Browse entries in the PDBbind-CN Database
HEADER 5T3N_COMPLEX COMPND 5T3N_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 153 HIS HIS GLU VAL LEU PHE GLN GLY PRO GLY ALA LYS LYS SEQRES 2 A 153 ARG LYS MET TYR GLU ASP ILE LEU SER HIS VAL ASN ILE SEQRES 3 A 153 LEU LYS ASP MET ASP PRO TYR GLU ARG CYS LYS VAL ALA SEQRES 4 A 153 ASP CYS LEU LYS SER LYS SER TYR ASN ASP GLY GLU ILE SEQRES 5 A 153 ILE ILE LYS GLU GLY GLU GLU GLY ASP THR PHE PHE ILE SEQRES 6 A 153 LEU ILE ASP GLY ASN ALA VAL ALA SER LYS ASP ASN LYS SEQRES 7 A 153 VAL ILE LYS THR TYR THR LYS GLY ASP TYR PHE GLY GLU SEQRES 8 A 153 LEU ALA LEU LEU LYS ASN LYS PRO ARG ALA ALA THR ILE SEQRES 9 A 153 LYS ALA GLN ASN PHE CYS GLN VAL VAL TYR LEU ASP ARG SEQRES 10 A 153 LYS SER PHE LYS ARG LEU LEU GLY PRO ILE GLU ASP ILE SEQRES 11 A 153 LEU HIS ARG ASN VAL GLU ASN TYR LYS LYS VAL LEU ASN SEQRES 12 A 153 GLU LEU GLY LEU ASP THR THR CYS ILE ASP HET UNN A 161 34 ATOM 1 N HIS A 287 93.475 95.428 3.049 1.00107.27 N ATOM 2 CA HIS A 287 92.518 96.221 2.290 1.00109.11 C ATOM 3 C HIS A 287 91.449 95.343 1.661 1.00105.98 C ATOM 4 O HIS A 287 91.657 94.166 1.484 1.00100.61 O ATOM 5 CB HIS A 287 93.218 97.056 1.222 1.00113.82 C ATOM 6 CG HIS A 287 92.521 98.345 0.922 1.00116.91 C ATOM 7 ND1 HIS A 287 91.624 98.483 -0.113 1.00115.55 N ATOM 8 CD2 HIS A 287 92.574 99.550 1.536 1.00121.05 C ATOM 9 CE1 HIS A 287 91.156 99.716 -0.129 1.00118.91 C ATOM 10 NE2 HIS A 287 91.716 100.383 0.863 1.00122.32 N ATOM 11 HN3 HIS A 287 93.937 94.745 2.415 1.00 0.00 H ATOM 12 HN2 HIS A 287 92.977 94.918 3.806 1.00 0.00 H ATOM 13 HN1 HIS A 287 94.191 96.057 3.465 1.00 0.00 H ATOM 14 N HIS A 288 90.301 95.928 1.363 1.00111.12 N ATOM 15 CA HIS A 288 89.155 95.186 0.892 1.00108.14 C ATOM 16 C HIS A 288 88.765 95.279 -0.544 1.00104.12 C ATOM 17 O HIS A 288 87.739 94.752 -0.894 1.00100.12 O ATOM 18 CB HIS A 288 87.937 95.619 1.659 1.00113.22 C ATOM 19 CG HIS A 288 88.194 95.839 3.100 1.00119.96 C ATOM 20 ND1 HIS A 288 89.333 95.389 3.718 1.00123.88 N ATOM 21 CD2 HIS A 288 87.456 96.450 4.052 1.00122.94 C ATOM 22 CE1 HIS A 288 89.289 95.714 4.996 1.00126.82 C ATOM 23 NE2 HIS A 288 88.159 96.358 5.225 1.00126.32 N ATOM 24 H HIS A 288 90.221 96.959 1.472 1.00 0.00 H ATOM 25 N GLU A 289 89.525 95.964 -1.372 1.00105.35 N ATOM 26 CA GLU A 289 89.140 96.121 -2.766 1.00102.25 C ATOM 27 C GLU A 289 88.814 94.765 -3.371 1.00 92.18 C ATOM 28 O GLU A 289 87.960 94.651 -4.221 1.00 90.38 O ATOM 29 CB GLU A 289 90.268 96.802 -3.545 1.00109.77 C ATOM 30 CG GLU A 289 89.863 97.526 -4.821 1.00115.07 C ATOM 31 CD GLU A 289 90.978 97.536 -5.856 1.00120.98 C ATOM 32 OE1 GLU A 289 90.761 98.035 -6.979 1.00124.65 O ATOM 33 OE2 GLU A 289 92.079 97.036 -5.543 1.00121.62 O ATOM 34 H GLU A 289 90.406 96.396 -1.027 1.00 0.00 H ATOM 35 N VAL A 290 89.494 93.734 -2.901 1.00 86.37 N ATOM 36 CA VAL A 290 89.348 92.384 -3.472 1.00 81.32 C ATOM 37 C VAL A 290 87.986 91.760 -3.200 1.00 75.57 C ATOM 38 O VAL A 290 87.500 90.914 -3.961 1.00 72.24 O ATOM 39 CB VAL A 290 90.419 91.437 -2.930 1.00 80.14 C ATOM 40 CG1 VAL A 290 90.397 90.103 -3.677 1.00 77.85 C ATOM 41 CG2 VAL A 290 91.765 92.082 -3.066 1.00 84.44 C ATOM 42 H VAL A 290 90.150 93.880 -2.107 1.00 0.00 H ATOM 43 N LEU A 291 87.354 92.194 -2.118 1.00 74.41 N ATOM 44 CA LEU A 291 86.072 91.615 -1.738 1.00 70.38 C ATOM 45 C LEU A 291 84.910 92.264 -2.481 1.00 73.58 C ATOM 46 O LEU A 291 83.783 91.808 -2.372 1.00 71.81 O ATOM 47 CB LEU A 291 85.860 91.726 -0.226 1.00 66.73 C ATOM 48 CG LEU A 291 87.029 91.177 0.584 1.00 66.23 C ATOM 49 CD1 LEU A 291 86.878 91.547 2.036 1.00 68.71 C ATOM 50 CD2 LEU A 291 87.141 89.674 0.399 1.00 59.66 C ATOM 51 H LEU A 291 87.774 92.949 -1.539 1.00 0.00 H ATOM 52 N PHE A 292 85.176 93.313 -3.251 1.00 79.96 N ATOM 53 CA PHE A 292 84.084 94.023 -3.910 1.00 83.69 C ATOM 54 C PHE A 292 84.356 94.374 -5.373 1.00 88.84 C ATOM 55 O PHE A 292 84.244 95.531 -5.752 1.00 91.49 O ATOM 56 CB PHE A 292 83.768 95.309 -3.140 1.00 86.63 C ATOM 57 CG PHE A 292 83.510 95.098 -1.681 1.00 84.66 C ATOM 58 CD1 PHE A 292 82.253 94.730 -1.234 1.00 81.42 C ATOM 59 CD2 PHE A 292 84.518 95.285 -0.750 1.00 85.69 C ATOM 60 CE1 PHE A 292 82.012 94.538 0.103 1.00 78.60 C ATOM 61 CE2 PHE A 292 84.279 95.089 0.590 1.00 82.98 C ATOM 62 CZ PHE A 292 83.025 94.713 1.012 1.00 80.20 C ATOM 63 H PHE A 292 86.158 93.627 -3.384 1.00 0.00 H ATOM 64 N GLN A 293 84.680 93.382 -6.196 1.00 93.32 N ATOM 65 CA GLN A 293 85.130 93.644 -7.569 1.00100.31 C ATOM 66 C GLN A 293 84.302 92.908 -8.634 1.00100.29 C ATOM 67 O GLN A 293 84.004 93.439 -9.709 1.00107.81 O ATOM 68 CB GLN A 293 86.605 93.264 -7.714 1.00102.60 C ATOM 69 CG GLN A 293 87.553 94.127 -6.899 1.00108.35 C ATOM 70 CD GLN A 293 88.995 93.677 -7.010 1.00113.35 C ATOM 71 OE1 GLN A 293 89.267 92.509 -7.293 1.00111.84 O ATOM 72 NE2 GLN A 293 89.924 94.602 -6.790 1.00119.10 N ATOM 73 HE22 GLN A 293 89.643 95.575 -6.554 1.00 0.00 H ATOM 74 HE21 GLN A 293 90.932 94.353 -6.854 1.00 0.00 H ATOM 75 H GLN A 293 84.613 92.400 -5.861 1.00 0.00 H ATOM 76 N GLY A 294 83.949 91.677 -8.313 1.00 93.54 N ATOM 77 CA GLY A 294 83.218 90.778 -9.179 1.00 87.59 C ATOM 78 C GLY A 294 81.760 91.108 -9.384 1.00 79.47 C ATOM 79 O GLY A 294 81.327 92.226 -9.127 1.00 76.15 O ATOM 80 H GLY A 294 84.216 91.329 -7.370 1.00 0.00 H ATOM 81 N PRO A 295 81.029 90.173 -10.004 1.00 75.75 N ATOM 82 CA PRO A 295 79.611 90.368 -10.304 1.00 75.82 C ATOM 83 C PRO A 295 78.894 90.544 -8.962 1.00 77.63 C ATOM 84 O PRO A 295 77.997 91.389 -8.826 1.00 79.98 O ATOM 85 CB PRO A 295 79.203 89.062 -10.977 1.00 72.00 C ATOM 86 CG PRO A 295 80.499 88.476 -11.502 1.00 72.44 C ATOM 87 CD PRO A 295 81.566 88.922 -10.575 1.00 72.72 C ATOM 88 N GLY A 296 79.323 89.768 -7.964 1.00 72.66 N ATOM 89 CA GLY A 296 78.586 89.636 -6.729 1.00 70.09 C ATOM 90 C GLY A 296 78.629 90.933 -5.933 1.00 73.04 C ATOM 91 O GLY A 296 77.898 91.094 -4.965 1.00 70.55 O ATOM 92 H GLY A 296 80.214 89.243 -8.079 1.00 0.00 H ATOM 93 N ALA A 297 79.450 91.882 -6.377 1.00 49.18 N ATOM 94 CA ALA A 297 79.811 93.061 -5.596 1.00 53.10 C ATOM 95 C ALA A 297 78.655 93.953 -5.115 1.00 62.61 C ATOM 96 O ALA A 297 78.728 94.478 -4.014 1.00 70.80 O ATOM 97 CB ALA A 297 80.792 93.917 -6.403 1.00 50.32 C ATOM 98 H ALA A 297 79.855 91.778 -7.329 1.00 0.00 H ATOM 99 N LYS A 298 77.601 94.112 -5.906 1.00 62.74 N ATOM 100 CA LYS A 298 76.434 94.927 -5.522 1.00 65.37 C ATOM 101 C LYS A 298 75.759 94.414 -4.254 1.00 65.35 C ATOM 102 O LYS A 298 75.565 95.167 -3.301 1.00 69.78 O ATOM 103 CB LYS A 298 75.420 95.076 -6.658 1.00 63.98 C ATOM 104 CG LYS A 298 75.850 96.188 -7.626 1.00 75.35 C ATOM 105 CD LYS A 298 74.707 96.941 -8.322 1.00 80.92 C ATOM 106 CE LYS A 298 75.221 97.704 -9.574 1.00 79.66 C ATOM 107 NZ LYS A 298 76.069 98.919 -9.348 1.00 85.60 N ATOM 108 HZ1 LYS A 298 75.529 99.620 -8.802 1.00 0.00 H ATOM 109 HZ2 LYS A 298 76.924 98.650 -8.820 1.00 0.00 H ATOM 110 HZ3 LYS A 298 76.340 99.327 -10.266 1.00 0.00 H ATOM 111 H LYS A 298 77.598 93.643 -6.834 1.00 0.00 H ATOM 112 N LYS A 299 75.422 93.141 -4.264 1.00 60.18 N ATOM 113 CA LYS A 299 74.779 92.531 -3.141 1.00 59.49 C ATOM 114 C LYS A 299 75.734 92.503 -1.998 1.00 62.00 C ATOM 115 O LYS A 299 75.332 92.641 -0.865 1.00 65.06 O ATOM 116 CB LYS A 299 74.344 91.119 -3.472 1.00 52.17 C ATOM 117 CG LYS A 299 73.748 90.389 -2.305 1.00 44.83 C ATOM 118 CD LYS A 299 73.358 88.998 -2.692 1.00 43.03 C ATOM 119 CE LYS A 299 72.590 88.313 -1.600 1.00 46.86 C ATOM 120 NZ LYS A 299 72.334 86.922 -1.989 1.00 48.12 N ATOM 121 HZ1 LYS A 299 71.780 86.906 -2.869 1.00 0.00 H ATOM 122 HZ2 LYS A 299 73.240 86.433 -2.139 1.00 0.00 H ATOM 123 HZ3 LYS A 299 71.802 86.444 -1.234 1.00 0.00 H ATOM 124 H LYS A 299 75.628 92.567 -5.106 1.00 0.00 H ATOM 125 N ARG A 300 77.002 92.319 -2.296 1.00 60.20 N ATOM 126 CA ARG A 300 77.962 92.202 -1.243 1.00 62.64 C ATOM 127 C ARG A 300 77.959 93.503 -0.512 1.00 68.38 C ATOM 128 O ARG A 300 77.942 93.535 0.692 1.00 74.89 O ATOM 129 CB ARG A 300 79.333 91.871 -1.762 1.00 65.13 C ATOM 130 CG ARG A 300 80.125 91.024 -0.813 1.00 66.26 C ATOM 131 CD ARG A 300 81.279 90.394 -1.537 1.00 66.94 C ATOM 132 NE ARG A 300 80.828 89.446 -2.529 1.00 63.42 N ATOM 133 CZ ARG A 300 81.262 89.429 -3.767 1.00 58.88 C ATOM 134 NH1 ARG A 300 82.144 90.305 -4.150 1.00 61.73 N ATOM 135 NH2 ARG A 300 80.821 88.540 -4.610 1.00 49.09 N ATOM 136 HE ARG A 300 80.120 88.738 -2.246 1.00 0.00 H ATOM 137 HH12 ARG A 300 82.493 90.298 -5.130 1.00 0.00 H ATOM 138 HH11 ARG A 300 82.500 91.013 -3.476 1.00 0.00 H ATOM 139 HH22 ARG A 300 81.170 88.534 -5.590 1.00 0.00 H ATOM 140 HH21 ARG A 300 80.119 87.836 -4.304 1.00 0.00 H ATOM 141 H ARG A 300 77.304 92.259 -3.289 1.00 0.00 H ATOM 142 N LYS A 301 77.969 94.588 -1.254 1.00 67.44 N ATOM 143 CA LYS A 301 77.980 95.918 -0.645 1.00 73.00 C ATOM 144 C LYS A 301 76.744 96.484 0.045 1.00 75.95 C ATOM 145 O LYS A 301 76.909 97.141 1.067 1.00 83.15 O ATOM 146 CB LYS A 301 78.388 96.981 -1.669 1.00 77.99 C ATOM 147 CG LYS A 301 79.756 96.815 -2.254 1.00 80.85 C ATOM 148 CD LYS A 301 80.127 98.039 -3.074 1.00 89.22 C ATOM 149 CE LYS A 301 81.618 98.304 -3.000 1.00 95.40 C ATOM 150 NZ LYS A 301 82.118 99.242 -4.067 1.00101.34 N ATOM 151 HZ1 LYS A 301 81.920 98.836 -5.004 1.00 0.00 H ATOM 152 HZ2 LYS A 301 81.634 100.158 -3.976 1.00 0.00 H ATOM 153 HZ3 LYS A 301 83.143 99.377 -3.955 1.00 0.00 H ATOM 154 H LYS A 301 77.969 94.499 -2.290 1.00 0.00 H ATOM 155 N MET A 302 75.525 96.244 -0.435 1.00 71.84 N ATOM 156 CA MET A 302 74.382 96.663 0.385 1.00 74.73 C ATOM 157 C MET A 302 74.343 95.976 1.739 1.00 69.67 C ATOM 158 O MET A 302 74.125 96.609 2.743 1.00 73.59 O ATOM 159 CB MET A 302 73.045 96.477 -0.353 1.00 73.90 C ATOM 160 CG MET A 302 72.697 95.084 -0.816 1.00 67.65 C ATOM 161 SD MET A 302 71.039 95.054 -1.535 1.00126.96 S ATOM 162 CE MET A 302 70.062 95.770 -0.211 1.00 74.51 C ATOM 163 H MET A 302 75.388 95.778 -1.355 1.00 0.00 H ATOM 164 N TYR A 303 74.508 94.671 1.735 1.00 64.29 N ATOM 165 CA TYR A 303 74.639 93.828 2.928 1.00 64.85 C ATOM 166 C TYR A 303 75.793 94.160 3.910 1.00 89.84 C ATOM 167 O TYR A 303 75.587 94.074 5.105 1.00 92.86 O ATOM 168 CB TYR A 303 74.580 92.376 2.496 1.00 59.09 C ATOM 169 CG TYR A 303 73.121 92.075 2.163 1.00 57.61 C ATOM 170 CD1 TYR A 303 72.091 92.833 2.749 1.00 60.60 C ATOM 171 CD2 TYR A 303 72.772 91.156 1.158 1.00 50.60 C ATOM 172 CE1 TYR A 303 70.756 92.632 2.401 1.00 58.88 C ATOM 173 CE2 TYR A 303 71.435 90.931 0.819 1.00 48.18 C ATOM 174 CZ TYR A 303 70.438 91.678 1.427 1.00 56.54 C ATOM 175 OH TYR A 303 69.123 91.428 1.078 1.00 57.96 O ATOM 176 HH TYR A 303 68.900 90.487 1.289 1.00 0.00 H ATOM 177 H TYR A 303 74.549 94.198 0.810 1.00 0.00 H ATOM 178 N GLU A 304 77.000 94.479 3.439 1.00 91.20 N ATOM 179 CA GLU A 304 78.105 94.776 4.368 1.00 95.42 C ATOM 180 C GLU A 304 78.010 95.923 5.384 1.00104.33 C ATOM 181 O GLU A 304 78.498 95.734 6.497 1.00104.60 O ATOM 182 CB GLU A 304 79.343 95.074 3.513 1.00 96.63 C ATOM 183 CG GLU A 304 80.556 95.600 4.274 1.00102.49 C ATOM 184 CD GLU A 304 81.256 96.731 3.507 1.00108.03 C ATOM 185 OE1 GLU A 304 80.709 97.162 2.460 1.00106.70 O ATOM 186 OE2 GLU A 304 82.327 97.204 3.962 1.00113.70 O ATOM 187 H GLU A 304 77.162 94.518 