 11.823 43.491 1.00 44.25 N ATOM 1353 CA GLN A 148 18.052 13.014 43.554 1.00 49.77 C ATOM 1354 C GLN A 148 16.788 12.726 44.355 1.00 50.49 C ATOM 1355 O GLN A 148 16.101 11.729 44.111 1.00 51.21 O ATOM 1356 CB GLN A 148 17.693 13.483 42.144 1.00 46.19 C ATOM 1357 CG GLN A 148 17.124 14.889 42.082 1.00 42.87 C ATOM 1358 CD GLN A 148 17.032 15.417 40.664 1.00 47.95 C ATOM 1359 OE1 GLN A 148 18.048 15.614 39.995 1.00 50.96 O ATOM 1360 NE2 GLN A 148 15.812 15.658 40.200 1.00 48.55 N ATOM 1361 HE22 GLN A 148 14.982 15.477 40.800 1.00 0.00 H ATOM 1362 HE21 GLN A 148 15.686 16.028 39.236 1.00 0.00 H ATOM 1363 H GLN A 148 18.881 11.246 42.626 1.00 0.00 H ATOM 1364 N TYR A 149 16.487 13.597 45.317 1.00 48.87 N ATOM 1365 CA TYR A 149 15.331 13.442 46.187 1.00 41.60 C ATOM 1366 C TYR A 149 14.501 14.718 46.174 1.00 43.74 C ATOM 1367 O TYR A 149 14.987 15.798 45.833 1.00 46.97 O ATOM 1368 CB TYR A 149 15.744 13.125 47.630 1.00 38.96 C ATOM 1369 CG TYR A 149 16.303 11.736 47.823 1.00 51.82 C ATOM 1370 CD1 TYR A 149 15.464 10.652 48.031 1.00 56.33 C ATOM 1371 CD2 TYR A 149 17.673 11.512 47.810 1.00 57.02 C ATOM 1372 CE1 TYR A 149 15.972 9.379 48.212 1.00 60.04 C ATOM 1373 CE2 TYR A 149 18.191 10.245 47.990 1.00 60.41 C ATOM 1374 CZ TYR A 149 17.336 9.181 48.192 1.00 64.07 C ATOM 1375 OH TYR A 149 17.847 7.916 48.373 1.00 75.13 O ATOM 1376 HH TYR A 149 17.103 7.276 48.503 1.00 0.00 H ATOM 1377 H TYR A 149 17.105 14.423 45.452 1.00 0.00 H ATOM 1378 N VAL A 150 13.231 14.575 46.546 1.00 47.64 N ATOM 1379 CA VAL A 150 12.307 15.697 46.658 1.00 39.74 C ATOM 1380 C VAL A 150 11.771 15.714 48.082 1.00 48.64 C ATOM 1381 O VAL A 150 11.176 14.729 48.538 1.00 51.26 O ATOM 1382 CB VAL A 150 11.150 15.600 45.651 1.00 48.35 C ATOM 1383 CG1 VAL A 150 10.275 16.845 45.730 1.00 45.25 C ATOM 1384 CG2 VAL A 150 11.675 15.404 44.245 1.00 47.24 C ATOM 1385 H VAL A 150 12.882 13.620 46.767 1.00 0.00 H ATOM 1386 N TRP A 151 11.991 16.820 48.784 1.00 50.66 N ATOM 1387 CA TRP A 151 11.389 17.062 50.087 1.00 45.46 C ATOM 1388 C TRP A 151 10.302 18.112 49.904 1.00 47.44 C ATOM 1389 O TRP A 151 10.528 19.121 49.227 1.00 52.18 O ATOM 1390 CB TRP A 151 12.448 17.551 51.079 1.00 39.38 C ATOM 1391 CG TRP A 151 11.946 17.863 52.454 1.00 47.67 C ATOM 1392 CD1 TRP A 151 12.055 17.070 53.559 1.00 59.01 C ATOM 1393 CD2 TRP A 151 11.252 19.043 52.876 1.00 50.30 C ATOM 1394 NE1 TRP A 151 11.480 17.683 54.643 1.00 57.50 N ATOM 1395 CE2 TRP A 151 10.978 18.894 54.250 1.00 48.16 C ATOM 1396 CE3 TRP A 151 10.838 20.210 52.228 1.00 45.26 C ATOM 1397 CZ2 TRP A 151 10.312 19.865 54.986 1.00 50.42 C ATOM 1398 CZ3 TRP A 151 10.176 21.173 52.961 1.00 50.04 C ATOM 1399 CH2 TRP A 151 9.919 20.994 54.326 1.00 56.96 C ATOM 1400 HE1 TRP A 151 11.433 17.292 55.605 1.00 0.00 H ATOM 1401 H TRP A 151 12.621 17.545 48.385 1.00 0.00 H ATOM 1402 N GLU A 152 9.125 17.882 50.483 1.00 56.07 N ATOM 1403 CA GLU A 152 8.051 18.857 50.341 1.00 53.13 C ATOM 1404 C GLU A 152 7.135 18.823 51.555 1.00 52.16 C ATOM 1405 O GLU A 152 6.899 17.768 52.150 1.00 59.35 O ATOM 1406 CB GLU A 152 7.243 18.641 49.054 1.00 52.58 C ATOM 1407 CG GLU A 152 6.559 17.301 48.922 1.00 52.12 C ATOM 1408 CD GLU A 152 5.803 17.183 47.611 1.00 64.90 C ATOM 1409 OE1 GLU A 152 5.081 18.138 47.251 1.00 55.81 O ATOM 1410 OE2 GLU A 152 5.944 16.143 46.933 1.00 83.68 O ATOM 1411 H GLU A 152 8.973 17.012 51.033 1.00 0.00 H ATOM 1412 N SER A 153 6.628 20.001 51.911 1.00 46.43 N ATOM 1413 CA SER A 153 5.635 20.153 52.966 1.00 60.16 C ATOM 1414 C SER A 153 4.886 21.456 52.713 1.00 67.87 C ATOM 1415 O SER A 153 5.162 22.175 51.748 1.00 49.74 O ATOM 1416 CB SER A 153 6.289 20.139 54.350 1.00 72.58 C ATOM 1417 H SER A 153 6.956 20.853 51.413 1.00 0.00 H ATOM 1418 N ASN A 154 3.937 21.761 53.593 1.00 87.58 N ATOM 1419 CA ASN A 154 3.135 22.974 53.459 1.00 71.17 C ATOM 1420 C ASN A 154 2.815 23.584 54.820 1.00 60.44 C ATOM 1421 O ASN A 154 3.462 23.274 55.821 1.00 67.06 O ATOM 1422 CB ASN A 154 1.839 22.672 52.703 1.00 59.84 C ATOM 1423 H ASN A 154 3.762 21.122 54.394 1.00 0.00 H TER 1424 ASN A 154 ATOM 1425 N GLY A 157 2.758 21.252 59.225 1.00 89.89 N ATOM 1426 CA GLY A 157 2.729 20.591 57.934 1.00 89.38 C ATOM 1427 C GLY A 157 3.360 19.216 57.998 1.00 91.99 C ATOM 1428 O GLY A 157 4.134 18.930 58.910 1.00 92.34 O ATOM 1429 HN3 GLY A 157 3.744 21.357 59.537 1.00 0.00 H ATOM 1430 HN2 GLY A 157 2.233 20.681 59.917 1.00 0.00 H ATOM 1431 HN1 GLY A 157 2.318 22.191 59.143 1.00 0.00 H ATOM 1432 N LYS A 158 3.034 18.360 57.034 1.00 93.52 N ATOM 1433 CA LYS A 158 3.624 17.031 56.976 1.00 87.21 C ATOM 1434 C LYS A 158 4.855 17.077 56.084 1.00 78.19 C ATOM 1435 O LYS A 158 4.809 17.637 54.983 1.00 85.75 O ATOM 1436 CB LYS A 158 2.614 16.014 56.439 1.00 88.85 C ATOM 1437 H LYS A 158 2.345 18.645 56.309 1.00 0.00 H ATOM 1438 N PHE A 159 5.944 16.478 56.551 1.00 73.85 N ATOM 1439 CA PHE A 159 7.171 16.409 55.776 1.00 74.56 C ATOM 1440 C PHE A 159 7.233 15.065 55.063 1.00 81.07 C ATOM 1441 O PHE A 159 6.790 14.042 55.593 1.00 76.75 O ATOM 1442 CB PHE A 159 8.398 16.594 56.677 1.00 80.15 C ATOM 1443 CG PHE A 159 8.347 17.833 57.544 1.00 91.66 C ATOM 1444 CD1 PHE A 159 7.576 18.931 57.187 1.00 93.46 C ATOM 1445 CD2 PHE A 159 9.079 17.897 58.721 1.00101.69 C ATOM 1446 CE1 PHE A 159 7.536 20.063 57.988 1.00 95.67 C ATOM 1447 CE2 PHE A 159 9.042 19.026 59.523 1.00107.58 C ATOM 1448 CZ PHE A 159 8.270 20.109 59.156 1.00102.90 C ATOM 1449 H PHE A 159 5.918 16.047 57.497 1.00 0.00 H ATOM 1450 N THR A 160 7.797 15.070 53.856 1.00 79.23 N ATOM 1451 CA THR A 160 7.928 13.847 53.073 1.00 73.95 C ATOM 1452 C THR A 160 9.146 13.964 