Browse entries in the PDBbind-CN Database
HEADER 5Q16_COMPLEX COMPND 5Q16_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 230 MET GLU LEU THR PRO ASP GLN GLN THR LEU LEU HIS PHE SEQRES 2 A 230 ILE MET ASP SER TYR ASN LYS GLN ARG MET PRO GLN GLU SEQRES 3 A 230 ILE THR ASN LYS ILE LEU LYS GLU ALA PHE SER ALA GLU SEQRES 4 A 230 GLU ASN PHE LEU ILE LEU THR GLU MET ALA THR ASN HIS SEQRES 5 A 230 VAL GLN VAL LEU VAL GLU PHE THR LYS LYS LEU PRO GLY SEQRES 6 A 230 PHE GLN THR LEU ASP HIS GLU ASP GLN ILE ALA LEU LEU SEQRES 7 A 230 LYS GLY SER ALA VAL GLU ALA MET PHE LEU ARG SER ALA SEQRES 8 A 230 GLU ILE PHE ASN LYS LYS LEU PRO SER GLY HIS SER ASP SEQRES 9 A 230 LEU LEU GLU ALA ARG ILE ARG ASN SER GLY ILE SER ASP SEQRES 10 A 230 GLU TYR ILE THR PRO MET PHE SER PHE TYR LYS SER ILE SEQRES 11 A 230 GLY GLU LEU LYS MET THR GLN GLU GLU TYR ALA LEU LEU SEQRES 12 A 230 THR ALA ILE VAL ILE LEU SER PRO ASP ARG GLN TYR ILE SEQRES 13 A 230 LYS ASP ARG GLU ALA VAL GLU LYS LEU GLN GLU PRO LEU SEQRES 14 A 230 LEU ASP VAL LEU GLN LYS LEU CYS LYS ILE HIS GLN PRO SEQRES 15 A 230 GLU ASN PRO GLN HIS PHE ALA CYS LEU LEU GLY ARG LEU SEQRES 16 A 230 THR GLU LEU ARG THR PHE ASN HIS HIS HIS ALA GLU MET SEQRES 17 A 230 LEU MET SER TRP ARG VAL ASN ASP HIS LYS PHE THR PRO SEQRES 18 A 230 LEU LEU CYS GLU ILE TRP ASP VAL GLN HET UNN A 334 71 ATOM 1 N MET A 247 40.525 17.256 66.046 1.00 67.07 N ATOM 2 CA MET A 247 39.834 16.863 67.277 1.00 64.81 C ATOM 3 C MET A 247 40.222 17.742 68.477 1.00 67.17 C ATOM 4 O MET A 247 39.436 17.876 69.414 1.00 64.76 O ATOM 5 CB MET A 247 40.107 15.398 67.587 1.00 66.92 C ATOM 6 HN3 MET A 247 41.552 17.173 66.185 1.00 0.00 H ATOM 7 HN2 MET A 247 40.284 18.241 65.814 1.00 0.00 H ATOM 8 HN1 MET A 247 40.228 16.632 65.269 1.00 0.00 H ATOM 9 N GLU A 248 41.441 18.315 68.448 1.00 64.65 N ATOM 10 CA GLU A 248 42.015 19.177 69.481 1.00 63.53 C ATOM 11 C GLU A 248 41.321 20.531 69.548 1.00 62.53 C ATOM 12 O GLU A 248 40.772 20.993 68.544 1.00 62.03 O ATOM 13 CB GLU A 248 43.526 19.360 69.245 1.00 67.95 C ATOM 14 CG GLU A 248 44.373 18.260 69.867 1.00 82.73 C ATOM 15 CD GLU A 248 45.829 18.555 70.160 1.00111.56 C ATOM 16 OE1 GLU A 248 46.294 19.671 69.832 1.00111.12 O ATOM 17 OE2 GLU A 248 46.495 17.665 70.739 1.00108.74 O ATOM 18 H GLU A 248 42.030 18.127 67.612 1.00 0.00 H ATOM 19 N LEU A 249 41.348 21.167 70.731 1.00 55.42 N ATOM 20 CA LEU A 249 40.759 22.484 70.955 1.00 52.71 C ATOM 21 C LEU A 249 41.585 23.547 70.237 1.00 56.43 C ATOM 22 O LEU A 249 42.809 23.438 70.184 1.00 58.28 O ATOM 23 CB LEU A 249 40.721 22.821 72.457 1.00 51.36 C ATOM 24 CG LEU A 249 39.878 21.945 73.388 1.00 54.41 C ATOM 25 CD1 LEU A 249 40.124 22.324 74.835 1.00 54.06 C ATOM 26 CD2 LEU A 249 38.399 22.082 73.094 1.00 54.58 C ATOM 27 H LEU A 249 41.814 20.695 71.532 1.00 0.00 H ATOM 28 N THR A 250 40.915 24.579 69.704 1.00 51.29 N ATOM 29 CA THR A 250 41.552 25.712 69.033 1.00 52.04 C ATOM 30 C THR A 250 41.996 26.717 70.121 1.00 55.06 C ATOM 31 O THR A 250 41.497 26.608 71.247 1.00 52.17 O ATOM 32 CB THR A 250 40.560 26.380 68.053 1.00 57.33 C ATOM 33 OG1 THR A 250 39.447 26.904 68.785 1.00 52.50 O ATOM 34 CG2 THR A 250 40.104 25.449 66.930 1.00 54.51 C ATOM 35 HG1 THR A 250 38.992 26.167 69.265 1.00 0.00 H ATOM 36 H THR A 250 39.877 24.574 69.772 1.00 0.00 H ATOM 37 N PRO A 251 42.873 27.723 69.832 1.00 53.50 N ATOM 38 CA PRO A 251 43.240 28.698 70.881 1.00 53.50 C ATOM 39 C PRO A 251 42.028 29.418 71.484 1.00 55.14 C ATOM 40 O PRO A 251 42.019 29.673 72.687 1.00 53.93 O ATOM 41 CB PRO A 251 44.178 29.670 70.157 1.00 57.78 C ATOM 42 CG PRO A 251 44.704 28.900 68.999 1.00 63.76 C ATOM 43 CD PRO A 251 43.576 28.021 68.566 1.00 57.33 C ATOM 44 N ASP A 252 40.993 29.701 70.658 1.00 51.18 N ATOM 45 CA ASP A 252 39.750 30.351 71.081 1.00 48.99 C ATOM 46 C ASP A 252 38.955 29.479 72.054 1.00 50.65 C ATOM 47 O ASP A 252 38.432 29.995 73.043 1.00 49.30 O ATOM 48 CB ASP A 252 38.880 30.729 69.868 1.00 50.56 C ATOM 49 CG ASP A 252 39.348 31.947 69.088 1.00 62.01 C ATOM 50 OD1 ASP A 252 40.539 32.307 69.204 1.00 64.52 O ATOM 51 OD2 ASP A 252 38.527 32.526 68.340 1.00 66.50 O ATOM 52 H ASP A 252 41.087 29.439 69.656 1.00 0.00 H ATOM 53 N GLN A 253 38.871 28.164 71.778 1.00 46.16 N ATOM 54 CA GLN A 253 38.158 27.198 72.614 1.00 43.61 C ATOM 55 C GLN A 253 38.863 26.974 73.949 1.00 46.97 C ATOM 56 O GLN A 253 38.187 26.794 74.964 1.00 44.84 O ATOM 57 CB GLN A 253 37.958 25.869 71.872 1.00 44.55 C ATOM 58 CG GLN A 253 36.984 25.969 70.706 1.00 45.50 C ATOM 59 CD GLN A 253 36.872 24.685 69.930 1.00 58.99 C ATOM 60 OE1 GLN A 253 37.847 23.959 69.714 1.00 48.43 O ATOM 61 NE2 GLN A 253 35.668 24.395 69.465 1.00 54.10 N ATOM 62 HE22 GLN A 253 34.867 25.028 69.665 1.00 0.00 H ATOM 63 HE21 GLN A 253 35.522 23.534 68.900 1.00 0.00 H ATOM 64 H GLN A 253 39.341 27.814 70.919 1.00 0.00 H ATOM 65 N GLN A 254 40.211 26.977 73.947 1.00 45.97 N ATOM 66 CA GLN A 254 41.022 26.849 75.158 1.00 47.05 C ATOM 67 C GLN A 254 40.799 28.086 76.036 1.00 50.25 C ATOM 68 O GLN A 254 40.659 27.941 77.248 1.00 48.99 O ATOM 69 CB GLN A 254 42.513 26.663 74.818 1.00 51.50 C ATOM 70 CG GLN A 254 42.873 25.212 74.507 1.00 74.70 C ATOM 71 CD GLN A 254 44.309 25.028 74.078 1.00101.57 C ATOM 72 OE1 GLN A 254 44.781 25.633 73.109 1.00101.18 O ATOM 73 NE2 GLN A 254 45.019 24.139 74.757 1.00 94.74 N ATOM 74 HE22 GLN A 254 44.595 23.645 75.568 1.00 0.00 H ATOM 75 HE21 GLN A 254 46.000 23.935 74.479 1.00 0.00 H ATOM 76 H GLN A 254 40.701 27.076 73.035 1.00 0.00 H ATOM 77 N THR A 255 40.708 29.280 75.406 1.00 48.38 N ATOM 78 CA THR A 255 40.440 30.574 76.045 1.00 48.34 C ATOM 79 C THR A 255 39.053 30.525 76.678 1.00 50.03 C ATOM 80 O THR A 255 38.907 30.903 77.841 1.00 49.87 O ATOM 81 CB THR A 255 40.596 31.712 75.012 1.00 58.67 C ATOM 82 OG1 THR A 255 41.961 31.781 74.605 1.00 62.60 O ATOM 83 CG2 THR A 255 40.133 33.073 75.520 1.00 57.01 C ATOM 84 HG1 THR A 255 42.227 30.919 74.197 1.00 0.00 H ATOM 85 H THR A 255 40.840 29.281 74.374 1.00 0.00 H ATOM 86 N LEU A 256 38.049 30.041 75.921 1.00 44.78 N ATOM 87 CA LEU A 256 36.670 29.901 76.395 1.00 42.51 C ATOM 88 C LEU A 256 36.596 28.927 77.575 1.00 43.15 C ATOM 89 O LEU A 256 35.974 29.259 78.582 1.00 41.52 O ATOM 90 CB LEU A 256 35.739 29.468 75.237 1.00 41.94 C ATOM 91 CG LEU A 256 34.300 29.064 75.575 1.00 44.80 C ATOM 92 CD1 LEU A 256 33.547 30.187 76.282 1.00 44.37 C ATOM 93 CD2 LEU A 256 33.562 28.648 74.330 1.00 44.94 C ATOM 94 H LEU A 256 38.265 29.751 74.946 1.00 0.00 H ATOM 95 N LEU A 257 37.259 27.758 77.463 1.00 40.73 N ATOM 96 CA LEU A 257 37.288 26.744 78.515 1.00 40.23 C ATOM 97 C LEU A 257 37.865 27.265 79.837 1.00 44.72 C ATOM 98 O LEU A 257 37.222 27.089 80.870 1.00 42.45 O ATOM 99 CB LEU A 257 38.007 25.461 78.030 1.00 41.42 C ATOM 100 CG LEU A 257 38.230 24.318 79.051 1.00 46.59 C ATOM 101 CD1 LEU A 257 36.920 23.724 79.523 1.00 45.47 C ATOM 102 CD2 LEU A 257 39.094 23.233 78.455 1.00 52.55 C ATOM 103 H LEU A 257 37.777 27.568 76.581 1.00 0.00 H ATOM 104 N HIS A 258 39.051 27.933 79.809 1.00 43.35 N ATOM 105 CA HIS A 258 39.664 28.481 81.028 1.00 44.61 C ATOM 106 C HIS A 258 38.816 29.584 81.654 1.00 45.87 C ATOM 107 O HIS A 258 38.753 29.679 82.880 1.00 45.93 O ATOM 108 CB HIS A 258 41.113 28.955 80.807 1.00 48.88 C ATOM 109 CG HIS A 258 42.061 27.868 80.401 1.00 54.51 C ATOM 110 ND1 HIS A 258 42.664 27.873 79.164 1.00 58.12 N ATOM 111 CD2 HIS A 258 42.507 26.792 81.096 1.00 56.99 C ATOM 112 CE1 HIS A 258 43.422 26.788 79.120 1.00 58.61 C ATOM 113 NE2 HIS A 258 43.366 26.108 80.262 1.00 58.59 N ATOM 114 H HIS A 258 39.538 28.059 78.899 1.00 0.00 H ATOM 115 N PHE A 259 38.130 30.389 80.814 1.00 41.77 N ATOM 116 CA PHE A 259 37.251 31.464 81.266 1.00 40.48 C ATOM 117 C PHE A 259 36.032 30.910 82.018 1.00 42.22 C ATOM 118 O PHE A 259 35.650 31.471 83.050 1.00 41.75 O ATOM 119 CB PHE A 259 36.818 32.350 80.091 1.00 41.93 C ATOM 120 CG PHE A 259 36.078 33.600 80.507 1.00 43.59 C ATOM 121 CD1 PHE A 259 36.761 34.700 81.016 1.00 48.49 C ATOM 122 CD2 PHE A 259 34.701 33.688 80.373 1.00 44.69 C ATOM 123 CE1 PHE A 259 36.071 35.862 81.389 1.00 50.03 C ATOM 124 CE2 PHE A 259 34.013 34.850 80.753 1.00 47.73 C ATOM 125 CZ PHE A 259 34.700 35.927 81.254 1.00 47.53 C ATOM 126 H PHE A 259 38.233 30.235 79.791 1.00 0.00 H ATOM 127 N ILE A 260 35.446 29.805 81.514 1.00 37.76 N ATOM 128 CA ILE A 260 34.296 29.124 82.121 1.00 36.39 C ATOM 129 C ILE A 260 34.741 28.493 83.447 1.00 39.52 C ATOM 130 O ILE A 260 34.024 28.605 84.438 1.00 36.17 O ATOM 131 CB ILE A 260 33.655 28.094 81.127 1.00 38.54 C ATOM 132 CG1 ILE A 260 33.060 28.783 79.862 1.00 38.78 C ATOM 133 CG2 ILE A 260 32.627 27.152 81.798 1.00 38.61 C ATOM 134 CD1 ILE A 260 31.992 29.876 80.054 1.00 44.19 C ATOM 135 H ILE A 260 35.835 29.408 80.635 1.00 0.00 H ATOM 136 N MET A 261 35.950 27.886 83.456 1.00 38.04 N ATOM 137 CA MET A 261 36.553 27.239 84.616 1.00 39.19 C ATOM 138 C MET A 261 36.802 28.179 85.785 1.00 44.43 C ATOM 139 O MET A 261 36.493 27.817 86.920 1.00 43.11 O ATOM 140 CB MET A 261 37.840 26.488 84.236 1.00 43.33 C ATOM 141 CG MET A 261 37.594 25.099 83.694 1.00 46.69 C ATOM 142 SD MET A 261 36.420 24.114 84.685 1.00 49.57 S ATOM 143 CE MET A 261 37.302 23.910 86.187 1.00 47.63 C ATOM 144 H MET A 261 36.491 27.880 82.568 1.00 0.00 H ATOM 145 N ASP A 262 37.343 29.384 85.497 1.00 43.33 N ATOM 146 CA ASP A 262 37.616 30.434 86.482 1.00 44.45 C ATOM 147 C ASP A 262 36.312 30.901 87.133 1.00 47.22 C ATOM 148 O ASP A 262 36.291 31.117 88.345 1.00 47.38 O ATOM 149 CB ASP A 262 38.337 31.632 85.820 1.00 48.16 C ATOM 150 CG ASP A 262 39.770 31.366 85.381 1.00 62.42 C ATOM 151 OD1 ASP A 262 40.250 30.221 85.560 1.00 62.31 O ATOM 152 OD2 ASP A 262 40.411 32.296 84.849 1.00 72.42 O ATOM 153 H ASP A 262 37.583 29.580 84.504 1.00 0.00 H ATOM 154 N SER A 263 35.232 31.031 86.340 1.00 42.41 N ATOM 155 CA SER A 263 33.910 31.441 86.821 1.00 41.40 C ATOM 156 C SER A 263 33.258 30.331 87.650 1.00 43.10 C ATOM 157 O SER A 263 32.715 30.602 88.724 1.00 43.38 O ATOM 158 CB SER A 263 33.005 31.822 85.651 1.00 45.57 C ATOM 159 OG SER A 263 33.548 32.908 84.920 1.00 57.09 O ATOM 160 HG SER A 263 34.436 32.654 84.565 1.00 0.00 H ATOM 161 H SER A 263 35.342 30.828 85.326 1.00 0.00 H ATOM 162 N TYR A 264 33.346 29.066 87.164 1.00 37.90 N ATOM 163 CA TYR A 264 32.790 27.889 87.838 1.00 36.66 C ATOM 164 C TYR A 264 33.414 27.627 89.210 1.00 41.73 C ATOM 165 O TYR A 264 32.704 27.227 90.139 1.00 40.53 O ATOM 166 CB TYR A 264 32.943 26.641 86.958 1.00 37.32 C ATOM 167 CG TYR A 264 32.071 25.480 87.386 1.00 37.40 C ATOM 168 CD1 TYR A 264 30.699 25.495 87.154 1.00 38.18 C ATOM 169 CD2 TYR A 264 32.623 24.344 87.968 1.00 38.62 C ATOM 170 CE1 TYR A 264 29.895 24.419 87.521 1.00 38.56 C ATOM 171 CE2 TYR A 264 31.828 23.256 88.334 1.00 39.08 C ATOM 172 CZ TYR A 264 30.463 23.300 88.105 1.00 44.62 C ATOM 173 OH TYR A 264 29.648 22.251 88.451 1.00 44.86 O ATOM 174 HH TYR A 264 28.713 22.468 88.210 1.00 0.00 H ATOM 175 H TYR A 264 33.838 28.924 86.259 1.00 0.00 H ATOM 176 N ASN A 265 34.733 27.867 89.330 1.00 41.61 N ATOM 177 CA ASN A 265 35.499 27.641 90.558 1.00 43.31 C ATOM 178 C ASN A 265 35.196 28.653 91.678 1.00 48.13 C ATOM 179 O ASN A 265 35.590 28.406 92.813 1.00 48.72 O ATOM 180 CB ASN A 265 37.006 27.551 90.267 1.00 44.89 C ATOM 181 CG ASN A 265 37.458 26.196 89.826 1.00 72.12 C ATOM 182 OD1 ASN A 265 37.024 25.156 90.330 1.00 63.82 O ATOM 183 ND2 ASN A 265 38.350 26.176 88.869 1.00 68.67 N ATOM 184 HD22 ASN A 265 38.697 27.068 88.463 1.00 0.00 H ATOM 185 HD21 ASN A 265 38.712 25.268 88.514 1.00 0.00 H ATOM 186 H ASN A 265 35.239 28.236 88.500 1.00 0.00 H ATOM 187 N LYS A 266 34.447 29.737 91.381 1.00 44.87 N ATOM 188 CA LYS A 266 34.049 30.733 92.373 1.00 45.63 C ATOM 189 C LYS A 266 32.940 30.209 93.311 1.00 50.13 C ATOM 190 O LYS A 266 32.559 30.898 94.259 1.00 51.34 O ATOM 191 CB LYS A 266 33.657 32.063 91.699 1.00 48.21 C ATOM 192 CG LYS A 266 34.880 32.856 91.233 1.00 64.01 C ATOM 193 CD LYS A 266 34.500 34.202 90.650 1.00 75.12 C ATOM 194 CE LYS A 266 35.706 35.057 90.321 1.00 91.25 C ATOM 195 NZ LYS A 266 36.401 34.626 89.081 1.00101.72 N ATOM 196 HZ1 LYS A 266 36.729 33.645 89.192 1.00 0.00 H ATOM 197 HZ2 LYS A 266 35.743 34.684 88.278 1.00 0.00 H ATOM 198 HZ3 LYS A 266 37.217 35.248 88.908 1.00 0.00 H ATOM 199 H LYS A 266 34.138 29.869 90.397 1.00 0.00 H ATOM 200 N GLN A 267 32.460 