2.412 1.00 0.00 H ATOM 188 N ASP A 305 77.461 97.091 5.057 1.00113.30 N ATOM 189 CA ASP A 305 77.234 98.107 6.105 1.00124.15 C ATOM 190 C ASP A 305 76.325 97.452 7.157 1.00120.59 C ATOM 191 O ASP A 305 76.565 97.568 8.359 1.00124.68 O ATOM 192 CB ASP A 305 76.707 99.475 5.630 1.00134.30 C ATOM 193 CG ASP A 305 75.530 99.382 4.729 1.00135.45 C ATOM 194 OD1 ASP A 305 75.476 98.432 3.931 1.00130.98 O ATOM 195 OD2 ASP A 305 74.653 100.268 4.832 1.00140.15 O ATOM 196 H ASP A 305 77.194 97.287 4.071 1.00 0.00 H ATOM 197 N ILE A 306 75.253 96.807 6.699 1.00108.45 N ATOM 198 CA ILE A 306 74.333 96.130 7.613 1.00 99.97 C ATOM 199 C ILE A 306 75.041 95.091 8.478 1.00 90.26 C ATOM 200 O ILE A 306 74.863 95.114 9.690 1.00 94.41 O ATOM 201 CB ILE A 306 73.206 95.422 6.840 1.00 96.02 C ATOM 202 CG1 ILE A 306 72.324 96.452 6.127 1.00 99.47 C ATOM 203 CG2 ILE A 306 72.403 94.536 7.766 1.00 92.90 C ATOM 204 CD1 ILE A 306 71.228 95.847 5.278 1.00 94.89 C ATOM 205 H ILE A 306 75.067 96.784 5.676 1.00 0.00 H ATOM 206 N LEU A 307 75.819 94.183 7.899 1.00 77.66 N ATOM 207 CA LEU A 307 76.422 93.123 8.709 1.00 74.03 C ATOM 208 C LEU A 307 77.394 93.779 9.702 1.00 80.24 C ATOM 209 O LEU A 307 77.681 93.244 10.773 1.00 84.45 O ATOM 210 CB LEU A 307 77.125 92.079 7.838 1.00 70.70 C ATOM 211 CG LEU A 307 76.132 91.330 6.954 1.00 69.28 C ATOM 212 CD1 LEU A 307 76.752 90.149 6.207 1.00 66.65 C ATOM 213 CD2 LEU A 307 75.044 90.808 7.863 1.00 68.14 C ATOM 214 H LEU A 307 75.999 94.225 6.876 1.00 0.00 H ATOM 215 N SER A 308 77.879 94.964 9.339 1.00 81.70 N ATOM 216 CA SER A 308 78.814 95.695 10.168 1.00 86.30 C ATOM 217 C SER A 308 78.155 96.213 11.448 1.00 89.08 C ATOM 218 O SER A 308 78.857 96.721 12.313 1.00 84.95 O ATOM 219 CB SER A 308 79.436 96.857 9.399 1.00 89.74 C ATOM 220 OG SER A 308 78.497 97.899 9.209 1.00 90.81 O ATOM 221 HG SER A 308 77.724 97.555 8.695 1.00 0.00 H ATOM 222 H SER A 308 77.578 95.377 8.433 1.00 0.00 H ATOM 223 N HIS A 309 76.822 96.130 11.552 1.00 85.87 N ATOM 224 CA HIS A 309 76.123 96.613 12.763 1.00 90.47 C ATOM 225 C HIS A 309 75.374 95.500 13.485 1.00 87.67 C ATOM 226 O HIS A 309 74.680 95.752 14.450 1.00 89.54 O ATOM 227 CB HIS A 309 75.078 97.707 12.435 1.00 92.34 C ATOM 228 CG HIS A 309 75.626 98.955 11.798 1.00 99.71 C ATOM 229 ND1 HIS A 309 76.272 99.940 12.521 1.00108.74 N ATOM 230 CD2 HIS A 309 75.611 99.386 10.513 1.00 99.05 C ATOM 231 CE1 HIS A 309 76.629 100.923 11.710 1.00112.37 C ATOM 232 NE2 HIS A 309 76.244 100.608 10.485 1.00107.33 N ATOM 233 H HIS A 309 76.271 95.720 10.771 1.00 0.00 H ATOM 234 N VAL A 310 75.531 94.258 13.037 1.00 83.84 N ATOM 235 CA VAL A 310 74.889 93.141 13.714 1.00 83.08 C ATOM 236 C VAL A 310 76.029 92.886 14.627 1.00 93.50 C ATOM 237 O VAL A 310 77.101 92.515 14.153 1.00 94.64 O ATOM 238 CB VAL A 310 74.536 91.987 12.789 1.00 71.16 C ATOM 239 CG1 VAL A 310 74.033 90.811 13.603 1.00 67.92 C ATOM 240 CG2 VAL A 310 73.466 92.442 11.840 1.00 65.88 C ATOM 241 H VAL A 310 76.117 94.083 12.196 1.00 0.00 H ATOM 242 N ASN A 311 75.839 93.048 15.925 1.00104.03 N ATOM 243 CA ASN A 311 77.024 92.988 16.751 1.00112.35 C ATOM 244 C ASN A 311 77.832 91.700 16.681 1.00111.73 C ATOM 245 O ASN A 311 79.034 91.780 16.454 1.00118.78 O ATOM 246 CB ASN A 311 76.688 93.367 18.219 1.00123.26 C ATOM 247 CG ASN A 311 75.653 92.470 18.857 1.00121.80 C ATOM 248 OD1 ASN A 311 75.866 91.273 19.034 1.00119.42 O ATOM 249 ND2 ASN A 311 74.520 93.057 19.225 1.00123.14 N ATOM 250 HD22 ASN A 311 74.382 94.074 19.056 1.00 0.00 H ATOM 251 HD21 ASN A 311 73.770 92.500 19.683 1.00 0.00 H ATOM 252 H ASN A 311 74.894 93.209 16.328 1.00 0.00 H ATOM 253 N ILE A 312 77.251 90.526 16.850 1.00102.87 N ATOM 254 CA ILE A 312 78.169 89.411 16.831 1.00 97.03 C ATOM 255 C ILE A 312 78.831 89.114 15.469 1.00 88.26 C ATOM 256 O ILE A 312 79.933 88.539 15.455 1.00 85.58 O ATOM 257 CB ILE A 312 77.500 88.144 17.359 1.00 97.50 C ATOM 258 CG1 ILE A 312 78.549 87.172 17.880 1.00 99.64 C ATOM 259 CG2 ILE A 312 76.420 87.658 16.438 1.00 91.35 C ATOM 260 CD1 ILE A 312 79.408 87.861 18.885 1.00103.04 C ATOM 261 H ILE A 312 76.226 90.415 16.985 1.00 0.00 H ATOM 262 N LEU A 313 78.276 89.575 14.334 1.00 80.98 N ATOM 263 CA LEU A 313 79.030 89.264 13.140 1.00 73.56 C ATOM 264 C LEU A 313 79.822 90.448 12.629 1.00 73.82 C ATOM 265 O LEU A 313 80.521 90.326 11.641 1.00 72.17 O ATOM 266 CB LEU A 313 78.064 88.813 12.032 1.00 66.15 C ATOM 267 CG LEU A 313 77.022 87.685 12.125 1.00 60.18 C ATOM 268 CD1 LEU A 313 75.985 87.986 13.167 1.00 63.15 C ATOM 269 CD2 LEU A 313 76.286 87.600 10.860 1.00 54.47 C ATOM 270 H LEU A 313 77.383 90.108 14.317 1.00 0.00 H ATOM 271 N LYS A 314 79.765 91.572 13.339 1.00 76.28 N ATOM 272 CA LYS A 314 80.425 92.781 12.872 1.00 76.85 C ATOM 273 C LYS A 314 81.925 92.493 13.070 1.00 80.37 C ATOM 274 O LYS A 314 82.822 93.169 12.555 1.00 80.86 O ATOM 275 CB LYS A 314 79.963 94.040 13.625 1.00 78.23 C ATOM 276 CG LYS A 314 80.486 94.146 15.050 1.00 80.56 C ATOM 277 CD LYS A 314 80.051 95.435 15.796 1.00101.67 C ATOM 278 CE LYS A 314 78.580 95.792 15.637 1.00 98.07 C ATOM 279 NZ LYS A 314 78.154 96.776 16.680 1.00100.92 N ATOM 280 HZ1 LYS A 314 78.298 96.363 17.624 1.00 0.00 H ATOM 281 HZ2 LYS A 314 78.721 97.643 16.589 1.00 0.00 H ATOM 282 HZ3 LYS A 314 77.147 97.003 16.550 1.00 0.00 H ATOM 283 H LYS A 314 79.243 91.586 14.238 1.00 0.00 H ATOM 284 N ASP A 315 82.114 91.553 14.002 1.00 83.83 N ATOM 285 CA ASP A 315 83.374 90.989 14.518 1.00 88.73 C ATOM 286 C ASP A 315 84.053 89.830 13.776 1.00 83.49 C ATOM 287 O ASP A 315 85.196 89.478 14.056 1.00 85.88 O ATOM 288 CB ASP A 315 83.106 90.594 15.964 1.00 94.54 C ATOM 289 CG ASP A 315 83.030 91.804 16.860 1.00102.21 C ATOM 290 OD1 ASP A 315 83.351 92.906 16.351 1.00103.85 O ATOM 291 OD2 ASP A 315 82.607 91.671 18.034 1.00107.12 O ATOM 292 H ASP A 315 81.247 91.164 14.424 1.00 0.00 H ATOM 293 N MET A 316 83.350 89.287 12.804 1.00 80.27 N ATOM 294 CA MET A 316 83.844 88.269 11.882 1.00 78.90 C ATOM 295 C MET A 316 84.848 89.035 11.055 1.00 76.14 C ATOM 296 O MET A 316 84.693 90.245 10.927 1.00 76.10 O ATOM 297 CB MET A 316 82.712 87.689 11.087 1.00 75.06 C ATOM 298 CG MET A 316 81.835 86.781 11.920 1.00 72.69 C ATOM 299 SD MET A 316 80.612 86.003 10.857 1.00 86.36 S ATOM 300 CE MET A 316 81.648 84.964 9.843 1.00 76.98 C ATOM 301 H MET A 316 82.368 89.608 12.684 1.00 0.00 H ATOM 302 N ASP A 317 85.829 88.404 10.415 1.00 87.24 N ATOM 303 CA ASP A 317 86.627 89.303 9.592 1.00 90.39 C ATOM 304 C ASP A 317 85.976 89.461 8.242 1.00 85.42 C ATOM 305 O ASP A 317 84.987 88.795 7.968 1.00 73.49 O ATOM 306 CB ASP A 317 88.074 88.782 9.462 1.00100.03 C ATOM 307 CG ASP A 317 88.183 87.563 8.573 1.00105.59 C ATOM 308 OD1 ASP A 317 87.172 86.857 8.435 1.00106.21 O ATOM 309 OD2 ASP A 317 89.257 87.341 7.963 1.00109.52 O ATOM 310 H ASP A 317 86.006 87.382 10.494 1.00 0.00 H ATOM 311 N PRO A 318 86.507 90.281 7.391 1.00 56.65 N ATOM 312 CA PRO A 318 85.801 90.643 6.178 1.00 56.64 C ATOM 313 C PRO A 318 85.507 89.499 5.220 1.00 55.55 C ATOM 314 O PRO A 318 84.446 89.454 4.659 1.00 53.29 O ATOM 315 CB PRO A 318 86.732 91.653 5.541 1.00 61.17 C ATOM 316 CG PRO A 318 87.553 92.166 6.648 1.00 62.92 C ATOM 317 CD PRO A 318 87.752 91.018 7.555 1.00 61.84 C ATOM 318 N TYR A 319 86.437 88.602 5.002 1.00 59.27 N ATOM 319 CA TYR A 319 86.203 87.553 4.032 1.00 60.21 C ATOM 320 C TYR A 319 85.046 86.707 4.470 1.00 59.20 C ATOM 321 O TYR A 319 84.108 86.476 3.720 1.00 58.94 O ATOM 322 CB TYR A 319 87.427 86.668 3.891 1.00 64.53 C ATOM 323 CG TYR A 319 87.258 85.530 2.925 1.00 66.96 C ATOM 324 CD1 TYR A 319 87.122 85.755 1.559 1.00 67.52 C ATOM 325 CD2 TYR A 319 87.168 84.228 3.384 1.00 67.03 C ATOM 326 CE1 TYR A 319 86.950 84.702 0.665 1.00 66.40 C ATOM 327 CE2 TYR A 319 86.993 83.174 2.511 1.00 67.27 C ATOM 328 CZ TYR A 319 86.886 83.413 1.149 1.00 65.59 C ATOM 329 OH TYR A 319 86.713 82.352 0.285 1.00 60.76 O ATOM 330 HH TYR A 319 86.655 82.690 -0.644 1.00 0.00 H ATOM 331 H TYR A 319 87.337 88.643 5.522 1.00 0.00 H ATOM 332 N GLU A 320 85.068 86.360 5.744 1.00 59.41 N ATOM 333 CA GLU A 320 84.033 85.539 6.309 1.00 60.01 C ATOM 334 C GLU A 320 82.707 86.255 6.231 1.00 53.98 C ATOM 335 O GLU A 320 81.690 85.660 5.931 1.00 54.69 O ATOM 336 CB GLU A 320 84.386 85.240 7.763 1.00 71.38 C ATOM 337 CG GLU A 320 85.630 84.384 7.994 1.00 83.07 C ATOM 338 CD GLU A 320 85.479 82.942 7.577 1.00 91.57 C ATOM 339 OE1 GLU A 320 84.351 82.416 7.661 1.00 91.79 O ATOM 340 OE2 GLU A 320 86.519 82.329 7.219 1.00 98.48 O ATOM 341 H GLU A 320 85.848 86.687 6.349 1.00 0.00 H ATOM 342 N ARG A 321 82.715 87.549 6.507 1.00 53.36 N ATOM 343 CA ARG A 321 81.487 88.328 6.451 1.00 50.34 C ATOM 344 C ARG A 321 80.969 88.563 5.006 1.00 48.26 C ATOM 345 O ARG A 321 79.753 88.539 4.757 1.00 45.15 O ATOM 346 CB ARG A 321 81.740 89.614 7.275 1.00 50.23 C ATOM 347 CG ARG A 321 80.493 90.316 7.775 1.00 51.60 C ATOM 348 CD ARG A 321 80.670 91.740 8.444 1.00 59.39 C ATOM 349 NE ARG A 321 81.689 92.685 7.979 1.00 62.55 N ATOM 350 CZ ARG A 321 82.930 92.734 8.465 1.00 66.94 C ATOM 351 NH1 ARG A 321 83.296 91.895 9.423 1.00 68.84 N ATOM 352 NH2 ARG A 321 83.806 93.614 8.000 1.00 68.61 N ATOM 353 HE ARG A 321 81.430 93.355 7.227 1.00 0.00 H ATOM 354 HH12 ARG A 321 84.263 91.931 9.804 1.00 0.00 H ATOM 355 HH11 ARG A 321 82.616 91.201 9.794 1.00 0.00 H ATOM 356 HH22 ARG A 321 84.771 93.642 8.388 1.00 0.00 H ATOM 357 HH21 ARG A 321 83.528 94.276 7.248 1.00 0.00 H ATOM 358 H ARG A 321 83.608 88.014 6.767 1.00 0.00 H ATOM 359 N CYS A 322 81.857 88.715 4.054 1.00 49.88 N ATOM 360 CA CYS A 322 81.415 88.822 2.686 1.00 47.83 C ATOM 361 C CYS A 322 80.741 87.557 2.195 1.00 40.81 C ATOM 362 O CYS A 322 79.819 87.611 1.447 1.00 39.05 O ATOM 363 CB CYS A 322 82.572 89.182 1.789 1.00 49.27 C ATOM 364 SG CYS A 322 83.066 90.876 1.960 1.00 61.48 S ATOM 365 H CYS A 322 82.871 88.758 4.283 1.00 0.00 H ATOM 366 N LYS A 323 81.217 86.412 2.618 1.00 41.33 N ATOM 367 CA LYS A 323 80.572 85.153 2.264 1.00 44.57 C ATOM 368 C LYS A 323 79.139 85.122 2.803 1.00 51.77 C ATOM 369 O LYS A 323 78.217 84.678 2.102 1.00 56.71 O ATOM 370 CB LYS A 323 81.376 83.960 2.783 1.00 45.90 C ATOM 371 CG LYS A 323 82.735 83.792 2.146 1.00 48.41 C ATOM 372 CD LYS A 323 83.432 82.538 2.667 1.00 49.59 C ATOM 373 CE LYS A 323 82.621 81.304 2.340 1.00 49.81 C ATOM 374 NZ LYS A 323 83.276 80.057 2.860 1.00 50.80 N ATOM 375 HZ1 LYS A 323 84.217 79.955 2.429 1.00 0.00 H ATOM 376 HZ2 LYS A 323 83.372 80.123 3.893 1.00 0.00 H ATOM 377 HZ3 LYS A 323 82.691 79.232 2.617 1.00 0.00 H ATOM 378 H LYS A 323 82.068 86.401 3.216 1.00 0.00 H ATOM 379 N VAL A 324 78.926 85.611 4.028 1.00 49.27 N ATOM 380 CA VAL A 324 77.567 85.680 4.555 1.00 43.87 C ATOM 381 C VAL A 324 76.747 86.592 3.690 1.00 41.69 C ATOM 382 O VAL A 324 75.608 86.253 3.345 1.00 43.19 O ATOM 383 CB VAL A 324 77.508 86.150 6.004 1.00 43.26 C ATOM 384 CG1 VAL A 324 76.060 86.345 6.442 1.00 40.63 C ATOM 385 CG2 VAL A 324 78.266 85.169 6.900 1.00 42.40 C ATOM 386 H VAL A 324 79.726 85.941 4.604 1.00 0.00 H ATOM 387 N ALA A 325 77.266 87.744 3.342 1.00 40.86 N ATOM 388 CA ALA A 325 76.489 88.650 2.535 1.00 42.32 C ATOM 389 C ALA A 325 76.054 88.001 1.243 1.00 49.16 C ATOM 390 O ALA A 325 74.961 