52.170 1.00 63.62 C ATOM 1453 O THR A 160 9.270 14.939 51.424 1.00 67.07 O ATOM 1454 CB THR A 160 6.672 13.578 52.232 1.00 74.25 C ATOM 1455 OG1 THR A 160 6.459 14.664 51.321 1.00 71.28 O ATOM 1456 CG2 THR A 160 5.435 13.412 53.116 1.00102.35 C ATOM 1457 HG1 THR A 160 7.243 14.750 50.723 1.00 0.00 H ATOM 1458 H THR A 160 8.151 15.966 53.464 1.00 0.00 H ATOM 1459 N VAL A 161 10.030 12.972 52.236 1.00 63.22 N ATOM 1460 CA VAL A 161 11.178 12.866 51.340 1.00 63.62 C ATOM 1461 C VAL A 161 10.908 11.749 50.340 1.00 59.90 C ATOM 1462 O VAL A 161 10.786 10.580 50.726 1.00 57.09 O ATOM 1463 CB VAL A 161 12.476 12.603 52.115 1.00 70.80 C ATOM 1464 CG1 VAL A 161 13.635 12.419 51.156 1.00 60.67 C ATOM 1465 CG2 VAL A 161 12.762 13.739 53.078 1.00 67.20 C ATOM 1466 H VAL A 161 9.897 12.237 52.960 1.00 0.00 H ATOM 1467 N THR A 162 10.823 12.102 49.060 1.00 60.93 N ATOM 1468 CA THR A 162 10.507 11.150 48.004 1.00 57.56 C ATOM 1469 C THR A 162 11.635 11.108 46.982 1.00 53.78 C ATOM 1470 O THR A 162 12.149 12.150 46.563 1.00 54.49 O ATOM 1471 CB THR A 162 9.195 11.516 47.303 1.00 46.79 C ATOM 1472 OG1 THR A 162 8.152 11.647 48.276 1.00 52.47 O ATOM 1473 CG2 THR A 162 8.811 10.444 46.293 1.00 43.77 C ATOM 1474 HG1 THR A 162 8.391 12.359 48.921 1.00 0.00 H ATOM 1475 H THR A 162 10.989 13.096 48.804 1.00 0.00 H ATOM 1476 N LEU A 163 12.012 9.896 46.580 1.00 58.38 N ATOM 1477 CA LEU A 163 12.965 9.729 45.491 1.00 52.34 C ATOM 1478 C LEU A 163 12.415 10.357 44.215 1.00 50.73 C ATOM 1479 O LEU A 163 11.255 10.142 43.853 1.00 52.35 O ATOM 1480 CB LEU A 163 13.260 8.244 45.279 1.00 54.25 C ATOM 1481 CG LEU A 163 14.416 7.902 44.339 1.00 65.43 C ATOM 1482 CD1 LEU A 163 15.745 8.353 44.931 1.00 61.21 C ATOM 1483 CD2 LEU A 163 14.435 6.408 44.055 1.00 55.45 C ATOM 1484 H LEU A 163 11.620 9.056 47.051 1.00 0.00 H ATOM 1485 N ASP A 164 13.251 11.139 43.537 1.00 51.48 N ATOM 1486 CA ASP A 164 12.815 11.950 42.404 1.00 56.37 C ATOM 1487 C ASP A 164 12.911 11.130 41.121 1.00 60.40 C ATOM 1488 O ASP A 164 14.008 10.911 40.596 1.00 65.05 O ATOM 1489 CB ASP A 164 13.657 13.218 42.301 1.00 52.88 C ATOM 1490 CG ASP A 164 13.043 14.249 41.378 1.00 56.10 C ATOM 1491 OD1 ASP A 164 12.252 13.865 40.491 1.00 63.52 O ATOM 1492 OD2 ASP A 164 13.347 15.448 41.546 1.00 58.50 O ATOM 1493 H ASP A 164 14.250 11.174 43.824 1.00 0.00 H ATOM 1494 N GLU A 165 11.762 10.687 40.611 1.00 62.57 N ATOM 1495 CA GLU A 165 11.694 9.911 39.379 1.00 68.54 C ATOM 1496 C GLU A 165 10.997 10.657 38.245 1.00 60.54 C ATOM 1497 O GLU A 165 10.772 10.070 37.181 1.00 74.55 O ATOM 1498 CB GLU A 165 10.989 8.577 39.638 1.00 64.93 C ATOM 1499 CG GLU A 165 11.794 7.612 40.496 1.00 74.74 C ATOM 1500 CD GLU A 165 10.918 6.715 41.349 1.00 82.19 C ATOM 1501 OE1 GLU A 165 10.040 7.244 42.061 1.00102.77 O ATOM 1502 OE2 GLU A 165 11.108 5.481 41.309 1.00 86.29 O ATOM 1503 H GLU A 165 10.877 10.904 41.113 1.00 0.00 H ATOM 1504 N THR A 166 10.652 11.931 38.438 1.00 53.27 N ATOM 1505 CA THR A 166 9.909 12.694 37.440 1.00 61.32 C ATOM 1506 C THR A 166 10.614 13.975 37.023 1.00 64.62 C ATOM 1507 O THR A 166 10.796 14.209 35.822 1.00 68.93 O ATOM 1508 CB THR A 166 8.503 13.023 37.967 1.00 66.21 C ATOM 1509 OG1 THR A 166 8.602 13.707 39.223 1.00 66.18 O ATOM 1510 CG2 THR A 166 7.681 11.751 38.132 1.00 56.70 C ATOM 1511 HG1 THR A 166 7.693 13.916 39.556 1.00 0.00 H ATOM 1512 H THR A 166 10.921 12.396 39.329 1.00 0.00 H ATOM 1513 N ASN A 167 11.011 14.817 37.974 1.00 61.02 N ATOM 1514 CA ASN A 167 11.619 16.095 37.632 1.00 62.27 C ATOM 1515 C ASN A 167 12.892 15.886 36.815 1.00 58.25 C ATOM 1516 O ASN A 167 13.535 14.834 36.869 1.00 57.70 O ATOM 1517 CB ASN A 167 11.946 16.887 38.897 1.00 55.01 C ATOM 1518 CG ASN A 167 10.734 17.120 39.767 1.00 53.34 C ATOM 1519 OD1 ASN A 167 10.711 16.728 40.933 1.00 60.22 O ATOM 1520 ND2 ASN A 167 9.718 17.768 39.208 1.00 67.65 N ATOM 1521 HD22 ASN A 167 9.782 18.081 38.218 1.00 0.00 H ATOM 1522 HD21 ASN A 167 8.858 17.963 39.760 1.00 0.00 H ATOM 1523 H ASN A 167 10.885 14.559 38.974 1.00 0.00 H ATOM 1524 N GLU A 168 13.251 16.911 36.044 1.00 57.88 N ATOM 1525 CA GLU A 168 14.478 16.861 35.264 1.00 61.30 C ATOM 1526 C GLU A 168 15.683 16.726 36.187 1.00 61.62 C ATOM 1527 O GLU A 168 15.632 17.044 37.377 1.00 67.12 O ATOM 1528 CB GLU A 168 14.627 18.110 34.396 1.00 66.57 C ATOM 1529 CG GLU A 168 13.732 18.130 33.165 1.00 97.17 C ATOM 1530 CD GLU A 168 14.130 17.093 32.127 1.00 84.57 C ATOM 1531 OE1 GLU A 168 15.333 16.768 32.033 1.00 74.20 O ATOM 1532 OE2 GLU A 168 13.237 16.602 31.403 1.00 76.85 O ATOM 1533 H GLU A 168 12.647 17.757 35.999 1.00 0.00 H ATOM 1534 N ARG A 169 16.784 16.248 35.619 1.00 67.22 N ATOM 1535 CA ARG A 169 17.970 15.966 36.410 1.00 67.60 C ATOM 1536 C ARG A 169 18.779 17.228 36.659 1.00 61.84 C ATOM 1537 O ARG A 169 19.063 17.995 35.733 1.00 57.72 O ATOM 1538 CB ARG A 169 18.851 14.938 35.707 1.00 61.06 C ATOM 1539 CG ARG A 169 18.150 13.651 35.323 1.00 59.31 C ATOM 1540 CD ARG A 169 17.786 12.828 36.546 1.00 59.54 C ATOM 1541 NE ARG A 169 16.420 13.055 36.998 1.00 55.68 N ATOM 1542 CZ ARG A 169 15.876 12.444 38.046 1.00 64.50 C ATOM 1543 NH1 ARG A 169 16.588 11.574 38.751 1.00 71.52 N ATOM 1544 NH2 ARG A 169 14.624 12.700 38.394 1.00 63.12 N ATOM 1545 HE ARG A 169 15.836 13.735 36.470 1.00 0.00 H ATOM 1546 HH12 ARG A 169 16.162 11.096 39.571 1.00 0.00 H ATOM 1547 HH11 ARG A 169 17.572 11.370 38.484 1.00 0.00 H ATOM 1548 HH22 ARG A 169 14.204 12.219 39.215 1.00 0.00 H ATOM 1549 HH21 ARG A 169 14.061 13.382 37.847 1.00 0.00 H ATOM 1550 H ARG A 169 16.798 16.073 34.594 1.00 0.00 H ATOM 1551 N LEU A 170 19.143 17.438 