28.979 93.071 1.00 45.66 N ATOM 201 CA GLN A 267 31.450 28.285 93.871 1.00 44.50 C ATOM 202 C GLN A 267 32.046 27.825 95.209 1.00 50.08 C ATOM 203 O GLN A 267 33.264 27.668 95.323 1.00 51.86 O ATOM 204 CB GLN A 267 30.910 27.067 93.103 1.00 44.20 C ATOM 205 CG GLN A 267 29.900 27.414 92.015 1.00 54.94 C ATOM 206 CD GLN A 267 29.427 26.199 91.256 1.00 75.37 C ATOM 207 OE1 GLN A 267 28.222 25.917 91.179 1.00 72.88 O ATOM 208 NE2 GLN A 267 30.355 25.473 90.638 1.00 64.84 N ATOM 209 HE22 GLN A 267 31.359 25.733 90.720 1.00 0.00 H ATOM 210 HE21 GLN A 267 30.077 24.646 90.073 1.00 0.00 H ATOM 211 H GLN A 267 32.839 28.475 92.244 1.00 0.00 H ATOM 212 N ARG A 268 31.184 27.581 96.208 1.00 46.33 N ATOM 213 CA ARG A 268 31.556 27.073 97.525 1.00 46.94 C ATOM 214 C ARG A 268 32.258 25.715 97.316 1.00 51.04 C ATOM 215 O ARG A 268 31.767 24.882 96.552 1.00 49.62 O ATOM 216 CB ARG A 268 30.290 26.924 98.397 1.00 45.79 C ATOM 217 CG ARG A 268 30.554 26.679 99.877 1.00 53.34 C ATOM 218 CD ARG A 268 29.266 26.708 100.678 1.00 53.97 C ATOM 219 NE ARG A 268 28.858 28.072 101.033 1.00 54.09 N ATOM 220 CZ ARG A 268 27.713 28.381 101.635 1.00 60.44 C ATOM 221 NH1 ARG A 268 26.843 27.432 101.957 1.00 42.60 N ATOM 222 NH2 ARG A 268 27.425 29.646 101.910 1.00 45.57 N ATOM 223 HE ARG A 268 29.508 28.849 100.798 1.00 0.00 H ATOM 224 HH12 ARG A 268 25.950 27.683 102.428 1.00 0.00 H ATOM 225 HH11 ARG A 268 27.054 26.437 101.739 1.00 0.00 H ATOM 226 HH22 ARG A 268 26.529 29.885 102.381 1.00 0.00 H ATOM 227 HH21 ARG A 268 28.095 30.399 101.655 1.00 0.00 H ATOM 228 H ARG A 268 30.176 27.768 96.031 1.00 0.00 H ATOM 229 N MET A 269 33.440 25.532 97.924 1.00 49.03 N ATOM 230 CA MET A 269 34.231 24.309 97.787 1.00 49.83 C ATOM 231 C MET A 269 33.478 23.053 98.240 1.00 51.21 C ATOM 232 O MET A 269 32.819 23.088 99.284 1.00 50.49 O ATOM 233 CB MET A 269 35.588 24.433 98.502 1.00 54.99 C ATOM 234 CG MET A 269 36.567 25.366 97.797 1.00 60.51 C ATOM 235 SD MET A 269 36.935 24.868 96.089 1.00 65.35 S ATOM 236 CE MET A 269 37.744 26.361 95.492 1.00 63.19 C ATOM 237 H MET A 269 33.812 26.297 98.522 1.00 0.00 H ATOM 238 N PRO A 270 33.540 21.946 97.459 1.00 46.73 N ATOM 239 CA PRO A 270 32.817 20.718 97.852 1.00 46.32 C ATOM 240 C PRO A 270 33.204 20.179 99.223 1.00 52.26 C ATOM 241 O PRO A 270 32.321 19.771 99.988 1.00 50.91 O ATOM 242 CB PRO A 270 33.180 19.726 96.741 1.00 48.09 C ATOM 243 CG PRO A 270 33.511 20.589 95.579 1.00 51.74 C ATOM 244 CD PRO A 270 34.248 21.746 96.180 1.00 47.94 C ATOM 245 N GLN A 271 34.520 20.229 99.545 1.00 51.61 N ATOM 246 CA GLN A 271 35.074 19.787 100.826 1.00 54.13 C ATOM 247 C GLN A 271 34.426 20.527 101.992 1.00 58.90 C ATOM 248 O GLN A 271 34.099 19.896 102.987 1.00 59.55 O ATOM 249 CB GLN A 271 36.609 19.943 100.858 1.00 57.73 C ATOM 250 CG GLN A 271 37.272 18.970 101.826 1.00 79.31 C ATOM 251 CD GLN A 271 38.567 19.507 102.370 1.00104.01 C ATOM 252 OE1 GLN A 271 38.586 20.277 103.336 1.00 99.33 O ATOM 253 NE2 GLN A 271 39.676 19.065 101.795 1.00100.47 N ATOM 254 HE22 GLN A 271 39.618 18.417 100.983 1.00 0.00 H ATOM 255 HE21 GLN A 271 40.604 19.366 102.155 1.00 0.00 H ATOM 256 H GLN A 271 35.180 20.606 98.835 1.00 0.00 H ATOM 257 N GLU A 272 34.179 21.846 101.836 1.00 55.34 N ATOM 258 CA GLU A 272 33.526 22.703 102.834 1.00 55.39 C ATOM 259 C GLU A 272 32.111 22.186 103.148 1.00 57.75 C ATOM 260 O GLU A 272 31.723 22.147 104.317 1.00 58.68 O ATOM 261 CB GLU A 272 33.471 24.158 102.334 1.00 56.28 C ATOM 262 CG GLU A 272 33.159 25.187 103.403 1.00 70.11 C ATOM 263 CD GLU A 272 32.808 26.563 102.871 1.00 94.01 C ATOM 264 OE1 GLU A 272 33.640 27.155 102.145 1.00 92.04 O ATOM 265 OE2 GLU A 272 31.708 27.061 103.205 1.00 87.10 O ATOM 266 H GLU A 272 34.473 22.288 100.942 1.00 0.00 H ATOM 267 N ILE A 273 31.363 21.771 102.102 1.00 51.24 N ATOM 268 CA ILE A 273 30.000 21.243 102.201 1.00 48.52 C ATOM 269 C ILE A 273 29.997 19.843 102.843 1.00 51.53 C ATOM 270 O ILE A 273 29.245 19.620 103.801 1.00 50.75 O ATOM 271 CB ILE A 273 29.296 21.307 100.808 1.00 49.70 C ATOM 272 CG1 ILE A 273 29.136 22.782 100.357 1.00 48.96 C ATOM 273 CG2 ILE A 273 27.935 20.580 100.815 1.00 49.24 C ATOM 274 CD1 ILE A 273 29.142 23.045 98.880 1.00 51.10 C ATOM 275 H ILE A 273 31.787 21.831 101.154 1.00 0.00 H ATOM 276 N THR A 274 30.849 18.923 102.336 1.00 48.02 N ATOM 277 CA THR A 274 30.936 17.553 102.852 1.00 48.75 C ATOM 278 C THR A 274 31.462 17.497 104.287 1.00 54.34 C ATOM 279 O THR A 274 30.992 16.654 105.050 1.00 54.40 O ATOM 280 CB THR A 274 31.712 16.628 101.914 1.00 54.88 C ATOM 281 OG1 THR A 274 32.895 17.282 101.457 1.00 56.52 O ATOM 282 CG2 THR A 274 30.873 16.170 100.733 1.00 49.86 C ATOM 283 HG1 THR A 274 33.392 16.677 100.851 1.00 0.00 H ATOM 284 H THR A 274 31.468 19.199 101.547 1.00 0.00 H ATOM 285 N ASN A 275 32.399 18.405 104.669 1.00 51.98 N ATOM 286 CA ASN A 275 32.951 18.479 106.030 1.00 53.93 C ATOM 287 C ASN A 275 31.863 18.723 107.080 1.00 57.72 C ATOM 288 O ASN A 275 31.913 18.107 108.146 1.00 59.38 O ATOM 289 CB ASN A 275 34.043 19.560 106.151 1.00 55.12 C ATOM 290 CG ASN A 275 35.428 19.161 105.679 1.00 75.08 C ATOM 291 OD1 ASN A 275 35.707 18.010 105.313 1.00 68.75 O ATOM 292 ND2 ASN A 275 36.334 20.130 105.663 1.00 67.32 N ATOM 293 HD22 ASN A 275 36.076 21.088 105.975 1.00 0.00 H ATOM 294 HD21 ASN A 275 37.302 19.932 105.339 1.00 0.00 H ATOM 295 H ASN A 275 32.744 19.084 103.961 1.00 0.00 H ATOM 296 N LYS A 276 30.887 19.601 106.774 1.00 52.34 N ATOM 297 CA LYS A 276 29.777 19.952 107.666 1.00 51.81 C ATOM 298 C LYS A 276 28.794 18.787 107.858 1.00 55.32 C ATOM 299 O LYS A 276 28.353 18.542 108.983 1.00 56.46 O ATOM 300 CB LYS A 276 29.049 21.210 107.153 1.00 52.60 C ATOM 301 CG LYS A 276 28.156 21.874 108.197 1.00 67.97 C ATOM 302 CD LYS A 276 27.408 23.062 107.627 1.00 78.37 C ATOM 303 CE LYS A 276 26.490 23.683 108.648 1.00 91.48 C ATOM 304 NZ LYS A 276 25.808 24.892 108.100 1.00101.74 N ATOM 305 HZ1 LYS A 276 26.522 25.596 107.824 1.00 0.00 H ATOM 306 HZ2 LYS A 276 25.245 24.624 107.268 1.00 0.00 H ATOM 307 HZ3 LYS A 276 25.184 25.296 108.827 1.00 0.00 H ATOM 308 H LYS A 276 30.924 20.061 105.842 1.00 0.00 H ATOM 309 N ILE A 277 28.449 18.083 106.764 1.00 50.90 N ATOM 310 CA ILE A 277 27.518 16.946 106.766 1.00 50.30 C ATOM 311 C ILE A 277 28.148 15.714 107.436 1.00 56.25 C ATOM 312 O ILE A 277 27.430 14.953 108.084 1.00 57.49 O ATOM 313 CB ILE A 277 26.965 16.657 105.329 1.00 51.52 C ATOM 314 CG1 ILE A 277 26.327 17.921 104.713 1.00 49.84 C ATOM 315 CG2 ILE A 277 25.961 15.486 105.317 1.00 52.53 C ATOM 316 CD1 ILE A 277 26.346 17.968 103.210 1.00 56.71 C ATOM 317 H ILE A 277 28.870 18.363 105.855 1.00 0.00 H ATOM 318 N LEU A 278 29.479 15.532 107.307 1.00 53.45 N ATOM 319 CA LEU A 278 30.196 14.388 107.888 1.00 55.76 C ATOM 320 C LEU A 278 30.587 14.546 109.369 1.00 62.01 C ATOM 321 O LEU A 278 30.651 13.541 110.080 1.00 62.75 O ATOM 322 CB LEU A 278 31.430 14.020 107.057 1.00 56.61 C ATOM 323 CG LEU A 278 31.179 13.389 105.676 1.00 60.05 C ATOM 324 CD1 LEU A 278 32.471 13.270 104.907 1.00 60.84 C ATOM 325 CD2 LEU A 278 30.507 12.021 105.789 1.00 63.50 C ATOM 326 H LEU A 278 30.024 16.236 106.770 1.00 0.00 H ATOM 327 N LYS A 279 30.830 15.791 109.826 1.00 59.68 N ATOM 328 CA LYS A 279 31.243 16.113 111.199 1.00 61.86 C ATOM 329 C LYS A 279 30.197 15.740 112.252 1.00 66.96 C ATOM 330 O LYS A 279 30.510 14.993 113.184 1.00 68.55 O ATOM 331 CB LYS A 279 31.635 17.601 111.311 1.00 64.03 C ATOM 332 CG LYS A 279 32.277 18.007 112.640 1.00 83.22 C ATOM 333 CD LYS A 279 32.569 19.508 112.710 1.00 95.77 C ATOM 334 CE LYS A 279 31.381 20.337 113.155 1.00108.74 C ATOM 335 NZ LYS A 279 31.759 21.751 113.402 1.00119.65 N ATOM 336 HZ1 LYS A 279 32.483 21.790 114.147 1.00 0.00 H ATOM 337 HZ2 LYS A 279 32.138 22.165 112.527 1.00 0.00 H ATOM 338 HZ3 LYS A 279 30.920 22.285 113.704 1.00 0.00 H ATOM 339 H LYS A 279 30.717 16.581 109.159 1.00 0.00 H ATOM 340 N GLU A 280 28.967 16.272 112.115 1.00 62.34 N ATOM 341 CA GLU A 280 27.885 16.046 113.077 1.00 62.83 C ATOM 342 C GLU A 280 26.619 15.575 112.379 1.00 64.15 C ATOM 343 O GLU A 280 26.351 15.982 111.250 1.00 62.15 O ATOM 344 CB GLU A 280 27.560 17.343 113.843 1.00 64.09 C ATOM 345 CG GLU A 280 28.667 17.858 114.747 1.00 78.49 C ATOM 346 CD GLU A 280 28.426 19.214 115.387 1.00102.27 C ATOM 347 OE1 GLU A 280 27.845 20.103 114.723 1.00 92.85 O ATOM 348 OE2 GLU A 280 28.862 19.399 116.544 1.00 99.84 O ATOM 349 H GLU A 280 28.776 16.872 111.287 1.00 0.00 H ATOM 350 N ALA A 281 25.829 14.746 113.067 1.00 60.32 N ATOM 351 CA ALA A 281 24.543 14.291 112.566 1.00 58.53 C ATOM 352 C ALA A 281 23.524 15.321 113.047 1.00 59.66 C ATOM 353 O ALA A 281 23.492 15.652 114.240 1.00 60.77 O ATOM 354 CB ALA A 281 24.216 12.917 113.126 1.00 61.36 C ATOM 355 H ALA A 281 26.147 14.413 113.999 1.00 0.00 H ATOM 356 N PHE A 282 22.767 15.899 112.111 1.00 52.08 N ATOM 357 CA PHE A 282 21.784 16.932 112.436 1.00 50.12 C ATOM 358 C PHE A 282 20.359 16.404 112.345 1.00 51.04 C ATOM 359 O PHE A 282 20.116 15.370 111.712 1.00 49.58 O ATOM 360 CB PHE A 282 21.973 18.171 111.538 1.00 50.02 C ATOM 361 CG PHE A 282 23.337 18.813 111.626 1.00 52.02 C ATOM 362 CD1 PHE A 282 23.661 19.656 112.683 1.00 56.64 C ATOM 363 CD2 PHE A 282 24.296 18.584 110.648 1.00 53.81 C ATOM 364 CE1 PHE A 282 24.926 20.246 112.765 1.00 57.96 C ATOM 365 CE2 PHE A 282 25.555 19.186 110.721 1.00 57.19 C ATOM 366 CZ PHE A 282 25.865 20.007 111.784 1.00 56.43 C ATOM 367 H PHE A 282 22.880 15.605 111.120 1.00 0.00 H ATOM 368 N SER A 283 19.420 17.110 112.995 1.00 47.30 N ATOM 369 CA SER A 283 17.995 16.794 112.961 1.00 47.12 C ATOM 370 C SER A 283 17.438 17.258 111.601 1.00 48.17 C ATOM 371 O SER A 283 18.074 18.076 110.924 1.00 45.36 O ATOM 372 CB SER A 283 17.271 17.518 114.092 1.00 52.34 C ATOM 373 OG SER A 283 17.357 18.927 113.944 1.00 61.09 O ATOM 374 HG SER A 283 18.308 19.201 113.953 1.00 0.00 H ATOM 375 H SER A 283 19.726 17.931 113.556 1.00 0.00 H ATOM 376 N ALA A 284 16.247 16.756 111.222 1.00 44.54 N ATOM 377 CA ALA A 284 15.568 17.109 109.975 1.00 42.70 C ATOM 378 C ALA A 284 15.336 18.626 109.870 1.00 43.99 C ATOM 379 O ALA A 284 15.460 19.191 108.782 1.00 41.25 O ATOM 380 CB ALA A 284 14.252 16.358 109.862 1.00 44.62 C ATOM 381 H ALA A 284 15.781 16.075 111.855 1.00 0.00 H ATOM 382 N GLU A 285 15.074 19.279 111.016 1.00 41.24 N ATOM 383 CA GLU A 285 14.855 20.722 111.148 1.00 41.00 C ATOM 384 C GLU A 285 16.140 21.503 110.862 1.00 42.47 C ATOM 385 O GLU A 285 16.107 22.475 110.103 1.00 41.84 O ATOM 386 CB GLU A 285 14.292 21.062 112.541 1.00 44.38 C ATOM 387 CG GLU A 285 12.856 20.603 112.775 1.00 60.32 C ATOM 388 CD GLU A 285 12.569 19.120 112.951 1.00 84.20 C ATOM 389 OE1 GLU A 285 11.386 18.734 112.814 1.00 84.91 O ATOM 390 OE2 GLU A 285 13.516 18.344 113.222 1.00 72.49 O ATOM 391 H GLU A 285 15.022 18.710 111.885 1.00 0.00 H ATOM 392 N GLU A 286 17.277 21.049 111.437 1.00 37.59 N ATOM 393 CA GLU A 286 18.590 21.673 111.236 1.00 36.02 C ATOM 394 C GLU A 286 19.053 21.465 109.791 1.00 38.09 C ATOM 395 O GLU A 286 19.578 22.392 109.174 1.00 37.28 O ATOM 396 CB GLU A 286 19.627 21.111 112.215 1.00 38.27 C ATOM 397 CG GLU A 286 19.424 21.579 113.651 1.00 46.60 C ATOM 398 CD GLU A 286 20.312 20.899 114.678 1.00 69.34 C ATOM 399 OE1 GLU A 286 20.313 19.645 114.734 1.00 58.50 O ATOM 400 OE2 GLU A 286 20.982 21.628 115.448 1.00 67.59 O ATOM 401 H GLU A 286 17.218 20.214 112.054 1.00 0.00 H ATOM 402 N ASN A 287 18.813 20.259 109.252 1.00 34.03 N ATOM 403 CA ASN A 287 19.179 19.886 107.893 1.00 32.79 C ATOM 404 C ASN A 287 18.400 20.663 106.835 1.00 35.07 C ATOM 405 O ASN A 287 18.947 20.926 105.762 1.00 32.21 O ATOM 406 CB ASN A 287 19.058 18.377 107.682 1.00 34.32 C ATOM 407 CG ASN A 287 20.230 17.559 108.172 1.00 49.43 C ATOM 408 OD1 ASN A 287 21.390 18.002 108.166 1.00 42.00 O ATOM 409 ND2 ASN A 287 19.951 16.316 108.543 1.00 38.93 N ATOM 410 HD22 ASN A 287 18.967 15.979 108.535 1.00 0.00 H ATOM 411 HD21 ASN A 287 20.716 15.678 108.841 1.00 0.00 H ATOM 412 H ASN A 287 18.336 19.547 109.842 1.00 0.00 H ATOM 413 N PHE A 288 17.129 21.043 107.130 1.00 33.97 N ATOM 414 CA PHE A 288 16.326 21.845 106.202 1.00 33.67 C ATOM 415 C PHE A 288 16.929 23.247 106.083 1.00 39.23 C ATOM 416 O PHE A 288 17.022 23.788 104.978 1.00 38.65 O ATOM 417 CB PHE A 288 14.847 21.921 106.635 1.00 36.18 C ATOM 418 CG PHE A 288 13.953 22.603 105.622 1.00 