88.219 0.792 1.00 55.33 O ATOM 391 CB ALA A 325 77.261 89.908 2.265 1.00 40.97 C ATOM 392 H ALA A 325 78.227 88.001 3.645 1.00 0.00 H ATOM 393 N ASP A 326 76.899 87.175 0.667 1.00 46.25 N ATOM 394 CA ASP A 326 76.585 86.562 -0.594 1.00 47.02 C ATOM 395 C ASP A 326 75.357 85.697 -0.502 1.00 46.90 C ATOM 396 O ASP A 326 74.580 85.662 -1.415 1.00 44.60 O ATOM 397 CB ASP A 326 77.747 85.721 -1.071 1.00 48.34 C ATOM 398 CG ASP A 326 78.879 86.538 -1.599 1.00 54.80 C ATOM 399 OD1 ASP A 326 78.631 87.496 -2.318 1.00 58.83 O ATOM 400 OD2 ASP A 326 80.029 86.229 -1.309 1.00 57.21 O ATOM 401 H ASP A 326 77.806 86.963 1.130 1.00 0.00 H ATOM 402 N CYS A 327 75.195 84.980 0.594 1.00 42.41 N ATOM 403 CA CYS A 327 74.148 83.995 0.722 1.00 41.29 C ATOM 404 C CYS A 327 72.873 84.451 1.388 1.00 44.94 C ATOM 405 O CYS A 327 71.972 83.686 1.516 1.00 44.52 O ATOM 406 CB CYS A 327 74.679 82.790 1.469 1.00 43.14 C ATOM 407 SG CYS A 327 76.059 81.947 0.699 1.00 58.06 S ATOM 408 H CYS A 327 75.844 85.130 1.393 1.00 0.00 H ATOM 409 N LEU A 328 72.779 85.702 1.787 1.00 49.87 N ATOM 410 CA LEU A 328 71.602 86.170 2.510 1.00 51.05 C ATOM 411 C LEU A 328 70.455 86.184 1.523 1.00 51.69 C ATOM 412 O LEU A 328 70.656 86.480 0.376 1.00 57.31 O ATOM 413 CB LEU A 328 71.811 87.564 3.110 1.00 50.66 C ATOM 414 CG LEU A 328 72.805 87.701 4.274 1.00 49.56 C ATOM 415 CD1 LEU A 328 73.005 89.174 4.563 1.00 52.22 C ATOM 416 CD2 LEU A 328 72.278 86.994 5.528 1.00 46.08 C ATOM 417 H LEU A 328 73.554 86.365 1.584 1.00 0.00 H ATOM 418 N LYS A 329 69.243 85.991 2.018 1.00 52.00 N ATOM 419 CA LYS A 329 68.030 86.188 1.249 1.00 52.70 C ATOM 420 C LYS A 329 67.170 87.154 2.066 1.00 56.31 C ATOM 421 O LYS A 329 67.426 87.364 3.260 1.00 58.61 O ATOM 422 CB LYS A 329 67.309 84.859 1.034 1.00 51.67 C ATOM 423 CG LYS A 329 68.074 83.887 0.175 1.00 48.41 C ATOM 424 CD LYS A 329 67.400 82.512 0.090 1.00 50.44 C ATOM 425 CE LYS A 329 68.199 81.522 -0.770 1.00 52.80 C ATOM 426 NZ LYS A 329 68.095 81.920 -2.252 1.00 62.25 N ATOM 427 HZ1 LYS A 329 67.097 81.904 -2.545 1.00 0.00 H ATOM 428 HZ2 LYS A 329 68.480 82.878 -2.380 1.00 0.00 H ATOM 429 HZ3 LYS A 329 68.638 81.246 -2.829 1.00 0.00 H ATOM 430 H LYS A 329 69.156 85.683 3.008 1.00 0.00 H ATOM 431 N SER A 330 66.187 87.763 1.412 1.00 57.10 N ATOM 432 CA SER A 330 65.304 88.763 1.989 1.00 63.07 C ATOM 433 C SER A 330 63.911 88.212 1.947 1.00 68.05 C ATOM 434 O SER A 330 63.517 87.498 1.011 1.00 69.52 O ATOM 435 CB SER A 330 65.390 90.094 1.260 1.00 72.48 C ATOM 436 OG SER A 330 66.713 90.592 1.319 1.00 76.00 O ATOM 437 HG SER A 330 67.327 89.945 0.891 1.00 0.00 H ATOM 438 H SER A 330 66.039 87.506 0.415 1.00 0.00 H ATOM 439 N LYS A 331 63.175 88.616 2.971 1.00 71.11 N ATOM 440 CA LYS A 331 61.749 88.475 3.099 1.00 75.52 C ATOM 441 C LYS A 331 61.158 89.513 4.060 1.00 71.71 C ATOM 442 O LYS A 331 61.880 90.213 4.779 1.00 68.46 O ATOM 443 CB LYS A 331 61.543 87.087 3.719 1.00 81.46 C ATOM 444 CG LYS A 331 60.190 86.465 3.818 1.00 92.07 C ATOM 445 CD LYS A 331 60.388 85.077 4.455 1.00 94.38 C ATOM 446 CE LYS A 331 59.078 84.451 4.901 1.00102.55 C ATOM 447 NZ LYS A 331 58.367 83.855 3.714 1.00111.79 N ATOM 448 HZ1 LYS A 331 58.172 84.602 3.017 1.00 0.00 H ATOM 449 HZ2 LYS A 331 58.968 83.125 3.282 1.00 0.00 H ATOM 450 HZ3 LYS A 331 57.471 83.428 4.026 1.00 0.00 H ATOM 451 H LYS A 331 63.675 89.079 3.757 1.00 0.00 H ATOM 452 N SER A 332 59.841 89.644 4.028 1.00 67.45 N ATOM 453 CA SER A 332 59.143 90.642 4.813 1.00 63.68 C ATOM 454 C SER A 332 58.052 90.011 5.677 1.00 66.55 C ATOM 455 O SER A 332 57.626 88.890 5.400 1.00 71.98 O ATOM 456 CB SER A 332 58.501 91.693 3.917 1.00 65.41 C ATOM 457 OG SER A 332 57.450 91.106 3.158 1.00 69.49 O ATOM 458 HG SER A 332 57.038 91.795 2.579 1.00 0.00 H ATOM 459 H SER A 332 59.288 89.008 3.418 1.00 0.00 H ATOM 460 N TYR A 333 57.678 90.673 6.772 1.00 62.12 N ATOM 461 CA TYR A 333 56.570 90.200 7.614 1.00 59.77 C ATOM 462 C TYR A 333 55.645 91.373 7.849 1.00 62.84 C ATOM 463 O TYR A 333 56.095 92.487 8.075 1.00 65.83 O ATOM 464 CB TYR A 333 57.009 89.542 8.891 1.00 54.71 C ATOM 465 CG TYR A 333 57.760 88.275 8.675 1.00 51.97 C ATOM 466 CD1 TYR A 333 57.108 87.046 8.682 1.00 54.28 C ATOM 467 CD2 TYR A 333 59.112 88.299 8.478 1.00 47.75 C ATOM 468 CE1 TYR A 333 57.809 85.868 8.492 1.00 52.37 C ATOM 469 CE2 TYR A 333 59.825 87.141 8.260 1.00 50.11 C ATOM 470 CZ TYR A 333 59.172 85.926 8.260 1.00 51.14 C ATOM 471 OH TYR A 333 59.954 84.820 8.062 1.00 46.28 O ATOM 472 HH TYR A 333 59.387 84.009 8.081 1.00 0.00 H ATOM 473 H TYR A 333 58.182 91.544 7.036 1.00 0.00 H ATOM 474 N ASN A 334 54.348 91.110 7.847 1.00 58.99 N ATOM 475 CA ASN A 334 53.375 92.143 8.182 1.00 74.75 C ATOM 476 C ASN A 334 53.194 92.253 9.701 1.00 72.20 C ATOM 477 O ASN A 334 53.542 91.334 10.463 1.00 68.23 O ATOM 478 CB ASN A 334 52.024 91.873 7.500 1.00 78.19 C ATOM 479 CG ASN A 334 52.134 91.753 5.957 1.00 78.41 C ATOM 480 OD1 ASN A 334 51.467 90.913 5.353 1.00 75.63 O ATOM 481 ND2 ASN A 334 52.961 92.599 5.333 1.00 71.79 N ATOM 482 HD22 ASN A 334 53.506 93.294 5.883 1.00 0.00 H ATOM 483 HD21 ASN A 334 53.059 92.562 4.298 1.00 0.00 H ATOM 484 H ASN A 334 54.018 90.154 7.603 1.00 0.00 H ATOM 485 N ASP A 335 52.708 93.418 10.120 1.00 72.03 N ATOM 486 CA ASP A 335 52.353 93.679 11.492 1.00 66.65 C ATOM 487 C ASP A 335 51.555 92.507 12.052 1.00 70.13 C ATOM 488 O ASP A 335 50.533 92.127 11.500 1.00 76.14 O ATOM 489 CB ASP A 335 51.563 94.992 11.549 1.00 67.72 C ATOM 490 CG ASP A 335 51.191 95.418 12.982 1.00 66.70 C ATOM 491 OD1 ASP A 335 51.837 94.965 13.960 1.00 60.78 O ATOM 492 OD2 ASP A 335 50.291 96.268 13.104 1.00 69.95 O ATOM 493 H ASP A 335 52.578 94.178 9.423 1.00 0.00 H ATOM 494 N GLY A 336 51.988 91.954 13.178 1.00 66.49 N ATOM 495 CA GLY A 336 51.231 90.866 13.757 1.00 69.56 C ATOM 496 C GLY A 336 51.613 89.470 13.296 1.00 70.67 C ATOM 497 O GLY A 336 51.168 88.497 13.885 1.00 72.10 O ATOM 498 H GLY A 336 52.856 92.297 13.636 1.00 0.00 H ATOM 499 N GLU A 337 52.398 89.333 12.234 1.00 70.90 N ATOM 500 CA GLU A 337 52.744 87.985 11.786 1.00 70.16 C ATOM 501 C GLU A 337 53.772 87.278 12.681 1.00 64.68 C ATOM 502 O GLU A 337 54.707 87.895 13.202 1.00 60.50 O ATOM 503 CB GLU A 337 53.320 87.988 10.377 1.00 69.73 C ATOM 504 CG GLU A 337 52.305 88.227 9.261 1.00 81.08 C ATOM 505 CD GLU A 337 52.938 88.247 7.869 1.00 84.83 C ATOM 506 OE1 GLU A 337 54.181 88.225 7.759 1.00 79.81 O ATOM 507 OE2 GLU A 337 52.183 88.305 6.878 1.00 95.02 O ATOM 508 H GLU A 337 52.760 90.168 11.731 1.00 0.00 H ATOM 509 N ILE A 338 53.595 85.967 12.813 1.00 63.39 N ATOM 510 CA ILE A 338 54.527 85.152 13.553 1.00 60.50 C ATOM 511 C ILE A 338 55.731 84.802 12.667 1.00 60.67 C ATOM 512 O ILE A 338 55.606 84.364 11.513 1.00 66.68 O ATOM 513 CB ILE A 338 53.882 83.872 14.091 1.00 63.67 C ATOM 514 CG1 ILE A 338 52.863 84.232 15.188 1.00 60.69 C ATOM 515 CG2 ILE A 338 54.905 83.038 14.820 1.00 63.72 C ATOM 516 CD1 ILE A 338 51.988 83.081 15.603 1.00 61.54 C ATOM 517 H ILE A 338 52.766 85.519 12.373 1.00 0.00 H ATOM 518 N ILE A 339 56.898 85.158 13.168 1.00 55.95 N ATOM 519 CA ILE A 339 58.145 84.863 12.512 1.00 54.00 C ATOM 520 C ILE A 339 58.680 83.521 12.944 1.00 58.81 C ATOM 521 O ILE A 339 59.129 82.717 12.154 1.00 62.66 O ATOM 522 CB ILE A 339 59.172 85.925 12.788 1.00 50.35 C ATOM 523 CG1 ILE A 339 58.672 87.248 12.203 1.00 52.84 C ATOM 524 CG2 ILE A 339 60.484 85.554 12.092 1.00 50.23 C ATOM 525 CD1 ILE A 339 59.562 88.419 12.456 1.00 52.10 C ATOM 526 H ILE A 339 56.918 85.672 14.072 1.00 0.00 H ATOM 527 N ILE A 340 58.606 83.268 14.234 1.00 62.02 N ATOM 528 CA ILE A 340 59.031 82.000 14.787 1.00 61.55 C ATOM 529 C ILE A 340 57.956 81.569 15.750 1.00 65.66 C ATOM 530 O ILE A 340 57.520 82.377 16.579 1.00 65.08 O ATOM 531 CB ILE A 340 60.407 82.135 15.473 1.00 56.01 C ATOM 532 CG1 ILE A 340 61.503 82.251 14.418 1.00 54.44 C ATOM 533 CG2 ILE A 340 60.682 80.965 16.437 1.00 56.22 C ATOM 534 CD1 ILE A 340 62.878 82.529 14.981 1.00 50.99 C ATOM 535 H ILE A 340 58.232 83.999 14.873 1.00 0.00 H ATOM 536 N LYS A 341 57.544 80.307 15.654 1.00 69.61 N ATOM 537 CA LYS A 341 56.540 79.788 16.561 1.00 74.60 C ATOM 538 C LYS A 341 57.236 78.825 17.481 1.00 74.08 C ATOM 539 O LYS A 341 57.901 77.887 17.028 1.00 71.89 O ATOM 540 CB LYS A 341 55.429 79.033 15.823 1.00 81.46 C ATOM 541 CG LYS A 341 54.347 78.523 16.758 1.00 87.32 C ATOM 542 CD LYS A 341 53.113 77.990 16.003 1.00 94.78 C ATOM 543 CE LYS A 341 53.272 76.490 15.738 1.00100.26 C ATOM 544 NZ LYS A 341 52.183 75.823 14.976 1.00107.27 N ATOM 545 HZ1 LYS A 341 51.287 75.924 15.494 1.00 0.00 H ATOM 546 HZ2 LYS A 341 52.095 76.266 14.039 1.00 0.00 H ATOM 547 HZ3 LYS A 341 52.408 74.814 14.863 1.00 0.00 H ATOM 548 H LYS A 341 57.946 79.688 14.922 1.00 0.00 H ATOM 549 N GLU A 342 57.045 79.067 18.776 1.00 75.98 N ATOM 550 CA GLU A 342 57.641 78.289 19.844 1.00 77.48 C ATOM 551 C GLU A 342 57.239 76.840 19.682 1.00 80.75 C ATOM 552 O GLU A 342 56.082 76.544 19.387 1.00 81.17 O ATOM 553 CB GLU A 342 57.180 78.883 21.175 1.00 82.79 C ATOM 554 CG GLU A 342 57.687 78.300 22.473 1.00 88.06 C ATOM 555 CD GLU A 342 56.960 78.955 23.666 1.00 93.00 C ATOM 556 OE1 GLU A 342 56.955 78.394 24.802 1.00 98.23 O ATOM 557 OE2 GLU A 342 56.400 80.060 23.444 1.00 90.22 O ATOM 558 H GLU A 342 56.430 79.864 19.038 1.00 0.00 H ATOM 559 N GLY A 343 58.186 75.929 19.868 1.00 84.46 N ATOM 560 CA GLY A 343 57.878 74.510 19.776 1.00 93.23 C ATOM 561 C GLY A 343 58.054 73.878 18.402 1.00 93.64 C ATOM 562 O GLY A 343 58.077 72.656 18.275 1.00 97.39 O ATOM 563 H GLY A 343 59.158 76.232 20.082 1.00 0.00 H ATOM 564 N GLU A 344 58.177 74.700 17.366 1.00 90.71 N ATOM 565 CA GLU A 344 58.397 74.182 16.012 1.00 93.40 C ATOM 566 C GLU A 344 59.842 73.866 15.741 1.00 91.91 C ATOM 567 O GLU A 344 60.732 74.398 16.399 1.00 88.29 O ATOM 568 CB GLU A 344 57.911 75.167 14.966 1.00 93.71 C ATOM 569 CG GLU A 344 56.426 75.349 14.915 1.00100.64 C ATOM 570 CD GLU A 344 56.032 76.085 13.666 1.00105.45 C ATOM 571 OE1 GLU A 344 56.944 76.621 12.999 1.00104.23 O ATOM 572 OE2 GLU A 344 54.839 76.082 13.312 1.00111.82 O ATOM 573 H GLU A 344 58.116 75.727 17.518 1.00 0.00 H ATOM 574 N GLU A 345 60.076 73.028 14.738 1.00 95.64 N ATOM 575 CA GLU A 345 61.429 72.810 14.282 1.00 94.98 C ATOM 576 C GLU A 345 61.843 74.100 13.625 1.00 88.55 C ATOM 577 O GLU A 345 61.017 74.803 13.046 1.00 88.10 O ATOM 578 CB GLU A 345 61.503 71.629 13.313 1.00103.29 C ATOM 579 CG GLU A 345 61.227 70.265 13.949 1.00112.55 C ATOM 580 CD GLU A 345 61.998 70.060 15.248 1.00114.48 C ATOM 581 OE1 GLU A 345 63.245 70.027 15.194 1.00113.20 O ATOM 582 OE2 GLU A 345 61.367 69.915 16.320 1.00117.20 O ATOM 583 H GLU A 345 59.286 72.529 14.281 1.00 0.00 H ATOM 584 N GLY A 346 63.123 74.414 13.696 1.00 85.18 N ATOM 585 CA GLY A 346 63.574 75.660 13.127 1.00 82.02 C ATOM 586 C GLY A 346 64.755 75.342 12.272 1.00 82.55 C ATOM 587 O GLY A 346 65.656 74.606 12.686 1.00 83.09 O ATOM 588 H GLY A 346 63.798 73.771 14.157 1.00 0.00 H ATOM 589 N ASP A 347 64.797 75.984 11.114 1.00 81.01 N ATOM 590 CA ASP A 347 65.892 75.782 10.202 1.00 82.02 C ATOM 591 C ASP A 347 66.364 77.100 9.656 1.00 75.55 C ATOM 592 O ASP A 347 67.082 77.132 8.666 1.00 76.26 O ATOM 