37.916 1.00 54.53 N ATOM 1552 CA LEU A 170 20.121 18.441 38.283 1.00 53.42 C ATOM 1553 C LEU A 170 21.472 17.743 38.279 1.00 56.94 C ATOM 1554 O LEU A 170 21.593 16.616 38.768 1.00 58.05 O ATOM 1555 CB LEU A 170 19.849 18.987 39.683 1.00 46.94 C ATOM 1556 CG LEU A 170 18.414 19.325 40.088 1.00 39.24 C ATOM 1557 CD1 LEU A 170 18.392 19.457 41.594 1.00 37.09 C ATOM 1558 CD2 LEU A 170 17.872 20.589 39.449 1.00 40.76 C ATOM 1559 H LEU A 170 18.711 16.862 38.666 1.00 0.00 H ATOM 1560 N GLY A 171 22.484 18.386 37.708 1.00 48.57 N ATOM 1561 CA GLY A 171 23.802 17.782 37.757 1.00 51.01 C ATOM 1562 C GLY A 171 24.237 17.571 39.193 1.00 51.22 C ATOM 1563 O GLY A 171 24.644 16.476 39.588 1.00 46.26 O ATOM 1564 H GLY A 171 22.335 19.301 37.237 1.00 0.00 H ATOM 1565 N ARG A 172 24.104 18.618 39.998 1.00 54.87 N ATOM 1566 CA ARG A 172 24.409 18.666 41.418 1.00 46.29 C ATOM 1567 C ARG A 172 23.783 19.941 41.960 1.00 43.20 C ATOM 1568 O ARG A 172 23.612 20.914 41.220 1.00 39.07 O ATOM 1569 CB ARG A 172 25.926 18.667 41.648 1.00 45.64 C ATOM 1570 CG ARG A 172 26.384 18.563 43.099 1.00 47.99 C ATOM 1571 CD ARG A 172 27.822 19.060 43.248 1.00 37.56 C ATOM 1572 NE ARG A 172 27.962 20.417 42.721 1.00 36.86 N ATOM 1573 CZ ARG A 172 28.614 20.746 41.606 1.00 48.71 C ATOM 1574 NH1 ARG A 172 29.229 19.826 40.871 1.00 48.78 N ATOM 1575 NH2 ARG A 172 28.655 22.014 41.221 1.00 41.13 N ATOM 1576 HE ARG A 172 27.517 21.187 43.260 1.00 0.00 H ATOM 1577 HH12 ARG A 172 29.732 20.104 40.004 1.00 0.00 H ATOM 1578 HH11 ARG A 172 29.207 18.828 41.162 1.00 0.00 H ATOM 1579 HH22 ARG A 172 29.162 22.277 40.352 1.00 0.00 H ATOM 1580 HH21 ARG A 172 28.180 22.745 41.788 1.00 0.00 H ATOM 1581 H ARG A 172 23.745 19.494 39.568 1.00 0.00 H ATOM 1582 N GLY A 173 23.444 19.932 43.238 1.00 41.84 N ATOM 1583 CA GLY A 173 22.886 21.104 43.875 1.00 45.28 C ATOM 1584 C GLY A 173 21.441 20.926 44.298 1.00 43.48 C ATOM 1585 O GLY A 173 20.925 19.814 44.437 1.00 43.56 O ATOM 1586 H GLY A 173 23.581 19.065 43.796 1.00 0.00 H ATOM 1587 N THR A 174 20.776 22.063 44.494 1.00 38.27 N ATOM 1588 CA THR A 174 19.453 22.105 45.090 1.00 28.97 C ATOM 1589 C THR A 174 18.563 23.073 44.329 1.00 33.52 C ATOM 1590 O THR A 174 19.021 24.122 43.875 1.00 28.57 O ATOM 1591 CB THR A 174 19.545 22.539 46.558 1.00 35.14 C ATOM 1592 OG1 THR A 174 20.356 21.607 47.281 1.00 37.23 O ATOM 1593 CG2 THR A 174 18.173 22.619 47.204 1.00 33.51 C ATOM 1594 HG1 THR A 174 21.263 21.584 46.885 1.00 0.00 H ATOM 1595 H THR A 174 21.223 22.958 44.208 1.00 0.00 H ATOM 1596 N MET A 175 17.285 22.718 44.204 1.00 35.88 N ATOM 1597 CA MET A 175 16.281 23.601 43.623 1.00 34.25 C ATOM 1598 C MET A 175 15.108 23.705 44.583 1.00 32.84 C ATOM 1599 O MET A 175 14.518 22.687 44.955 1.00 30.94 O ATOM 1600 CB MET A 175 15.801 23.083 42.274 1.00 33.73 C ATOM 1601 CG MET A 175 14.771 23.964 41.621 1.00 36.98 C ATOM 1602 SD MET A 175 14.372 23.336 39.991 1.00 55.05 S ATOM 1603 CE MET A 175 12.950 24.329 39.632 1.00 51.59 C ATOM 1604 H MET A 175 16.993 21.776 44.533 1.00 0.00 H ATOM 1605 N LEU A 176 14.756 24.928 44.962 1.00 33.62 N ATOM 1606 CA LEU A 176 13.592 25.177 45.799 1.00 34.80 C ATOM 1607 C LEU A 176 12.465 25.720 44.932 1.00 36.92 C ATOM 1608 O LEU A 176 12.650 26.710 44.218 1.00 34.00 O ATOM 1609 CB LEU A 176 13.925 26.157 46.918 1.00 33.71 C ATOM 1610 CG LEU A 176 14.855 25.606 47.997 1.00 32.68 C ATOM 1611 CD1 LEU A 176 16.309 25.875 47.643 1.00 38.84 C ATOM 1612 CD2 LEU A 176 14.496 26.197 49.343 1.00 39.59 C ATOM 1613 H LEU A 176 15.332 25.736 44.650 1.00 0.00 H ATOM 1614 N ARG A 177 11.309 25.063 44.986 1.00 35.61 N ATOM 1615 CA ARG A 177 10.120 25.491 44.256 1.00 39.98 C ATOM 1616 C ARG A 177 9.123 26.026 45.276 1.00 36.76 C ATOM 1617 O ARG A 177 8.640 25.278 46.132 1.00 34.76 O ATOM 1618 CB ARG A 177 9.530 24.342 43.444 1.00 42.85 C ATOM 1619 CG ARG A 177 10.550 23.642 42.565 1.00 40.58 C ATOM 1620 CD ARG A 177 9.896 22.723 41.545 1.00 45.14 C ATOM 1621 NE ARG A 177 9.286 23.486 40.457 1.00 45.74 N ATOM 1622 CZ ARG A 177 7.978 23.596 40.232 1.00 44.23 C ATOM 1623 NH1 ARG A 177 7.095 22.987 41.013 1.00 52.72 N ATOM 1624 NH2 ARG A 177 7.551 24.324 39.210 1.00 47.19 N ATOM 1625 HE ARG A 177 9.926 23.984 39.805 1.00 0.00 H ATOM 1626 HH12 ARG A 177 6.077 23.084 40.822 1.00 0.00 H ATOM 1627 HH11 ARG A 177 7.421 22.412 41.816 1.00 0.00 H ATOM 1628 HH22 ARG A 177 6.531 24.415 39.027 1.00 0.00 H ATOM 1629 HH21 ARG A 177 8.236 24.804 38.591 1.00 0.00 H ATOM 1630 H ARG A 177 11.250 24.207 45.574 1.00 0.00 H ATOM 1631 N LEU A 178 8.832 27.321 45.193 1.00 35.13 N ATOM 1632 CA LEU A 178 7.914 27.980 46.113 1.00 34.33 C ATOM 1633 C LEU A 178 6.576 28.209 45.424 1.00 35.43 C ATOM 1634 O LEU A 178 6.509 28.909 44.409 1.00 40.09 O ATOM 1635 CB LEU A 178 8.494 29.308 46.595 1.00 39.55 C ATOM 1636 CG LEU A 178 9.922 29.246 47.131 1.00 40.91 C ATOM 1637 CD1 LEU A 178 10.353 30.618 47.629 1.00 42.32 C ATOM 1638 CD2 LEU A 178 10.038 28.205 48.229 1.00 42.27 C ATOM 1639 H LEU A 178 9.277 27.886 44.442 1.00 0.00 H ATOM 1640 N PHE A 179 5.519 27.621 45.976 1.00 43.40 N ATOM 1641 CA PHE A 179 4.158 27.879 45.519 1.00 34.99 C ATOM 1642 C PHE A 179 3.638 29.098 46.273 1.00 39.63 C ATOM 1643 O PHE A 179 3.321 29.014 47.464 1.00 44.08 O ATOM 1644 CB PHE A 179 3.275 26.654 45.740 1.00 39.30 C ATOM 1645 CG PHE A 179 3.700 25.453 44.940 1.00 39.25 C ATOM 1646 CD1 PHE A 179 4.789 24.691 45.330 1.00 37.20 C ATOM 1647 CD2 PHE A 179 3.013 25.089 43.795 1.00 42.46 C ATOM 1648 CE1 PHE A 179 5.182 23.590 44.593 1.00 43.31 C ATOM 1649 CE2 PHE A 179 3.404 23.988 43.054 1.00 41.38 C ATOM 1650 CZ PHE A 179 4.489 23.238 