37.22 C ATOM 419 CD1 PHE A 288 13.511 21.925 104.492 1.00 39.75 C ATOM 420 CD2 PHE A 288 13.596 23.940 105.773 1.00 39.77 C ATOM 421 CE1 PHE A 288 12.695 22.559 103.546 1.00 40.90 C ATOM 422 CE2 PHE A 288 12.784 24.574 104.827 1.00 42.34 C ATOM 423 CZ PHE A 288 12.332 23.877 103.726 1.00 40.25 C ATOM 424 H PHE A 288 16.714 20.757 108.040 1.00 0.00 H ATOM 425 N LEU A 289 17.334 23.821 107.234 1.00 37.75 N ATOM 426 CA LEU A 289 17.960 25.133 107.369 1.00 37.99 C ATOM 427 C LEU A 289 19.298 25.172 106.625 1.00 39.44 C ATOM 428 O LEU A 289 19.595 26.159 105.951 1.00 38.42 O ATOM 429 CB LEU A 289 18.144 25.438 108.865 1.00 39.90 C ATOM 430 CG LEU A 289 17.870 26.870 109.383 1.00 46.12 C ATOM 431 CD1 LEU A 289 17.050 27.712 108.384 1.00 48.73 C ATOM 432 CD2 LEU A 289 17.111 26.819 110.702 1.00 47.13 C ATOM 433 H LEU A 289 17.186 23.278 108.108 1.00 0.00 H ATOM 434 N ILE A 290 20.088 24.067 106.720 1.00 35.29 N ATOM 435 CA ILE A 290 21.383 23.882 106.041 1.00 33.49 C ATOM 436 C ILE A 290 21.138 23.945 104.526 1.00 34.44 C ATOM 437 O ILE A 290 21.809 24.713 103.840 1.00 32.04 O ATOM 438 CB ILE A 290 22.105 22.568 106.492 1.00 37.31 C ATOM 439 CG1 ILE A 290 22.677 22.702 107.925 1.00 39.07 C ATOM 440 CG2 ILE A 290 23.208 22.146 105.492 1.00 37.63 C ATOM 441 CD1 ILE A 290 22.901 21.370 108.681 1.00 46.20 C ATOM 442 H ILE A 290 19.750 23.289 107.322 1.00 0.00 H ATOM 443 N LEU A 291 20.138 23.180 104.024 1.00 30.86 N ATOM 444 CA LEU A 291 19.771 23.165 102.607 1.00 30.27 C ATOM 445 C LEU A 291 19.375 24.551 102.090 1.00 35.81 C ATOM 446 O LEU A 291 19.841 24.943 101.029 1.00 36.13 O ATOM 447 CB LEU A 291 18.642 22.146 102.309 1.00 30.44 C ATOM 448 CG LEU A 291 18.103 22.190 100.848 1.00 33.84 C ATOM 449 CD1 LEU A 291 19.099 21.613 99.860 1.00 33.54 C ATOM 450 CD2 LEU A 291 16.765 21.531 100.723 1.00 36.65 C ATOM 451 H LEU A 291 19.605 22.573 104.679 1.00 0.00 H ATOM 452 N THR A 292 18.520 25.278 102.840 1.00 33.32 N ATOM 453 CA THR A 292 18.030 26.617 102.486 1.00 33.46 C ATOM 454 C THR A 292 19.208 27.599 102.327 1.00 36.13 C ATOM 455 O THR A 292 19.259 28.316 101.329 1.00 34.69 O ATOM 456 CB THR A 292 16.942 27.042 103.486 1.00 47.54 C ATOM 457 OG1 THR A 292 15.706 26.462 103.044 1.00 47.01 O ATOM 458 CG2 THR A 292 16.775 28.557 103.589 1.00 50.48 C ATOM 459 HG1 THR A 292 14.981 26.717 103.668 1.00 0.00 H ATOM 460 H THR A 292 18.184 24.861 103.732 1.00 0.00 H ATOM 461 N GLU A 293 20.171 27.583 103.271 1.00 33.57 N ATOM 462 CA GLU A 293 21.365 28.431 103.224 1.00 33.70 C ATOM 463 C GLU A 293 22.283 28.003 102.065 1.00 36.41 C ATOM 464 O GLU A 293 22.792 28.870 101.353 1.00 35.42 O ATOM 465 CB GLU A 293 22.097 28.414 104.581 1.00 36.32 C ATOM 466 CG GLU A 293 23.142 29.514 104.760 1.00 47.47 C ATOM 467 CD GLU A 293 24.483 29.313 104.071 1.00 63.99 C ATOM 468 OE1 GLU A 293 24.924 28.146 103.955 1.00 42.01 O ATOM 469 OE2 GLU A 293 25.092 30.323 103.648 1.00 60.27 O ATOM 470 H GLU A 293 20.060 26.934 104.076 1.00 0.00 H ATOM 471 N MET A 294 22.486 26.682 101.885 1.00 33.13 N ATOM 472 CA MET A 294 23.300 26.114 100.800 1.00 32.82 C ATOM 473 C MET A 294 22.746 26.499 99.426 1.00 33.37 C ATOM 474 O MET A 294 23.513 26.858 98.539 1.00 30.52 O ATOM 475 CB MET A 294 23.374 24.578 100.898 1.00 35.37 C ATOM 476 CG MET A 294 24.294 24.076 101.985 1.00 40.68 C ATOM 477 SD MET A 294 26.043 24.327 101.635 1.00 46.07 S ATOM 478 CE MET A 294 26.735 23.776 103.189 1.00 44.13 C ATOM 479 H MET A 294 22.039 26.024 102.555 1.00 0.00 H ATOM 480 N ALA A 295 21.416 26.414 99.259 1.00 29.91 N ATOM 481 CA ALA A 295 20.735 26.722 98.005 1.00 29.07 C ATOM 482 C ALA A 295 20.730 28.208 97.677 1.00 32.23 C ATOM 483 O ALA A 295 20.824 28.560 96.501 1.00 30.24 O ATOM 484 CB ALA A 295 19.317 26.193 98.044 1.00 30.28 C ATOM 485 H ALA A 295 20.838 26.112 100.069 1.00 0.00 H ATOM 486 N THR A 296 20.606 29.081 98.709 1.00 29.61 N ATOM 487 CA THR A 296 20.623 30.546 98.550 1.00 30.26 C ATOM 488 C THR A 296 21.979 30.983 97.981 1.00 35.97 C ATOM 489 O THR A 296 22.011 31.736 97.008 1.00 36.64 O ATOM 490 CB THR A 296 20.248 31.249 99.868 1.00 39.72 C ATOM 491 OG1 THR A 296 18.951 30.806 100.268 1.00 39.48 O ATOM 492 CG2 THR A 296 20.243 32.772 99.748 1.00 39.51 C ATOM 493 HG1 THR A 296 18.965 29.825 100.401 1.00 0.00 H ATOM 494 H THR A 296 20.492 28.694 99.667 1.00 0.00 H ATOM 495 N ASN A 297 23.089 30.483 98.567 1.00 33.39 N ATOM 496 CA ASN A 297 24.452 30.774 98.107 1.00 33.79 C ATOM 497 C ASN A 297 24.649 30.236 96.689 1.00 35.42 C ATOM 498 O ASN A 297 25.214 30.946 95.860 1.00 34.46 O ATOM 499 CB ASN A 297 25.491 30.181 99.068 1.00 34.77 C ATOM 500 CG ASN A 297 26.896 30.137 98.524 1.00 49.56 C ATOM 501 OD1 ASN A 297 27.348 29.121 97.984 1.00 45.31 O ATOM 502 ND2 ASN A 297 27.619 31.228 98.663 1.00 40.02 N ATOM 503 HD22 ASN A 297 27.211 32.067 99.122 1.00 0.00 H ATOM 504 HD21 ASN A 297 28.598 31.251 98.314 1.00 0.00 H ATOM 505 H ASN A 297 22.971 29.857 99.389 1.00 0.00 H ATOM 506 N HIS A 298 24.187 28.989 96.416 1.00 30.90 N ATOM 507 CA HIS A 298 24.284 28.379 95.089 1.00 30.30 C ATOM 508 C HIS A 298 23.640 29.260 94.019 1.00 36.65 C ATOM 509 O HIS A 298 24.277 29.504 92.996 1.00 37.28 O ATOM 510 CB HIS A 298 23.665 26.967 95.045 1.00 29.89 C ATOM 511 CG HIS A 298 23.829 26.323 93.699 1.00 32.15 C ATOM 512 ND1 HIS A 298 22.850 26.433 92.713 1.00 33.35 N ATOM 513 CD2 HIS A 298 24.903 25.689 93.170 1.00 33.68 C ATOM 514 CE1 HIS A 298 23.343 25.829 91.642 1.00 31.88 C ATOM 515 NE2 HIS A 298 24.571 25.358 91.870 1.00 32.37 N ATOM 516 H HIS A 298 23.745 28.443 97.183 1.00 0.00 H ATOM 517 N VAL A 299 22.385 29.728 94.252 1.00 33.41 N ATOM 518 CA VAL A 299 21.650 30.582 93.304 1.00 33.38 C ATOM 519 C VAL A 299 22.420 31.889 93.043 1.00 35.73 C ATOM 520 O VAL A 299 22.605 32.258 91.887 1.00 34.95 O ATOM 521 CB VAL A 299 20.170 30.818 93.738 1.00 38.31 C ATOM 522 CG1 VAL A 299 19.507 31.918 92.911 1.00 39.17 C ATOM 523 CG2 VAL A 299 19.359 29.528 93.649 1.00 37.90 C ATOM 524 H VAL A 299 21.920 29.470 95.146 1.00 0.00 H ATOM 525 N GLN A 300 22.911 32.541 94.119 1.00 32.95 N ATOM 526 CA GLN A 300 23.682 33.787 94.044 1.00 33.15 C ATOM 527 C GLN A 300 24.923 33.627 93.187 1.00 35.27 C ATOM 528 O GLN A 300 25.171 34.462 92.322 1.00 35.68 O ATOM 529 CB GLN A 300 24.075 34.269 95.445 1.00 35.05 C ATOM 530 CG GLN A 300 22.935 34.901 96.221 1.00 42.59 C ATOM 531 CD GLN A 300 23.259 35.129 97.677 1.00 60.20 C ATOM 532 OE1 GLN A 300 24.304 34.722 98.197 1.00 56.87 O ATOM 533 NE2 GLN A 300 22.347 35.778 98.383 1.00 56.77 N ATOM 534 HE22 GLN A 300 21.475 36.111 97.925 1.00 0.00 H ATOM 535 HE21 GLN A 300 22.502 35.955 99.396 1.00 0.00 H ATOM 536 H GLN A 300 22.731 32.135 95.059 1.00 0.00 H ATOM 537 N VAL A 301 25.680 32.540 93.403 1.00 31.49 N ATOM 538 CA VAL A 301 26.896 32.251 92.643 1.00 31.12 C ATOM 539 C VAL A 301 26.526 31.846 91.201 1.00 34.02 C ATOM 540 O VAL A 301 27.220 32.249 90.269 1.00 32.40 O ATOM 541 CB VAL A 301 27.840 31.250 93.369 1.00 35.09 C ATOM 542 CG1 VAL A 301 29.102 30.975 92.558 1.00 35.03 C ATOM 543 CG2 VAL A 301 28.223 31.767 94.765 1.00 35.83 C ATOM 544 H VAL A 301 25.389 31.872 94.145 1.00 0.00 H ATOM 545 N LEU A 302 25.396 31.117 91.020 1.00 31.23 N ATOM 546 CA LEU A 302 24.909 30.706 89.696 1.00 31.38 C ATOM 547 C LEU A 302 24.564 31.921 88.821 1.00 36.23 C ATOM 548 O LEU A 302 24.889 31.908 87.630 1.00 35.26 O ATOM 549 CB LEU A 302 23.706 29.754 89.809 1.00 30.87 C ATOM 550 CG LEU A 302 23.230 29.098 88.502 1.00 35.45 C ATOM 551 CD1 LEU A 302 24.210 28.037 88.019 1.00 35.97 C ATOM 552 CD2 LEU A 302 21.873 28.494 88.677 1.00 38.34 C ATOM 553 H LEU A 302 24.849 30.836 91.858 1.00 0.00 H ATOM 554 N VAL A 303 23.927 32.955 89.409 1.00 33.97 N ATOM 555 CA VAL A 303 23.579 34.193 88.694 1.00 34.90 C ATOM 556 C VAL A 303 24.870 34.869 88.194 1.00 38.04 C ATOM 557 O VAL A 303 24.940 35.251 87.026 1.00 37.68 O ATOM 558 CB VAL A 303 22.670 35.151 89.523 1.00 40.19 C ATOM 559 CG1 VAL A 303 22.428 36.464 88.787 1.00 41.89 C ATOM 560 CG2 VAL A 303 21.333 34.490 89.862 1.00 39.65 C ATOM 561 H VAL A 303 23.670 32.873 90.413 1.00 0.00 H ATOM 562 N GLU A 304 25.910 34.941 89.063 1.00 34.43 N ATOM 563 CA GLU A 304 27.210 35.519 88.713 1.00 35.42 C ATOM 564 C GLU A 304 27.916 34.722 87.619 1.00 38.54 C ATOM 565 O GLU A 304 28.508 35.332 86.725 1.00 39.17 O ATOM 566 CB GLU A 304 28.109 35.700 89.942 1.00 37.53 C ATOM 567 CG GLU A 304 27.700 36.859 90.846 1.00 50.99 C ATOM 568 CD GLU A 304 27.437 38.183 90.154 1.00 68.24 C ATOM 569 OE1 GLU A 304 28.365 38.714 89.504 1.00 64.80 O ATOM 570 OE2 GLU A 304 26.290 38.677 90.242 1.00 60.22 O ATOM 571 H GLU A 304 25.778 34.568 90.025 1.00 0.00 H ATOM 572 N PHE A 305 27.808 33.371 87.656 1.00 33.34 N ATOM 573 CA PHE A 305 28.385 32.481 86.640 1.00 32.95 C ATOM 574 C PHE A 305 27.647 32.656 85.303 1.00 38.40 C ATOM 575 O PHE A 305 28.287 32.714 84.256 1.00 39.55 O ATOM 576 CB PHE A 305 28.344 31.005 87.105 1.00 33.30 C ATOM 577 CG PHE A 305 28.761 29.978 86.072 1.00 34.21 C ATOM 578 CD1 PHE A 305 30.104 29.688 85.853 1.00 37.19 C ATOM 579 CD2 PHE A 305 27.812 29.271 85.343 1.00 35.28 C ATOM 580 CE1 PHE A 305 30.491 28.725 84.905 1.00 37.98 C ATOM 581 CE2 PHE A 305 28.203 28.322 84.385 1.00 37.85 C ATOM 582 CZ PHE A 305 29.539 28.049 84.183 1.00 36.27 C ATOM 583 H PHE A 305 27.288 32.941 88.447 1.00 0.00 H ATOM 584 N THR A 306 26.308 32.743 85.352 1.00 34.59 N ATOM 585 CA THR A 306 25.431 32.908 84.189 1.00 35.11 C ATOM 586 C THR A 306 25.706 34.238 83.461 1.00 41.25 C ATOM 587 O THR A 306 25.784 34.244 82.231 1.00 42.63 O ATOM 588 CB THR A 306 23.970 32.706 84.619 1.00 40.41 C ATOM 589 OG1 THR A 306 23.831 31.386 85.144 1.00 37.42 O ATOM 590 CG2 THR A 306 22.995 32.886 83.489 1.00 39.68 C ATOM 591 HG1 THR A 306 24.431 31.277 85.924 1.00 0.00 H ATOM 592 H THR A 306 25.858 32.689 86.288 1.00 0.00 H ATOM 593 N LYS A 307 25.887 35.333 84.224 1.00 38.79 N ATOM 594 CA LYS A 307 26.189 36.684 83.718 1.00 40.80 C ATOM 595 C LYS A 307 27.502 36.738 82.927 1.00 45.88 C ATOM 596 O LYS A 307 27.628 37.555 82.013 1.00 47.93 O ATOM 597 CB LYS A 307 26.282 37.677 84.887 1.00 43.94 C ATOM 598 CG LYS A 307 24.946 38.196 85.403 1.00 53.85 C ATOM 599 CD LYS A 307 25.074 38.811 86.796 1.00 63.55 C ATOM 600 CE LYS A 307 25.684 40.196 86.814 1.00 72.96 C ATOM 601 NZ LYS A 307 25.918 40.676 88.204 1.00 84.27 N ATOM 602 HZ1 LYS A 307 25.013 40.709 88.715 1.00 0.00 H ATOM 603 HZ2 LYS A 307 26.568 40.025 88.690 1.00 0.00 H ATOM 604 HZ3 LYS A 307 26.336 41.628 88.175 1.00 0.00 H ATOM 605 H LYS A 307 25.807 35.216 85.254 1.00 0.00 H ATOM 606 N LYS A 308 28.484 35.897 83.309 1.00 41.10 N ATOM 607 CA LYS A 308 29.802 35.825 82.675 1.00 41.85 C ATOM 608 C LYS A 308 29.835 34.909 81.447 1.00 44.33 C ATOM 609 O LYS A 308 30.824 34.936 80.713 1.00 44.31 O ATOM 610 CB LYS A 308 30.881 35.413 83.687 1.00 44.77 C ATOM 611 CG LYS A 308 31.226 36.491 84.700 1.00 61.55 C ATOM 612 CD LYS A 308 32.369 36.072 85.617 1.00 76.66 C ATOM 613 CE LYS A 308 33.722 36.536 85.126 1.00 96.44 C ATOM 614 NZ LYS A 308 34.824 36.109 86.027 1.00110.41 N ATOM 615 HZ1 LYS A 308 34.670 36.508 86.975 1.00 0.00 H ATOM 616 HZ2 LYS A 308 34.840 35.071 86.085 1.00 0.00 H ATOM 617 HZ3 LYS A 308 35.731 36.450 85.649 1.00 0.00 H ATOM 618 H LYS A 308 28.293 35.257 84.106 1.00 0.00 H ATOM 619 N LEU A 309 28.785 34.087 81.228 1.00 38.92 N ATOM 620 CA LEU A 309 28.735 33.204 80.062 1.00 37.87 C ATOM 621 C LEU A 309 28.761 34.061 78.796 1.00 44.27 C ATOM 622 O LEU A 309 28.024 35.049 78.731 1.00 44.18 O ATOM 623 CB LEU A 309 27.502 32.280 80.066 1.00 36.16 C ATOM 624 CG LEU A 309 27.374 31.294 81.228 1.00 38.47 C ATOM 625 CD1 LEU A 309 26.033 30.571 81.181 1.00 36.88 C ATOM 626 CD2 LEU A 309 28.500 30.277 81.218 1.00 39.38 C ATOM 627 H LEU A 309 27.994 34.082 81.904 1.00 0.00 H ATOM 628 N PRO A 310 29.660 33.758 77.826 1.00 42.26 N ATOM 629 CA PRO A 310 29.762 34.596 76.615 1.00 43.43 C ATOM 630 C PRO A 310 28.459 34.779 75.846 1.00 46.12 C ATOM 631 O PRO A 310 27.799 33.803 75.463 1.00 44.41 O ATOM 632 CB PRO A 310 30.836 33.887 75.781 1.00 45.54 C ATOM 633 CG PRO A 310 31.622 33.118 76.766 1.00 49.37 C ATOM 634 CD PRO A 310 30.628 32.643 77.777 1.00 43.60 C ATOM 635 N GLY A 311 28.094 36.047 75.688 1.00 42.76 N ATOM 636 CA GLY A 311 26.896 36.478 74.987 1.00 42.98 C ATOM 637 C GLY A 311 25.631 36.552 75.815 1.00 45.99 C ATOM 638 O GLY A 311 24.617 37.038 75.310 1.00 46.77 O ATOM 639 H GLY A 311 28.708 