593 CB ASP A 347 65.455 74.875 9.053 1.00 92.25 C ATOM 594 CG ASP A 347 65.075 73.488 9.528 1.00103.22 C ATOM 595 OD1 ASP A 347 65.788 72.939 10.393 1.00105.38 O ATOM 596 OD2 ASP A 347 64.064 72.944 9.039 1.00110.25 O ATOM 597 H ASP A 347 64.031 76.641 10.861 1.00 0.00 H ATOM 598 N THR A 348 65.948 78.198 10.277 1.00 69.08 N ATOM 599 CA THR A 348 66.239 79.470 9.665 1.00 63.46 C ATOM 600 C THR A 348 66.825 80.426 10.692 1.00 59.65 C ATOM 601 O THR A 348 66.263 80.629 11.768 1.00 62.70 O ATOM 602 CB THR A 348 64.973 80.104 9.052 1.00 62.09 C ATOM 603 OG1 THR A 348 64.318 79.174 8.189 1.00 66.13 O ATOM 604 CG2 THR A 348 65.319 81.397 8.309 1.00 59.37 C ATOM 605 HG1 THR A 348 63.509 79.596 7.804 1.00 0.00 H ATOM 606 H THR A 348 65.429 78.142 11.176 1.00 0.00 H ATOM 607 N PHE A 349 67.931 81.060 10.313 1.00 54.53 N ATOM 608 CA PHE A 349 68.557 82.105 11.101 1.00 52.34 C ATOM 609 C PHE A 349 68.172 83.461 10.512 1.00 53.30 C ATOM 610 O PHE A 349 68.302 83.621 9.308 1.00 56.60 O ATOM 611 CB PHE A 349 70.068 81.890 11.127 1.00 50.83 C ATOM 612 CG PHE A 349 70.843 83.060 11.657 1.00 50.12 C ATOM 613 CD1 PHE A 349 71.037 83.213 13.034 1.00 48.55 C ATOM 614 CD2 PHE A 349 71.480 83.931 10.787 1.00 49.69 C ATOM 615 CE1 PHE A 349 71.774 84.275 13.542 1.00 47.63 C ATOM 616 CE2 PHE A 349 72.238 84.985 11.276 1.00 50.00 C ATOM 617 CZ PHE A 349 72.386 85.156 12.666 1.00 48.77 C ATOM 618 H PHE A 349 68.368 80.794 9.408 1.00 0.00 H ATOM 619 N PHE A 350 67.805 84.443 11.355 1.00 47.67 N ATOM 620 CA PHE A 350 67.320 85.743 10.897 1.00 43.69 C ATOM 621 C PHE A 350 68.137 86.919 11.377 1.00 45.48 C ATOM 622 O PHE A 350 68.655 86.916 12.467 1.00 52.34 O ATOM 623 CB PHE A 350 65.877 86.006 11.379 1.00 41.06 C ATOM 624 CG PHE A 350 64.824 85.026 10.869 1.00 44.62 C ATOM 625 CD1 PHE A 350 64.515 83.876 11.565 1.00 38.15 C ATOM 626 CD2 PHE A 350 64.113 85.297 9.674 1.00 48.66 C ATOM 627 CE1 PHE A 350 63.545 83.004 11.105 1.00 40.75 C ATOM 628 CE2 PHE A 350 63.128 84.434 9.212 1.00 49.85 C ATOM 629 CZ PHE A 350 62.848 83.275 9.929 1.00 48.77 C ATOM 630 H PHE A 350 67.869 84.269 12.378 1.00 0.00 H ATOM 631 N ILE A 351 68.259 87.927 10.530 1.00 46.97 N ATOM 632 CA ILE A 351 68.653 89.260 10.937 1.00 43.87 C ATOM 633 C ILE A 351 67.587 90.271 10.562 1.00 46.02 C ATOM 634 O ILE A 351 67.106 90.297 9.429 1.00 52.14 O ATOM 635 CB ILE A 351 69.984 89.679 10.318 1.00 45.65 C ATOM 636 CG1 ILE A 351 71.100 88.747 10.790 1.00 43.15 C ATOM 637 CG2 ILE A 351 70.273 91.126 10.625 1.00 45.81 C ATOM 638 CD1 ILE A 351 72.356 88.878 9.992 1.00 43.06 C ATOM 639 H ILE A 351 68.063 87.754 9.523 1.00 0.00 H ATOM 640 N LEU A 352 67.189 91.080 11.525 1.00 43.47 N ATOM 641 CA LEU A 352 66.212 92.131 11.327 1.00 44.68 C ATOM 642 C LEU A 352 66.828 93.392 10.753 1.00 49.81 C ATOM 643 O LEU A 352 67.772 93.919 11.324 1.00 55.62 O ATOM 644 CB LEU A 352 65.533 92.437 12.671 1.00 41.64 C ATOM 645 CG LEU A 352 64.430 93.468 12.714 1.00 42.55 C ATOM 646 CD1 LEU A 352 63.295 92.990 11.780 1.00 41.96 C ATOM 647 CD2 LEU A 352 63.913 93.588 14.203 1.00 32.15 C ATOM 648 H LEU A 352 67.597 90.957 12.474 1.00 0.00 H ATOM 649 N ILE A 353 66.436 93.816 9.572 1.00 48.16 N ATOM 650 CA ILE A 353 67.115 94.997 9.058 1.00 52.76 C ATOM 651 C ILE A 353 66.245 96.241 9.106 1.00 53.58 C ATOM 652 O ILE A 353 66.716 97.354 8.873 1.00 58.96 O ATOM 653 CB ILE A 353 67.663 94.771 7.650 1.00 57.37 C ATOM 654 CG1 ILE A 353 66.542 94.495 6.674 1.00 56.15 C ATOM 655 CG2 ILE A 353 68.603 93.566 7.663 1.00 58.83 C ATOM 656 CD1 ILE A 353 67.026 94.498 5.263 1.00 55.28 C ATOM 657 H ILE A 353 65.685 93.336 9.036 1.00 0.00 H ATOM 658 N ASP A 354 64.956 96.033 9.319 1.00 51.52 N ATOM 659 CA ASP A 354 64.017 97.130 9.510 1.00 58.09 C ATOM 660 C ASP A 354 62.747 96.655 10.146 1.00 61.70 C ATOM 661 O ASP A 354 62.220 95.618 9.737 1.00 64.05 O ATOM 662 CB ASP A 354 63.670 97.836 8.189 1.00 63.14 C ATOM 663 CG ASP A 354 63.083 99.211 8.419 1.00 69.90 C ATOM 664 OD1 ASP A 354 61.851 99.364 8.247 1.00 72.71 O ATOM 665 OD2 ASP A 354 63.826 100.121 8.833 1.00 72.92 O ATOM 666 H ASP A 354 64.602 95.056 9.351 1.00 0.00 H ATOM 667 N GLY A 355 62.218 97.449 11.079 1.00 61.25 N ATOM 668 CA GLY A 355 60.980 97.115 11.747 1.00 61.19 C ATOM 669 C GLY A 355 61.195 96.801 13.220 1.00 58.48 C ATOM 670 O GLY A 355 62.296 96.958 13.743 1.00 58.06 O ATOM 671 H GLY A 355 62.709 98.330 11.332 1.00 0.00 H ATOM 672 N ASN A 356 60.144 96.291 13.862 1.00 56.04 N ATOM 673 CA ASN A 356 60.116 96.015 15.280 1.00 52.95 C ATOM 674 C ASN A 356 59.473 94.664 15.452 1.00 50.38 C ATOM 675 O ASN A 356 58.414 94.395 14.889 1.00 48.77 O ATOM 676 CB ASN A 356 59.317 97.109 16.025 1.00 55.70 C ATOM 677 CG ASN A 356 59.085 96.801 17.528 1.00 62.13 C ATOM 678 OD1 ASN A 356 58.328 95.890 17.898 1.00 60.71 O ATOM 679 ND2 ASN A 356 59.670 97.632 18.390 1.00 60.96 N ATOM 680 HD22 ASN A 356 60.299 98.384 18.042 1.00 0.00 H ATOM 681 HD21 ASN A 356 59.498 97.529 19.410 1.00 0.00 H ATOM 682 H ASN A 356 59.290 96.078 13.307 1.00 0.00 H ATOM 683 N ALA A 357 60.149 93.784 16.183 1.00 49.96 N ATOM 684 CA ALA A 357 59.603 92.460 16.439 1.00 48.86 C ATOM 685 C ALA A 357 59.789 92.151 17.948 1.00 56.09 C ATOM 686 O ALA A 357 60.633 92.754 18.602 1.00 55.86 O ATOM 687 CB ALA A 357 60.286 91.419 15.540 1.00 41.53 C ATOM 688 H ALA A 357 61.076 94.044 16.575 1.00 0.00 H ATOM 689 N VAL A 358 59.041 91.199 18.497 1.00 56.19 N ATOM 690 CA VAL A 358 59.126 90.933 19.932 1.00 53.99 C ATOM 691 C VAL A 358 59.144 89.439 20.244 1.00 50.67 C ATOM 692 O VAL A 358 58.371 88.687 19.649 1.00 49.03 O ATOM 693 CB VAL A 358 57.960 91.620 20.698 1.00 52.46 C ATOM 694 CG1 VAL A 358 56.602 91.110 20.234 1.00 54.22 C ATOM 695 CG2 VAL A 358 58.128 91.423 22.213 1.00 51.71 C ATOM 696 H VAL A 358 58.393 90.642 17.904 1.00 0.00 H ATOM 697 N ALA A 359 60.043 88.994 21.141 1.00 44.15 N ATOM 698 CA ALA A 359 60.063 87.582 21.520 1.00 44.70 C ATOM 699 C ALA A 359 59.394 87.361 22.856 1.00 55.46 C ATOM 700 O ALA A 359 59.692 88.039 23.847 1.00 58.08 O ATOM 701 CB ALA A 359 61.463 87.075 21.547 1.00 40.30 C ATOM 702 H ALA A 359 60.724 89.655 21.565 1.00 0.00 H ATOM 703 N SER A 360 58.569 86.328 22.921 1.00 57.02 N ATOM 704 CA SER A 360 57.918 85.986 24.140 1.00 57.13 C ATOM 705 C SER A 360 57.951 84.472 24.321 1.00 63.29 C ATOM 706 O SER A 360 58.161 83.730 23.350 1.00 64.38 O ATOM 707 CB SER A 360 56.486 86.494 24.154 1.00 55.97 C ATOM 708 OG SER A 360 55.717 85.871 23.164 1.00 56.80 O ATOM 709 HG SER A 360 54.792 86.221 23.197 1.00 0.00 H ATOM 710 H SER A 360 58.394 85.758 22.069 1.00 0.00 H ATOM 711 N LYS A 361 57.862 84.035 25.576 1.00 65.71 N ATOM 712 CA LYS A 361 57.805 82.624 25.929 1.00 69.84 C ATOM 713 C LYS A 361 56.807 82.493 27.085 1.00 77.70 C ATOM 714 O LYS A 361 56.872 83.229 28.082 1.00 77.13 O ATOM 715 CB LYS A 361 59.188 82.078 26.280 1.00 70.13 C ATOM 716 CG LYS A 361 59.216 80.585 26.632 1.00 76.47 C ATOM 717 CD LYS A 361 60.631 80.087 26.955 1.00 76.51 C ATOM 718 CE LYS A 361 60.620 78.615 27.348 1.00 82.38 C ATOM 719 NZ LYS A 361 60.088 77.712 26.318 1.00 83.78 N ATOM 720 HZ1 LYS A 361 59.105 77.975 26.102 1.00 0.00 H ATOM 721 HZ2 LYS A 361 60.666 77.791 25.457 1.00 0.00 H ATOM 722 HZ3 LYS A 361 60.117 76.733 26.668 1.00 0.00 H ATOM 723 H LYS A 361 57.832 84.737 26.342 1.00 0.00 H ATOM 724 N ASP A 362 55.905 81.521 26.964 1.00 85.50 N ATOM 725 CA ASP A 362 54.747 81.390 27.872 1.00 93.57 C ATOM 726 C ASP A 362 54.113 82.732 28.208 1.00 99.18 C ATOM 727 O ASP A 362 53.798 83.013 29.358 1.00100.25 O ATOM 728 CB ASP A 362 55.175 80.748 29.191 1.00 91.83 C ATOM 729 CG ASP A 362 55.885 79.426 29.012 1.00 93.83 C ATOM 730 OD1 ASP A 362 55.488 78.629 28.145 1.00 93.96 O ATOM 731 OD2 ASP A 362 56.886 79.194 29.720 1.00 97.15 O ATOM 732 H ASP A 362 56.020 80.826 26.199 1.00 0.00 H ATOM 733 N ASN A 363 53.947 83.554 27.175 1.00104.11 N ATOM 734 CA ASN A 363 53.312 84.870 27.257 1.00107.40 C ATOM 735 C ASN A 363 54.081 85.859 28.139 1.00101.79 C ATOM 736 O ASN A 363 53.491 86.802 28.655 1.00108.49 O ATOM 737 CB ASN A 363 51.856 84.770 27.730 1.00115.81 C ATOM 738 CG ASN A 363 50.981 85.849 27.108 1.00116.86 C ATOM 739 OD1 ASN A 363 51.235 86.282 25.975 1.00115.23 O ATOM 740 ND2 ASN A 363 49.966 86.303 27.843 1.00120.18 N ATOM 741 HD22 ASN A 363 49.792 85.908 28.789 1.00 0.00 H ATOM 742 HD21 ASN A 363 49.348 87.052 27.470 1.00 0.00 H ATOM 743 H ASN A 363 54.292 83.240 26.246 1.00 0.00 H ATOM 744 N LYS A 364 55.392 85.693 28.278 1.00 86.12 N ATOM 745 CA LYS A 364 56.185 86.720 28.939 1.00 73.32 C ATOM 746 C LYS A 364 57.164 87.288 27.917 1.00 63.05 C ATOM 747 O LYS A 364 57.854 86.546 27.205 1.00 58.58 O ATOM 748 CB LYS A 364 56.925 86.151 30.159 1.00 68.86 C ATOM 749 CG LYS A 364 56.045 85.959 31.397 1.00 68.27 C ATOM 750 CD LYS A 364 56.881 85.861 32.666 1.00 68.64 C ATOM 751 CE LYS A 364 55.989 85.651 33.900 1.00 72.22 C ATOM 752 NZ LYS A 364 56.831 85.633 35.120 1.00 77.23 N ATOM 753 HZ1 LYS A 364 57.520 84.857 35.053 1.00 0.00 H ATOM 754 HZ2 LYS A 364 57.335 86.539 35.205 1.00 0.00 H ATOM 755 HZ3 LYS A 364 56.227 85.491 35.955 1.00 0.00 H ATOM 756 H LYS A 364 55.850 84.832 27.916 1.00 0.00 H ATOM 757 N VAL A 365 57.247 88.612 27.864 1.00 57.52 N ATOM 758 CA VAL A 365 58.149 89.234 26.925 1.00 55.11 C ATOM 759 C VAL A 365 59.563 89.032 27.404 1.00 49.72 C ATOM 760 O VAL A 365 59.919 89.535 28.470 1.00 51.79 O ATOM 761 CB VAL A 365 57.893 90.752 26.754 1.00 60.14 C ATOM 762 CG1 VAL A 365 58.955 91.347 25.774 1.00 38.96 C ATOM 763 CG2 VAL A 365 56.536 90.987 26.158 1.00 64.15 C ATOM 764 H VAL A 365 56.665 89.198 28.496 1.00 0.00 H ATOM 765 N ILE A 366 60.412 88.454 26.557 1.00 46.53 N ATOM 766 CA ILE A 366 61.768 88.147 26.954 1.00 44.79 C ATOM 767 C ILE A 366 62.743 88.983 26.138 1.00 45.61 C ATOM 768 O ILE A 366 63.905 89.097 26.530 1.00 48.51 O ATOM 769 CB ILE A 366 62.085 86.640 26.793 1.00 42.30 C ATOM 770 CG1 ILE A 366 61.964 86.207 25.314 1.00 48.47 C ATOM 771 CG2 ILE A 366 61.126 85.791 27.632 1.00 43.78 C ATOM 772 CD1 ILE A 366 62.259 84.709 25.072 1.00 49.07 C ATOM 773 H ILE A 366 60.095 88.220 25.595 1.00 0.00 H ATOM 774 N LYS A 367 62.308 89.566 25.016 1.00 50.24 N ATOM 775 CA LYS A 367 63.228 90.438 24.266 1.00 50.75 C ATOM 776 C LYS A 367 62.471 91.249 23.202 1.00 51.21 C ATOM 777 O LYS A 367 61.585 90.726 22.504 1.00 52.23 O ATOM 778 CB LYS A 367 64.398 89.651 23.682 1.00 52.13 C ATOM 779 CG LYS A 367 65.482 90.517 23.069 1.00 53.20 C ATOM 780 CD LYS A 367 66.851 89.909 23.445 1.00 56.77 C ATOM 781 CE LYS A 367 68.055 90.826 23.156 1.00 60.60 C ATOM 782 NZ LYS A 367 67.690 92.169 22.602 1.00 63.34 N ATOM 783 HZ1 LYS A 367 67.179 92.045 21.704 1.00 0.00 H ATOM 784 HZ2 LYS A 367 67.083 92.670 23.282 1.00 0.00 H ATOM 785 HZ3 LYS A 367 68.556 92.721 22.437 1.00 0.00 H ATOM 786 H LYS A 367 61.337 89.407 24.679 1.00 0.00 H ATOM 787 N THR A 368 62.831 92.524 23.086 1.00 53.49 N ATOM 788 CA THR A 368 62.381 93.378 21.993 1.00 55.61 C ATOM 789 C THR A 368 63.465 93.494 20.910 1.00 53.88 C ATOM 790 O THR A 368 64.665 93.593 21.201 1.00 54.50 O ATOM 791 CB THR A 368 62.062 94.799 22.466 1.00 60.43 C ATOM 792 OG1 THR A 368 63.192 95.320 23.170 1.00 66.38 O ATOM 793 CG2 THR A 368 60.838 94.813 23.348 1.00 62.16 C ATOM 794 HG1 THR A 368 