43.455 1.00 35.04 C ATOM 1651 H PHE A 179 5.668 26.954 46.760 1.00 0.00 H ATOM 1652 N LEU A 180 3.558 30.229 45.579 1.00 32.76 N ATOM 1653 CA LEU A 180 3.355 31.515 46.226 1.00 32.57 C ATOM 1654 C LEU A 180 1.901 31.713 46.642 1.00 46.36 C ATOM 1655 O LEU A 180 0.970 31.223 45.996 1.00 41.37 O ATOM 1656 CB LEU A 180 3.777 32.644 45.286 1.00 36.26 C ATOM 1657 CG LEU A 180 5.252 32.666 44.869 1.00 44.53 C ATOM 1658 CD1 LEU A 180 5.507 33.788 43.879 1.00 46.72 C ATOM 1659 CD2 LEU A 180 6.162 32.811 46.081 1.00 41.46 C ATOM 1660 H LEU A 180 3.643 30.193 44.543 1.00 0.00 H ATOM 1661 N LYS A 181 1.716 32.444 47.741 1.00 42.07 N ATOM 1662 CA LYS A 181 0.384 32.876 48.134 1.00 45.52 C ATOM 1663 C LYS A 181 -0.190 33.812 47.077 1.00 55.21 C ATOM 1664 O LYS A 181 0.542 34.512 46.372 1.00 51.74 O ATOM 1665 CB LYS A 181 0.428 33.577 49.494 1.00 48.94 C ATOM 1666 CG LYS A 181 0.760 32.660 50.661 1.00 44.29 C ATOM 1667 CD LYS A 181 1.054 33.452 51.930 1.00 49.99 C ATOM 1668 CE LYS A 181 1.377 32.536 53.103 1.00 43.84 C ATOM 1669 NZ LYS A 181 1.815 33.300 54.306 1.00 52.92 N ATOM 1670 HZ1 LYS A 181 2.669 33.847 54.076 1.00 0.00 H ATOM 1671 HZ2 LYS A 181 1.056 33.948 54.599 1.00 0.00 H ATOM 1672 HZ3 LYS A 181 2.024 32.637 55.079 1.00 0.00 H ATOM 1673 H LYS A 181 2.535 32.709 48.325 1.00 0.00 H ATOM 1674 N GLU A 182 -1.522 33.830 46.974 1.00 59.58 N ATOM 1675 CA GLU A 182 -2.171 34.625 45.937 1.00 55.50 C ATOM 1676 C GLU A 182 -1.909 36.116 46.093 1.00 53.59 C ATOM 1677 O GLU A 182 -2.043 36.860 45.116 1.00 57.12 O ATOM 1678 CB GLU A 182 -3.678 34.365 45.934 1.00 63.12 C ATOM 1679 CG GLU A 182 -4.134 33.351 44.896 1.00 80.86 C ATOM 1680 CD GLU A 182 -3.836 33.786 43.473 1.00 70.05 C ATOM 1681 OE1 GLU A 182 -3.732 35.007 43.231 1.00 68.65 O ATOM 1682 OE2 GLU A 182 -3.704 32.904 42.598 1.00 63.47 O ATOM 1683 H GLU A 182 -2.099 33.274 47.637 1.00 0.00 H ATOM 1684 N ASP A 183 -1.531 36.568 47.286 1.00 51.65 N ATOM 1685 CA ASP A 183 -1.223 37.972 47.523 1.00 50.18 C ATOM 1686 C ASP A 183 0.265 38.274 47.417 1.00 53.04 C ATOM 1687 O ASP A 183 0.660 39.435 47.568 1.00 61.86 O ATOM 1688 CB ASP A 183 -1.740 38.407 48.900 1.00 51.32 C ATOM 1689 CG ASP A 183 -1.291 37.482 50.013 1.00 57.09 C ATOM 1690 OD1 ASP A 183 -1.500 36.257 49.887 1.00 61.75 O ATOM 1691 OD2 ASP A 183 -0.729 37.979 51.012 1.00 55.28 O ATOM 1692 H ASP A 183 -1.453 35.896 48.076 1.00 0.00 H ATOM 1693 N GLN A 184 1.099 37.262 47.173 1.00 48.79 N ATOM 1694 CA GLN A 184 2.546 37.429 47.133 1.00 53.73 C ATOM 1695 C GLN A 184 3.123 37.168 45.745 1.00 45.31 C ATOM 1696 O GLN A 184 4.328 36.932 45.611 1.00 40.01 O ATOM 1697 CB GLN A 184 3.196 36.507 48.164 1.00 56.14 C ATOM 1698 CG GLN A 184 2.734 36.783 49.585 1.00 51.55 C ATOM 1699 CD GLN A 184 3.072 38.184 50.045 1.00 53.17 C ATOM 1700 OE1 GLN A 184 4.125 38.725 49.707 1.00 50.21 O ATOM 1701 NE2 GLN A 184 2.176 38.781 50.820 1.00 60.27 N ATOM 1702 HE22 GLN A 184 1.300 38.284 51.080 1.00 0.00 H ATOM 1703 HE21 GLN A 184 2.350 39.746 51.168 1.00 0.00 H ATOM 1704 H GLN A 184 0.701 36.316 47.005 1.00 0.00 H ATOM 1705 N LEU A 185 2.286 37.209 44.708 1.00 47.22 N ATOM 1706 CA LEU A 185 2.739 36.943 43.349 1.00 47.96 C ATOM 1707 C LEU A 185 3.649 38.035 42.805 1.00 45.94 C ATOM 1708 O LEU A 185 4.173 37.882 41.696 1.00 50.64 O ATOM 1709 CB LEU A 185 1.532 36.763 42.427 1.00 50.67 C ATOM 1710 CG LEU A 185 0.593 35.615 42.804 1.00 48.63 C ATOM 1711 CD1 LEU A 185 -0.656 35.633 41.939 1.00 44.19 C ATOM 1712 CD2 LEU A 185 1.306 34.278 42.686 1.00 47.14 C ATOM 1713 H LEU A 185 1.285 37.437 44.873 1.00 0.00 H ATOM 1714 N GLU A 186 3.853 39.123 43.549 1.00 49.19 N ATOM 1715 CA GLU A 186 4.803 40.148 43.133 1.00 42.52 C ATOM 1716 C GLU A 186 6.208 39.590 42.954 1.00 46.00 C ATOM 1717 O GLU A 186 7.032 40.221 42.283 1.00 52.47 O ATOM 1718 CB GLU A 186 4.829 41.279 44.161 1.00 41.25 C ATOM 1719 CG GLU A 186 5.191 40.816 45.566 1.00 57.41 C ATOM 1720 CD GLU A 186 5.202 41.947 46.575 1.00 55.52 C ATOM 1721 OE1 GLU A 186 6.215 42.676 46.647 1.00 54.25 O ATOM 1722 OE2 GLU A 186 4.195 42.104 47.297 1.00 75.86 O ATOM 1723 H GLU A 186 3.327 39.242 44.438 1.00 0.00 H ATOM 1724 N TYR A 187 6.505 38.433 43.541 1.00 44.69 N ATOM 1725 CA TYR A 187 7.840 37.856 43.487 1.00 51.56 C ATOM 1726 C TYR A 187 8.065 37.001 42.246 1.00 45.62 C ATOM 1727 O TYR A 187 9.099 36.333 42.148 1.00 46.06 O ATOM 1728 CB TYR A 187 8.104 37.045 44.757 1.00 39.44 C ATOM 1729 CG TYR A 187 8.189 37.930 45.978 1.00 44.16 C ATOM 1730 CD1 TYR A 187 9.294 38.743 46.187 1.00 41.32 C ATOM 1731 CD2 TYR A 187 7.155 37.981 46.901 1.00 48.52 C ATOM 1732 CE1 TYR A 187 9.376 39.567 47.288 1.00 45.42 C ATOM 1733 CE2 TYR A 187 7.228 38.804 48.010 1.00 48.81 C ATOM 1734 CZ TYR A 187 8.342 39.595 48.197 1.00 45.46 C ATOM 1735 OH TYR A 187 8.422 40.417 49.298 1.00 54.45 O ATOM 1736 HH TYR A 187 7.669 41.060 49.284 1.00 0.00 H ATOM 1737 H TYR A 187 5.758 37.924 44.056 1.00 0.00 H ATOM 1738 N LEU A 188 7.123 37.002 41.306 1.00 49.66 N ATOM 1739 CA LEU A 188 7.360 36.452 39.979 1.00 51.31 C ATOM 1740 C LEU A 188 7.795 37.515 38.980 1.00 55.78 C ATOM 1741 O LEU A 188 8.241 37.166 37.882 1.00 57.79 O ATOM 1742 CB LEU A 188 6.098 35.757 39.457 1.00 52.21 C ATOM 1743 CG LEU A 188 5.525 34.651 40.345 1.00 50.01 C ATOM 1744 CD1 LEU A 188 4.192 34.173 39.797 1.00 50.68 C ATOM 1745 CD2 LEU A 188 6.502 33.492 40.480 1.00 48.20 C ATOM 1746 H LEU A 188 6.191 37.407 41.526 1.00 0.00 H ATOM 1747 N GLU A 189 7.687 38.793 39.337 1.00 53.96 N ATOM 1748 CA GLU A 189 7.983 39.885 38.424 1.00 54.31 C ATOM 1749 C GLU A 189 9.472 40.199 38.443 1.00 61.97 C ATOM 1750 O GLU A 189 10.109 40.197 