36.782 76.094 1.00 0.00 H ATOM 640 N PHE A 312 25.654 36.062 77.078 1.00 41.01 N ATOM 641 CA PHE A 312 24.461 36.072 77.940 1.00 40.04 C ATOM 642 C PHE A 312 23.873 37.469 78.143 1.00 45.83 C ATOM 643 O PHE A 312 22.650 37.618 78.124 1.00 45.20 O ATOM 644 CB PHE A 312 24.705 35.371 79.290 1.00 40.01 C ATOM 645 CG PHE A 312 23.440 35.183 80.099 1.00 40.55 C ATOM 646 CD1 PHE A 312 22.583 34.117 79.843 1.00 42.26 C ATOM 647 CD2 PHE A 312 23.083 36.098 81.082 1.00 43.24 C ATOM 648 CE1 PHE A 312 21.387 33.975 80.556 1.00 42.86 C ATOM 649 CE2 PHE A 312 21.892 35.951 81.798 1.00 45.58 C ATOM 650 CZ PHE A 312 21.052 34.893 81.529 1.00 42.84 C ATOM 651 H PHE A 312 26.541 35.667 77.450 1.00 0.00 H ATOM 652 N GLN A 313 24.737 38.482 78.312 1.00 45.29 N ATOM 653 CA GLN A 313 24.338 39.880 78.516 1.00 47.76 C ATOM 654 C GLN A 313 23.719 40.534 77.273 1.00 53.82 C ATOM 655 O GLN A 313 23.011 41.532 77.414 1.00 54.67 O ATOM 656 CB GLN A 313 25.507 40.722 79.063 1.00 50.40 C ATOM 657 CG GLN A 313 25.874 40.425 80.522 1.00 67.96 C ATOM 658 CD GLN A 313 24.779 40.754 81.514 1.00 92.79 C ATOM 659 OE1 GLN A 313 24.171 41.832 81.490 1.00 92.28 O ATOM 660 NE2 GLN A 313 24.502 39.824 82.408 1.00 83.84 N ATOM 661 HE22 GLN A 313 25.028 38.927 82.406 1.00 0.00 H ATOM 662 HE21 GLN A 313 23.757 39.988 83.115 1.00 0.00 H ATOM 663 H GLN A 313 25.754 38.263 78.298 1.00 0.00 H ATOM 664 N THR A 314 23.967 39.969 76.068 1.00 51.10 N ATOM 665 CA THR A 314 23.415 40.480 74.805 1.00 53.24 C ATOM 666 C THR A 314 21.976 39.997 74.565 1.00 57.27 C ATOM 667 O THR A 314 21.282 40.549 73.709 1.00 58.86 O ATOM 668 CB THR A 314 24.336 40.175 73.606 1.00 64.12 C ATOM 669 OG1 THR A 314 24.314 38.776 73.308 1.00 61.57 O ATOM 670 CG2 THR A 314 25.762 40.682 73.800 1.00 65.37 C ATOM 671 HG1 THR A 314 24.629 38.267 74.096 1.00 0.00 H ATOM 672 H THR A 314 24.580 39.130 76.034 1.00 0.00 H ATOM 673 N LEU A 315 21.532 38.974 75.322 1.00 51.86 N ATOM 674 CA LEU A 315 20.182 38.407 75.220 1.00 51.54 C ATOM 675 C LEU A 315 19.133 39.356 75.787 1.00 57.35 C ATOM 676 O LEU A 315 19.462 40.214 76.609 1.00 58.02 O ATOM 677 CB LEU A 315 20.091 37.065 75.971 1.00 49.17 C ATOM 678 CG LEU A 315 20.941 35.890 75.480 1.00 51.98 C ATOM 679 CD1 LEU A 315 21.002 34.813 76.533 1.00 49.58 C ATOM 680 CD2 LEU A 315 20.405 35.306 74.179 1.00 54.46 C ATOM 681 H LEU A 315 22.184 38.562 76.019 1.00 0.00 H ATOM 682 N ASP A 316 17.865 39.173 75.369 1.00 55.11 N ATOM 683 CA ASP A 316 16.707 39.932 75.851 1.00 56.42 C ATOM 684 C ASP A 316 16.581 39.673 77.354 1.00 57.65 C ATOM 685 O ASP A 316 16.730 38.522 77.784 1.00 54.41 O ATOM 686 CB ASP A 316 15.431 39.469 75.112 1.00 59.56 C ATOM 687 CG ASP A 316 14.184 40.266 75.447 1.00 74.15 C ATOM 688 OD1 ASP A 316 14.103 41.445 75.033 1.00 77.91 O ATOM 689 OD2 ASP A 316 13.274 39.698 76.087 1.00 80.44 O ATOM 690 H ASP A 316 17.695 38.439 74.652 1.00 0.00 H ATOM 691 N HIS A 317 16.355 40.740 78.138 1.00 55.26 N ATOM 692 CA HIS A 317 16.265 40.688 79.599 1.00 54.05 C ATOM 693 C HIS A 317 15.191 39.728 80.114 1.00 54.95 C ATOM 694 O HIS A 317 15.412 39.091 81.138 1.00 52.72 O ATOM 695 CB HIS A 317 16.112 42.090 80.208 1.00 57.48 C ATOM 696 CG HIS A 317 17.315 42.962 80.006 1.00 62.28 C ATOM 697 ND1 HIS A 317 18.600 42.483 80.217 1.00 62.81 N ATOM 698 CD2 HIS A 317 17.390 44.258 79.624 1.00 66.86 C ATOM 699 CE1 HIS A 317 19.410 43.490 79.942 1.00 63.75 C ATOM 700 NE2 HIS A 317 18.728 44.584 79.588 1.00 66.66 N ATOM 701 H HIS A 317 16.236 41.665 77.677 1.00 0.00 H ATOM 702 N GLU A 318 14.055 39.606 79.398 1.00 52.08 N ATOM 703 CA GLU A 318 12.979 38.686 79.780 1.00 51.25 C ATOM 704 C GLU A 318 13.418 37.227 79.597 1.00 52.17 C ATOM 705 O GLU A 318 13.090 36.380 80.431 1.00 50.74 O ATOM 706 CB GLU A 318 11.699 38.979 79.014 1.00 55.37 C ATOM 707 CG GLU A 318 10.833 40.034 79.684 1.00 70.88 C ATOM 708 CD GLU A 318 9.675 39.484 80.496 1.00 98.32 C ATOM 709 OE1 GLU A 318 8.515 39.586 80.032 1.00103.00 O ATOM 710 OE2 GLU A 318 9.921 38.982 81.616 1.00 91.31 O ATOM 711 H GLU A 318 13.938 40.186 78.543 1.00 0.00 H ATOM 712 N ASP A 319 14.197 36.950 78.533 1.00 47.22 N ATOM 713 CA ASP A 319 14.730 35.617 78.238 1.00 44.74 C ATOM 714 C ASP A 319 15.827 35.225 79.225 1.00 45.18 C ATOM 715 O ASP A 319 15.959 34.044 79.544 1.00 43.54 O ATOM 716 CB ASP A 319 15.242 35.544 76.789 1.00 46.86 C ATOM 717 CG ASP A 319 14.161 35.424 75.728 1.00 56.17 C ATOM 718 OD1 ASP A 319 12.998 35.136 76.090 1.00 57.24 O ATOM 719 OD2 ASP A 319 14.485 35.583 74.532 1.00 62.18 O ATOM 720 H ASP A 319 14.434 37.727 77.884 1.00 0.00 H ATOM 721 N GLN A 320 16.585 36.222 79.735 1.00 41.37 N ATOM 722 CA GLN A 320 17.657 36.038 80.717 1.00 39.06 C ATOM 723 C GLN A 320 17.113 35.423 82.008 1.00 41.25 C ATOM 724 O GLN A 320 17.736 34.510 82.561 1.00 38.13 O ATOM 725 CB GLN A 320 18.336 37.376 81.032 1.00 40.96 C ATOM 726 CG GLN A 320 19.355 37.862 80.001 1.00 40.73 C ATOM 727 CD GLN A 320 20.086 39.097 80.492 1.00 54.47 C ATOM 728 OE1 GLN A 320 19.670 39.780 81.437 1.00 52.04 O ATOM 729 NE2 GLN A 320 21.198 39.412 79.866 1.00 42.12 N ATOM 730 HE22 GLN A 320 21.533 38.827 79.074 1.00 0.00 H ATOM 731 HE21 GLN A 320 21.743 40.246 80.163 1.00 0.00 H ATOM 732 H GLN A 320 16.393 37.190 79.406 1.00 0.00 H ATOM 733 N ILE A 321 15.948 35.930 82.476 1.00 39.64 N ATOM 734 CA ILE A 321 15.235 35.467 83.675 1.00 39.39 C ATOM 735 C ILE A 321 14.692 34.066 83.422 1.00 42.82 C ATOM 736 O ILE A 321 14.826 33.201 84.288 1.00 41.32 O ATOM 737 CB ILE A 321 14.103 36.456 84.096 1.00 44.34 C ATOM 738 CG1 ILE A 321 14.625 37.918 84.207 1.00 45.83 C ATOM 739 CG2 ILE A 321 13.359 35.989 85.364 1.00 45.10 C ATOM 740 CD1 ILE A 321 14.940 38.526 85.588 1.00 50.07 C ATOM 741 H ILE A 321 15.521 36.714 81.942 1.00 0.00 H ATOM 742 N ALA A 322 14.082 33.843 82.233 1.00 40.74 N ATOM 743 CA ALA A 322 13.523 32.551 81.827 1.00 40.23 C ATOM 744 C ALA A 322 14.593 31.443 81.842 1.00 41.01 C ATOM 745 O ALA A 322 14.315 30.344 82.322 1.00 39.21 O ATOM 746 CB ALA A 322 12.890 32.668 80.449 1.00 42.71 C ATOM 747 H ALA A 322 14.006 34.638 81.567 1.00 0.00 H ATOM 748 N LEU A 323 15.827 31.762 81.372 1.00 36.62 N ATOM 749 CA LEU A 323 16.963 30.841 81.362 1.00 34.67 C ATOM 750 C LEU A 323 17.427 30.530 82.789 1.00 37.63 C ATOM 751 O LEU A 323 17.625 29.361 83.116 1.00 35.35 O ATOM 752 CB LEU A 323 18.130 31.390 80.521 1.00 34.46 C ATOM 753 CG LEU A 323 17.937 31.421 78.994 1.00 39.53 C ATOM 754 CD1 LEU A 323 19.053 32.184 78.329 1.00 39.34 C ATOM 755 CD2 LEU A 323 17.836 30.024 78.409 1.00 39.85 C ATOM 756 H LEU A 323 15.973 32.721 80.996 1.00 0.00 H ATOM 757 N LEU A 324 17.575 31.566 83.637 1.00 36.58 N ATOM 758 CA LEU A 324 17.988 31.408 85.036 1.00 36.42 C ATOM 759 C LEU A 324 16.974 30.619 85.863 1.00 39.34 C ATOM 760 O LEU A 324 17.369 29.705 86.581 1.00 37.85 O ATOM 761 CB LEU A 324 18.266 32.768 85.700 1.00 37.66 C ATOM 762 CG LEU A 324 19.734 33.171 85.830 1.00 42.64 C ATOM 763 CD1 LEU A 324 19.851 34.572 86.356 1.00 44.70 C ATOM 764 CD2 LEU A 324 20.503 32.225 86.754 1.00 43.52 C ATOM 765 H LEU A 324 17.387 32.526 83.283 1.00 0.00 H ATOM 766 N LYS A 325 15.672 30.948 85.733 1.00 37.77 N ATOM 767 CA LYS A 325 14.588 30.285 86.464 1.00 37.67 C ATOM 768 C LYS A 325 14.402 28.820 86.033 1.00 40.38 C ATOM 769 O LYS A 325 14.144 27.960 86.881 1.00 38.95 O ATOM 770 CB LYS A 325 13.276 31.069 86.323 1.00 42.11 C ATOM 771 CG LYS A 325 12.414 31.018 87.591 1.00 60.42 C ATOM 772 CD LYS A 325 11.068 31.686 87.368 1.00 72.55 C ATOM 773 CE LYS A 325 10.007 31.114 88.283 1.00 84.37 C ATOM 774 NZ LYS A 325 8.650 31.559 87.887 1.00 99.44 N ATOM 775 HZ1 LYS A 325 8.600 32.597 87.933 1.00 0.00 H ATOM 776 HZ2 LYS A 325 8.453 31.243 86.916 1.00 0.00 H ATOM 777 HZ3 LYS A 325 7.949 31.148 88.536 1.00 0.00 H ATOM 778 H LYS A 325 15.423 31.716 85.077 1.00 0.00 H ATOM 779 N GLY A 326 14.558 28.553 84.730 1.00 36.28 N ATOM 780 CA GLY A 326 14.414 27.219 84.156 1.00 35.41 C ATOM 781 C GLY A 326 15.586 26.287 84.394 1.00 37.37 C ATOM 782 O GLY A 326 15.436 25.072 84.239 1.00 36.52 O ATOM 783 H GLY A 326 14.795 29.340 84.092 1.00 0.00 H ATOM 784 N SER A 327 16.761 26.834 84.770 1.00 32.62 N ATOM 785 CA SER A 327 17.982 26.049 84.987 1.00 31.86 C ATOM 786 C SER A 327 18.470 25.945 86.438 1.00 34.57 C ATOM 787 O SER A 327 19.294 25.079 86.721 1.00 32.62 O ATOM 788 CB SER A 327 19.113 26.590 84.120 1.00 34.74 C ATOM 789 OG SER A 327 19.528 27.869 84.577 1.00 38.75 O ATOM 790 HG SER A 327 18.764 28.497 84.535 1.00 0.00 H ATOM 791 H SER A 327 16.803 27.863 84.913 1.00 0.00 H ATOM 792 N ALA A 328 18.008 26.837 87.344 1.00 32.61 N ATOM 793 CA ALA A 328 18.469 26.885 88.737 1.00 32.33 C ATOM 794 C ALA A 328 18.425 25.551 89.483 1.00 36.11 C ATOM 795 O ALA A 328 19.428 25.198 90.109 1.00 35.72 O ATOM 796 CB ALA A 328 17.719 27.948 89.515 1.00 34.17 C ATOM 797 H ALA A 328 17.290 27.524 87.038 1.00 0.00 H ATOM 798 N VAL A 329 17.291 24.810 89.397 1.00 32.38 N ATOM 799 CA VAL A 329 17.085 23.510 90.056 1.00 32.33 C ATOM 800 C VAL A 329 18.028 22.443 89.472 1.00 33.52 C ATOM 801 O VAL A 329 18.674 21.719 90.230 1.00 31.92 O ATOM 802 CB VAL A 329 15.587 23.063 90.041 1.00 37.53 C ATOM 803 CG1 VAL A 329 15.409 21.659 90.609 1.00 37.74 C ATOM 804 CG2 VAL A 329 14.707 24.049 90.811 1.00 38.10 C ATOM 805 H VAL A 329 16.510 25.189 88.823 1.00 0.00 H ATOM 806 N GLU A 330 18.093 22.352 88.133 1.00 29.23 N ATOM 807 CA GLU A 330 18.949 21.398 87.420 1.00 28.79 C ATOM 808 C GLU A 330 20.429 21.625 87.740 1.00 30.99 C ATOM 809 O GLU A 330 21.149 20.659 87.965 1.00 28.62 O ATOM 810 CB GLU A 330 18.723 21.488 85.905 1.00 30.32 C ATOM 811 CG GLU A 330 17.345 21.027 85.466 1.00 40.39 C ATOM 812 CD GLU A 330 16.978 21.309 84.020 1.00 56.01 C ATOM 813 OE1 GLU A 330 17.889 21.330 83.162 1.00 53.80 O ATOM 814 OE2 GLU A 330 15.770 21.487 83.740 1.00 46.82 O ATOM 815 H GLU A 330 17.502 22.996 87.569 1.00 0.00 H ATOM 816 N ALA A 331 20.870 22.897 87.792 1.00 28.25 N ATOM 817 CA ALA A 331 22.247 23.265 88.140 1.00 27.76 C ATOM 818 C ALA A 331 22.570 22.832 89.568 1.00 32.41 C ATOM 819 O ALA A 331 23.670 22.334 89.811 1.00 31.02 O ATOM 820 CB ALA A 331 22.443 24.759 87.997 1.00 28.40 C ATOM 821 H ALA A 331 20.198 23.660 87.574 1.00 0.00 H ATOM 822 N MET A 332 21.597 23.000 90.503 1.00 32.13 N ATOM 823 CA MET A 332 21.728 22.613 91.911 1.00 32.89 C ATOM 824 C MET A 332 21.953 21.105 92.032 1.00 36.08 C ATOM 825 O MET A 332 22.846 20.679 92.759 1.00 35.15 O ATOM 826 CB MET A 332 20.473 23.036 92.679 1.00 36.14 C ATOM 827 CG MET A 332 20.636 23.006 94.168 1.00 41.37 C ATOM 828 SD MET A 332 19.137 23.536 95.027 1.00 47.61 S ATOM 829 CE MET A 332 19.027 25.285 94.441 1.00 44.24 C ATOM 830 H MET A 332 20.701 23.431 90.199 1.00 0.00 H ATOM 831 N PHE A 333 21.148 20.307 91.296 1.00 33.09 N ATOM 832 CA PHE A 333 21.248 18.854 91.299 1.00 34.02 C ATOM 833 C PHE A 333 22.531 18.364 90.623 1.00 35.46 C ATOM 834 O PHE A 333 23.106 17.386 91.083 1.00 35.67 O ATOM 835 CB PHE A 333 20.000 18.197 90.695 1.00 36.92 C ATOM 836 CG PHE A 333 18.856 18.052 91.666 1.00 40.23 C ATOM 837 CD1 PHE A 333 18.850 17.034 92.613 1.00 44.80 C ATOM 838 CD2 PHE A 333 17.787 18.938 91.641 1.00 43.29 C ATOM 839 CE1 PHE A 333 17.790 16.900 93.510 1.00 46.79 C ATOM 840 CE2 PHE A 333 16.729 18.807 92.550 1.00 47.55 C ATOM 841 CZ PHE A 333 16.735 17.780 93.467 1.00 46.50 C ATOM 842 H PHE A 333 20.422 20.752 90.699 1.00 0.00 H ATOM 843 N LEU A 334 22.994 19.041 89.558 1.00 30.88 N ATOM 844 CA LEU A 334 24.240 18.676 88.872 1.00 31.30 C ATOM 845 C LEU A 334 25.427 18.947 89.798 1.00 32.49 C ATOM 846 O LEU A 334 26.322 18.112 89.889 1.00 33.26 O ATOM 847 CB LEU A 334 24.387 19.428 87.532 1.00 31.82 C ATOM 848 CG LEU A 334 25.604 19.079 86.655 1.00 37.40 C ATOM 849 CD1 LEU A 334 25.599 17.626 86.241 1.00 39.52 C ATOM 850 CD2 LEU A 334 25.645 19.952 85.420 1.00 38.65 C ATOM 851 H LEU A 334 22.449 19.854 89.207 1.00 0.00 H ATOM 852 N ARG A 335 25.394 20.077 90.528 1.00 27.84 N ATOM 853 CA ARG A 335 26.428 20.458 91.495 1.00 27.47 C ATOM 854 C ARG A 335 26.428 19.498 92.686 1.00 28.66 C ATOM 855 O ARG A 335 27.494 19.111 93.146 1.00 25.95 O ATOM 856 CB ARG A 335 26.258 21.924 91.953 1.00 26.72 C ATOM 857 CG ARG A 335 27.340 22.427 92.915 1.00 32.26 C ATOM 858 CD ARG A 335 28.718 22.382 92.284 1.00 35.83 C ATOM 859 NE ARG A 335 29.742 22.848 93.203 1.00 34.22 N ATOM 860 CZ ARG A 335 31.038 22.915 92.913 1.00 45.52 C ATOM 861 NH1 ARG A 335 