63.976 95.337 22.566 1.00 0.00 H ATOM 795 H THR A 368 63.461 92.930 23.807 1.00 0.00 H ATOM 796 N TYR A 369 63.056 93.471 19.657 1.00 49.38 N ATOM 797 CA TYR A 369 64.050 93.530 18.591 1.00 46.97 C ATOM 798 C TYR A 369 63.866 94.727 17.674 1.00 43.90 C ATOM 799 O TYR A 369 62.744 95.136 17.344 1.00 40.55 O ATOM 800 CB TYR A 369 63.991 92.246 17.734 1.00 43.44 C ATOM 801 CG TYR A 369 64.495 90.961 18.392 1.00 46.30 C ATOM 802 CD1 TYR A 369 65.825 90.824 18.746 1.00 47.11 C ATOM 803 CD2 TYR A 369 63.623 89.901 18.701 1.00 44.23 C ATOM 804 CE1 TYR A 369 66.293 89.661 19.327 1.00 45.44 C ATOM 805 CE2 TYR A 369 64.083 88.733 19.287 1.00 41.36 C ATOM 806 CZ TYR A 369 65.426 88.621 19.602 1.00 42.50 C ATOM 807 OH TYR A 369 65.947 87.477 20.179 1.00 40.24 O ATOM 808 HH TYR A 369 66.919 87.595 20.325 1.00 0.00 H ATOM 809 H TYR A 369 62.042 93.412 19.432 1.00 0.00 H ATOM 810 N THR A 370 64.979 95.285 17.243 1.00 45.48 N ATOM 811 CA THR A 370 64.904 96.371 16.266 1.00 52.34 C ATOM 812 C THR A 370 66.023 96.074 15.283 1.00 48.27 C ATOM 813 O THR A 370 66.688 95.033 15.381 1.00 41.25 O ATOM 814 CB THR A 370 65.058 97.799 16.831 1.00 60.02 C ATOM 815 OG1 THR A 370 66.385 97.986 17.338 1.00 62.33 O ATOM 816 CG2 THR A 370 63.988 98.100 17.879 1.00 63.75 C ATOM 817 HG1 THR A 370 66.473 98.904 17.698 1.00 0.00 H ATOM 818 H THR A 370 65.901 94.957 17.594 1.00 0.00 H ATOM 819 N LYS A 371 66.222 97.015 14.367 1.00 54.78 N ATOM 820 CA LYS A 371 67.213 96.978 13.308 1.00 55.53 C ATOM 821 C LYS A 371 68.593 96.580 13.856 1.00 52.32 C ATOM 822 O LYS A 371 69.053 97.143 14.861 1.00 56.08 O ATOM 823 CB LYS A 371 67.217 98.375 12.698 1.00 62.25 C ATOM 824 CG LYS A 371 68.130 98.658 11.581 1.00 68.85 C ATOM 825 CD LYS A 371 68.099 100.178 11.319 1.00 78.68 C ATOM 826 CE LYS A 371 68.835 100.602 10.024 1.00 86.45 C ATOM 827 NZ LYS A 371 68.182 100.125 8.762 1.00 88.67 N ATOM 828 HZ1 LYS A 371 68.142 99.086 8.765 1.00 0.00 H ATOM 829 HZ2 LYS A 371 67.217 100.510 8.705 1.00 0.00 H ATOM 830 HZ3 LYS A 371 68.735 100.450 7.943 1.00 0.00 H ATOM 831 H LYS A 371 65.611 97.856 14.413 1.00 0.00 H ATOM 832 N GLY A 372 69.227 95.598 13.221 1.00 43.01 N ATOM 833 CA GLY A 372 70.556 95.130 13.596 1.00 42.09 C ATOM 834 C GLY A 372 70.561 93.866 14.481 1.00 43.45 C ATOM 835 O GLY A 372 71.609 93.229 14.727 1.00 43.14 O ATOM 836 H GLY A 372 68.751 95.141 12.417 1.00 0.00 H ATOM 837 N ASP A 373 69.413 93.545 15.058 1.00 41.45 N ATOM 838 CA ASP A 373 69.327 92.348 15.887 1.00 38.64 C ATOM 839 C ASP A 373 69.261 91.065 15.074 1.00 41.65 C ATOM 840 O ASP A 373 68.763 91.074 13.957 1.00 43.98 O ATOM 841 CB ASP A 373 68.105 92.394 16.812 1.00 38.78 C ATOM 842 CG ASP A 373 68.204 93.498 17.913 1.00 47.74 C ATOM 843 OD1 ASP A 373 67.152 93.888 18.471 1.00 47.78 O ATOM 844 OD2 ASP A 373 69.323 93.941 18.248 1.00 48.70 O ATOM 845 H ASP A 373 68.575 94.145 14.920 1.00 0.00 H ATOM 846 N TYR A 374 69.687 89.958 15.673 1.00 40.13 N ATOM 847 CA TYR A 374 69.605 88.647 15.045 1.00 43.16 C ATOM 848 C TYR A 374 68.841 87.755 16.009 1.00 47.74 C ATOM 849 O TYR A 374 68.748 88.057 17.205 1.00 50.53 O ATOM 850 CB TYR A 374 70.973 88.038 14.705 1.00 44.42 C ATOM 851 CG TYR A 374 71.727 87.612 15.935 1.00 45.88 C ATOM 852 CD1 TYR A 374 71.649 86.313 16.423 1.00 50.09 C ATOM 853 CD2 TYR A 374 72.673 88.464 16.492 1.00 45.80 C ATOM 854 CE1 TYR A 374 72.366 85.920 17.548 1.00 54.43 C ATOM 855 CE2 TYR A 374 73.416 88.084 17.591 1.00 50.88 C ATOM 856 CZ TYR A 374 73.257 86.804 18.130 1.00 53.30 C ATOM 857 OH TYR A 374 73.971 86.397 19.246 1.00 49.76 O ATOM 858 HH TYR A 374 73.723 85.466 19.474 1.00 0.00 H ATOM 859 H TYR A 374 70.095 90.031 16.627 1.00 0.00 H ATOM 860 N PHE A 375 68.235 86.698 15.481 1.00 48.71 N ATOM 861 CA PHE A 375 67.536 85.757 16.320 1.00 46.12 C ATOM 862 C PHE A 375 67.288 84.486 15.530 1.00 50.15 C ATOM 863 O PHE A 375 67.348 84.499 14.298 1.00 51.87 O ATOM 864 CB PHE A 375 66.184 86.276 16.799 1.00 43.40 C ATOM 865 CG PHE A 375 65.321 86.894 15.722 1.00 44.17 C ATOM 866 CD1 PHE A 375 65.177 88.272 15.620 1.00 45.04 C ATOM 867 CD2 PHE A 375 64.591 86.070 14.841 1.00 40.15 C ATOM 868 CE1 PHE A 375 64.355 88.830 14.654 1.00 41.60 C ATOM 869 CE2 PHE A 375 63.758 86.614 13.895 1.00 39.71 C ATOM 870 CZ PHE A 375 63.645 87.999 13.789 1.00 41.27 C ATOM 871 H PHE A 375 68.265 86.548 14.452 1.00 0.00 H ATOM 872 N GLY A 376 66.905 83.426 16.239 1.00 47.91 N ATOM 873 CA GLY A 376 66.618 82.148 15.615 1.00 43.63 C ATOM 874 C GLY A 376 67.832 81.267 15.503 1.00 45.71 C ATOM 875 O GLY A 376 67.770 80.214 14.884 1.00 52.78 O ATOM 876 H GLY A 376 66.809 83.517 17.271 1.00 0.00 H ATOM 877 N GLU A 377 68.927 81.657 16.145 1.00 44.36 N ATOM 878 CA GLU A 377 70.147 80.858 16.090 1.00 45.96 C ATOM 879 C GLU A 377 70.188 79.631 17.010 1.00 48.70 C ATOM 880 O GLU A 377 70.867 78.642 16.695 1.00 47.47 O ATOM 881 CB GLU A 377 71.352 81.759 16.403 1.00 48.29 C ATOM 882 CG GLU A 377 71.675 81.951 17.908 1.00 60.29 C ATOM 883 CD GLU A 377 70.695 82.880 18.645 1.00 59.16 C ATOM 884 OE1 GLU A 377 69.635 83.241 18.068 1.00 62.07 O ATOM 885 OE2 GLU A 377 70.978 83.241 19.816 1.00 54.08 O ATOM 886 H GLU A 377 68.915 82.541 16.693 1.00 0.00 H ATOM 887 N LEU A 378 69.453 79.660 18.122 1.00 52.08 N ATOM 888 CA LEU A 378 69.628 78.633 19.141 1.00 53.20 C ATOM 889 C LEU A 378 69.203 77.247 18.629 1.00 55.91 C ATOM 890 O LEU A 378 69.918 76.255 18.834 1.00 60.29 O ATOM 891 CB LEU A 378 68.840 79.010 20.377 1.00 57.11 C ATOM 892 CG LEU A 378 69.142 78.144 21.580 1.00 63.23 C ATOM 893 CD1 LEU A 378 70.616 78.267 21.992 1.00 62.16 C ATOM 894 CD2 LEU A 378 68.237 78.605 22.652 1.00 65.95 C ATOM 895 H LEU A 378 68.754 80.417 18.262 1.00 0.00 H ATOM 896 N ALA A 379 68.079 77.187 17.912 1.00 53.96 N ATOM 897 CA ALA A 379 67.585 75.924 17.346 1.00 61.54 C ATOM 898 C ALA A 379 68.604 75.339 16.342 1.00 63.58 C ATOM 899 O ALA A 379 68.687 74.121 16.162 1.00 67.16 O ATOM 900 CB ALA A 379 66.240 76.122 16.691 1.00 64.05 C ATOM 901 H ALA A 379 67.537 78.059 17.749 1.00 0.00 H ATOM 902 N LEU A 380 69.313 76.208 15.631 1.00 61.33 N ATOM 903 CA LEU A 380 70.307 75.756 14.661 1.00 65.95 C ATOM 904 C LEU A 380 71.536 75.216 15.390 1.00 68.85 C ATOM 905 O LEU A 380 72.149 74.232 14.946 1.00 71.33 O ATOM 906 CB LEU A 380 70.691 76.860 13.677 1.00 63.17 C ATOM 907 CG LEU A 380 69.477 77.554 13.084 1.00 66.20 C ATOM 908 CD1 LEU A 380 69.914 78.612 12.102 1.00 66.55 C ATOM 909 CD2 LEU A 380 68.591 76.509 12.400 1.00 70.59 C ATOM 910 H LEU A 380 69.158 77.227 15.767 1.00 0.00 H ATOM 911 N LEU A 381 71.909 75.883 16.487 1.00 66.75 N ATOM 912 CA LEU A 381 73.077 75.463 17.254 1.00 72.67 C ATOM 913 C LEU A 381 72.831 74.231 18.114 1.00 80.42 C ATOM 914 O LEU A 381 73.743 73.438 18.304 1.00 86.67 O ATOM 915 CB LEU A 381 73.500 76.606 18.190 1.00 69.60 C ATOM 916 CG LEU A 381 73.976 77.964 17.671 1.00 63.66 C ATOM 917 CD1 LEU A 381 74.098 78.947 18.837 1.00 62.05 C ATOM 918 CD2 LEU A 381 75.301 77.803 16.984 1.00 62.78 C ATOM 919 H LEU A 381 71.361 76.710 16.797 1.00 0.00 H ATOM 920 N LYS A 382 71.609 74.046 18.609 1.00 81.47 N ATOM 921 CA LYS A 382 71.353 72.935 19.546 1.00 90.90 C ATOM 922 C LYS A 382 70.564 71.785 18.946 1.00 97.08 C ATOM 923 O LYS A 382 70.466 70.718 19.556 1.00103.86 O ATOM 924 CB LYS A 382 70.649 73.436 20.813 1.00 91.85 C ATOM 925 CG LYS A 382 71.473 74.487 21.515 1.00 90.98 C ATOM 926 CD LYS A 382 71.428 74.375 23.006 1.00 95.85 C ATOM 927 CE LYS A 382 72.169 75.545 23.602 1.00 94.95 C ATOM 928 NZ LYS A 382 72.451 75.288 25.032 1.00100.48 N ATOM 929 HZ1 LYS A 382 71.555 75.153 25.542 1.00 0.00 H ATOM 930 HZ2 LYS A 382 73.034 74.431 25.121 1.00 0.00 H ATOM 931 HZ3 LYS A 382 72.962 76.099 25.435 1.00 0.00 H ATOM 932 H LYS A 382 70.835 74.684 18.335 1.00 0.00 H ATOM 933 N ASN A 383 70.004 72.015 17.762 1.00 96.23 N ATOM 934 CA ASN A 383 69.171 71.009 17.107 1.00102.55 C ATOM 935 C ASN A 383 67.979 70.566 17.941 1.00102.40 C ATOM 936 O ASN A 383 67.715 69.367 18.117 1.00108.91 O ATOM 937 CB ASN A 383 69.995 69.795 16.682 1.00111.93 C ATOM 938 CG ASN A 383 70.856 70.096 15.473 1.00113.65 C ATOM 939 OD1 ASN A 383 71.943 70.670 15.581 1.00112.16 O ATOM 940 ND2 ASN A 383 70.327 69.791 14.300 1.00116.55 N ATOM 941 HD22 ASN A 383 69.408 69.307 14.254 1.00 0.00 H ATOM 942 HD21 ASN A 383 70.830 70.035 13.423 1.00 0.00 H ATOM 943 H ASN A 383 70.162 72.930 17.293 1.00 0.00 H ATOM 944 N LYS A 384 67.291 71.564 18.475 1.00 94.74 N ATOM 945 CA LYS A 384 66.136 71.373 19.318 1.00 93.04 C ATOM 946 C LYS A 384 65.067 72.294 18.712 1.00 87.64 C ATOM 947 O LYS A 384 65.402 73.182 17.927 1.00 82.64 O ATOM 948 CB LYS A 384 66.471 71.762 20.766 1.00 89.15 C ATOM 949 CG LYS A 384 67.364 70.795 21.527 1.00 93.24 C ATOM 950 CD LYS A 384 67.657 71.342 22.937 1.00 92.70 C ATOM 951 CE LYS A 384 67.844 70.211 23.977 1.00100.89 C ATOM 952 NZ LYS A 384 68.181 70.699 25.362 1.00100.92 N ATOM 953 HZ1 LYS A 384 69.070 71.238 25.332 1.00 0.00 H ATOM 954 HZ2 LYS A 384 67.415 71.311 25.709 1.00 0.00 H ATOM 955 HZ3 LYS A 384 68.290 69.884 25.999 1.00 0.00 H ATOM 956 H LYS A 384 67.600 72.537 18.276 1.00 0.00 H ATOM 957 N PRO A 385 63.791 72.104 19.076 1.00 87.28 N ATOM 958 CA PRO A 385 62.742 73.005 18.585 1.00 83.91 C ATOM 959 C PRO A 385 62.907 74.453 19.050 1.00 79.52 C ATOM 960 O PRO A 385 63.659 74.718 19.995 1.00 78.25 O ATOM 961 CB PRO A 385 61.455 72.390 19.153 1.00 89.21 C ATOM 962 CG PRO A 385 61.894 71.578 20.310 1.00 93.38 C ATOM 963 CD PRO A 385 63.229 71.017 19.894 1.00 93.72 C ATOM 964 N ARG A 386 62.279 75.380 18.332 1.00 77.22 N ATOM 965 CA ARG A 386 62.216 76.774 18.743 1.00 72.27 C ATOM 966 C ARG A 386 61.778 76.916 20.210 1.00 74.94 C ATOM 967 O ARG A 386 60.767 76.331 20.642 1.00 77.45 O ATOM 968 CB ARG A 386 61.230 77.527 17.842 1.00 72.37 C ATOM 969 CG ARG A 386 61.584 77.491 16.344 1.00 71.58 C ATOM 970 CD ARG A 386 62.875 78.214 16.011 1.00 68.07 C ATOM 971 NE ARG A 386 62.941 78.582 14.597 1.00 65.03 N ATOM 972 CZ ARG A 386 64.013 79.116 14.013 1.00 64.37 C ATOM 973 NH1 ARG A 386 65.089 79.385 14.748 1.00 60.55 N ATOM 974 NH2 ARG A 386 63.997 79.426 12.703 1.00 65.51 N ATOM 975 HE ARG A 386 62.098 78.416 14.011 1.00 0.00 H ATOM 976 HH12 ARG A 386 65.932 79.802 14.303 1.00 0.00 H ATOM 977 HH11 ARG A 386 65.087 79.178 15.767 1.00 0.00 H ATOM 978 HH22 ARG A 386 64.839 79.842 12.257 1.00 0.00 H ATOM 979 HH21 ARG A 386 63.143 79.249 12.137 1.00 0.00 H ATOM 980 H ARG A 386 61.816 75.098 17.444 1.00 0.00 H ATOM 981 N ALA A 387 62.535 77.704 20.964 1.00 70.88 N ATOM 982 CA ALA A 387 62.325 77.810 22.398 1.00 68.89 C ATOM 983 C ALA A 387 61.396 78.977 22.725 1.00 69.75 C ATOM 984 O ALA A 387 61.009 79.160 23.873 1.00 75.27 O ATOM 985 CB ALA A 387 63.630 77.942 23.130 1.00 63.76 C ATOM 986 H ALA A 387 63.295 78.257 20.519 1.00 0.00 H ATOM 987 N ALA A 388 61.076 79.795 21.734 1.00 65.62 N ATOM 988 CA ALA A 388 60.291 80.998 21.987 1.00 61.48 C ATOM 989 C ALA A 388 59.590 81.453 20.715 1.00 64.09 C ATOM 990 O ALA A 388 59.945 81.029 19.615 1.00 68.17 O ATOM 991 CB ALA A 388 61.191 82.124 22.523 1.00 52.39 C ATOM 992 H ALA A 388 61.387 79.578 20.766 1.00 0.00 H ATOM 993 N THR A 389 58.576 82.293 20.879 1.00 61.30 N ATOM 994 CA THR A 389 57.858 82.897 19.783 1.00 60.29 C ATOM 995 C