39.501 1.00 64.03 O ATOM 1751 CB GLU A 189 7.182 41.132 38.802 1.00 54.58 C ATOM 1752 CG GLU A 189 5.672 40.938 38.790 1.00 59.47 C ATOM 1753 CD GLU A 189 5.150 40.465 37.446 1.00 75.41 C ATOM 1754 OE1 GLU A 189 5.750 40.831 36.413 1.00 83.95 O ATOM 1755 OE2 GLU A 189 4.135 39.736 37.422 1.00 67.24 O ATOM 1756 H GLU A 189 7.380 39.018 40.305 1.00 0.00 H ATOM 1757 N GLU A 190 10.020 40.475 37.258 1.00 57.89 N ATOM 1758 CA GLU A 190 11.452 40.726 37.132 1.00 53.76 C ATOM 1759 C GLU A 190 11.896 41.882 38.021 1.00 51.19 C ATOM 1760 O GLU A 190 12.861 41.758 38.784 1.00 50.94 O ATOM 1761 CB GLU A 190 11.800 41.010 35.671 1.00 61.56 C ATOM 1762 CG GLU A 190 13.288 40.992 35.384 1.00 54.38 C ATOM 1763 CD GLU A 190 13.637 41.581 34.027 1.00 62.50 C ATOM 1764 OE1 GLU A 190 12.775 41.554 33.122 1.00 46.15 O ATOM 1765 OE2 GLU A 190 14.774 42.075 33.869 1.00 54.09 O ATOM 1766 H GLU A 190 9.417 40.512 36.411 1.00 0.00 H ATOM 1767 N LYS A 191 11.201 43.018 37.936 1.00 44.38 N ATOM 1768 CA LYS A 191 11.626 44.207 38.669 1.00 47.41 C ATOM 1769 C LYS A 191 11.777 43.910 40.154 1.00 50.51 C ATOM 1770 O LYS A 191 12.803 44.231 40.765 1.00 50.24 O ATOM 1771 CB LYS A 191 10.623 45.342 38.450 1.00 53.58 C ATOM 1772 H LYS A 191 10.348 43.057 37.342 1.00 0.00 H ATOM 1773 N ARG A 192 10.765 43.276 40.748 1.00 58.00 N ATOM 1774 CA ARG A 192 10.794 42.994 42.178 1.00 51.15 C ATOM 1775 C ARG A 192 11.985 42.113 42.539 1.00 48.48 C ATOM 1776 O ARG A 192 12.700 42.382 43.511 1.00 45.28 O ATOM 1777 CB ARG A 192 9.484 42.326 42.597 1.00 55.68 C ATOM 1778 CG ARG A 192 9.290 42.187 44.101 1.00 59.27 C ATOM 1779 CD ARG A 192 8.990 43.529 44.751 1.00 57.54 C ATOM 1780 NE ARG A 192 8.811 43.411 46.198 1.00 49.78 N ATOM 1781 CZ ARG A 192 9.743 43.686 47.108 1.00 47.41 C ATOM 1782 NH1 ARG A 192 10.948 44.104 46.743 1.00 49.13 N ATOM 1783 NH2 ARG A 192 9.464 43.541 48.396 1.00 46.07 N ATOM 1784 HE ARG A 192 7.885 43.087 46.542 1.00 0.00 H ATOM 1785 HH12 ARG A 192 11.666 44.315 47.465 1.00 0.00 H ATOM 1786 HH11 ARG A 192 11.175 44.221 45.735 1.00 0.00 H ATOM 1787 HH22 ARG A 192 10.188 43.754 49.112 1.00 0.00 H ATOM 1788 HH21 ARG A 192 8.522 43.214 48.690 1.00 0.00 H ATOM 1789 H ARG A 192 9.944 42.979 40.183 1.00 0.00 H ATOM 1790 N ILE A 193 12.214 41.052 41.763 1.00 37.28 N ATOM 1791 CA ILE A 193 13.303 40.128 42.073 1.00 44.14 C ATOM 1792 C ILE A 193 14.641 40.858 42.073 1.00 44.43 C ATOM 1793 O ILE A 193 15.443 40.711 43.001 1.00 42.91 O ATOM 1794 CB ILE A 193 13.301 38.946 41.087 1.00 53.90 C ATOM 1795 CG1 ILE A 193 11.999 38.149 41.226 1.00 40.21 C ATOM 1796 CG2 ILE A 193 14.512 38.047 41.327 1.00 42.77 C ATOM 1797 CD1 ILE A 193 11.798 37.097 40.157 1.00 49.83 C ATOM 1798 H ILE A 193 11.613 40.881 40.931 1.00 0.00 H ATOM 1799 N LYS A 194 14.904 41.662 41.039 1.00 46.24 N ATOM 1800 CA LYS A 194 16.157 42.413 41.007 1.00 46.15 C ATOM 1801 C LYS A 194 16.254 43.376 42.183 1.00 44.79 C ATOM 1802 O LYS A 194 17.320 43.512 42.794 1.00 41.48 O ATOM 1803 CB LYS A 194 16.309 43.161 39.683 1.00 52.77 C ATOM 1804 CG LYS A 194 16.715 42.272 38.512 1.00 47.76 C ATOM 1805 CD LYS A 194 16.986 43.081 37.249 1.00 51.54 C ATOM 1806 CE LYS A 194 15.727 43.740 36.712 1.00 57.98 C ATOM 1807 NZ LYS A 194 15.994 44.547 35.491 1.00 64.36 N ATOM 1808 HZ1 LYS A 194 16.681 45.295 35.715 1.00 0.00 H ATOM 1809 HZ2 LYS A 194 16.380 43.931 34.747 1.00 0.00 H ATOM 1810 HZ3 LYS A 194 15.107 44.977 35.161 1.00 0.00 H ATOM 1811 H LYS A 194 14.220 41.753 40.261 1.00 0.00 H ATOM 1812 N GLU A 195 15.157 44.065 42.506 1.00 48.16 N ATOM 1813 CA GLU A 195 15.154 44.945 43.670 1.00 45.50 C ATOM 1814 C GLU A 195 15.635 44.205 44.912 1.00 51.79 C ATOM 1815 O GLU A 195 16.574 44.642 45.586 1.00 52.56 O ATOM 1816 CB GLU A 195 13.753 45.515 43.898 1.00 57.46 C ATOM 1817 CG GLU A 195 13.457 46.782 43.113 1.00 60.21 C ATOM 1818 CD GLU A 195 12.022 47.241 43.275 1.00 67.10 C ATOM 1819 OE1 GLU A 195 11.274 46.592 44.038 1.00 62.74 O ATOM 1820 OE2 GLU A 195 11.644 48.252 42.647 1.00 79.48 O ATOM 1821 H GLU A 195 14.300 43.974 41.925 1.00 0.00 H ATOM 1822 N VAL A 196 15.008 43.067 45.222 1.00 44.25 N ATOM 1823 CA VAL A 196 15.349 42.347 46.446 1.00 51.77 C ATOM 1824 C VAL A 196 16.770 41.808 46.366 1.00 47.74 C ATOM 1825 O VAL A 196 17.544 41.915 47.324 1.00 46.50 O ATOM 1826 CB VAL A 196 14.329 41.224 46.709 1.00 48.17 C ATOM 1827 CG1 VAL A 196 14.694 40.452 47.974 1.00 45.20 C ATOM 1828 CG2 VAL A 196 12.924 41.800 46.830 1.00 49.64 C ATOM 1829 H VAL A 196 14.273 42.692 44.589 1.00 0.00 H ATOM 1830 N VAL A 197 17.134 41.213 45.230 1.00 52.33 N ATOM 1831 CA VAL A 197 18.477 40.661 45.079 1.00 52.21 C ATOM 1832 C VAL A 197 19.518 41.760 45.252 1.00 49.97 C ATOM 1833 O VAL A 197 20.478 41.615 46.018 1.00 57.29 O ATOM 1834 CB VAL A 197 18.615 39.953 43.718 1.00 52.98 C ATOM 1835 CG1 VAL A 197 20.048 39.497 43.489 1.00 51.69 C ATOM 1836 CG2 VAL A 197 17.672 38.757 43.649 1.00 55.68 C ATOM 1837 H VAL A 197 16.456 41.141 44.445 1.00 0.00 H ATOM 1838 N LYS A 198 19.344 42.876 44.541 1.00 52.95 N ATOM 1839 CA LYS A 198 20.299 43.976 44.639 1.00 62.22 C ATOM 1840 C LYS A 198 20.512 44.405 46.087 1.00 57.57 C ATOM 1841 O LYS A 198 21.635 44.733 46.487 1.00 60.59 O ATOM 1842 CB LYS A 198 19.821 45.161 43.797 1.00 55.14 C ATOM 1843 H LYS A 198 18.521 42.963 43.911 1.00 0.00 H ATOM 1844 N LYS A 199 19.445 44.420 46.886 1.00 56.82 N ATOM 1845 CA LYS A 199 19.561 44.803 48.289 1.00 59.61 C ATOM 1846 C LYS A 199 20.543 43.914 49.045 1.00 67.39 C ATOM 1847 O LYS A 199 21.614 44.376 49.453 1.00 71.25 O ATOM 1848 CB LYS A 199 18.195 44.747 48.981 1.00 53.48 C ATOM 1849 CG LYS A 199 17.215 45.845 