31.474 22.541 91.711 1.00 32.23 N ATOM 862 NH2 ARG A 335 31.903 23.365 93.805 1.00 33.17 N ATOM 863 HE ARG A 335 29.441 23.150 94.152 1.00 0.00 H ATOM 864 HH12 ARG A 335 32.488 22.594 91.486 1.00 0.00 H ATOM 865 HH11 ARG A 335 30.800 22.196 90.998 1.00 0.00 H ATOM 866 HH22 ARG A 335 32.915 23.414 93.570 1.00 0.00 H ATOM 867 HH21 ARG A 335 31.572 23.670 94.742 1.00 0.00 H ATOM 868 H ARG A 335 24.586 20.719 90.398 1.00 0.00 H ATOM 869 N SER A 336 25.236 19.083 93.156 1.00 27.81 N ATOM 870 CA SER A 336 25.090 18.119 94.253 1.00 29.01 C ATOM 871 C SER A 336 25.678 16.768 93.851 1.00 34.30 C ATOM 872 O SER A 336 26.327 16.113 94.665 1.00 34.60 O ATOM 873 CB SER A 336 23.623 17.952 94.629 1.00 32.94 C ATOM 874 OG SER A 336 23.138 19.098 95.305 1.00 42.84 O ATOM 875 HG SER A 336 23.227 19.889 94.717 1.00 0.00 H ATOM 876 H SER A 336 24.374 19.466 92.719 1.00 0.00 H ATOM 877 N ALA A 337 25.483 16.384 92.571 1.00 31.45 N ATOM 878 CA ALA A 337 25.996 15.136 91.995 1.00 31.88 C ATOM 879 C ALA A 337 27.525 15.156 91.937 1.00 35.37 C ATOM 880 O ALA A 337 28.156 14.156 92.276 1.00 36.55 O ATOM 881 CB ALA A 337 25.402 14.908 90.614 1.00 32.13 C ATOM 882 H ALA A 337 24.933 17.014 91.953 1.00 0.00 H ATOM 883 N GLU A 338 28.114 16.308 91.557 1.00 29.54 N ATOM 884 CA GLU A 338 29.559 16.534 91.501 1.00 29.73 C ATOM 885 C GLU A 338 30.165 16.395 92.899 1.00 34.93 C ATOM 886 O GLU A 338 31.144 15.668 93.055 1.00 35.73 O ATOM 887 CB GLU A 338 29.869 17.916 90.905 1.00 29.86 C ATOM 888 CG GLU A 338 31.356 18.200 90.740 1.00 34.46 C ATOM 889 CD GLU A 338 31.715 19.550 90.149 1.00 44.64 C ATOM 890 OE1 GLU A 338 30.806 20.394 89.989 1.00 32.51 O ATOM 891 OE2 GLU A 338 32.911 19.771 89.856 1.00 42.26 O ATOM 892 H GLU A 338 27.494 17.096 91.283 1.00 0.00 H ATOM 893 N ILE A 339 29.581 17.071 93.909 1.00 31.38 N ATOM 894 CA ILE A 339 30.054 17.019 95.297 1.00 32.78 C ATOM 895 C ILE A 339 30.024 15.574 95.839 1.00 40.89 C ATOM 896 O ILE A 339 31.020 15.118 96.402 1.00 42.55 O ATOM 897 CB ILE A 339 29.318 18.043 96.212 1.00 35.31 C ATOM 898 CG1 ILE A 339 29.553 19.495 95.729 1.00 34.76 C ATOM 899 CG2 ILE A 339 29.753 17.893 97.682 1.00 37.06 C ATOM 900 CD1 ILE A 339 28.520 20.484 96.211 1.00 40.55 C ATOM 901 H ILE A 339 28.752 17.660 93.693 1.00 0.00 H ATOM 902 N PHE A 340 28.907 14.855 95.614 1.00 38.63 N ATOM 903 CA PHE A 340 28.697 13.463 96.041 1.00 41.08 C ATOM 904 C PHE A 340 29.723 12.485 95.453 1.00 46.40 C ATOM 905 O PHE A 340 30.073 11.514 96.117 1.00 48.10 O ATOM 906 CB PHE A 340 27.266 13.006 95.682 1.00 42.49 C ATOM 907 CG PHE A 340 26.859 11.666 96.247 1.00 45.59 C ATOM 908 CD1 PHE A 340 26.362 11.562 97.536 1.00 49.10 C ATOM 909 CD2 PHE A 340 26.950 10.511 95.476 1.00 48.93 C ATOM 910 CE1 PHE A 340 25.986 10.322 98.056 1.00 52.09 C ATOM 911 CE2 PHE A 340 26.568 9.273 95.993 1.00 53.71 C ATOM 912 CZ PHE A 340 26.084 9.187 97.277 1.00 52.55 C ATOM 913 H PHE A 340 28.133 15.320 95.098 1.00 0.00 H ATOM 914 N ASN A 341 30.171 12.722 94.212 1.00 42.71 N ATOM 915 CA ASN A 341 31.108 11.830 93.536 1.00 44.78 C ATOM 916 C ASN A 341 32.575 12.213 93.690 1.00 51.21 C ATOM 917 O ASN A 341 33.438 11.539 93.112 1.00 52.64 O ATOM 918 CB ASN A 341 30.733 11.673 92.068 1.00 43.96 C ATOM 919 CG ASN A 341 29.450 10.907 91.907 1.00 66.70 C ATOM 920 OD1 ASN A 341 29.353 9.730 92.257 1.00 66.90 O ATOM 921 ND2 ASN A 341 28.438 11.563 91.366 1.00 54.73 N ATOM 922 HD22 ASN A 341 28.555 12.557 91.082 1.00 0.00 H ATOM 923 HD21 ASN A 341 27.525 11.086 91.224 1.00 0.00 H ATOM 924 H ASN A 341 29.839 13.572 93.713 1.00 0.00 H ATOM 925 N LYS A 342 32.871 13.269 94.480 1.00 47.99 N ATOM 926 CA LYS A 342 34.252 13.685 94.735 1.00 49.82 C ATOM 927 C LYS A 342 34.886 12.705 95.715 1.00 57.24 C ATOM 928 O LYS A 342 34.240 12.313 96.688 1.00 56.73 O ATOM 929 CB LYS A 342 34.338 15.134 95.240 1.00 51.85 C ATOM 930 CG LYS A 342 35.537 15.863 94.650 1.00 73.74 C ATOM 931 CD LYS A 342 35.544 17.331 95.023 1.00 82.64 C ATOM 932 CE LYS A 342 36.602 18.105 94.312 1.00 93.94 C ATOM 933 NZ LYS A 342 37.117 19.218 95.144 1.00101.86 N ATOM 934 HZ1 LYS A 342 36.337 19.865 95.377 1.00 0.00 H ATOM 935 HZ2 LYS A 342 37.524 18.834 96.021 1.00 0.00 H ATOM 936 HZ3 LYS A 342 37.851 19.733 94.616 1.00 0.00 H ATOM 937 H LYS A 342 32.094 13.802 94.920 1.00 0.00 H ATOM 938 N LYS A 343 36.130 12.270 95.424 1.00 57.00 N ATOM 939 CA LYS A 343 36.873 11.299 96.228 1.00 59.90 C ATOM 940 C LYS A 343 37.095 11.752 97.669 1.00 64.65 C ATOM 941 O LYS A 343 37.597 12.854 97.917 1.00 63.72 O ATOM 942 CB LYS A 343 38.210 10.930 95.562 1.00 64.96 C ATOM 943 CG LYS A 343 38.343 9.440 95.246 1.00 85.00 C ATOM 944 CD LYS A 343 39.026 8.649 96.366 1.00 96.90 C ATOM 945 CE LYS A 343 39.176 7.193 95.993 1.00109.96 C ATOM 946 NZ LYS A 343 39.817 6.402 97.074 1.00122.84 N ATOM 947 HZ1 LYS A 343 40.764 6.786 97.268 1.00 0.00 H ATOM 948 HZ2 LYS A 343 39.235 6.458 97.934 1.00 0.00 H ATOM 949 HZ3 LYS A 343 39.899 5.410 96.774 1.00 0.00 H ATOM 950 H LYS A 343 36.591 12.650 94.573 1.00 0.00 H ATOM 951 N LEU A 344 36.686 10.891 98.613 1.00 62.54 N ATOM 952 CA LEU A 344 36.801 11.103 100.048 1.00 63.59 C ATOM 953 C LEU A 344 37.542 9.906 100.671 1.00 71.79 C ATOM 954 O LEU A 344 37.491 8.818 100.089 1.00 72.35 O ATOM 955 CB LEU A 344 35.388 11.186 100.668 1.00 61.89 C ATOM 956 CG LEU A 344 34.516 12.407 100.360 1.00 63.47 C ATOM 957 CD1 LEU A 344 33.064 12.123 100.720 1.00 62.58 C ATOM 958 CD2 LEU A 344 34.995 13.648 101.098 1.00 65.33 C ATOM 959 H LEU A 344 36.252 10.001 98.294 1.00 0.00 H ATOM 960 N PRO A 345 38.186 10.047 101.862 1.00 71.49 N ATOM 961 CA PRO A 345 38.843 8.882 102.495 1.00 75.15 C ATOM 962 C PRO A 345 37.890 7.718 102.750 1.00 81.00 C ATOM 963 O PRO A 345 36.677 7.929 102.843 1.00 78.00 O ATOM 964 CB PRO A 345 39.384 9.443 103.812 1.00 78.09 C ATOM 965 CG PRO A 345 39.529 10.898 103.560 1.00 80.21 C ATOM 966 CD PRO A 345 38.374 11.261 102.678 1.00 72.50 C ATOM 967 N SER A 346 38.443 6.483 102.780 1.00 81.44 N ATOM 968 CA SER A 346 37.723 5.215 102.949 1.00 82.69 C ATOM 969 C SER A 346 36.607 5.278 104.003 1.00 85.95 C ATOM 970 O SER A 346 36.856 5.626 105.163 1.00 86.89 O ATOM 971 CB SER A 346 38.694 4.071 103.237 1.00 90.82 C ATOM 972 OG SER A 346 38.033 2.816 103.250 1.00101.07 O ATOM 973 HG SER A 346 38.690 2.100 103.439 1.00 0.00 H ATOM 974 H SER A 346 39.476 6.427 102.673 1.00 0.00 H ATOM 975 N GLY A 347 35.388 4.978 103.555 1.00 81.74 N ATOM 976 CA GLY A 347 34.199 4.964 104.396 1.00 80.99 C ATOM 977 C GLY A 347 33.406 6.255 104.481 1.00 81.27 C ATOM 978 O GLY A 347 32.220 6.196 104.811 1.00 80.86 O ATOM 979 H GLY A 347 35.280 4.741 102.548 1.00 0.00 H ATOM 980 N HIS A 348 34.043 7.429 104.220 1.00 77.00 N ATOM 981 CA HIS A 348 33.389 8.746 104.276 1.00 74.08 C ATOM 982 C HIS A 348 32.234 8.915 103.288 1.00 72.97 C ATOM 983 O HIS A 348 31.252 9.570 103.630 1.00 70.98 O ATOM 984 CB HIS A 348 34.389 9.904 104.117 1.00 74.97 C ATOM 985 CG HIS A 348 35.157 10.236 105.352 1.00 80.58 C ATOM 986 ND1 HIS A 348 36.553 10.172 105.369 1.00 82.28 N ATOM 987 CD2 HIS A 348 34.698 10.738 106.523 1.00 84.82 C ATOM 988 CE1 HIS A 348 36.881 10.606 106.572 1.00 83.90 C ATOM 989 NE2 HIS A 348 35.805 10.883 107.318 1.00 85.70 N ATOM 990 H HIS A 348 35.051 7.393 103.966 1.00 0.00 H ATOM 991 N SER A 349 32.342 8.337 102.067 1.00 68.15 N ATOM 992 CA SER A 349 31.277 8.420 101.061 1.00 65.61 C ATOM 993 C SER A 349 30.043 7.613 101.471 1.00 68.66 C ATOM 994 O SER A 349 28.921 8.009 101.143 1.00 66.06 O ATOM 995 CB SER A 349 31.783 7.992 99.690 1.00 69.02 C ATOM 996 OG SER A 349 32.566 9.022 99.114 1.00 76.38 O ATOM 997 HG SER A 349 32.888 8.731 98.224 1.00 0.00 H ATOM 998 H SER A 349 33.211 7.816 101.835 1.00 0.00 H ATOM 999 N ASP A 350 30.251 6.507 102.217 1.00 66.07 N ATOM 1000 CA ASP A 350 29.178 5.658 102.743 1.00 66.52 C ATOM 1001 C ASP A 350 28.404 6.424 103.822 1.00 67.52 C ATOM 1002 O ASP A 350 27.176 6.347 103.855 1.00 66.71 O ATOM 1003 CB ASP A 350 29.749 4.345 103.318 1.00 72.14 C ATOM 1004 CG ASP A 350 30.463 3.461 102.308 1.00 84.66 C ATOM 1005 OD1 ASP A 350 31.312 3.987 101.548 1.00 84.63 O ATOM 1006 OD2 ASP A 350 30.218 2.233 102.316 1.00 92.45 O ATOM 1007 H ASP A 350 31.233 6.241 102.432 1.00 0.00 H ATOM 1008 N LEU A 351 29.127 7.182 104.681 1.00 62.89 N ATOM 1009 CA LEU A 351 28.537 7.998 105.744 1.00 61.08 C ATOM 1010 C LEU A 351 27.798 9.202 105.155 1.00 60.78 C ATOM 1011 O LEU A 351 26.727 9.548 105.651 1.00 59.15 O ATOM 1012 CB LEU A 351 29.592 8.440 106.781 1.00 62.17 C ATOM 1013 CG LEU A 351 29.067 9.166 108.040 1.00 66.75 C ATOM 1014 CD1 LEU A 351 28.255 8.237 108.931 1.00 68.93 C ATOM 1015 CD2 LEU A 351 30.199 9.778 108.832 1.00 70.88 C ATOM 1016 H LEU A 351 30.162 7.184 104.579 1.00 0.00 H ATOM 1017 N LEU A 352 28.351 9.813 104.088 1.00 55.41 N ATOM 1018 CA LEU A 352 27.737 10.945 103.393 1.00 52.13 C ATOM 1019 C LEU A 352 26.363 10.541 102.850 1.00 53.44 C ATOM 1020 O LEU A 352 25.384 11.245 103.104 1.00 51.52 O ATOM 1021 CB LEU A 352 28.658 11.466 102.267 1.00 51.39 C ATOM 1022 CG LEU A 352 28.131 12.629 101.405 1.00 53.99 C ATOM 1023 CD1 LEU A 352 27.983 13.922 102.219 1.00 53.54 C ATOM 1024 CD2 LEU A 352 29.021 12.854 100.210 1.00 55.85 C ATOM 1025 H LEU A 352 29.265 9.460 103.739 1.00 0.00 H ATOM 1026 N GLU A 353 26.287 9.378 102.173 1.00 49.74 N ATOM 1027 CA GLU A 353 25.056 8.819 101.617 1.00 49.01 C ATOM 1028 C GLU A 353 24.021 8.563 102.719 1.00 52.65 C ATOM 1029 O GLU A 353 22.857 8.931 102.555 1.00 50.82 O ATOM 1030 CB GLU A 353 25.359 7.529 100.840 1.00 52.11 C ATOM 1031 CG GLU A 353 24.275 7.149 99.846 1.00 62.19 C ATOM 1032 CD GLU A 353 24.551 5.889 99.048 1.00 75.94 C ATOM 1033 OE1 GLU A 353 25.652 5.784 98.461 1.00 64.35 O ATOM 1034 OE2 GLU A 353 23.647 5.025 98.978 1.00 73.82 O ATOM 1035 H GLU A 353 27.167 8.840 102.036 1.00 0.00 H ATOM 1036 N ALA A 354 24.458 7.954 103.847 1.00 51.37 N ATOM 1037 CA ALA A 354 23.613 7.655 105.006 1.00 51.72 C ATOM 1038 C ALA A 354 23.067 8.940 105.634 1.00 52.31 C ATOM 1039 O ALA A 354 21.885 8.988 105.966 1.00 51.63 O ATOM 1040 CB ALA A 354 24.393 6.845 106.035 1.00 55.13 C ATOM 1041 H ALA A 354 25.460 7.680 103.894 1.00 0.00 H ATOM 1042 N ARG A 355 23.912 9.985 105.749 1.00 47.14 N ATOM 1043 CA ARG A 355 23.527 11.288 106.300 1.00 45.91 C ATOM 1044 C ARG A 355 22.486 11.995 105.424 1.00 48.59 C ATOM 1045 O ARG A 355 21.562 12.603 105.962 1.00 48.38 O ATOM 1046 CB ARG A 355 24.758 12.178 106.567 1.00 44.52 C ATOM 1047 CG ARG A 355 25.631 11.700 107.735 1.00 49.01 C ATOM 1048 CD ARG A 355 25.265 12.326 109.072 1.00 52.57 C ATOM 1049 NE ARG A 355 25.970 11.697 110.195 1.00 58.60 N ATOM 1050 CZ ARG A 355 27.201 12.014 110.589 1.00 72.26 C ATOM 1051 NH1 ARG A 355 27.751 11.400 111.626 1.00 68.00 N ATOM 1052 NH2 ARG A 355 27.895 12.935 109.940 1.00 55.17 N ATOM 1053 HE ARG A 355 25.472 10.950 110.720 1.00 0.00 H ATOM 1054 HH12 ARG A 355 28.713 11.652 111.929 1.00 0.00 H ATOM 1055 HH11 ARG A 355 27.220 10.666 112.137 1.00 0.00 H ATOM 1056 HH22 ARG A 355 28.857 13.178 110.253 1.00 0.00 H ATOM 1057 HH21 ARG A 355 27.479 13.416 109.117 1.00 0.00 H ATOM 1058 H ARG A 355 24.893 9.859 105.428 1.00 0.00 H ATOM 1059 N ILE A 356 22.600 11.865 104.084 1.00 44.96 N ATOM 1060 CA ILE A 356 21.635 12.444 103.138 1.00 43.29 C ATOM 1061 C ILE A 356 20.310 11.647 103.180 1.00 49.43 C ATOM 1062 O ILE A 356 19.240 12.258 103.093 1.00 48.50 O ATOM 1063 CB ILE A 356 22.219 12.636 101.699 1.00 44.82 C ATOM 1064 CG1 ILE A 356 23.476 13.537 101.718 1.00 43.75 C ATOM 1065 CG2 ILE A 356 21.167 13.217 100.751 1.00 44.78 C ATOM 1066 CD1 ILE A 356 24.454 13.294 100.593 1.00 46.72 C ATOM 1067 H ILE A 356 23.408 11.331 103.704 1.00 0.00 H ATOM 1068 N ARG A 357 20.381 10.300 103.351 1.00 48.94 N ATOM 1069 CA ARG A 357 19.190 9.444 103.452 1.00 50.41 C ATOM 1070 C ARG A 357 18.349 9.811 104.670 1.00 54.89 C ATOM 1071 O ARG A 357 17.122 9.751 104.606 1.00 55.09 O ATOM 1072 CB ARG A 357 19.572 7.955 103.524 1.00 53.50 C ATOM 1073 CG ARG A 357 19.913 7.355 102.176 1.00 63.49 C ATOM 1074 CD ARG A 357 19.294 5.990 101.957 1.00 76.78 C ATOM 1075 NE ARG A 357 19.290 5.633 100.535 1.00 86.95 N ATOM 1076 CZ ARG A 357 20.273 4.989 99.912 1.00103.38 C ATOM 1077 NH1 ARG A 357 20.178 4.715 98.618 1.00 91.16 N ATOM 1078 NH2 ARG A 357 21.360 4.617 100.579 1.00 92.65 N ATOM 1079 HE ARG A 357 18.458 5.903 99.972 1.00 0.00 H ATOM 1080 HH12 ARG A 357 20.949 4.211 98.135 1.00 0.00 H ATOM 1081 