THR A 389 58.242 84.343 19.521 1.00 58.19 C ATOM 996 O THR A 389 58.322 85.161 20.451 1.00 57.68 O ATOM 997 CB THR A 389 56.363 82.803 20.013 1.00 62.95 C ATOM 998 OG1 THR A 389 55.981 81.429 19.910 1.00 63.52 O ATOM 999 CG2 THR A 389 55.621 83.585 18.950 1.00 66.32 C ATOM 1000 HG1 THR A 389 55.006 81.347 20.058 1.00 0.00 H ATOM 1001 H THR A 389 58.283 82.528 21.849 1.00 0.00 H ATOM 1002 N ILE A 390 58.476 84.641 18.239 1.00 54.71 N ATOM 1003 CA ILE A 390 58.794 85.993 17.793 1.00 48.51 C ATOM 1004 C ILE A 390 57.771 86.497 16.751 1.00 47.24 C ATOM 1005 O ILE A 390 57.504 85.830 15.726 1.00 43.87 O ATOM 1006 CB ILE A 390 60.205 86.045 17.245 1.00 48.71 C ATOM 1007 CG1 ILE A 390 61.167 85.653 18.368 1.00 44.83 C ATOM 1008 CG2 ILE A 390 60.550 87.448 16.690 1.00 50.61 C ATOM 1009 CD1 ILE A 390 62.632 85.478 17.935 1.00 42.35 C ATOM 1010 H ILE A 390 58.430 83.879 17.532 1.00 0.00 H ATOM 1011 N LYS A 391 57.176 87.657 17.062 1.00 46.01 N ATOM 1012 CA LYS A 391 56.090 88.245 16.278 1.00 53.05 C ATOM 1013 C LYS A 391 56.531 89.619 15.806 1.00 56.92 C ATOM 1014 O LYS A 391 57.193 90.360 16.562 1.00 53.02 O ATOM 1015 CB LYS A 391 54.792 88.369 17.077 1.00 54.16 C ATOM 1016 CG LYS A 391 53.928 87.112 17.070 1.00 61.86 C ATOM 1017 CD LYS A 391 52.645 87.274 17.900 1.00 71.27 C ATOM 1018 CE LYS A 391 52.425 86.049 18.855 1.00 95.36 C ATOM 1019 NZ LYS A 391 51.112 86.070 19.583 1.00 97.74 N ATOM 1020 HZ1 LYS A 391 51.054 86.929 20.166 1.00 0.00 H ATOM 1021 HZ2 LYS A 391 50.334 86.065 18.893 1.00 0.00 H ATOM 1022 HZ3 LYS A 391 51.041 85.230 20.192 1.00 0.00 H ATOM 1023 H LYS A 391 57.504 88.167 17.907 1.00 0.00 H ATOM 1024 N ALA A 392 56.211 89.939 14.541 1.00 55.54 N ATOM 1025 CA ALA A 392 56.421 91.273 14.012 1.00 54.66 C ATOM 1026 C ALA A 392 55.471 92.281 14.647 1.00 51.12 C ATOM 1027 O ALA A 392 54.300 91.983 14.842 1.00 53.36 O ATOM 1028 CB ALA A 392 56.249 91.274 12.488 1.00 62.01 C ATOM 1029 H ALA A 392 55.801 89.209 13.924 1.00 0.00 H ATOM 1030 N GLN A 393 55.944 93.471 14.998 1.00 47.59 N ATOM 1031 CA GLN A 393 54.988 94.446 15.535 1.00 52.36 C ATOM 1032 C GLN A 393 54.686 95.622 14.570 1.00 55.82 C ATOM 1033 O GLN A 393 53.955 96.560 14.893 1.00 56.04 O ATOM 1034 CB GLN A 393 55.473 94.971 16.884 1.00 52.23 C ATOM 1035 CG GLN A 393 55.569 93.897 17.977 1.00 49.99 C ATOM 1036 CD GLN A 393 55.345 94.497 19.372 1.00 50.67 C ATOM 1037 OE1 GLN A 393 54.346 94.194 20.068 1.00 51.39 O ATOM 1038 NE2 GLN A 393 56.264 95.384 19.772 1.00 46.61 N ATOM 1039 HE22 GLN A 393 57.076 95.603 19.160 1.00 0.00 H ATOM 1040 HE21 GLN A 393 56.166 95.854 20.695 1.00 0.00 H ATOM 1041 H GLN A 393 56.953 93.703 14.896 1.00 0.00 H ATOM 1042 N ASN A 394 55.242 95.541 13.376 1.00 56.54 N ATOM 1043 CA ASN A 394 54.964 96.502 12.316 1.00 61.79 C ATOM 1044 C ASN A 394 55.568 95.855 11.097 1.00 62.99 C ATOM 1045 O ASN A 394 56.041 94.715 11.215 1.00 63.42 O ATOM 1046 CB ASN A 394 55.532 97.904 12.577 1.00 61.03 C ATOM 1047 CG ASN A 394 57.021 97.911 12.826 1.00 54.55 C ATOM 1048 OD1 ASN A 394 57.716 96.930 12.579 1.00 51.93 O ATOM 1049 ND2 ASN A 394 57.537 99.068 13.205 1.00 55.44 N ATOM 1050 HD22 ASN A 394 56.913 99.875 13.405 1.00 0.00 H ATOM 1051 HD21 ASN A 394 58.567 99.171 13.303 1.00 0.00 H ATOM 1052 H ASN A 394 55.904 94.762 13.184 1.00 0.00 H ATOM 1053 N PHE A 395 55.680 96.581 9.983 1.00 61.92 N ATOM 1054 CA PHE A 395 56.285 95.992 8.799 1.00 61.07 C ATOM 1055 C PHE A 395 57.762 95.819 8.968 1.00 57.52 C ATOM 1056 O PHE A 395 58.509 96.795 9.028 1.00 61.62 O ATOM 1057 CB PHE A 395 56.008 96.831 7.546 1.00 69.83 C ATOM 1058 CG PHE A 395 56.326 96.126 6.272 1.00 71.38 C ATOM 1059 CD1 PHE A 395 55.495 95.124 5.788 1.00 75.27 C ATOM 1060 CD2 PHE A 395 57.448 96.484 5.534 1.00 74.47 C ATOM 1061 CE1 PHE A 395 55.786 94.478 4.569 1.00 79.02 C ATOM 1062 CE2 PHE A 395 57.748 95.837 4.312 1.00 75.58 C ATOM 1063 CZ PHE A 395 56.910 94.845 3.832 1.00 76.35 C ATOM 1064 H PHE A 395 55.337 97.562 9.962 1.00 0.00 H ATOM 1065 N CYS A 396 58.162 94.553 8.968 1.00 51.22 N ATOM 1066 CA CYS A 396 59.523 94.149 9.232 1.00 49.82 C ATOM 1067 C CYS A 396 60.188 93.579 7.964 1.00 56.37 C ATOM 1068 O CYS A 396 59.548 92.866 7.165 1.00 56.47 O ATOM 1069 CB CYS A 396 59.542 93.066 10.285 1.00 49.57 C ATOM 1070 SG CYS A 396 59.220 93.612 12.009 1.00 54.07 S ATOM 1071 H CYS A 396 57.458 93.814 8.767 1.00 0.00 H ATOM 1072 N GLN A 397 61.431 93.960 7.733 1.00 55.47 N ATOM 1073 CA GLN A 397 62.187 93.330 6.663 1.00 55.71 C ATOM 1074 C GLN A 397 63.366 92.574 7.268 1.00 52.69 C ATOM 1075 O GLN A 397 64.133 93.128 8.041 1.00 52.50 O ATOM 1076 CB GLN A 397 62.605 94.369 5.642 1.00 59.75 C ATOM 1077 CG GLN A 397 61.411 95.078 5.008 1.00 70.22 C ATOM 1078 CD GLN A 397 61.839 96.223 4.090 1.00 79.71 C ATOM 1079 OE1 GLN A 397 62.431 97.210 4.546 1.00 82.41 O ATOM 1080 NE2 GLN A 397 61.648 96.039 2.771 1.00 83.47 N ATOM 1081 HE22 GLN A 397 61.145 95.195 2.431 1.00 0.00 H ATOM 1082 HE21 GLN A 397 62.004 96.741 2.091 1.00 0.00 H ATOM 1083 H GLN A 397 61.866 94.706 8.313 1.00 0.00 H ATOM 1084 N VAL A 398 63.557 91.326 6.874 1.00 53.54 N ATOM 1085 CA VAL A 398 64.679 90.568 7.392 1.00 51.62 C ATOM 1086 C VAL A 398 65.539 89.988 6.284 1.00 53.21 C ATOM 1087 O VAL A 398 65.096 89.821 5.127 1.00 52.84 O ATOM 1088 CB VAL A 398 64.188 89.426 8.312 1.00 51.84 C ATOM 1089 CG1 VAL A 398 63.284 89.999 9.466 1.00 44.83 C ATOM 1090 CG2 VAL A 398 63.401 88.416 7.511 1.00 53.49 C ATOM 1091 H VAL A 398 62.903 90.889 6.193 1.00 0.00 H ATOM 1092 N VAL A 399 66.777 89.680 6.646 1.00 56.41 N ATOM 1093 CA VAL A 399 67.590 88.785 5.853 1.00 57.81 C ATOM 1094 C VAL A 399 67.863 87.548 6.667 1.00 55.08 C ATOM 1095 O VAL A 399 67.829 87.597 7.888 1.00 58.03 O ATOM 1096 CB VAL A 399 68.880 89.433 5.400 1.00 59.13 C ATOM 1097 CG1 VAL A 399 68.573 90.589 4.451 1.00 57.88 C ATOM 1098 CG2 VAL A 399 69.700 89.868 6.611 1.00 57.97 C ATOM 1099 H VAL A 399 67.171 90.090 7.517 1.00 0.00 H ATOM 1100 N TYR A 400 68.081 86.432 5.985 1.00 49.35 N ATOM 1101 CA TYR A 400 68.179 85.127 6.631 1.00 46.25 C ATOM 1102 C TYR A 400 69.064 84.087 5.964 1.00 49.13 C ATOM 1103 O TYR A 400 69.385 84.211 4.780 1.00 48.00 O ATOM 1104 CB TYR A 400 66.793 84.519 6.790 1.00 46.95 C ATOM 1105 CG TYR A 400 66.046 84.179 5.525 1.00 51.09 C ATOM 1106 CD1 TYR A 400 66.101 82.891 4.984 1.00 53.81 C ATOM 1107 CD2 TYR A 400 65.244 85.116 4.891 1.00 55.08 C ATOM 1108 CE1 TYR A 400 65.396 82.554 3.807 1.00 58.42 C ATOM 1109 CE2 TYR A 400 64.528 84.789 3.717 1.00 55.80 C ATOM 1110 CZ TYR A 400 64.617 83.512 3.190 1.00 59.75 C ATOM 1111 OH TYR A 400 63.924 83.196 2.043 1.00 67.34 O ATOM 1112 HH TYR A 400 64.096 82.251 1.804 1.00 0.00 H ATOM 1113 H TYR A 400 68.186 86.489 4.952 1.00 0.00 H ATOM 1114 N LEU A 401 69.453 83.075 6.740 1.00 48.53 N ATOM 1115 CA LEU A 401 70.197 81.954 6.212 1.00 49.07 C ATOM 1116 C LEU A 401 69.498 80.657 6.606 1.00 52.08 C ATOM 1117 O LEU A 401 68.957 80.560 7.716 1.00 48.99 O ATOM 1118 CB LEU A 401 71.588 81.940 6.802 1.00 50.49 C ATOM 1119 CG LEU A 401 72.476 83.131 6.514 1.00 52.93 C ATOM 1120 CD1 LEU A 401 73.742 83.032 7.389 1.00 49.06 C ATOM 1121 CD2 LEU A 401 72.819 83.093 4.968 1.00 43.02 C ATOM 1122 H LEU A 401 69.215 83.093 7.752 1.00 0.00 H ATOM 1123 N ASP A 402 69.500 79.644 5.730 1.00 55.26 N ATOM 1124 CA ASP A 402 68.995 78.331 6.144 1.00 62.18 C ATOM 1125 C ASP A 402 70.084 77.570 6.888 1.00 62.93 C ATOM 1126 O ASP A 402 71.221 78.044 6.975 1.00 61.09 O ATOM 1127 CB ASP A 402 68.497 77.494 4.985 1.00 72.13 C ATOM 1128 CG ASP A 402 69.595 77.154 3.997 1.00 80.03 C ATOM 1129 OD1 ASP A 402 70.591 77.904 3.912 1.00 77.56 O ATOM 1130 OD2 ASP A 402 69.469 76.116 3.311 1.00 89.49 O ATOM 1131 H ASP A 402 69.857 79.787 4.764 1.00 0.00 H ATOM 1132 N ARG A 403 69.735 76.394 7.415 1.00 69.77 N ATOM 1133 CA ARG A 403 70.625 75.644 8.301 1.00 70.54 C ATOM 1134 C ARG A 403 71.930 75.311 7.596 1.00 69.29 C ATOM 1135 O ARG A 403 73.004 75.506 8.173 1.00 69.45 O ATOM 1136 CB ARG A 403 69.978 74.426 8.990 1.00 77.37 C ATOM 1137 CG ARG A 403 71.069 73.569 9.670 1.00 81.78 C ATOM 1138 CD ARG A 403 70.610 72.335 10.414 1.00 88.37 C ATOM 1139 NE ARG A 403 69.795 72.757 11.558 1.00 92.75 N ATOM 1140 CZ ARG A 403 68.518 72.475 11.769 1.00 98.04 C ATOM 1141 NH1 ARG A 403 67.845 71.744 10.887 1.00103.20 N ATOM 1142 NH2 ARG A 403 67.917 72.931 12.870 1.00 97.29 N ATOM 1143 HE ARG A 403 70.269 73.338 12.279 1.00 0.00 H ATOM 1144 HH12 ARG A 403 66.842 71.522 11.052 1.00 0.00 H ATOM 1145 HH11 ARG A 403 68.321 71.393 10.031 1.00 0.00 H ATOM 1146 HH22 ARG A 403 66.915 72.714 13.043 1.00 0.00 H ATOM 1147 HH21 ARG A 403 68.451 73.503 13.555 1.00 0.00 H ATOM 1148 H ARG A 403 68.800 75.998 7.188 1.00 0.00 H ATOM 1149 N LYS A 404 71.855 74.813 6.364 1.00 67.30 N ATOM 1150 CA LYS A 404 73.100 74.432 5.692 1.00 63.98 C ATOM 1151 C LYS A 404 73.963 75.662 5.500 1.00 58.49 C ATOM 1152 O LYS A 404 75.179 75.568 5.697 1.00 59.31 O ATOM 1153 CB LYS A 404 72.844 73.703 4.368 1.00 64.61 C ATOM 1154 CG LYS A 404 72.453 72.192 4.520 1.00 94.42 C ATOM 1155 CD LYS A 404 72.299 71.802 6.001 1.00 95.47 C ATOM 1156 CE LYS A 404 72.506 70.324 6.239 1.00 97.81 C ATOM 1157 NZ LYS A 404 72.474 70.048 7.699 1.00 97.62 N ATOM 1158 HZ1 LYS A 404 73.231 70.585 8.169 1.00 0.00 H ATOM 1159 HZ2 LYS A 404 71.552 70.336 8.085 1.00 0.00 H ATOM 1160 HZ3 LYS A 404 72.617 69.031 7.861 1.00 0.00 H ATOM 1161 H LYS A 404 70.936 74.697 5.890 1.00 0.00 H ATOM 1162 N SER A 405 73.381 76.790 5.116 1.00 53.00 N ATOM 1163 CA SER A 405 74.194 77.988 4.957 1.00 48.89 C ATOM 1164 C SER A 405 74.730 78.519 6.320 1.00 50.80 C ATOM 1165 O SER A 405 75.881 78.932 6.448 1.00 48.19 O ATOM 1166 CB SER A 405 73.345 79.111 4.398 1.00 50.48 C ATOM 1167 OG SER A 405 72.792 78.807 3.143 1.00 57.21 O ATOM 1168 HG SER A 405 72.217 78.005 3.223 1.00 0.00 H ATOM 1169 H SER A 405 72.358 76.819 4.931 1.00 0.00 H ATOM 1170 N PHE A 406 73.864 78.501 7.338 1.00 52.67 N ATOM 1171 CA PHE A 406 74.239 78.903 8.702 1.00 54.78 C ATOM 1172 C PHE A 406 75.420 77.978 9.164 1.00 51.67 C ATOM 1173 O PHE A 406 76.450 78.518 9.567 1.00 44.41 O ATOM 1174 CB PHE A 406 73.055 78.875 9.668 1.00 57.00 C ATOM 1175 CG PHE A 406 73.445 78.942 11.121 1.00 61.06 C ATOM 1176 CD1 PHE A 406 73.715 80.198 11.681 1.00 59.63 C ATOM 1177 CD2 PHE A 406 73.609 77.823 11.902 1.00 65.50 C ATOM 1178 CE1 PHE A 406 74.037 80.334 12.999 1.00 58.03 C ATOM 1179 CE2 PHE A 406 73.947 77.959 13.253 1.00 66.32 C ATOM 1180 CZ PHE A 406 74.171 79.216 13.786 1.00 61.99 C ATOM 1181 H PHE A 406 72.888 78.191 7.159 1.00 0.00 H ATOM 1182 N LYS A 407 75.319 76.635 9.049 1.00 53.72 N ATOM 1183 CA LYS A 407 76.386 75.733 9.516 1.00 59.85 C ATOM 1184 C LYS A 407 77.622 75.955 8.753 1.00 59.37 C ATOM 1185 O LYS A 407 78.690 76.075 9.388 1.00 61.04 O ATOM 1186 CB LYS A 407 76.037 74.277 9.408 1.00 66.49 C ATOM 1187 CG LYS A 407 75.119 73.670 10.403 1.00 73.03 C ATOM 1188 CD LYS A 407 75.626 73.787 11.853 1.00 76.78 C ATOM 1189 CE LYS A 407 74.512 73.477 12.829 1.00 82.10 C ATOM 1190 NZ LYS A 407 73.687 72.257 12.436 1.00 88.05 N ATOM 1191 HZ1 LYS A 407 73.252 72.419 11.505 1.00 0.00 H ATOM 1192 HZ2 LYS A 407 74.305 71.422 12.390 1.00 0.00 H ATOM 1193 HZ3 LYS A 407 72.943 72.100 13.145 1.00 0.00 H ATOM 1194 H LYS A 