48.578 1.00 54.86 C ATOM 1850 CD LYS A 199 16.037 45.906 49.548 1.00 63.26 C ATOM 1851 CE LYS A 199 15.005 46.948 49.138 1.00 62.87 C ATOM 1852 NZ LYS A 199 13.839 46.348 48.425 1.00 65.51 N ATOM 1853 HZ1 LYS A 199 14.170 45.868 47.564 1.00 0.00 H ATOM 1854 HZ2 LYS A 199 13.370 45.660 49.048 1.00 0.00 H ATOM 1855 HZ3 LYS A 199 13.167 47.099 48.168 1.00 0.00 H ATOM 1856 H LYS A 199 18.515 44.154 46.503 1.00 0.00 H ATOM 1857 N HIS A 200 20.197 42.640 49.229 1.00 72.88 N ATOM 1858 CA HIS A 200 20.924 41.753 50.137 1.00 62.38 C ATOM 1859 C HIS A 200 21.853 40.794 49.403 1.00 70.12 C ATOM 1860 O HIS A 200 22.012 39.647 49.832 1.00 74.64 O ATOM 1861 CB HIS A 200 19.944 40.951 50.987 1.00 55.73 C ATOM 1862 CG HIS A 200 18.660 41.662 51.287 1.00 63.78 C ATOM 1863 ND1 HIS A 200 18.456 42.381 52.445 1.00 66.73 N ATOM 1864 CD2 HIS A 200 17.501 41.732 50.591 1.00 66.50 C ATOM 1865 CE1 HIS A 200 17.231 42.878 52.440 1.00 70.61 C ATOM 1866 NE2 HIS A 200 16.631 42.499 51.326 1.00 70.45 N ATOM 1867 H HIS A 200 19.380 42.263 48.708 1.00 0.00 H ATOM 1868 N SER A 201 22.485 41.214 48.303 1.00 72.87 N ATOM 1869 CA SER A 201 23.317 40.297 47.531 1.00 70.48 C ATOM 1870 C SER A 201 24.608 40.932 47.029 1.00 81.46 C ATOM 1871 O SER A 201 25.271 40.344 46.165 1.00 79.38 O ATOM 1872 CB SER A 201 22.532 39.738 46.338 1.00 70.62 C ATOM 1873 H SER A 201 22.383 42.202 47.995 1.00 0.00 H ATOM 1874 N GLU A 202 24.989 42.105 47.535 1.00 82.53 N ATOM 1875 CA GLU A 202 26.219 42.741 47.077 1.00 86.06 C ATOM 1876 C GLU A 202 27.438 41.866 47.353 1.00 76.03 C ATOM 1877 O GLU A 202 28.364 41.803 46.536 1.00 71.78 O ATOM 1878 CB GLU A 202 26.374 44.106 47.748 1.00 96.59 C ATOM 1879 CG GLU A 202 25.132 44.984 47.643 1.00 94.56 C ATOM 1880 CD GLU A 202 25.402 46.435 47.993 1.00 94.13 C ATOM 1881 OE1 GLU A 202 26.585 46.801 48.160 1.00 99.10 O ATOM 1882 OE2 GLU A 202 24.429 47.212 48.100 1.00 81.71 O ATOM 1883 H GLU A 202 24.406 42.569 48.260 1.00 0.00 H ATOM 1884 N PHE A 203 27.461 41.190 48.499 1.00 79.52 N ATOM 1885 CA PHE A 203 28.637 40.455 48.952 1.00 84.18 C ATOM 1886 C PHE A 203 28.750 39.046 48.378 1.00 73.38 C ATOM 1887 O PHE A 203 29.741 38.365 48.664 1.00 81.83 O ATOM 1888 CB PHE A 203 28.653 40.405 50.481 1.00 89.16 C ATOM 1889 CG PHE A 203 29.040 41.712 51.113 1.00 89.16 C ATOM 1890 CD1 PHE A 203 30.372 42.083 51.202 1.00 98.65 C ATOM 1891 CD2 PHE A 203 28.075 42.577 51.600 1.00 80.93 C ATOM 1892 CE1 PHE A 203 30.736 43.287 51.774 1.00 90.78 C ATOM 1893 CE2 PHE A 203 28.433 43.783 52.174 1.00 88.02 C ATOM 1894 CZ PHE A 203 29.766 44.138 52.260 1.00 80.43 C ATOM 1895 H PHE A 203 26.608 41.185 49.094 1.00 0.00 H ATOM 1896 N VAL A 204 27.783 38.585 47.592 1.00 70.38 N ATOM 1897 CA VAL A 204 27.816 37.222 47.068 1.00 64.53 C ATOM 1898 C VAL A 204 28.823 37.155 45.926 1.00 58.31 C ATOM 1899 O VAL A 204 28.835 38.016 45.039 1.00 62.71 O ATOM 1900 CB VAL A 204 26.418 36.783 46.600 1.00 62.01 C ATOM 1901 CG1 VAL A 204 26.416 35.303 46.235 1.00 52.32 C ATOM 1902 CG2 VAL A 204 25.373 37.074 47.668 1.00 71.73 C ATOM 1903 H VAL A 204 26.987 39.207 47.345 1.00 0.00 H ATOM 1904 N ALA A 205 29.669 36.124 45.944 1.00 57.15 N ATOM 1905 CA ALA A 205 30.750 35.980 44.975 1.00 53.56 C ATOM 1906 C ALA A 205 30.365 35.151 43.759 1.00 53.57 C ATOM 1907 O ALA A 205 31.195 34.981 42.859 1.00 54.14 O ATOM 1908 CB ALA A 205 31.971 35.340 45.645 1.00 55.97 C ATOM 1909 H ALA A 205 29.554 35.395 46.677 1.00 0.00 H ATOM 1910 N TYR A 206 29.142 34.635 43.706 1.00 61.40 N ATOM 1911 CA TYR A 206 28.698 33.808 42.598 1.00 43.69 C ATOM 1912 C TYR A 206 27.653 34.545 41.768 1.00 37.45 C ATOM 1913 O TYR A 206 26.929 35.399 42.287 1.00 43.69 O ATOM 1914 CB TYR A 206 28.114 32.486 43.106 1.00 44.11 C ATOM 1915 CG TYR A 206 29.084 31.710 43.965 1.00 38.65 C ATOM 1916 CD1 TYR A 206 29.978 30.813 43.398 1.00 39.26 C ATOM 1917 CD2 TYR A 206 29.119 31.889 45.339 1.00 33.82 C ATOM 1918 CE1 TYR A 206 30.871 30.109 44.176 1.00 41.72 C ATOM 1919 CE2 TYR A 206 30.009 31.191 46.126 1.00 36.50 C ATOM 1920 CZ TYR A 206 30.884 30.302 45.541 1.00 41.75 C ATOM 1921 OH TYR A 206 31.774 29.600 46.321 1.00 38.02 O ATOM 1922 HH TYR A 206 32.362 30.235 46.802 1.00 0.00 H ATOM 1923 H TYR A 206 28.480 34.830 44.484 1.00 0.00 H ATOM 1924 N PRO A 207 27.556 34.249 40.473 1.00 44.77 N ATOM 1925 CA PRO A 207 26.569 34.943 39.634 1.00 45.13 C ATOM 1926 C PRO A 207 25.149 34.547 40.011 1.00 41.47 C ATOM 1927 O PRO A 207 24.842 33.363 40.166 1.00 40.68 O ATOM 1928 CB PRO A 207 26.925 34.486 38.215 1.00 45.63 C ATOM 1929 CG PRO A 207 27.592 33.168 38.404 1.00 42.71 C ATOM 1930 CD PRO A 207 28.333 33.260 39.705 1.00 41.37 C ATOM 1931 N ILE A 208 24.287 35.549 40.156 1.00 35.40 N ATOM 1932 CA ILE A 208 22.865 35.340 40.403 1.00 37.69 C ATOM 1933 C ILE A 208 22.149 35.616 39.090 1.00 41.51 C ATOM 1934 O ILE A 208 22.006 36.772 38.678 1.00 42.74 O ATOM 1935 CB ILE A 208 22.338 36.241 41.530 1.00 42.79 C ATOM 1936 CG1 ILE A 208 23.039 35.908 42.848 1.00 34.66 C ATOM 1937 CG2 ILE A 208 20.822 36.083 41.677 1.00 38.00 C ATOM 1938 CD1 ILE A 208 22.671 36.834 43.993 1.00 42.27 C ATOM 1939 H ILE A 208 24.642 36.524 40.090 1.00 0.00 H ATOM 1940 N GLN A 209 21.696 34.554 38.433 1.00 41.36 N ATOM 1941 CA GLN A 209 21.089 34.651 37.116 1.00 42.49 C ATOM 1942 C GLN A 209 19.573 34.649 37.243 1.00 45.53 C ATOM 1943 O GLN A 209 19.011 33.948 38.089 1.00 46.85 O ATOM 1944 CB GLN A 209 21.548 33.489 36.234 1.00 43.24 C ATOM 1945 CG GLN A 209 23.052 33.268 36.271 1.00 39.57 C ATOM 1946 CD GLN A 209 23.495 32.070 35.456 1.00 52.10 C ATOM 1947 OE1 GLN A 209 23.032 30.950 35.672 1.00 50.60 O ATOM 1948 