HH11 ARG A 357 19.332 5.004 98.086 1.00 0.00 H ATOM 1082 HH22 ARG A 357 22.125 4.114 100.087 1.00 0.00 H ATOM 1083 HH21 ARG A 357 21.446 4.829 101.594 1.00 0.00 H ATOM 1084 H ARG A 357 21.319 9.856 103.413 1.00 0.00 H ATOM 1085 N ASN A 358 19.008 10.198 105.778 1.00 52.47 N ATOM 1086 CA ASN A 358 18.366 10.570 107.044 1.00 53.42 C ATOM 1087 C ASN A 358 18.237 12.089 107.261 1.00 56.12 C ATOM 1088 O ASN A 358 18.041 12.537 108.397 1.00 57.00 O ATOM 1089 CB ASN A 358 19.118 9.918 108.210 1.00 58.40 C ATOM 1090 CG ASN A 358 18.228 9.495 109.351 1.00 91.10 C ATOM 1091 OD1 ASN A 358 17.331 8.657 109.198 1.00 86.94 O ATOM 1092 ND2 ASN A 358 18.477 10.049 110.525 1.00 84.51 N ATOM 1093 HD22 ASN A 358 19.239 10.750 110.618 1.00 0.00 H ATOM 1094 HD21 ASN A 358 17.911 9.783 111.356 1.00 0.00 H ATOM 1095 H ASN A 358 20.046 10.236 105.734 1.00 0.00 H ATOM 1096 N SER A 359 18.333 12.883 106.187 1.00 50.25 N ATOM 1097 CA SER A 359 18.265 14.345 106.262 1.00 48.42 C ATOM 1098 C SER A 359 16.881 14.924 106.574 1.00 52.55 C ATOM 1099 O SER A 359 16.794 16.017 107.133 1.00 51.29 O ATOM 1100 CB SER A 359 18.800 14.965 104.981 1.00 48.97 C ATOM 1101 OG SER A 359 18.021 14.562 103.872 1.00 55.38 O ATOM 1102 HG SER A 359 18.052 13.576 103.790 1.00 0.00 H ATOM 1103 H SER A 359 18.462 12.441 105.255 1.00 0.00 H ATOM 1104 N GLY A 360 15.833 14.224 106.157 1.00 50.34 N ATOM 1105 CA GLY A 360 14.452 14.653 106.330 1.00 51.04 C ATOM 1106 C GLY A 360 13.594 14.474 105.090 1.00 54.83 C ATOM 1107 O GLY A 360 12.367 14.520 105.196 1.00 55.81 O ATOM 1108 H GLY A 360 16.008 13.317 105.679 1.00 0.00 H ATOM 1109 N ILE A 361 14.221 14.269 103.908 1.00 50.71 N ATOM 1110 CA ILE A 361 13.510 14.058 102.630 1.00 50.77 C ATOM 1111 C ILE A 361 12.737 12.728 102.668 1.00 56.54 C ATOM 1112 O ILE A 361 13.194 11.794 103.324 1.00 56.92 O ATOM 1113 CB ILE A 361 14.452 14.062 101.385 1.00 52.46 C ATOM 1114 CG1 ILE A 361 15.752 14.853 101.606 1.00 51.41 C ATOM 1115 CG2 ILE A 361 13.708 14.547 100.142 1.00 52.90 C ATOM 1116 CD1 ILE A 361 16.922 14.505 100.659 1.00 59.22 C ATOM 1117 H ILE A 361 15.261 14.259 103.899 1.00 0.00 H ATOM 1118 N SER A 362 11.588 12.638 101.953 1.00 54.06 N ATOM 1119 CA SER A 362 10.824 11.387 101.842 1.00 56.29 C ATOM 1120 C SER A 362 11.623 10.350 101.059 1.00 60.28 C ATOM 1121 O SER A 362 12.350 10.721 100.135 1.00 57.53 O ATOM 1122 CB SER A 362 9.487 11.619 101.149 1.00 61.05 C ATOM 1123 OG SER A 362 8.636 12.393 101.978 1.00 71.55 O ATOM 1124 HG SER A 362 9.063 13.267 102.163 1.00 0.00 H ATOM 1125 H SER A 362 11.234 13.486 101.465 1.00 0.00 H ATOM 1126 N ASP A 363 11.477 9.054 101.431 1.00 59.95 N ATOM 1127 CA ASP A 363 12.146 7.890 100.819 1.00 61.15 C ATOM 1128 C ASP A 363 11.936 7.848 99.305 1.00 64.99 C ATOM 1129 O ASP A 363 12.853 7.498 98.556 1.00 64.29 O ATOM 1130 CB ASP A 363 11.624 6.581 101.444 1.00 66.63 C ATOM 1131 CG ASP A 363 11.487 6.604 102.954 1.00 83.06 C ATOM 1132 OD1 ASP A 363 10.592 7.320 103.458 1.00 85.14 O ATOM 1133 OD2 ASP A 363 12.249 5.879 103.630 1.00 91.25 O ATOM 1134 H ASP A 363 10.832 8.862 102.224 1.00 0.00 H ATOM 1135 N GLU A 364 10.719 8.223 98.872 1.00 62.52 N ATOM 1136 CA GLU A 364 10.189 8.319 97.508 1.00 62.57 C ATOM 1137 C GLU A 364 11.106 9.141 96.586 1.00 65.03 C ATOM 1138 O GLU A 364 11.202 8.877 95.385 1.00 65.08 O ATOM 1139 CB GLU A 364 8.815 9.011 97.613 1.00 64.60 C ATOM 1140 CG GLU A 364 7.950 9.035 96.364 1.00 77.02 C ATOM 1141 CD GLU A 364 6.527 9.504 96.615 1.00103.04 C ATOM 1142 OE1 GLU A 364 6.346 10.552 97.277 1.00 94.55 O ATOM 1143 OE2 GLU A 364 5.588 8.816 96.154 1.00101.76 O ATOM 1144 H GLU A 364 10.049 8.486 99.622 1.00 0.00 H ATOM 1145 N TYR A 365 11.722 10.188 97.156 1.00 59.79 N ATOM 1146 CA TYR A 365 12.558 11.144 96.438 1.00 57.77 C ATOM 1147 C TYR A 365 14.052 10.880 96.570 1.00 61.05 C ATOM 1148 O TYR A 365 14.815 11.294 95.695 1.00 59.58 O ATOM 1149 CB TYR A 365 12.200 12.572 96.855 1.00 57.84 C ATOM 1150 CG TYR A 365 10.759 12.928 96.565 1.00 61.44 C ATOM 1151 CD1 TYR A 365 10.309 13.092 95.256 1.00 63.79 C ATOM 1152 CD2 TYR A 365 9.841 13.091 97.597 1.00 63.52 C ATOM 1153 CE1 TYR A 365 8.975 13.391 94.982 1.00 66.74 C ATOM 1154 CE2 TYR A 365 8.510 13.409 97.336 1.00 66.06 C ATOM 1155 CZ TYR A 365 8.081 13.558 96.027 1.00 74.45 C ATOM 1156 OH TYR A 365 6.768 13.865 95.772 1.00 78.33 O ATOM 1157 HH TYR A 365 6.631 13.935 94.794 1.00 0.00 H ATOM 1158 H TYR A 365 11.595 10.327 98.179 1.00 0.00 H ATOM 1159 N ILE A 366 14.458 10.171 97.634 1.00 58.57 N ATOM 1160 CA ILE A 366 15.847 9.801 97.929 1.00 58.03 C ATOM 1161 C ILE A 366 16.393 8.818 96.875 1.00 61.08 C ATOM 1162 O ILE A 366 17.506 9.023 96.383 1.00 59.47 O ATOM 1163 CB ILE A 366 15.958 9.256 99.385 1.00 62.80 C ATOM 1164 CG1 ILE A 366 15.795 10.389 100.413 1.00 62.51 C ATOM 1165 CG2 ILE A 366 17.255 8.480 99.637 1.00 64.10 C ATOM 1166 CD1 ILE A 366 15.310 9.933 101.686 1.00 72.89 C ATOM 1167 H ILE A 366 13.728 9.858 98.305 1.00 0.00 H ATOM 1168 N THR A 367 15.615 7.761 96.546 1.00 58.26 N ATOM 1169 CA THR A 367 15.971 6.710 95.582 1.00 58.70 C ATOM 1170 C THR A 367 16.297 7.291 94.172 1.00 59.19 C ATOM 1171 O THR A 367 17.415 7.041 93.721 1.00 58.79 O ATOM 1172 CB THR A 367 14.909 5.588 95.557 1.00 70.96 C ATOM 1173 OG1 THR A 367 14.488 5.298 96.891 1.00 72.24 O ATOM 1174 CG2 THR A 367 15.408 4.317 94.875 1.00 71.61 C ATOM 1175 HG1 THR A 367 14.098 6.112 97.297 1.00 0.00 H ATOM 1176 H THR A 367 14.689 7.686 97.014 1.00 0.00 H ATOM 1177 N PRO A 368 15.423 8.079 93.475 1.00 53.52 N ATOM 1178 CA PRO A 368 15.822 8.614 92.155 1.00 51.91 C ATOM 1179 C PRO A 368 16.979 9.621 92.199 1.00 53.19 C ATOM 1180 O PRO A 368 17.698 9.759 91.207 1.00 52.61 O ATOM 1181 CB PRO A 368 14.532 9.247 91.612 1.00 53.49 C ATOM 1182 CG PRO A 368 13.725 9.537 92.796 1.00 58.20 C ATOM 1183 CD PRO A 368 14.048 8.498 93.819 1.00 55.13 C ATOM 1184 N MET A 369 17.165 10.304 93.348 1.00 47.63 N ATOM 1185 CA MET A 369 18.242 11.271 93.563 1.00 44.71 C ATOM 1186 C MET A 369 19.604 10.551 93.572 1.00 47.57 C ATOM 1187 O MET A 369 20.524 10.991 92.882 1.00 45.00 O ATOM 1188 CB MET A 369 18.013 12.034 94.876 1.00 46.32 C ATOM 1189 CG MET A 369 18.869 13.274 95.021 1.00 48.18 C ATOM 1190 SD MET A 369 18.817 13.960 96.688 1.00 51.98 S ATOM 1191 CE MET A 369 19.846 12.811 97.527 1.00 50.18 C ATOM 1192 H MET A 369 16.501 10.132 94.130 1.00 0.00 H ATOM 1193 N PHE A 370 19.714 9.427 94.328 1.00 46.69 N ATOM 1194 CA PHE A 370 20.948 8.636 94.398 1.00 47.46 C ATOM 1195 C PHE A 370 21.208 7.860 93.113 1.00 50.82 C ATOM 1196 O PHE A 370 22.370 7.624 92.770 1.00 50.49 O ATOM 1197 CB PHE A 370 20.993 7.732 95.639 1.00 51.50 C ATOM 1198 CG PHE A 370 21.265 8.473 96.933 1.00 52.97 C ATOM 1199 CD1 PHE A 370 22.257 9.445 97.009 1.00 55.07 C ATOM 1200 CD2 PHE A 370 20.558 8.172 98.085 1.00 56.94 C ATOM 1201 CE1 PHE A 370 22.502 10.133 98.207 1.00 55.35 C ATOM 1202 CE2 PHE A 370 20.819 8.851 99.287 1.00 59.37 C ATOM 1203 CZ PHE A 370 21.785 9.828 99.339 1.00 55.51 C ATOM 1204 H PHE A 370 18.890 9.115 94.880 1.00 0.00 H ATOM 1205 N SER A 371 20.133 7.504 92.380 1.00 47.34 N ATOM 1206 CA SER A 371 20.201 6.815 91.086 1.00 47.79 C ATOM 1207 C SER A 371 20.890 7.740 90.078 1.00 48.90 C ATOM 1208 O SER A 371 21.730 7.293 89.297 1.00 49.86 O ATOM 1209 CB SER A 371 18.801 6.449 90.598 1.00 50.87 C ATOM 1210 OG SER A 371 18.829 5.951 89.270 1.00 58.11 O ATOM 1211 HG SER A 371 17.909 5.724 88.985 1.00 0.00 H ATOM 1212 H SER A 371 19.192 7.734 92.758 1.00 0.00 H ATOM 1213 N PHE A 372 20.567 9.041 90.146 1.00 42.85 N ATOM 1214 CA PHE A 372 21.159 10.072 89.301 1.00 39.32 C ATOM 1215 C PHE A 372 22.628 10.326 89.683 1.00 41.59 C ATOM 1216 O PHE A 372 23.477 10.406 88.798 1.00 40.90 O ATOM 1217 CB PHE A 372 20.330 11.364 89.349 1.00 39.04 C ATOM 1218 CG PHE A 372 20.934 12.513 88.575 1.00 38.19 C ATOM 1219 CD1 PHE A 372 20.921 12.521 87.182 1.00 40.71 C ATOM 1220 CD2 PHE A 372 21.522 13.579 89.234 1.00 38.08 C ATOM 1221 CE1 PHE A 372 21.508 13.567 86.466 1.00 40.20 C ATOM 1222 CE2 PHE A 372 22.099 14.628 88.517 1.00 39.68 C ATOM 1223 CZ PHE A 372 22.090 14.614 87.137 1.00 37.93 C ATOM 1224 H PHE A 372 19.852 9.331 90.843 1.00 0.00 H ATOM 1225 N TYR A 373 22.920 10.457 90.995 1.00 37.58 N ATOM 1226 CA TYR A 373 24.276 10.697 91.512 1.00 36.88 C ATOM 1227 C TYR A 373 25.241 9.573 91.115 1.00 44.73 C ATOM 1228 O TYR A 373 26.352 9.856 90.669 1.00 44.29 O ATOM 1229 CB TYR A 373 24.272 10.859 93.050 1.00 36.91 C ATOM 1230 CG TYR A 373 23.551 12.067 93.614 1.00 34.85 C ATOM 1231 CD1 TYR A 373 23.108 13.093 92.786 1.00 34.64 C ATOM 1232 CD2 TYR A 373 23.366 12.214 94.986 1.00 35.59 C ATOM 1233 CE1 TYR A 373 22.462 14.211 93.302 1.00 33.84 C ATOM 1234 CE2 TYR A 373 22.730 13.335 95.515 1.00 35.01 C ATOM 1235 CZ TYR A 373 22.279 14.332 94.669 1.00 40.96 C ATOM 1236 OH TYR A 373 21.623 15.425 95.183 1.00 39.58 O ATOM 1237 HH TYR A 373 22.219 15.899 95.816 1.00 0.00 H ATOM 1238 H TYR A 373 22.141 10.384 91.680 1.00 0.00 H ATOM 1239 N LYS A 374 24.807 8.304 91.265 1.00 45.17 N ATOM 1240 CA LYS A 374 25.612 7.129 90.916 1.00 47.61 C ATOM 1241 C LYS A 374 25.876 7.027 89.409 1.00 52.28 C ATOM 1242 O LYS A 374 27.004 6.726 89.017 1.00 52.43 O ATOM 1243 CB LYS A 374 24.991 5.841 91.479 1.00 53.17 C ATOM 1244 CG LYS A 374 25.182 5.695 92.992 1.00 72.90 C ATOM 1245 CD LYS A 374 24.403 4.517 93.555 1.00 89.16 C ATOM 1246 CE LYS A 374 24.653 4.339 95.032 1.00104.93 C ATOM 1247 NZ LYS A 374 23.785 3.278 95.598 1.00117.77 N ATOM 1248 HZ1 LYS A 374 22.787 3.537 95.458 1.00 0.00 H ATOM 1249 HZ2 LYS A 374 23.982 2.377 95.116 1.00 0.00 H ATOM 1250 HZ3 LYS A 374 23.979 3.178 96.615 1.00 0.00 H ATOM 1251 H LYS A 374 23.852 8.151 91.648 1.00 0.00 H ATOM 1252 N SER A 375 24.848 7.322 88.571 1.00 48.95 N ATOM 1253 CA SER A 375 24.950 7.314 87.105 1.00 49.57 C ATOM 1254 C SER A 375 25.884 8.418 86.601 1.00 52.13 C ATOM 1255 O SER A 375 26.637 8.191 85.653 1.00 52.66 O ATOM 1256 CB SER A 375 23.577 7.449 86.453 1.00 52.98 C ATOM 1257 OG SER A 375 22.702 6.392 86.801 1.00 64.28 O ATOM 1258 HG SER A 375 22.573 6.381 87.783 1.00 0.00 H ATOM 1259 H SER A 375 23.931 7.569 88.994 1.00 0.00 H ATOM 1260 N ILE A 376 25.849 9.602 87.249 1.00 47.19 N ATOM 1261 CA ILE A 376 26.738 10.730 86.960 1.00 45.47 C ATOM 1262 C ILE A 376 28.168 10.318 87.364 1.00 50.30 C ATOM 1263 O ILE A 376 29.125 10.610 86.643 1.00 50.06 O ATOM 1264 CB ILE A 376 26.238 12.014 87.697 1.00 46.72 C ATOM 1265 CG1 ILE A 376 25.112 12.723 86.899 1.00 46.15 C ATOM 1266 CG2 ILE A 376 27.374 12.972 88.088 1.00 47.11 C ATOM 1267 CD1 ILE A 376 25.538 13.696 85.722 1.00 50.58 C ATOM 1268 H ILE A 376 25.144 9.721 88.004 1.00 0.00 H ATOM 1269 N GLY A 377 28.279 9.626 88.501 1.00 47.60 N ATOM 1270 CA GLY A 377 29.538 9.124 89.046 1.00 49.29 C ATOM 1271 C GLY A 377 30.214 8.075 88.183 1.00 55.63 C ATOM 1272 O GLY A 377 31.443 8.070 88.073 1.00 56.16 O ATOM 1273 H GLY A 377 27.408 9.431 89.036 1.00 0.00 H ATOM 1274 N GLU A 378 29.414 7.189 87.545 1.00 53.71 N ATOM 1275 CA GLU A 378 29.909 6.132 86.655 1.00 56.31 C ATOM 1276 C GLU A 378 30.460 6.701 85.346 1.00 60.00 C ATOM 1277 O GLU A 378 31.249 6.033 84.676 1.00 61.71 O ATOM 1278 CB GLU A 378 28.854 5.046 86.408 1.00 59.33 C ATOM 1279 CG GLU A 378 28.572 4.191 87.638 1.00 73.42 C ATOM 1280 CD GLU A 378 27.894 2.860 87.366 1.00101.65 C ATOM 1281 OE1 GLU A 378 28.458 1.820 87.777 1.00103.51 O ATOM 1282 OE2 GLU A 378 26.795 2.857 86.763 1.00 96.41 O ATOM 1283 H GLU A 378 28.387 7.261 87.694 1.00 0.00 H ATOM 1284 N LEU A 379 30.082 7.956 85.006 1.00 54.65 N ATOM 1285 CA LEU A 379 30.577 8.669 83.831 1.00 53.63 C ATOM 1286 C LEU A 379 32.005 9.166 84.064 1.00 56.43 C ATOM 1287 O LEU A 379 32.747 9.345 83.095 1.00 57.07 O ATOM 1288 CB LEU A 379 29.670 9.863 83.504 1.00 51.69 C ATOM 1289 CG LEU A 379 28.408 9.555 82.710 1.00 56.54 C ATOM 1290 CD1 LEU A 379 27.374 10.643 82.907 1.00 54.51 C ATOM 1291 CD2 LEU A 379 28.730 9.375 81.242 1.00 59.45 C ATOM 1292 H LEU A 379 29.397 8.442 85.619 1.00 0.00 H ATOM 1293 N LYS A 380 32.378 9.388 85.346 1.00 51.45 N ATOM 1294 CA LYS A 380 33.684 9.878 85.806 1.00 51.22 C ATOM 1295 C LYS A 380 34.086 11.166 85.069 1.00 51.84 C ATOM 1296 O LYS A 380 35.052 11.208 84.294 1.00 51.08 O ATOM 1297 CB LYS A 380 34.767 8.785 85.759 1.00 56.47 C ATOM 1298 CG LYS A 380 34.643 7.781 86.904 1.00 73.28 C ATOM 1299 CD LYS A 380 35.953 7.037 87.140 1.00 89.22 C ATOM 1300 CE LYS A 380 35.875 6.080 