407 74.464 76.227 8.619 1.00 0.00 H ATOM 1195 N ARG A 408 77.476 76.149 7.449 1.00 54.58 N ATOM 1196 CA ARG A 408 78.676 76.390 6.667 1.00 53.04 C ATOM 1197 C ARG A 408 79.333 77.742 6.942 1.00 54.06 C ATOM 1198 O ARG A 408 80.542 77.827 7.084 1.00 58.54 O ATOM 1199 CB ARG A 408 78.326 76.219 5.160 1.00 55.48 C ATOM 1200 CG ARG A 408 79.471 76.293 4.156 1.00 51.01 C ATOM 1201 CD ARG A 408 78.998 76.013 2.699 1.00 63.21 C ATOM 1202 NE ARG A 408 78.575 77.259 2.075 1.00 56.86 N ATOM 1203 CZ ARG A 408 77.298 77.590 1.916 1.00 51.61 C ATOM 1204 NH1 ARG A 408 76.354 76.708 2.202 1.00 54.39 N ATOM 1205 NH2 ARG A 408 76.956 78.766 1.426 1.00 46.72 N ATOM 1206 HE ARG A 408 79.305 77.919 1.739 1.00 0.00 H ATOM 1207 HH12 ARG A 408 75.352 76.960 2.080 1.00 0.00 H ATOM 1208 HH11 ARG A 408 76.614 75.763 2.549 1.00 0.00 H ATOM 1209 HH22 ARG A 408 75.951 79.008 1.308 1.00 0.00 H ATOM 1210 HH21 ARG A 408 77.691 79.451 1.157 1.00 0.00 H ATOM 1211 H ARG A 408 76.537 76.129 7.003 1.00 0.00 H ATOM 1212 N LEU A 409 78.552 78.805 6.913 1.00 53.36 N ATOM 1213 CA LEU A 409 79.177 80.094 6.972 1.00 54.34 C ATOM 1214 C LEU A 409 79.413 80.589 8.376 1.00 58.60 C ATOM 1215 O LEU A 409 80.390 81.288 8.648 1.00 56.64 O ATOM 1216 CB LEU A 409 78.284 81.115 6.273 1.00 52.16 C ATOM 1217 CG LEU A 409 78.076 80.931 4.771 1.00 53.96 C ATOM 1218 CD1 LEU A 409 76.957 81.837 4.296 1.00 52.93 C ATOM 1219 CD2 LEU A 409 79.367 81.169 4.008 1.00 52.71 C ATOM 1220 H LEU A 409 77.518 78.711 6.850 1.00 0.00 H ATOM 1221 N LEU A 410 78.556 80.158 9.302 1.00 62.02 N ATOM 1222 CA LEU A 410 78.736 80.656 10.645 1.00 66.54 C ATOM 1223 C LEU A 410 79.364 79.686 11.641 1.00 76.61 C ATOM 1224 O LEU A 410 79.430 79.991 12.828 1.00 78.65 O ATOM 1225 CB LEU A 410 77.342 81.088 11.100 1.00 61.36 C ATOM 1226 CG LEU A 410 77.088 82.541 10.636 1.00 58.21 C ATOM 1227 CD1 LEU A 410 75.849 83.193 11.238 1.00 58.24 C ATOM 1228 CD2 LEU A 410 78.297 83.451 10.585 1.00 56.53 C ATOM 1229 H LEU A 410 77.792 79.493 9.067 1.00 0.00 H ATOM 1230 N GLY A 411 79.831 78.537 11.156 1.00 89.79 N ATOM 1231 CA GLY A 411 80.690 77.654 11.922 1.00102.90 C ATOM 1232 C GLY A 411 81.800 78.300 12.724 1.00110.49 C ATOM 1233 O GLY A 411 81.970 77.969 13.896 1.00111.04 O ATOM 1234 H GLY A 411 79.569 78.261 10.188 1.00 0.00 H ATOM 1235 N PRO A 412 82.552 79.239 12.112 1.00117.39 N ATOM 1236 CA PRO A 412 83.643 79.853 12.873 1.00119.70 C ATOM 1237 C PRO A 412 83.203 80.535 14.152 1.00120.85 C ATOM 1238 O PRO A 412 84.050 80.740 15.008 1.00131.45 O ATOM 1239 CB PRO A 412 84.205 80.888 11.894 1.00119.34 C ATOM 1240 CG PRO A 412 83.955 80.297 10.582 1.00120.30 C ATOM 1241 CD PRO A 412 82.626 79.608 10.687 1.00120.05 C ATOM 1242 N ILE A 413 81.937 80.904 14.291 1.00113.98 N ATOM 1243 CA ILE A 413 81.585 81.636 15.492 1.00107.14 C ATOM 1244 C ILE A 413 80.487 81.002 16.318 1.00 97.61 C ATOM 1245 O ILE A 413 79.828 81.703 17.089 1.00 93.66 O ATOM 1246 CB ILE A 413 81.147 83.094 15.163 1.00 63.78 C ATOM 1247 CG1 ILE A 413 79.924 83.125 14.246 1.00 61.61 C ATOM 1248 CG2 ILE A 413 82.275 83.855 14.530 1.00 66.59 C ATOM 1249 CD1 ILE A 413 79.118 84.395 14.346 1.00 59.34 C ATOM 1250 H ILE A 413 81.225 80.677 13.568 1.00 0.00 H ATOM 1251 N GLU A 414 80.274 79.695 16.190 1.00116.85 N ATOM 1252 CA GLU A 414 79.170 79.129 16.949 1.00108.18 C ATOM 1253 C GLU A 414 79.413 79.267 18.442 1.00106.44 C ATOM 1254 O GLU A 414 78.472 79.450 19.223 1.00103.96 O ATOM 1255 CB GLU A 414 78.903 77.654 16.628 1.00111.14 C ATOM 1256 CG GLU A 414 78.222 77.393 15.306 1.00107.53 C ATOM 1257 CD GLU A 414 78.028 75.906 15.054 1.00116.46 C ATOM 1258 OE1 GLU A 414 77.508 75.540 13.979 1.00114.62 O ATOM 1259 OE2 GLU A 414 78.358 75.100 15.959 1.00125.99 O ATOM 1260 H GLU A 414 80.870 79.105 15.575 1.00 0.00 H ATOM 1261 N ASP A 415 80.674 79.191 18.848 1.00107.05 N ATOM 1262 CA ASP A 415 80.967 79.376 20.255 1.00107.99 C ATOM 1263 C ASP A 415 80.673 80.759 20.835 1.00 98.22 C ATOM 1264 O ASP A 415 80.155 80.864 21.948 1.00 98.44 O ATOM 1265 CB ASP A 415 82.421 79.051 20.519 1.00118.45 C ATOM 1266 CG ASP A 415 82.725 79.046 21.981 1.00126.68 C ATOM 1267 OD1 ASP A 415 82.050 78.278 22.717 1.00129.86 O ATOM 1268 OD2 ASP A 415 83.582 79.829 22.403 1.00130.52 O ATOM 1269 H ASP A 415 81.438 79.002 18.169 1.00 0.00 H ATOM 1270 N ILE A 416 80.976 81.812 20.083 1.00 90.26 N ATOM 1271 CA ILE A 416 80.707 83.159 20.571 1.00 85.84 C ATOM 1272 C ILE A 416 79.203 83.370 20.639 1.00 83.92 C ATOM 1273 O ILE A 416 78.700 83.926 21.611 1.00 85.71 O ATOM 1274 CB ILE A 416 81.418 84.221 19.752 1.00 80.35 C ATOM 1275 CG1 ILE A 416 82.924 83.955 19.801 1.00 90.17 C ATOM 1276 CG2 ILE A 416 81.193 85.542 20.385 1.00 74.58 C ATOM 1277 CD1 ILE A 416 83.743 84.802 18.861 1.00 89.92 C ATOM 1278 H ILE A 416 81.405 81.675 19.146 1.00 0.00 H ATOM 1279 N LEU A 417 78.494 82.905 19.615 1.00 81.91 N ATOM 1280 CA LEU A 417 77.040 82.980 19.607 1.00 78.89 C ATOM 1281 C LEU A 417 76.472 82.225 20.799 1.00 85.93 C ATOM 1282 O LEU A 417 75.529 82.668 21.458 1.00 81.88 O ATOM 1283 CB LEU A 417 76.417 82.403 18.347 1.00 71.16 C ATOM 1284 CG LEU A 417 76.558 83.135 17.038 1.00 64.48 C ATOM 1285 CD1 LEU A 417 76.174 82.183 15.911 1.00 48.66 C ATOM 1286 CD2 LEU A 417 75.609 84.310 17.083 1.00 56.54 C ATOM 1287 H LEU A 417 78.987 82.480 18.804 1.00 0.00 H ATOM 1288 N HIS A 418 77.069 81.074 21.063 1.00 97.40 N ATOM 1289 CA HIS A 418 76.627 80.236 22.156 1.00105.20 C ATOM 1290 C HIS A 418 76.818 80.947 23.505 1.00108.57 C ATOM 1291 O HIS A 418 75.990 80.766 24.371 1.00109.02 O ATOM 1292 CB HIS A 418 77.368 78.898 22.120 1.00115.00 C ATOM 1293 CG HIS A 418 77.032 77.992 23.257 1.00124.51 C ATOM 1294 ND1 HIS A 418 77.762 77.956 24.426 1.00134.48 N ATOM 1295 CD2 HIS A 418 76.044 77.077 23.398 1.00126.54 C ATOM 1296 CE1 HIS A 418 77.235 77.057 25.240 1.00139.82 C ATOM 1297 NE2 HIS A 418 76.192 76.510 24.639 1.00135.74 N ATOM 1298 H HIS A 418 77.870 80.767 20.475 1.00 0.00 H ATOM 1299 N ARG A 419 77.910 81.645 23.789 1.00110.05 N ATOM 1300 CA ARG A 419 77.853 82.322 25.084 1.00115.79 C ATOM 1301 C ARG A 419 77.248 83.748 25.058 1.00108.95 C ATOM 1302 O ARG A 419 77.931 84.748 25.241 1.00110.01 O ATOM 1303 CB ARG A 419 79.186 82.299 25.794 1.00129.60 C ATOM 1304 CG ARG A 419 79.331 80.939 26.480 1.00141.16 C ATOM 1305 CD ARG A 419 80.587 80.793 27.287 1.00153.36 C ATOM 1306 NE ARG A 419 81.787 81.117 26.532 1.00156.84 N ATOM 1307 CZ ARG A 419 82.393 80.311 25.672 1.00160.31 C ATOM 1308 NH1 ARG A 419 83.488 80.733 25.064 1.00161.96 N ATOM 1309 NH2 ARG A 419 81.920 79.094 25.431 1.00162.30 N ATOM 1310 HE ARG A 419 82.204 82.058 26.679 1.00 0.00 H ATOM 1311 HH12 ARG A 419 83.977 80.115 24.386 1.00 0.00 H ATOM 1312 HH11 ARG A 419 83.860 81.683 25.264 1.00 0.00 H ATOM 1313 HH22 ARG A 419 82.406 78.472 24.754 1.00 0.00 H ATOM 1314 HH21 ARG A 419 81.064 78.763 25.920 1.00 0.00 H ATOM 1315 H ARG A 419 78.729 81.705 23.151 1.00 0.00 H ATOM 1316 N ASN A 420 75.973 83.778 24.705 1.00102.29 N ATOM 1317 CA ASN A 420 75.061 84.926 24.598 1.00 96.60 C ATOM 1318 C ASN A 420 73.846 84.321 25.238 1.00 98.14 C ATOM 1319 O ASN A 420 72.980 84.959 25.823 1.00 97.19 O ATOM 1320 CB ASN A 420 74.756 85.443 23.210 1.00 87.14 C ATOM 1321 CG ASN A 420 73.926 86.722 23.261 1.00 80.60 C ATOM 1322 OD1 ASN A 420 73.450 87.125 24.336 1.00 83.23 O ATOM 1323 ND2 ASN A 420 73.730 87.358 22.106 1.00 72.21 N ATOM 1324 HD22 ASN A 420 74.148 86.985 21.230 1.00 0.00 H ATOM 1325 HD21 ASN A 420 73.160 88.227 22.081 1.00 0.00 H ATOM 1326 H ASN A 420 75.555 82.855 24.469 1.00 0.00 H ATOM 1327 N VAL A 421 73.839 83.016 25.051 1.00 88.41 N ATOM 1328 CA VAL A 421 72.899 82.091 25.605 1.00 89.44 C ATOM 1329 C VAL A 421 72.980 82.253 27.106 1.00 91.95 C ATOM 1330 O VAL A 421 71.932 82.190 27.741 1.00 92.66 O ATOM 1331 CB VAL A 421 73.206 80.679 25.159 1.00 93.68 C ATOM 1332 CG1 VAL A 421 72.462 79.705 25.980 1.00 95.36 C ATOM 1333 CG2 VAL A 421 72.838 80.523 23.696 1.00 92.12 C ATOM 1334 H VAL A 421 74.586 82.622 24.444 1.00 0.00 H ATOM 1335 N GLU A 422 74.155 82.371 27.716 1.00 93.30 N ATOM 1336 CA GLU A 422 74.104 82.590 29.157 1.00 93.94 C ATOM 1337 C GLU A 422 73.246 83.810 29.424 1.00 86.12 C ATOM 1338 O GLU A 422 72.512 83.818 30.413 1.00 86.12 O ATOM 1339 CB GLU A 422 75.491 82.867 29.764 1.00100.72 C ATOM 1340 CG GLU A 422 76.595 81.818 29.702 1.00108.21 C ATOM 1341 CD GLU A 422 76.199 80.469 30.283 1.00113.36 C ATOM 1342 OE1 GLU A 422 75.048 80.282 30.734 1.00112.41 O ATOM 1343 OE2 GLU A 422 77.074 79.578 30.285 1.00118.86 O ATOM 1344 H GLU A 422 75.055 82.311 27.198 1.00 0.00 H ATOM 1345 N ASN A 423 73.324 84.847 28.591 1.00 80.00 N ATOM 1346 CA ASN A 423 72.458 85.953 28.913 1.00 75.98 C ATOM 1347 C ASN A 423 70.987 85.568 28.750 1.00 69.16 C ATOM 1348 O ASN A 423 70.114 86.155 29.427 1.00 64.58 O ATOM 1349 CB ASN A 423 72.765 87.134 28.000 1.00 78.05 C ATOM 1350 CG ASN A 423 74.086 87.770 28.321 1.00 86.40 C ATOM 1351 OD1 ASN A 423 74.665 87.523 29.382 1.00 92.60 O ATOM 1352 ND2 ASN A 423 74.599 88.567 27.391 1.00 87.65 N ATOM 1353 HD22 ASN A 423 74.073 88.746 26.512 1.00 0.00 H ATOM 1354 HD21 ASN A 423 75.527 89.013 27.542 1.00 0.00 H ATOM 1355 H ASN A 423 73.962 84.857 27.770 1.00 0.00 H ATOM 1356 N TYR A 424 70.700 84.600 27.861 1.00 65.32 N ATOM 1357 CA TYR A 424 69.322 84.143 27.763 1.00 62.25 C ATOM 1358 C TYR A 424 68.863 83.510 29.084 1.00 63.24 C ATOM 1359 O TYR A 424 67.685 83.571 29.425 1.00 59.91 O ATOM 1360 CB TYR A 424 69.163 83.099 26.651 1.00 62.60 C ATOM 1361 CG TYR A 424 69.315 83.609 25.240 1.00 60.09 C ATOM 1362 CD1 TYR A 424 68.916 84.889 24.880 1.00 56.73 C ATOM 1363 CD2 TYR A 424 69.844 82.777 24.246 1.00 60.99 C ATOM 1364 CE1 TYR A 424 69.076 85.343 23.568 1.00 54.06 C ATOM 1365 CE2 TYR A 424 70.007 83.210 22.953 1.00 57.50 C ATOM 1366 CZ TYR A 424 69.613 84.484 22.607 1.00 57.17 C ATOM 1367 OH TYR A 424 69.787 84.918 21.296 1.00 58.78 O ATOM 1368 HH TYR A 424 69.456 85.847 21.211 1.00 0.00 H ATOM 1369 H TYR A 424 71.443 84.189 27.260 1.00 0.00 H ATOM 1370 N LYS A 425 69.796 82.850 29.797 1.00 67.36 N ATOM 1371 CA LYS A 425 69.408 82.156 31.030 1.00 72.60 C ATOM 1372 C LYS A 425 68.937 83.091 32.089 1.00 71.82 C ATOM 1373 O LYS A 425 68.000 82.819 32.806 1.00 73.91 O ATOM 1374 CB LYS A 425 70.549 81.363 31.649 1.00 77.04 C ATOM 1375 CG LYS A 425 70.957 80.055 31.050 1.00 80.59 C ATOM 1376 CD LYS A 425 71.882 79.458 32.091 1.00 87.46 C ATOM 1377 CE LYS A 425 72.448 78.123 31.738 1.00 93.33 C ATOM 1378 NZ LYS A 425 73.295 77.701 32.889 1.00101.25 N ATOM 1379 HZ1 LYS A 425 74.053 78.399 33.034 1.00 0.00 H ATOM 1380 HZ2 LYS A 425 72.708 77.641 33.746 1.00 0.00 H ATOM 1381 HZ3 LYS A 425 73.713 76.770 32.687 1.00 0.00 H ATOM 1382 H LYS A 425 70.785 82.832 29.476 1.00 0.00 H ATOM 1383 N LYS A 426 69.639 84.195 32.168 1.00 69.97 N ATOM 1384 CA LYS A 426 69.318 85.194 33.124 1.00 69.98 C ATOM 1385 C LYS A 426 67.898 85.642 32.912 1.00 66.21 C ATOM 1386 O LYS A 426 67.150 85.698 33.861 1.00 70.31 O ATOM 1387 CB LYS A 426 70.270 86.365 33.010 1.00 70.20 C ATOM 1388 CG LYS A 426 71.728 85.981 32.968 1.00 76.18 C ATOM 1389 CD LYS A 426 72.599 87.129 33.449 1.00 80.43 C ATOM 1390 CE LYS A 426 74.056 86.723 33.582 1.00 87.86 C ATOM 1391 NZ LYS A 426 74.961 87.900 33.627 