NE2 GLN A 209 24.420 32.296 34.529 1.00 63.67 N ATOM 1949 HE22 GLN A 209 24.783 33.259 34.381 1.00 0.00 H ATOM 1950 HE21 GLN A 209 24.781 31.510 33.952 1.00 0.00 H ATOM 1951 H GLN A 209 21.779 33.618 38.878 1.00 0.00 H ATOM 1952 N LEU A 210 18.916 35.439 36.397 1.00 42.92 N ATOM 1953 CA LEU A 210 17.463 35.551 36.384 1.00 35.45 C ATOM 1954 C LEU A 210 16.963 35.141 35.007 1.00 48.69 C ATOM 1955 O LEU A 210 17.367 35.727 33.996 1.00 48.56 O ATOM 1956 CB LEU A 210 17.015 36.974 36.719 1.00 40.84 C ATOM 1957 CG LEU A 210 15.505 37.181 36.861 1.00 39.73 C ATOM 1958 CD1 LEU A 210 14.952 36.360 38.012 1.00 34.11 C ATOM 1959 CD2 LEU A 210 15.184 38.653 37.053 1.00 42.22 C ATOM 1960 H LEU A 210 19.464 36.001 35.715 1.00 0.00 H ATOM 1961 N VAL A 211 16.089 34.141 34.972 1.00 43.23 N ATOM 1962 CA VAL A 211 15.530 33.612 33.733 1.00 38.37 C ATOM 1963 C VAL A 211 14.100 34.122 33.615 1.00 42.46 C ATOM 1964 O VAL A 211 13.225 33.726 34.391 1.00 46.40 O ATOM 1965 CB VAL A 211 15.579 32.078 33.707 1.00 48.30 C ATOM 1966 CG1 VAL A 211 15.002 31.545 32.403 1.00 44.67 C ATOM 1967 CG2 VAL A 211 17.009 31.588 33.908 1.00 35.25 C ATOM 1968 H VAL A 211 15.789 33.715 35.872 1.00 0.00 H ATOM 1969 N VAL A 212 13.852 34.990 32.638 1.00 46.20 N ATOM 1970 CA VAL A 212 12.540 35.593 32.438 1.00 42.82 C ATOM 1971 C VAL A 212 12.040 35.222 31.049 1.00 42.44 C ATOM 1972 O VAL A 212 12.808 35.226 30.080 1.00 47.46 O ATOM 1973 CB VAL A 212 12.579 37.127 32.618 1.00 42.55 C ATOM 1974 CG1 VAL A 212 13.569 37.513 33.715 1.00 48.01 C ATOM 1975 CG2 VAL A 212 12.921 37.844 31.310 1.00 58.81 C ATOM 1976 H VAL A 212 14.624 35.249 31.991 1.00 0.00 H ATOM 1977 N THR A 213 10.754 34.890 30.959 1.00 42.60 N ATOM 1978 CA THR A 213 10.094 34.592 29.693 1.00 46.14 C ATOM 1979 C THR A 213 9.117 35.724 29.399 1.00 46.00 C ATOM 1980 O THR A 213 8.115 35.884 30.103 1.00 58.96 O ATOM 1981 CB THR A 213 9.372 33.247 29.751 1.00 47.87 C ATOM 1982 OG1 THR A 213 10.296 32.221 30.133 1.00 53.62 O ATOM 1983 CG2 THR A 213 8.782 32.899 28.392 1.00 57.46 C ATOM 1984 HG1 THR A 213 9.825 31.351 30.170 1.00 0.00 H ATOM 1985 H THR A 213 10.193 34.841 31.833 1.00 0.00 H ATOM 1986 N LYS A 214 9.407 36.502 28.361 1.00 45.69 N ATOM 1987 CA LYS A 214 8.577 37.629 27.961 1.00 44.29 C ATOM 1988 C LYS A 214 8.110 37.435 26.526 1.00 48.53 C ATOM 1989 O LYS A 214 8.872 36.970 25.673 1.00 55.91 O ATOM 1990 CB LYS A 214 9.342 38.951 28.088 1.00 41.47 C ATOM 1991 H LYS A 214 10.265 36.296 27.810 1.00 0.00 H ATOM 1992 N GLU A 215 6.855 37.790 26.264 1.00 49.15 N ATOM 1993 CA GLU A 215 6.338 37.753 24.906 1.00 49.84 C ATOM 1994 C GLU A 215 6.817 38.973 24.129 1.00 57.28 C ATOM 1995 O GLU A 215 7.071 40.040 24.695 1.00 63.87 O ATOM 1996 CB GLU A 215 4.810 37.704 24.909 1.00 54.53 C ATOM 1997 CG GLU A 215 4.200 37.540 23.524 1.00 62.05 C ATOM 1998 CD GLU A 215 2.697 37.370 23.558 1.00 60.53 C ATOM 1999 OE1 GLU A 215 2.152 37.058 24.638 1.00 73.65 O ATOM 2000 OE2 GLU A 215 2.060 37.556 22.499 1.00 46.43 O ATOM 2001 H GLU A 215 6.236 38.098 27.041 1.00 0.00 H ATOM 2002 N VAL A 216 6.937 38.802 22.815 1.00 55.17 N ATOM 2003 CA VAL A 216 7.482 39.820 21.926 1.00 56.58 C ATOM 2004 C VAL A 216 6.350 40.427 21.110 1.00 60.84 C ATOM 2005 O VAL A 216 5.441 39.719 20.662 1.00 58.60 O ATOM 2006 CB VAL A 216 8.573 39.238 21.006 1.00 59.77 C ATOM 2007 CG1 VAL A 216 9.233 40.347 20.198 1.00 59.12 C ATOM 2008 CG2 VAL A 216 9.608 38.484 21.827 1.00 52.46 C ATOM 2009 H VAL A 216 6.627 37.899 22.403 1.00 0.00 H ATOM 2010 N GLU A 217 6.413 41.741 20.919 1.00 74.48 N ATOM 2011 CA GLU A 217 5.382 42.476 20.196 1.00 78.12 C ATOM 2012 C GLU A 217 5.523 42.286 18.688 1.00 79.50 C ATOM 2013 O GLU A 217 6.552 41.813 18.203 1.00 74.92 O ATOM 2014 CB GLU A 217 5.460 43.962 20.546 1.00 78.40 C ATOM 2015 CG GLU A 217 4.529 44.855 19.748 1.00 87.44 C ATOM 2016 CD GLU A 217 4.604 46.298 20.194 1.00 93.57 C ATOM 2017 OE1 GLU A 217 4.362 46.558 21.390 1.00104.10 O ATOM 2018 OE2 GLU A 217 4.918 47.169 19.354 1.00 94.84 O ATOM 2019 H GLU A 217 7.228 42.264 21.299 1.00 0.00 H TER 2020 GLU A 217 HETATM 2021 O HOH 1 18.350 28.554 48.071 1.00 26.26 O HETATM 2022 O HOH 2 4.154 37.726 20.288 1.00 48.02 O HETATM 2023 O HOH 3 24.817 18.382 51.948 1.00 54.20 O HETATM 2024 O HOH 4 28.808 32.119 51.209 1.00 30.82 O HETATM 2025 O HOH 5 8.250 14.092 48.760 1.00 51.36 O HETATM 2026 O HOH 6 5.869 40.735 50.003 1.00 47.01 O HETATM 2027 O HOH 7 21.305 13.648 47.024 1.00 43.88 O HETATM 2028 O HOH 8 16.258 46.160 61.819 1.00 56.37 O HETATM 2029 O HOH 9 22.924 22.592 46.993 1.00 35.75 O HETATM 2030 O HOH 10 18.837 27.356 45.670 1.00 27.09 O HETATM 2031 O HOH 11 15.444 26.743 59.358 1.00 43.97 O HETATM 2032 O HOH 12 14.524 24.165 59.075 1.00 52.32 O HETATM 2033 O HOH 13 23.262 36.996 51.047 1.00 54.88 O HETATM 2034 O HOH 14 6.251 41.891 51.940 1.00 54.74 O HETATM 2035 C10 F A 5 19.673 24.008 52.997 1.00 0.02 C HETATM 2036 C09 F A 5 19.730 24.804 51.662 1.00 -0.03 C HETATM 2037 C03 F A 5 20.684 24.492 50.669 1.00 0.08 C HETATM 2038 C02 F A 5 20.715 25.194 49.469 1.00 0.10 C HETATM 2039 O01 F A 5 21.688 24.864 48.503 1.00 -0.33 O HETATM 2040 H12 F A 5 21.583 25.426 47.744 1.00 0.25 H HETATM 2041 C34 F A 5 19.794 26.208 49.220 1.00 -0.01 C HETATM 2042 C32 F A 5 18.835 26.518 50.183 1.00 0.08 C HETATM 2043 C31 F A 5 18.797 25.817 51.399 1.00 -0.03 C HETATM 2044 H25 F A 5 18.042 26.060 52.138 1.00 0.04 H HETATM 2045 O33 F A 5 17.909 27.549 49.918 1.00 -0.33 O HETATM 2046 H26 F A 5 18.078 27.912 49.056 1.00 0.25 H HETATM 2047 H27 F A 5 19.823 26.753 48.283 1.00 0.04 H HETATM 2048 C04 F A 5 21.743 23.400 50.842 1.00 0.24 C HETATM 