88.302 1.00105.67 C ATOM 1301 NZ LYS A 380 35.169 4.819 87.951 1.00117.85 N ATOM 1302 HZ1 LYS A 380 34.198 5.039 87.649 1.00 0.00 H ATOM 1303 HZ2 LYS A 380 35.675 4.344 87.176 1.00 0.00 H ATOM 1304 HZ3 LYS A 380 35.142 4.195 88.783 1.00 0.00 H ATOM 1305 H LYS A 380 31.668 9.192 86.080 1.00 0.00 H ATOM 1306 N MET A 381 33.281 12.206 85.286 1.00 45.93 N ATOM 1307 CA MET A 381 33.454 13.510 84.664 1.00 43.99 C ATOM 1308 C MET A 381 34.588 14.284 85.315 1.00 45.86 C ATOM 1309 O MET A 381 34.812 14.154 86.516 1.00 44.88 O ATOM 1310 CB MET A 381 32.156 14.320 84.785 1.00 44.52 C ATOM 1311 CG MET A 381 31.017 13.793 83.937 1.00 48.19 C ATOM 1312 SD MET A 381 29.444 14.581 84.362 1.00 50.80 S ATOM 1313 CE MET A 381 29.737 16.198 83.671 1.00 45.93 C ATOM 1314 H MET A 381 32.482 12.078 85.939 1.00 0.00 H ATOM 1315 N THR A 382 35.282 15.111 84.518 1.00 42.58 N ATOM 1316 CA THR A 382 36.349 15.990 85.008 1.00 42.40 C ATOM 1317 C THR A 382 35.673 17.297 85.434 1.00 43.22 C ATOM 1318 O THR A 382 34.504 17.507 85.092 1.00 41.23 O ATOM 1319 CB THR A 382 37.401 16.250 83.916 1.00 49.51 C ATOM 1320 OG1 THR A 382 36.788 16.906 82.809 1.00 47.61 O ATOM 1321 CG2 THR A 382 38.102 14.967 83.459 1.00 50.10 C ATOM 1322 HG1 THR A 382 37.467 17.072 82.108 1.00 0.00 H ATOM 1323 H THR A 382 35.052 15.130 83.504 1.00 0.00 H ATOM 1324 N GLN A 383 36.402 18.178 86.161 1.00 38.25 N ATOM 1325 CA GLN A 383 35.880 19.488 86.589 1.00 35.91 C ATOM 1326 C GLN A 383 35.409 20.351 85.392 1.00 37.78 C ATOM 1327 O GLN A 383 34.369 21.014 85.473 1.00 35.72 O ATOM 1328 CB GLN A 383 36.895 20.244 87.470 1.00 37.99 C ATOM 1329 CG GLN A 383 38.306 20.373 86.869 1.00 42.40 C ATOM 1330 CD GLN A 383 39.206 21.312 87.634 1.00 53.04 C ATOM 1331 OE1 GLN A 383 39.060 21.496 88.841 1.00 48.38 O ATOM 1332 NE2 GLN A 383 40.196 21.880 86.947 1.00 41.25 N ATOM 1333 HE22 GLN A 383 40.290 21.702 85.927 1.00 0.00 H ATOM 1334 HE21 GLN A 383 40.875 22.501 87.431 1.00 0.00 H ATOM 1335 H GLN A 383 37.373 17.918 86.429 1.00 0.00 H ATOM 1336 N GLU A 384 36.152 20.281 84.272 1.00 34.44 N ATOM 1337 CA GLU A 384 35.875 20.980 83.016 1.00 33.40 C ATOM 1338 C GLU A 384 34.561 20.512 82.381 1.00 35.07 C ATOM 1339 O GLU A 384 33.832 21.333 81.826 1.00 34.05 O ATOM 1340 CB GLU A 384 37.050 20.814 82.034 1.00 36.20 C ATOM 1341 CG GLU A 384 38.348 21.481 82.494 1.00 45.99 C ATOM 1342 CD GLU A 384 39.300 20.645 83.340 1.00 57.68 C ATOM 1343 OE1 GLU A 384 39.029 19.436 83.519 1.00 42.60 O ATOM 1344 OE2 GLU A 384 40.259 21.218 83.902 1.00 51.70 O ATOM 1345 H GLU A 384 36.998 19.677 84.301 1.00 0.00 H ATOM 1346 N GLU A 385 34.277 19.196 82.458 1.00 31.85 N ATOM 1347 CA GLU A 385 33.051 18.611 81.928 1.00 31.46 C ATOM 1348 C GLU A 385 31.845 19.059 82.761 1.00 34.02 C ATOM 1349 O GLU A 385 30.804 19.347 82.188 1.00 32.48 O ATOM 1350 CB GLU A 385 33.162 17.080 81.834 1.00 33.92 C ATOM 1351 CG GLU A 385 34.117 16.644 80.722 1.00 41.50 C ATOM 1352 CD GLU A 385 34.286 15.154 80.497 1.00 60.86 C ATOM 1353 OE1 GLU A 385 34.048 14.370 81.445 1.00 47.42 O ATOM 1354 OE2 GLU A 385 34.686 14.771 79.372 1.00 62.19 O ATOM 1355 H GLU A 385 34.966 18.567 82.918 1.00 0.00 H ATOM 1356 N TYR A 386 32.007 19.185 84.095 1.00 30.63 N ATOM 1357 CA TYR A 386 30.951 19.660 84.991 1.00 29.03 C ATOM 1358 C TYR A 386 30.634 21.130 84.726 1.00 31.80 C ATOM 1359 O TYR A 386 29.458 21.489 84.683 1.00 30.78 O ATOM 1360 CB TYR A 386 31.336 19.472 86.466 1.00 30.53 C ATOM 1361 CG TYR A 386 31.104 18.077 87.002 1.00 32.91 C ATOM 1362 CD1 TYR A 386 29.812 17.594 87.207 1.00 34.12 C ATOM 1363 CD2 TYR A 386 32.170 17.262 87.366 1.00 34.69 C ATOM 1364 CE1 TYR A 386 29.590 16.317 87.717 1.00 35.42 C ATOM 1365 CE2 TYR A 386 31.961 15.992 87.899 1.00 36.46 C ATOM 1366 CZ TYR A 386 30.668 15.525 88.078 1.00 40.88 C ATOM 1367 OH TYR A 386 30.455 14.270 88.588 1.00 37.87 O ATOM 1368 HH TYR A 386 30.858 14.209 89.490 1.00 0.00 H ATOM 1369 H TYR A 386 32.928 18.932 84.507 1.00 0.00 H ATOM 1370 N ALA A 387 31.681 21.965 84.529 1.00 28.24 N ATOM 1371 CA ALA A 387 31.555 23.402 84.242 1.00 28.03 C ATOM 1372 C ALA A 387 30.836 23.677 82.911 1.00 31.26 C ATOM 1373 O ALA A 387 29.922 24.503 82.870 1.00 29.65 O ATOM 1374 CB ALA A 387 32.921 24.056 84.231 1.00 29.64 C ATOM 1375 H ALA A 387 32.639 21.564 84.584 1.00 0.00 H ATOM 1376 N LEU A 388 31.243 22.972 81.836 1.00 29.88 N ATOM 1377 CA LEU A 388 30.631 23.107 80.514 1.00 29.79 C ATOM 1378 C LEU A 388 29.198 22.604 80.506 1.00 33.36 C ATOM 1379 O LEU A 388 28.343 23.288 79.958 1.00 32.90 O ATOM 1380 CB LEU A 388 31.448 22.405 79.425 1.00 30.61 C ATOM 1381 CG LEU A 388 32.781 23.057 79.061 1.00 36.41 C ATOM 1382 CD1 LEU A 388 33.627 22.093 78.277 1.00 37.89 C ATOM 1383 CD2 LEU A 388 32.574 24.346 78.273 1.00 37.31 C ATOM 1384 H LEU A 388 32.029 22.301 81.952 1.00 0.00 H ATOM 1385 N LEU A 389 28.931 21.438 81.143 1.00 31.34 N ATOM 1386 CA LEU A 389 27.585 20.865 81.224 1.00 31.06 C ATOM 1387 C LEU A 389 26.617 21.811 81.939 1.00 33.31 C ATOM 1388 O LEU A 389 25.492 21.973 81.473 1.00 32.05 O ATOM 1389 CB LEU A 389 27.581 19.475 81.872 1.00 31.80 C ATOM 1390 CG LEU A 389 26.412 18.556 81.482 1.00 37.32 C ATOM 1391 CD1 LEU A 389 26.495 18.149 80.018 1.00 38.20 C ATOM 1392 CD2 LEU A 389 26.403 17.316 82.338 1.00 40.19 C ATOM 1393 H LEU A 389 29.716 20.927 81.594 1.00 0.00 H ATOM 1394 N THR A 390 27.082 22.483 83.018 1.00 29.10 N ATOM 1395 CA THR A 390 26.310 23.487 83.762 1.00 28.05 C ATOM 1396 C THR A 390 25.971 24.647 82.831 1.00 31.09 C ATOM 1397 O THR A 390 24.818 25.058 82.792 1.00 30.12 O ATOM 1398 CB THR A 390 27.078 23.978 85.004 1.00 34.76 C ATOM 1399 OG1 THR A 390 27.399 22.857 85.818 1.00 35.73 O ATOM 1400 CG2 THR A 390 26.275 24.995 85.836 1.00 28.30 C ATOM 1401 HG1 THR A 390 27.962 22.227 85.302 1.00 0.00 H ATOM 1402 H THR A 390 28.048 22.275 83.341 1.00 0.00 H ATOM 1403 N ALA A 391 26.979 25.161 82.075 1.00 27.66 N ATOM 1404 CA ALA A 391 26.807 26.241 81.091 1.00 27.77 C ATOM 1405 C ALA A 391 25.798 25.836 80.000 1.00 30.76 C ATOM 1406 O ALA A 391 24.971 26.655 79.602 1.00 30.77 O ATOM 1407 CB ALA A 391 28.142 26.597 80.458 1.00 29.12 C ATOM 1408 H ALA A 391 27.932 24.765 82.201 1.00 0.00 H ATOM 1409 N ILE A 392 25.871 24.561 79.535 1.00 26.46 N ATOM 1410 CA ILE A 392 24.980 23.983 78.521 1.00 26.02 C ATOM 1411 C ILE A 392 23.533 23.895 79.065 1.00 30.97 C ATOM 1412 O ILE A 392 22.591 24.212 78.335 1.00 32.35 O ATOM 1413 CB ILE A 392 25.559 22.639 77.990 1.00 28.54 C ATOM 1414 CG1 ILE A 392 26.757 22.909 77.047 1.00 29.15 C ATOM 1415 CG2 ILE A 392 24.500 21.767 77.280 1.00 27.59 C ATOM 1416 CD1 ILE A 392 27.792 21.791 76.941 1.00 36.26 C ATOM 1417 H ILE A 392 26.614 23.948 79.927 1.00 0.00 H ATOM 1418 N VAL A 393 23.376 23.486 80.351 1.00 27.92 N ATOM 1419 CA VAL A 393 22.088 23.409 81.073 1.00 28.53 C ATOM 1420 C VAL A 393 21.448 24.812 81.124 1.00 31.92 C ATOM 1421 O VAL A 393 20.272 24.958 80.791 1.00 31.95 O ATOM 1422 CB VAL A 393 22.249 22.776 82.499 1.00 32.57 C ATOM 1423 CG1 VAL A 393 21.078 23.118 83.426 1.00 32.60 C ATOM 1424 CG2 VAL A 393 22.423 21.268 82.408 1.00 32.71 C ATOM 1425 H VAL A 393 24.232 23.204 80.870 1.00 0.00 H ATOM 1426 N ILE A 394 22.235 25.837 81.529 1.00 28.18 N ATOM 1427 CA ILE A 394 21.781 27.230 81.616 1.00 27.92 C ATOM 1428 C ILE A 394 21.336 27.778 80.258 1.00 32.64 C ATOM 1429 O ILE A 394 20.254 28.371 80.162 1.00 33.44 O ATOM 1430 CB ILE A 394 22.829 28.150 82.291 1.00 30.52 C ATOM 1431 CG1 ILE A 394 23.045 27.761 83.778 1.00 30.01 C ATOM 1432 CG2 ILE A 394 22.437 29.627 82.168 1.00 30.96 C ATOM 1433 CD1 ILE A 394 24.448 28.098 84.287 1.00 34.01 C ATOM 1434 H ILE A 394 23.218 25.625 81.794 1.00 0.00 H ATOM 1435 N LEU A 395 22.161 27.591 79.221 1.00 28.44 N ATOM 1436 CA LEU A 395 21.859 28.110 77.882 1.00 29.78 C ATOM 1437 C LEU A 395 21.056 27.117 77.024 1.00 36.77 C ATOM 1438 O LEU A 395 21.338 26.929 75.839 1.00 36.39 O ATOM 1439 CB LEU A 395 23.140 28.594 77.184 1.00 29.61 C ATOM 1440 CG LEU A 395 23.816 29.823 77.808 1.00 34.41 C ATOM 1441 CD1 LEU A 395 25.210 29.994 77.286 1.00 34.83 C ATOM 1442 CD2 LEU A 395 22.998 31.107 77.569 1.00 38.43 C ATOM 1443 H LEU A 395 23.044 27.061 79.369 1.00 0.00 H ATOM 1444 N SER A 396 20.014 26.526 77.622 1.00 35.53 N ATOM 1445 CA SER A 396 19.118 25.592 76.947 1.00 37.51 C ATOM 1446 C SER A 396 18.035 26.380 76.207 1.00 45.23 C ATOM 1447 O SER A 396 17.280 27.123 76.831 1.00 45.74 O ATOM 1448 CB SER A 396 18.511 24.609 77.941 1.00 41.37 C ATOM 1449 OG SER A 396 19.516 23.762 78.474 1.00 50.17 O ATOM 1450 HG SER A 396 20.197 24.311 78.937 1.00 0.00 H ATOM 1451 H SER A 396 19.833 26.744 78.623 1.00 0.00 H ATOM 1452 N PRO A 397 17.968 26.262 74.861 1.00 44.56 N ATOM 1453 CA PRO A 397 16.960 27.023 74.100 1.00 46.59 C ATOM 1454 C PRO A 397 15.526 26.527 74.292 1.00 54.83 C ATOM 1455 O PRO A 397 14.586 27.287 74.065 1.00 55.72 O ATOM 1456 CB PRO A 397 17.423 26.870 72.644 1.00 48.92 C ATOM 1457 CG PRO A 397 18.785 26.236 72.716 1.00 51.80 C ATOM 1458 CD PRO A 397 18.796 25.443 73.962 1.00 46.05 C ATOM 1459 N ASP A 398 15.363 25.263 74.722 1.00 53.19 N ATOM 1460 CA ASP A 398 14.082 24.576 74.962 1.00 55.42 C ATOM 1461 C ASP A 398 13.358 24.993 76.248 1.00 61.04 C ATOM 1462 O ASP A 398 12.439 24.291 76.680 1.00 61.84 O ATOM 1463 CB ASP A 398 14.275 23.039 74.963 1.00 57.67 C ATOM 1464 CG ASP A 398 15.685 22.530 74.729 1.00 69.55 C ATOM 1465 OD1 ASP A 398 15.901 21.839 73.712 1.00 72.14 O ATOM 1466 OD2 ASP A 398 16.574 22.831 75.561 1.00 71.59 O ATOM 1467 H ASP A 398 16.228 24.715 74.903 1.00 0.00 H ATOM 1468 N ARG A 399 13.762 26.116 76.863 1.00 58.13 N ATOM 1469 CA ARG A 399 13.160 26.600 78.105 1.00 58.34 C ATOM 1470 C ARG A 399 11.835 27.331 77.874 1.00 66.67 C ATOM 1471 O ARG A 399 11.630 27.928 76.812 1.00 67.50 O ATOM 1472 CB ARG A 399 14.167 27.469 78.891 1.00 54.84 C ATOM 1473 CG ARG A 399 14.515 26.955 80.295 1.00 56.24 C ATOM 1474 CD ARG A 399 14.904 25.485 80.330 1.00 54.37 C ATOM 1475 NE ARG A 399 16.215 25.257 80.934 1.00 44.80 N ATOM 1476 CZ ARG A 399 16.611 24.090 81.429 1.00 53.96 C ATOM 1477 NH1 ARG A 399 15.791 23.047 81.427 1.00 40.57 N ATOM 1478 NH2 ARG A 399 17.824 23.964 81.955 1.00 41.51 N ATOM 1479 HE ARG A 399 16.878 26.057 80.979 1.00 0.00 H ATOM 1480 HH12 ARG A 399 16.107 22.136 81.816 1.00 0.00 H ATOM 1481 HH11 ARG A 399 14.832 23.140 81.036 1.00 0.00 H ATOM 1482 HH22 ARG A 399 18.131 23.049 82.342 1.00 0.00 H ATOM 1483 HH21 ARG A 399 18.467 24.781 81.980 1.00 0.00 H ATOM 1484 H ARG A 399 14.536 26.665 76.438 1.00 0.00 H ATOM 1485 N GLN A 400 10.932 27.262 78.876 1.00 65.28 N ATOM 1486 CA GLN A 400 9.615 27.900 78.873 1.00 67.98 C ATOM 1487 C GLN A 400 9.742 29.421 78.858 1.00 73.05 C ATOM 1488 O GLN A 400 10.646 29.968 79.494 1.00 71.27 O ATOM 1489 CB GLN A 400 8.816 27.475 80.118 1.00 69.88 C ATOM 1490 CG GLN A 400 7.400 27.003 79.813 1.00 88.51 C ATOM 1491 CD GLN A 400 6.478 27.057 81.011 1.00107.71 C ATOM 1492 OE1 GLN A 400 5.384 27.615 80.941 1.00105.49 O ATOM 1493 NE2 GLN A 400 6.873 26.449 82.126 1.00 96.78 N ATOM 1494 HE22 GLN A 400 7.802 25.983 82.163 1.00 0.00 H ATOM 1495 HE21 GLN A 400 6.253 26.439 82.961 1.00 0.00 H ATOM 1496 H GLN A 400 11.194 26.711 79.718 1.00 0.00 H ATOM 1497 N TYR A 401 8.821 30.088 78.129 1.00 72.37 N ATOM 1498 CA TYR A 401 8.691 31.545 77.956 1.00 73.32 C ATOM 1499 C TYR A 401 9.830 32.194 77.130 1.00 74.03 C ATOM 1500 O TYR A 401 9.860 33.426 77.022 1.00 75.14 O ATOM 1501 CB TYR A 401 8.503 32.278 79.310 1.00 75.00 C ATOM 1502 CG TYR A 401 7.344 31.770 80.143 1.00 78.62 C ATOM 1503 CD1 TYR A 401 6.032 32.123 79.838 1.00 83.60 C ATOM 1504 CD2 TYR A 401 7.561 30.977 81.267 1.00 77.96 C ATOM 1505 CE1 TYR A 401 4.962 31.668 80.608 1.00 85.93 C ATOM 1506 CE2 TYR A 401 6.499 30.521 82.050 1.00 80.13 C ATOM 1507 CZ TYR A 401 5.200 30.870 81.716 1.00 91.16 C ATOM 1508 OH TYR A 401 4.149 30.424 82.479 1.00 93.88 O ATOM 1509 HH TYR A 401 3.300 30.765 82.101 1.00 0.00 H ATOM 1510 H TYR A 401 8.120 29.503 77.630 1.00 0.00 H ATOM 1511 N ILE A 402 10.724 31.388 76.512 1.00 66.33 N ATOM 1512 CA ILE A 402 11.823 31.903 75.682 1.00 64.29 C ATOM 1513 C ILE A 402 11.283 32.460 74.362 1.00 67.62 C ATOM 1514 O ILE A 402 10.702 31.721 73.564 1.00 68.34 O ATOM 1515 CB ILE A 402 12.979 30.870 75.497 1.00 65.18 C ATOM 1516 CG1 ILE A 402 13.734 30.613 76.829 1.00 63.62 C ATOM 1517 CG2 ILE A 402 13.956 31.270 74.369 1.00 65.69 C ATOM 1518 CD1 ILE A 402 14.628 31.763 77.359 