1.00 89.82 N ATOM 1392 HZ1 LYS A 426 74.856 88.450 32.751 1.00 0.00 H ATOM 1393 HZ2 LYS A 426 74.714 88.495 34.443 1.00 0.00 H ATOM 1394 HZ3 LYS A 426 75.945 87.576 33.718 1.00 0.00 H ATOM 1395 H LYS A 426 70.441 84.341 31.522 1.00 0.00 H ATOM 1396 N VAL A 427 67.510 85.953 31.682 1.00 54.70 N ATOM 1397 CA VAL A 427 66.155 86.394 31.482 1.00 54.02 C ATOM 1398 C VAL A 427 65.127 85.290 31.787 1.00 56.13 C ATOM 1399 O VAL A 427 64.125 85.554 32.460 1.00 48.73 O ATOM 1400 CB VAL A 427 65.955 86.809 29.984 1.00 52.93 C ATOM 1401 CG1 VAL A 427 64.507 87.101 29.679 1.00 50.78 C ATOM 1402 CG2 VAL A 427 66.853 87.991 29.585 1.00 50.93 C ATOM 1403 H VAL A 427 68.170 85.880 30.881 1.00 0.00 H ATOM 1404 N LEU A 428 65.431 84.048 31.415 1.00 55.06 N ATOM 1405 CA LEU A 428 64.528 82.931 31.683 1.00 54.90 C ATOM 1406 C LEU A 428 64.367 82.824 33.201 1.00 61.27 C ATOM 1407 O LEU A 428 63.266 82.647 33.729 1.00 62.09 O ATOM 1408 CB LEU A 428 65.020 81.654 30.998 1.00 55.70 C ATOM 1409 CG LEU A 428 64.954 81.892 29.469 1.00 55.62 C ATOM 1410 CD1 LEU A 428 65.538 80.770 28.606 1.00 58.10 C ATOM 1411 CD2 LEU A 428 63.517 82.163 29.014 1.00 53.07 C ATOM 1412 H LEU A 428 66.330 83.869 30.923 1.00 0.00 H ATOM 1413 N ASN A 429 65.480 82.933 33.901 1.00 64.98 N ATOM 1414 CA ASN A 429 65.472 82.943 35.343 1.00 69.50 C ATOM 1415 C ASN A 429 64.855 84.192 35.945 1.00 67.82 C ATOM 1416 O ASN A 429 64.116 84.098 36.891 1.00 73.33 O ATOM 1417 CB ASN A 429 66.875 82.746 35.874 1.00 73.54 C ATOM 1418 CG ASN A 429 67.336 81.321 35.754 1.00 79.50 C ATOM 1419 OD1 ASN A 429 66.557 80.407 35.930 1.00 82.46 O ATOM 1420 ND2 ASN A 429 68.606 81.129 35.447 1.00 72.40 N ATOM 1421 HD22 ASN A 429 69.236 81.944 35.306 1.00 0.00 H ATOM 1422 HD21 ASN A 429 68.976 80.162 35.347 1.00 0.00 H ATOM 1423 H ASN A 429 66.387 83.014 33.399 1.00 0.00 H ATOM 1424 N GLU A 430 65.064 85.343 35.331 1.00 64.74 N ATOM 1425 CA GLU A 430 64.583 86.610 35.843 1.00 65.61 C ATOM 1426 C GLU A 430 63.082 86.424 35.984 1.00 66.31 C ATOM 1427 O GLU A 430 62.483 86.956 36.885 1.00 64.33 O ATOM 1428 CB GLU A 430 64.794 87.720 34.782 1.00 71.03 C ATOM 1429 CG GLU A 430 65.872 88.814 34.933 1.00 73.28 C ATOM 1430 CD GLU A 430 65.882 89.872 33.786 1.00 69.88 C ATOM 1431 OE1 GLU A 430 66.898 90.075 33.130 1.00 64.61 O ATOM 1432 OE2 GLU A 430 64.895 90.537 33.537 1.00 43.43 O ATOM 1433 H GLU A 430 65.599 85.339 34.439 1.00 0.00 H ATOM 1434 N LEU A 431 62.483 85.684 35.060 1.00 69.97 N ATOM 1435 CA LEU A 431 61.035 85.617 34.907 1.00 69.49 C ATOM 1436 C LEU A 431 60.396 84.325 35.330 1.00 74.57 C ATOM 1437 O LEU A 431 59.215 84.123 35.161 1.00 77.17 O ATOM 1438 CB LEU A 431 60.666 85.849 33.464 1.00 63.97 C ATOM 1439 CG LEU A 431 61.241 87.112 32.894 1.00 61.64 C ATOM 1440 CD1 LEU A 431 61.099 87.129 31.395 1.00 61.69 C ATOM 1441 CD2 LEU A 431 60.505 88.267 33.502 1.00 61.63 C ATOM 1442 H LEU A 431 63.075 85.125 34.414 1.00 0.00 H ATOM 1443 N GLY A 432 61.185 83.439 35.879 1.00 77.53 N ATOM 1444 CA GLY A 432 60.697 82.159 36.367 1.00 80.44 C ATOM 1445 C GLY A 432 60.222 81.144 35.332 1.00 79.84 C ATOM 1446 O GLY A 432 59.381 80.304 35.667 1.00 81.68 O ATOM 1447 H GLY A 432 62.198 83.657 35.970 1.00 0.00 H ATOM 1448 N LEU A 433 60.767 81.213 34.109 1.00 75.87 N ATOM 1449 CA LEU A 433 60.385 80.343 32.979 1.00 78.50 C ATOM 1450 C LEU A 433 61.278 79.124 32.849 1.00 83.28 C ATOM 1451 O LEU A 433 62.376 79.099 33.389 1.00 84.18 O ATOM 1452 CB LEU A 433 60.416 81.109 31.642 1.00 75.29 C ATOM 1453 CG LEU A 433 59.751 82.482 31.620 1.00 74.75 C ATOM 1454 CD1 LEU A 433 59.905 83.197 30.338 1.00 64.09 C ATOM 1455 CD2 LEU A 433 58.253 82.257 31.891 1.00 81.18 C ATOM 1456 H LEU A 433 61.507 81.926 33.946 1.00 0.00 H ATOM 1457 N ASP A 434 60.827 78.125 32.101 1.00 87.32 N ATOM 1458 CA ASP A 434 61.626 76.921 31.919 1.00 94.63 C ATOM 1459 C ASP A 434 62.936 77.223 31.193 1.00 87.75 C ATOM 1460 O ASP A 434 62.967 77.985 30.227 1.00 83.05 O ATOM 1461 CB ASP A 434 60.831 75.863 31.151 1.00103.87 C ATOM 1462 CG ASP A 434 59.708 75.265 31.976 1.00117.38 C ATOM 1463 OD1 ASP A 434 59.714 75.448 33.212 1.00124.25 O ATOM 1464 OD2 ASP A 434 58.821 74.611 31.389 1.00121.55 O ATOM 1465 H ASP A 434 59.897 78.202 31.642 1.00 0.00 H ATOM 1466 N THR A 435 64.013 76.607 31.670 1.00 90.81 N ATOM 1467 CA THR A 435 65.332 76.704 31.041 1.00 88.53 C ATOM 1468 C THR A 435 65.883 75.410 30.438 1.00 95.30 C ATOM 1469 O THR A 435 67.028 75.378 29.988 1.00 95.15 O ATOM 1470 CB THR A 435 66.392 77.177 32.047 1.00 87.11 C ATOM 1471 OG1 THR A 435 66.486 76.233 33.129 1.00 82.41 O ATOM 1472 CG2 THR A 435 66.062 78.568 32.566 1.00 79.16 C ATOM 1473 HG1 THR A 435 67.170 76.541 33.775 1.00 0.00 H ATOM 1474 H THR A 435 63.914 76.030 32.529 1.00 0.00 H ATOM 1475 N THR A 436 65.105 74.334 30.460 1.00102.98 N ATOM 1476 CA THR A 436 65.587 73.070 29.905 1.00110.43 C ATOM 1477 C THR A 436 65.791 73.119 28.401 1.00106.51 C ATOM 1478 O THR A 436 66.534 72.313 27.845 1.00109.32 O ATOM 1479 CB THR A 436 64.631 71.912 30.226 1.00118.30 C ATOM 1480 OG1 THR A 436 63.384 72.118 29.554 1.00115.74 O ATOM 1481 CG2 THR A 436 64.395 71.818 31.718 1.00123.64 C ATOM 1482 HG1 THR A 436 62.770 71.370 29.763 1.00 0.00 H ATOM 1483 H THR A 436 64.152 74.390 30.872 1.00 0.00 H ATOM 1484 N CYS A 437 65.175 74.100 27.756 1.00100.81 N ATOM 1485 CA CYS A 437 65.369 74.300 26.325 1.00 96.53 C ATOM 1486 C CYS A 437 66.782 74.744 25.936 1.00 97.88 C ATOM 1487 O CYS A 437 67.196 74.621 24.788 1.00 97.46 O ATOM 1488 CB CYS A 437 64.324 75.318 25.887 1.00 88.87 C ATOM 1489 SG CYS A 437 64.501 76.919 26.743 1.00109.16 S ATOM 1490 H CYS A 437 64.542 74.738 28.280 1.00 0.00 H ATOM 1491 N ILE A 438 67.495 75.296 26.900 1.00100.26 N ATOM 1492 CA ILE A 438 68.896 75.679 26.751 1.00102.97 C ATOM 1493 C ILE A 438 69.917 74.651 27.208 1.00115.77 C ATOM 1494 O ILE A 438 70.830 74.272 26.483 1.00120.20 O ATOM 1495 CB ILE A 438 69.181 76.965 27.475 1.00 96.79 C ATOM 1496 CG1 ILE A 438 68.363 78.086 26.839 1.00 89.54 C ATOM 1497 CG2 ILE A 438 70.612 77.312 27.275 1.00 96.09 C ATOM 1498 CD1 ILE A 438 68.702 79.457 27.371 1.00 86.54 C ATOM 1499 H ILE A 438 67.033 75.468 27.816 1.00 0.00 H ATOM 1500 N ASP A 439 69.721 74.210 28.444 1.00123.90 N ATOM 1501 CA ASP A 439 70.451 73.097 29.025 1.00134.53 C ATOM 1502 C ASP A 439 69.850 71.745 28.656 1.00140.51 C ATOM 1503 O ASP A 439 70.481 70.962 27.936 1.00144.31 O ATOM 1504 CB ASP A 439 70.460 73.274 30.547 1.00140.51 C ATOM 1505 CG ASP A 439 71.358 72.277 31.259 1.00152.67 C ATOM 1506 OD1 ASP A 439 71.396 72.285 32.513 1.00157.75 O ATOM 1507 OD2 ASP A 439 72.001 71.451 30.574 1.00158.06 O ATOM 1508 H ASP A 439 69.006 74.687 29.029 1.00 0.00 H TER 1509 ASP A 439 HETATM 1510 O HOH 1 73.377 84.142 20.333 1.00 49.34 O HETATM 1511 O HOH 2 68.599 87.360 20.116 1.00 44.59 O HETATM 1512 O HOH 3 59.015 82.532 9.248 1.00 51.28 O HETATM 1513 O HOH 4 66.188 87.511 26.252 1.00 37.88 O HETATM 1514 O HOH 5 70.795 90.403 18.764 1.00 59.48 O HETATM 1515 O HOH 6 68.075 74.098 5.625 1.00 63.76 O HETATM 1516 O HOH 7 70.760 89.450 21.005 1.00 65.43 O HETATM 1517 C1 UNN A 8 65.832 81.815 24.566 1.00 0.16 C HETATM 1518 N4 UNN A 8 65.811 82.619 25.686 1.00 -0.26 N HETATM 1519 C4 UNN A 8 65.689 83.964 25.557 1.00 0.13 C HETATM 1520 C3 UNN A 8 65.593 84.475 24.240 1.00 0.10 C HETATM 1521 C2 UNN A 8 65.637 83.652 23.101 1.00 0.16 C HETATM 1522 N1 UNN A 8 65.529 84.471 22.114 1.00 -0.19 N HETATM 1523 C7 UNN A 8 65.528 84.172 20.772 1.00 0.20 C HETATM 1524 O3 UNN A 8 64.122 83.689 20.263 1.00 -0.34 O HETATM 1525 C6 UNN A 8 64.509 82.557 19.342 1.00 0.13 C HETATM 1526 C5 UNN A 8 63.433 81.593 19.255 1.00 0.12 C HETATM 1527 O2 UNN A 8 63.909 80.529 18.153 1.00 -0.22 O HETATM 1528 P1 UNN A 8 65.512 80.011 18.656 1.00 0.33 P HETATM 1529 S1 UNN A 8 65.270 78.861 20.370 1.00 -0.01 S HETATM 1530 H1 UNN A 8 64.870 79.429 21.101 1.00 0.13 H HETATM 1531 O1 UNN A 8 66.101 79.051 17.684 1.00 -0.53 O HETATM 1532 O5 UNN A 8 66.410 81.247 18.957 1.00 -0.22 O HETATM 1533 C9 UNN A 8 65.750 82.034 19.883 1.00 0.16 C HETATM 1534 C8 UNN A 8 66.524 83.198 20.316 1.00 0.15 C HETATM 1535 O4 UNN A 8 67.263 83.802 19.227 1.00 -0.38 O HETATM 1536 H7 UNN A 8 67.917 83.190 18.912 1.00 0.21 H HETATM 1537 H6 UNN A 8 67.213 82.920 21.127 1.00 0.07 H HETATM 1538 H8 UNN A 8 65.529 81.408 20.760 1.00 0.07 H HETATM 1539 H2 UNN A 8 63.278 81.100 20.226 1.00 0.07 H HETATM 1540 H3 UNN A 8 62.500 82.084 18.940 1.00 0.07 H HETATM 1541 H4 UNN A 8 64.697 82.947 18.331 1.00 0.07 H HETATM 1542 H5 UNN A 8 65.756 85.117 20.258 1.00 0.10 H HETATM 1543 C10 UNN A 8 65.432 85.690 22.369 1.00 0.11 C HETATM 1544 N2 UNN A 8 65.469 85.816 23.719 1.00 -0.30 N HETATM 1545 H9 UNN A 8 65.336 86.498 21.645 1.00 0.13 H HETATM 1546 N5 UNN A 8 65.755 82.342 23.299 1.00 -0.26 N HETATM 1547 N3 UNN A 8 65.649 84.842 26.675 1.00 -0.32 N HETATM 1548 H10 UNN A 8 65.719 84.463 27.630 1.00 0.18 H HETATM 1549 H11 UNN A 8 65.550 85.857 26.530 1.00 0.18 H HETATM 1550 CL1 UNN A 8 65.994 80.081 24.776 1.00 -0.02 CL CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 1517 1518 1546 1550 CONECT 1518 1517 1519 CONECT 1519 1518 1520 1547 CONECT 1520 1519 1521 1544 CONECT 1521 1520 1522 1546 CONECT 1522 1521 1523 1543 CONECT 1523 1522 1524 1534 1542 CONECT 1524 1523 1525 CONECT 1525 1524 1526 1533 1541 CONECT 1526 1525 1527 1539 1540 CONECT 1527 1526 1528 CONECT 1528 1527 1529 1531 1532 CONECT 1529 1528 1530 CONECT 1530 1529 CONECT 1531 1528 CONECT 1532 1528 1533 CONECT 1533 1525 1532 1534 1538 CONECT 1534 1523 1533 1535 1537 CONECT 1535 1534 1536 CONECT 1536 1535 CONECT 1537 1534 CONECT 1538 1533 CONECT 1539 1526 CONECT 1540 1526 CONECT 1541 1525 CONECT 1542 1523 CONECT 1543 1522 1544 1545 CONECT 1544 1520 1543 CONECT 1545 1543 CONECT 1546 1517 1521 CONECT 1547 1519 1548 1549 CONECT 1548 1547 CONECT 1549 1547 CONECT 1550 1517 MASTER 0 0 0 0 0 0 0 0 1549 1 38 12 END
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Related entries of code: 5t3n
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5k8s
RCSB PDB
PDBbind
148aa, >5K8S_1|Chains... at 97%
5kbf
RCSB PDB
PDBbind
301aa, >5KBF_1|Chains... *
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
5t3n
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
CAMP-dependent protein kinase regulatory subunit (PfPKAR 297-441)
Ligand Name
75G
EC.Number
E.C.2.7.11.11
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
Kd=9.1nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) J. Biol. Chem. Vol. 291: pp. 25375-25386
Ligand Properties
Formula
C
1
0
H
1
1
ClN
5
O
5
PS
Molecular Weight
379.717
Exact Mass
378.991
No. of atoms
34
No. of bonds
37
Polar Surface Area
183.22
LOGP Value
-0.62 (
Computed with XLOGP3
)
1.35 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 4
Canonical SMILES
O[C@@H]1[C@@H]2O[P@@](=O)(S)OC[C@H]2O[C@H]1n1cnc2c1nc(Cl)nc2N
InChI String
InChI=1S/C10H11ClN5O5PS/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-5(17)6-3(20-9)1-19-22(18,23)21-6/h2-3,5-6,9,17H,1H2,(H,18,23)(H2,12,14,15)/t3-,5-,6-,9-,22+/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):
Q7KQK0
Entrez Gene ID
NCBI Entrez Gene ID:
811274
ASD
Information of known allosteric effects of PDB entries
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