2049 O05 F A 5 22.414 23.278 52.084 1.00 -0.28 O HETATM 2050 C06 F A 5 23.231 22.155 52.215 1.00 0.09 C HETATM 2051 C07 F A 5 23.237 21.665 53.651 1.00 -0.03 C HETATM 2052 H14 F A 5 23.886 20.780 53.734 1.00 0.03 H HETATM 2053 H15 F A 5 22.213 21.398 53.952 1.00 0.03 H HETATM 2054 H16 F A 5 23.617 22.461 54.309 1.00 0.03 H HETATM 2055 C19 F A 5 24.620 22.580 51.821 1.00 0.01 C HETATM 2056 C17 F A 5 25.295 23.456 52.861 1.00 0.10 C HETATM 2057 C16 F A 5 24.826 24.930 53.167 1.00 0.12 C HETATM 2058 C15 F A 5 24.582 26.180 54.298 1.00 -0.04 C HETATM 2059 C14 F A 5 23.343 26.619 54.637 1.00 -0.07 C HETATM 2060 C13 F A 5 22.017 26.134 54.043 1.00 -0.08 C HETATM 2061 C12 F A 5 21.270 25.255 54.773 1.00 -0.05 C HETATM 2062 C11 F A 5 19.897 24.733 54.330 1.00 0.05 C HETATM 2063 N20 F A 5 18.888 24.871 55.184 1.00 -0.17 N HETATM 2064 O21 F A 5 17.634 24.404 54.870 1.00 -0.24 O HETATM 2065 C22 F A 5 16.741 24.939 55.836 1.00 0.12 C HETATM 2066 C23 F A 5 16.254 26.254 55.253 1.00 -0.02 C HETATM 2067 C24 F A 5 16.377 27.422 55.997 1.00 -0.07 C HETATM 2068 C25 F A 5 15.940 28.623 55.456 1.00 -0.04 C HETATM 2069 C26 F A 5 15.378 28.650 54.184 1.00 0.08 C HETATM 2070 O27 F A 5 14.947 29.913 53.719 1.00 -0.33 O HETATM 2071 C28 F A 5 14.530 30.086 52.383 1.00 0.06 C HETATM 2072 H9 F A 5 14.236 31.134 52.223 1.00 0.06 H HETATM 2073 H10 F A 5 13.671 29.429 52.179 1.00 0.06 H HETATM 2074 H11 F A 5 15.357 29.830 51.705 1.00 0.06 H HETATM 2075 C29 F A 5 15.258 27.472 53.442 1.00 -0.04 C HETATM 2076 C30 F A 5 15.700 26.272 53.976 1.00 -0.07 C HETATM 2077 H24 F A 5 15.615 25.355 53.404 1.00 0.05 H HETATM 2078 H23 F A 5 14.820 27.497 52.451 1.00 0.05 H HETATM 2079 H22 F A 5 16.037 29.541 56.025 1.00 0.05 H HETATM 2080 H8 F A 5 16.810 27.395 56.990 1.00 0.05 H HETATM 2081 H6 F A 5 17.263 25.111 56.789 1.00 0.08 H HETATM 2082 H7 F A 5 15.896 24.254 55.999 1.00 0.08 H HETATM 2083 H17 F A 5 21.671 24.905 55.723 1.00 0.05 H HETATM 2084 H3 F A 5 21.680 26.480 53.067 1.00 0.06 H HETATM 2085 H18 F A 5 23.286 27.390 55.404 1.00 0.05 H HETATM 2086 H4 F A 5 25.450 26.643 54.765 1.00 0.08 H HETATM 2087 O18 F A 5 25.970 24.624 52.224 1.00 -0.35 O HETATM 2088 H19 F A 5 23.884 25.085 52.620 1.00 0.08 H HETATM 2089 H5 F A 5 25.750 22.850 53.658 1.00 0.07 H HETATM 2090 H20 F A 5 25.233 21.678 51.672 1.00 0.03 H HETATM 2091 H21 F A 5 24.559 23.142 50.877 1.00 0.03 H HETATM 2092 H13 F A 5 22.876 21.351 51.554 1.00 0.06 H HETATM 2093 O08 F A 5 22.005 22.669 49.902 1.00 -0.37 O HETATM 2094 H1 F A 5 20.438 23.221 52.931 1.00 0.06 H HETATM 2095 H2 F A 5 18.676 23.547 53.050 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1425 1426 1429 1430 1431 CONECT 1429 1425 CONECT 1430 1425 CONECT 1431 1425 CONECT 2035 2036 2062 2094 2095 CONECT 2036 2035 2037 2043 CONECT 2037 2036 2038 2048 CONECT 2038 2037 2039 2041 CONECT 2039 2038 2040 CONECT 2040 2039 CONECT 2041 2038 2042 2047 CONECT 2042 2041 2043 2045 CONECT 2043 2036 2042 2044 CONECT 2044 2043 CONECT 2045 2042 2046 CONECT 2046 2045 CONECT 2047 2041 CONECT 2048 2037 2049 2093 CONECT 2049 2048 2050 CONECT 2050 2049 2051 2055 2092 CONECT 2051 2050 2052 2053 2054 CONECT 2052 2051 CONECT 2053 2051 CONECT 2054 2051 CONECT 2055 2050 2056 2090 2091 CONECT 2056 2055 2057 2087 2089 CONECT 2057 2056 2058 2087 2088 CONECT 2058 2057 2059 2086 CONECT 2059 2058 2060 2085 CONECT 2060 2059 2061 2084 CONECT 2061 2060 2062 2083 CONECT 2062 2035 2061 2063 CONECT 2063 2062 2064 CONECT 2064 2063 2065 CONECT 2065 2064 2066 2081 2082 CONECT 2066 2065 2067 2076 CONECT 2067 2066 2068 2080 CONECT 2068 2067 2069 2079 CONECT 2069 2068 2070 2075 CONECT 2070 2069 2071 CONECT 2071 2070 2072 2073 2074 CONECT 2072 2071 CONECT 2073 2071 CONECT 2074 2071 CONECT 2075 2069 2076 2078 CONECT 2076 2066 2075 2077 CONECT 2077 2076 CONECT 2078 2075 CONECT 2079 2068 CONECT 2080 2067 CONECT 2081 2065 CONECT 2082 2065 CONECT 2083 2061 CONECT 2084 2060 CONECT 2085 2059 CONECT 2086 2058 CONECT 2087 2056 2057 CONECT 2088 2057 CONECT 2089 2056 CONECT 2090 2055 CONECT 2091 2055 CONECT 2092 2050 CONECT 2093 2048 CONECT 2094 2035 CONECT 2095 2035 MASTER 0 0 0 0 0 0 0 0 2093 2 69 17 END
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Structure:
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Protein
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Related entries of code: 6cjp
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6cjs
RCSB PDB
PDBbind
230aa, >6CJS_1|Chain... at 100%
6cjr
RCSB PDB
PDBbind
230aa, >6CJR_1|Chains... at 100%
6cjj
RCSB PDB
PDBbind
230aa, >6CJJ_1|Chain... *
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
6cjp
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Heat shock protein 90 homolog
Ligand Name
F5S
EC.Number
E.C.-.-.-.-
Resolution
2.6(Å)
Affinity (Kd/Ki/IC50)
Ki=7.7nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Nat Commun Vol. 10: pp. 402-402
Ligand Properties
Formula
C
2
6
H
2
7
NO
7
Molecular Weight
465.495
Exact Mass
465.179
No. of atoms
61
No. of bonds
64
Polar Surface Area
110.11
LOGP Value
4.79 (
Computed with XLOGP3
)
4.05 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
COc1ccc(cc1)CO/N=C\1/C=C/C=C\[C@H]2O[C@@H]2C[C@H](OC(=O)c2c(C1)cc(O)cc2O)C
InChI String
InChI=1S/C26H27NO7/c1-16-11-24-23(34-24)6-4-3-5-19(27-32-15-17-7-9-21(31-2)10-8-17)12-18-13-20(28)14-22(29)25(18)26(30)33-16/h3-10,13-14,16,23-24,28-29H,11-12,15H2,1-2H3/b5-3+,6-4-,27-19-/t16-,23-,24-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P46598
Entrez Gene ID
NCBI Entrez Gene ID:
3636951
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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