1.00 70.00 C ATOM 1519 H ILE A 402 10.630 30.359 76.629 1.00 0.00 H ATOM 1520 N LYS A 403 11.472 33.771 74.154 1.00 62.63 N ATOM 1521 CA LYS A 403 11.016 34.498 72.969 1.00 64.02 C ATOM 1522 C LYS A 403 11.920 34.253 71.752 1.00 64.80 C ATOM 1523 O LYS A 403 11.410 33.940 70.676 1.00 65.80 O ATOM 1524 CB LYS A 403 10.864 35.999 73.271 1.00 68.24 C ATOM 1525 CG LYS A 403 9.813 36.321 74.332 1.00 82.97 C ATOM 1526 CD LYS A 403 9.961 37.737 74.894 1.00 94.00 C ATOM 1527 CE LYS A 403 9.117 37.951 76.130 1.00104.79 C ATOM 1528 NZ LYS A 403 9.273 39.313 76.684 1.00114.90 N ATOM 1529 HZ1 LYS A 403 10.269 39.470 76.941 1.00 0.00 H ATOM 1530 HZ2 LYS A 403 8.984 40.012 75.970 1.00 0.00 H ATOM 1531 HZ3 LYS A 403 8.676 39.412 77.530 1.00 0.00 H ATOM 1532 H LYS A 403 11.978 34.309 74.886 1.00 0.00 H ATOM 1533 N ASP A 404 13.253 34.372 71.930 1.00 57.33 N ATOM 1534 CA ASP A 404 14.237 34.170 70.862 1.00 55.94 C ATOM 1535 C ASP A 404 15.068 32.906 71.134 1.00 56.46 C ATOM 1536 O ASP A 404 16.121 32.972 71.776 1.00 53.62 O ATOM 1537 CB ASP A 404 15.132 35.418 70.712 1.00 57.82 C ATOM 1538 CG ASP A 404 15.816 35.597 69.364 1.00 66.34 C ATOM 1539 OD1 ASP A 404 16.091 34.575 68.689 1.00 66.01 O ATOM 1540 OD2 ASP A 404 16.143 36.752 69.017 1.00 74.09 O ATOM 1541 H ASP A 404 13.601 34.621 72.878 1.00 0.00 H ATOM 1542 N ARG A 405 14.573 31.753 70.644 1.00 53.47 N ATOM 1543 CA ARG A 405 15.224 30.452 70.806 1.00 51.76 C ATOM 1544 C ARG A 405 16.532 30.359 70.053 1.00 53.94 C ATOM 1545 O ARG A 405 17.489 29.810 70.592 1.00 51.73 O ATOM 1546 CB ARG A 405 14.287 29.303 70.417 1.00 54.65 C ATOM 1547 CG ARG A 405 13.237 29.028 71.478 1.00 65.74 C ATOM 1548 CD ARG A 405 12.566 27.686 71.310 1.00 76.09 C ATOM 1549 NE ARG A 405 11.897 27.282 72.547 1.00 85.10 N ATOM 1550 CZ ARG A 405 11.052 26.263 72.647 1.00101.22 C ATOM 1551 NH1 ARG A 405 10.745 25.540 71.578 1.00 91.65 N ATOM 1552 NH2 ARG A 405 10.491 25.971 73.813 1.00 88.04 N ATOM 1553 HE ARG A 405 12.097 27.831 73.407 1.00 0.00 H ATOM 1554 HH12 ARG A 405 10.082 24.743 71.662 1.00 0.00 H ATOM 1555 HH11 ARG A 405 11.167 25.770 70.656 1.00 0.00 H ATOM 1556 HH22 ARG A 405 9.830 25.172 73.886 1.00 0.00 H ATOM 1557 HH21 ARG A 405 10.712 26.541 74.654 1.00 0.00 H ATOM 1558 H ARG A 405 13.676 31.789 70.120 1.00 0.00 H ATOM 1559 N GLU A 406 16.591 30.926 68.824 1.00 51.43 N ATOM 1560 CA GLU A 406 17.782 30.937 67.970 1.00 51.01 C ATOM 1561 C GLU A 406 18.970 31.656 68.617 1.00 51.76 C ATOM 1562 O GLU A 406 20.102 31.195 68.468 1.00 50.34 O ATOM 1563 CB GLU A 406 17.461 31.542 66.596 1.00 55.08 C ATOM 1564 CG GLU A 406 18.355 31.019 65.478 1.00 68.50 C ATOM 1565 CD GLU A 406 18.252 31.772 64.165 1.00 99.31 C ATOM 1566 OE1 GLU A 406 17.124 31.926 63.642 1.00 96.00 O ATOM 1567 OE2 GLU A 406 19.307 32.207 63.653 1.00 99.36 O ATOM 1568 H GLU A 406 15.731 31.385 68.461 1.00 0.00 H ATOM 1569 N ALA A 407 18.715 32.778 69.330 1.00 47.77 N ATOM 1570 CA ALA A 407 19.748 33.552 70.028 1.00 46.22 C ATOM 1571 C ALA A 407 20.402 32.733 71.147 1.00 44.93 C ATOM 1572 O ALA A 407 21.609 32.840 71.350 1.00 43.34 O ATOM 1573 CB ALA A 407 19.165 34.842 70.579 1.00 48.10 C ATOM 1574 H ALA A 407 17.731 33.110 69.386 1.00 0.00 H ATOM 1575 N VAL A 408 19.620 31.884 71.831 1.00 39.86 N ATOM 1576 CA VAL A 408 20.125 31.003 72.894 1.00 36.95 C ATOM 1577 C VAL A 408 20.950 29.857 72.265 1.00 40.02 C ATOM 1578 O VAL A 408 22.029 29.543 72.771 1.00 37.75 O ATOM 1579 CB VAL A 408 19.016 30.503 73.862 1.00 39.61 C ATOM 1580 CG1 VAL A 408 19.609 29.705 75.020 1.00 37.20 C ATOM 1581 CG2 VAL A 408 18.183 31.666 74.390 1.00 40.30 C ATOM 1582 H VAL A 408 18.607 31.847 71.598 1.00 0.00 H ATOM 1583 N GLU A 409 20.462 29.280 71.136 1.00 38.69 N ATOM 1584 CA GLU A 409 21.126 28.201 70.386 1.00 38.28 C ATOM 1585 C GLU A 409 22.551 28.599 69.993 1.00 42.01 C ATOM 1586 O GLU A 409 23.475 27.806 70.179 1.00 41.12 O ATOM 1587 CB GLU A 409 20.349 27.847 69.097 1.00 41.21 C ATOM 1588 CG GLU A 409 19.029 27.125 69.318 1.00 50.06 C ATOM 1589 CD GLU A 409 18.166 26.949 68.078 1.00 72.35 C ATOM 1590 OE1 GLU A 409 16.923 26.924 68.227 1.00 59.83 O ATOM 1591 OE2 GLU A 409 18.726 26.846 66.961 1.00 70.43 O ATOM 1592 H GLU A 409 19.551 29.627 70.774 1.00 0.00 H ATOM 1593 N LYS A 410 22.719 29.825 69.444 1.00 40.20 N ATOM 1594 CA LYS A 410 23.998 30.391 68.997 1.00 40.23 C ATOM 1595 C LYS A 410 25.032 30.450 70.121 1.00 41.84 C ATOM 1596 O LYS A 410 26.223 30.332 69.852 1.00 41.88 O ATOM 1597 CB LYS A 410 23.788 31.778 68.371 1.00 45.12 C ATOM 1598 CG LYS A 410 23.357 31.726 66.907 1.00 65.95 C ATOM 1599 CD LYS A 410 22.947 33.104 66.384 1.00 81.10 C ATOM 1600 CE LYS A 410 24.032 33.766 65.564 1.00 95.55 C ATOM 1601 NZ LYS A 410 23.571 35.062 64.991 1.00106.98 N ATOM 1602 HZ1 LYS A 410 22.749 34.895 64.376 1.00 0.00 H ATOM 1603 HZ2 LYS A 410 23.303 35.705 65.763 1.00 0.00 H ATOM 1604 HZ3 LYS A 410 24.340 35.487 64.435 1.00 0.00 H ATOM 1605 H LYS A 410 21.871 30.416 69.329 1.00 0.00 H ATOM 1606 N LEU A 411 24.572 30.633 71.369 1.00 37.07 N ATOM 1607 CA LEU A 411 25.421 30.686 72.559 1.00 36.18 C ATOM 1608 C LEU A 411 25.746 29.297 73.112 1.00 38.54 C ATOM 1609 O LEU A 411 26.844 29.097 73.626 1.00 38.36 O ATOM 1610 CB LEU A 411 24.795 31.572 73.649 1.00 36.15 C ATOM 1611 CG LEU A 411 24.456 33.029 73.271 1.00 42.74 C ATOM 1612 CD1 LEU A 411 23.908 33.776 74.462 1.00 42.94 C ATOM 1613 CD2 LEU A 411 25.668 33.767 72.720 1.00 47.09 C ATOM 1614 H LEU A 411 23.546 30.744 71.498 1.00 0.00 H ATOM 1615 N GLN A 412 24.805 28.337 73.000 1.00 34.41 N ATOM 1616 CA GLN A 412 24.983 26.964 73.488 1.00 33.42 C ATOM 1617 C GLN A 412 25.922 26.135 72.605 1.00 40.23 C ATOM 1618 O GLN A 412 26.747 25.387 73.142 1.00 39.37 O ATOM 1619 CB GLN A 412 23.629 26.264 73.627 1.00 34.08 C ATOM 1620 CG GLN A 412 23.679 24.980 74.465 1.00 36.62 C ATOM 1621 CD GLN A 412 22.394 24.203 74.390 1.00 44.92 C ATOM 1622 OE1 GLN A 412 21.796 24.045 73.325 1.00 38.43 O ATOM 1623 NE2 GLN A 412 21.949 23.678 75.521 1.00 43.16 N ATOM 1624 HE22 GLN A 412 22.474 23.828 76.406 1.00 0.00 H ATOM 1625 HE21 GLN A 412 21.074 23.116 75.525 1.00 0.00 H ATOM 1626 H GLN A 412 23.904 28.583 72.543 1.00 0.00 H ATOM 1627 N GLU A 413 25.771 26.240 71.263 1.00 39.20 N ATOM 1628 CA GLU A 413 26.548 25.512 70.244 1.00 40.31 C ATOM 1629 C GLU A 413 28.072 25.535 70.475 1.00 43.89 C ATOM 1630 O GLU A 413 28.648 24.447 70.493 1.00 43.88 O ATOM 1631 CB GLU A 413 26.206 25.980 68.823 1.00 43.40 C ATOM 1632 CG GLU A 413 24.902 25.431 68.285 1.00 56.53 C ATOM 1633 CD GLU A 413 24.545 25.943 66.899 1.00 87.15 C ATOM 1634 OE1 GLU A 413 24.618 27.175 66.667 1.00 79.41 O ATOM 1635 OE2 GLU A 413 24.114 25.110 66.066 1.00 88.45 O ATOM 1636 H GLU A 413 25.039 26.895 70.920 1.00 0.00 H ATOM 1637 N PRO A 414 28.756 26.695 70.695 1.00 40.15 N ATOM 1638 CA PRO A 414 30.206 26.637 70.934 1.00 40.14 C ATOM 1639 C PRO A 414 30.593 25.893 72.217 1.00 41.52 C ATOM 1640 O PRO A 414 31.670 25.311 72.252 1.00 40.90 O ATOM 1641 CB PRO A 414 30.627 28.109 70.975 1.00 42.71 C ATOM 1642 CG PRO A 414 29.405 28.845 71.343 1.00 46.66 C ATOM 1643 CD PRO A 414 28.282 28.097 70.710 1.00 42.07 C ATOM 1644 N LEU A 415 29.713 25.889 73.247 1.00 36.73 N ATOM 1645 CA LEU A 415 29.948 25.182 74.503 1.00 35.84 C ATOM 1646 C LEU A 415 29.801 23.675 74.295 1.00 38.89 C ATOM 1647 O LEU A 415 30.621 22.909 74.805 1.00 38.04 O ATOM 1648 CB LEU A 415 29.024 25.687 75.616 1.00 35.22 C ATOM 1649 CG LEU A 415 29.237 27.140 76.065 1.00 40.34 C ATOM 1650 CD1 LEU A 415 28.018 27.678 76.762 1.00 39.66 C ATOM 1651 CD2 LEU A 415 30.435 27.270 76.978 1.00 43.40 C ATOM 1652 H LEU A 415 28.824 26.417 73.138 1.00 0.00 H ATOM 1653 N LEU A 416 28.792 23.251 73.498 1.00 36.02 N ATOM 1654 CA LEU A 416 28.571 21.846 73.142 1.00 36.59 C ATOM 1655 C LEU A 416 29.765 21.305 72.353 1.00 41.79 C ATOM 1656 O LEU A 416 30.201 20.180 72.598 1.00 42.30 O ATOM 1657 CB LEU A 416 27.281 21.679 72.322 1.00 37.09 C ATOM 1658 CG LEU A 416 25.963 21.813 73.079 1.00 40.61 C ATOM 1659 CD1 LEU A 416 24.833 22.159 72.131 1.00 41.67 C ATOM 1660 CD2 LEU A 416 25.642 20.548 73.847 1.00 43.17 C ATOM 1661 H LEU A 416 28.136 23.962 73.117 1.00 0.00 H ATOM 1662 N ASP A 417 30.308 22.122 71.424 1.00 39.26 N ATOM 1663 CA ASP A 417 31.470 21.783 70.595 1.00 40.52 C ATOM 1664 C ASP A 417 32.729 21.544 71.434 1.00 43.45 C ATOM 1665 O ASP A 417 33.439 20.565 71.196 1.00 43.44 O ATOM 1666 CB ASP A 417 31.715 22.856 69.523 1.00 43.95 C ATOM 1667 CG ASP A 417 31.218 22.475 68.143 1.00 61.87 C ATOM 1668 OD1 ASP A 417 30.180 23.021 67.721 1.00 63.86 O ATOM 1669 OD2 ASP A 417 31.805 21.557 67.535 1.00 72.38 O ATOM 1670 H ASP A 417 29.872 23.056 71.287 1.00 0.00 H ATOM 1671 N VAL A 418 32.985 22.422 72.430 1.00 39.56 N ATOM 1672 CA VAL A 418 34.112 22.316 73.372 1.00 39.82 C ATOM 1673 C VAL A 418 33.948 21.047 74.230 1.00 41.74 C ATOM 1674 O VAL A 418 34.915 20.296 74.395 1.00 42.47 O ATOM 1675 CB VAL A 418 34.294 23.595 74.243 1.00 43.24 C ATOM 1676 CG1 VAL A 418 35.382 23.405 75.296 1.00 43.69 C ATOM 1677 CG2 VAL A 418 34.611 24.805 73.373 1.00 43.91 C ATOM 1678 H VAL A 418 32.340 23.230 72.539 1.00 0.00 H ATOM 1679 N LEU A 419 32.719 20.794 74.737 1.00 36.21 N ATOM 1680 CA LEU A 419 32.435 19.607 75.548 1.00 35.34 C ATOM 1681 C LEU A 419 32.670 18.323 74.751 1.00 40.55 C ATOM 1682 O LEU A 419 33.335 17.424 75.257 1.00 40.90 O ATOM 1683 CB LEU A 419 31.020 19.642 76.155 1.00 33.43 C ATOM 1684 CG LEU A 419 30.659 18.474 77.111 1.00 36.61 C ATOM 1685 CD1 LEU A 419 31.380 18.585 78.431 1.00 35.84 C ATOM 1686 CD2 LEU A 419 29.165 18.408 77.350 1.00 36.57 C ATOM 1687 H LEU A 419 31.949 21.466 74.544 1.00 0.00 H ATOM 1688 N GLN A 420 32.176 18.270 73.496 1.00 38.46 N ATOM 1689 CA GLN A 420 32.347 17.119 72.608 1.00 39.75 C ATOM 1690 C GLN A 420 33.830 16.793 72.417 1.00 45.88 C ATOM 1691 O GLN A 420 34.210 15.626 72.531 1.00 46.74 O ATOM 1692 CB GLN A 420 31.636 17.345 71.262 1.00 41.30 C ATOM 1693 CG GLN A 420 31.597 16.096 70.377 1.00 54.29 C ATOM 1694 CD GLN A 420 30.713 16.251 69.166 1.00 71.81 C ATOM 1695 OE1 GLN A 420 30.639 17.313 68.537 1.00 70.54 O ATOM 1696 NE2 GLN A 420 30.042 15.175 68.795 1.00 61.03 N ATOM 1697 HE22 GLN A 420 30.124 14.296 69.344 1.00 0.00 H ATOM 1698 HE21 GLN A 420 29.431 15.207 67.954 1.00 0.00 H ATOM 1699 H GLN A 420 31.645 19.091 73.141 1.00 0.00 H ATOM 1700 N LYS A 421 34.662 17.832 72.193 1.00 43.74 N ATOM 1701 CA LYS A 421 36.109 17.705 72.036 1.00 46.17 C ATOM 1702 C LYS A 421 36.767 17.186 73.320 1.00 53.00 C ATOM 1703 O LYS A 421 37.643 16.325 73.233 1.00 54.45 O ATOM 1704 CB LYS A 421 36.738 19.040 71.602 1.00 48.54 C ATOM 1705 CG LYS A 421 36.502 19.382 70.143 1.00 59.74 C ATOM 1706 CD LYS A 421 37.359 20.551 69.711 1.00 66.74 C ATOM 1707 CE LYS A 421 37.210 20.846 68.240 1.00 74.07 C ATOM 1708 NZ LYS A 421 38.107 21.944 67.807 1.00 79.97 N ATOM 1709 HZ1 LYS A 421 37.878 22.808 68.339 1.00 0.00 H ATOM 1710 HZ2 LYS A 421 39.095 21.675 67.989 1.00 0.00 H ATOM 1711 HZ3 LYS A 421 37.975 22.117 66.790 1.00 0.00 H ATOM 1712 H LYS A 421 34.247 18.783 72.128 1.00 0.00 H ATOM 1713 N LEU A 422 36.325 17.675 74.502 1.00 50.30 N ATOM 1714 CA LEU A 422 36.855 17.236 75.802 1.00 51.50 C ATOM 1715 C LEU A 422 36.545 15.780 76.125 1.00 58.04 C ATOM 1716 O LEU A 422 37.366 15.118 76.759 1.00 59.52 O ATOM 1717 CB LEU A 422 36.407 18.148 76.955 1.00 49.90 C ATOM 1718 CG LEU A 422 37.182 19.451 77.137 1.00 55.07 C ATOM 1719 CD1 LEU A 422 36.630 20.212 78.295 1.00 54.10 C ATOM 1720 CD2 LEU A 422 38.670 19.209 77.388 1.00 59.94 C ATOM 1721 H LEU A 422 35.575 18.395 74.491 1.00 0.00 H ATOM 1722 N CYS A 423 35.381 15.283 75.679 1.00 54.67 N ATOM 1723 CA CYS A 423 34.970 13.893 75.872 1.00 55.31 C ATOM 1724 C CYS A 423 35.862 12.958 75.073 1.00 63.39 C ATOM 1725 O CYS A 423 36.222 11.890 75.569 1.00 64.59 O ATOM 1726 CB CYS A 423 33.502 13.718 75.506 1.00 54.28 C ATOM 1727 SG CYS A 423 32.370 14.604 76.601 1.00 55.42 S ATOM 1728 H CYS A 423 34.737 15.920 75.169 1.00 0.00 H ATOM 1729 N LYS A 424 36.238 13.380 73.846 1.00 62.26 N ATOM 1730 CA LYS A 424 37.110 12.624 72.943 1.00 65.30 C ATOM 1731 C LYS A 424 38.556 12.564 73.464 1.00 72.49 C ATOM 1732 O LYS A 424 39.235 11.553 73.261 1.00 74.55 O ATOM 1733 CB LYS A 424 37.062 13.208 71.523 1.00 67.91 C ATOM 1734 CG LYS A 424 35.731 12.983 70.809 1.00 78.20 C ATOM 1735 CD LYS A 424 35.693 13.666 69.451 1.00 87.08 C ATOM 1736 CE LYS A 424 34.378 13.452 68.746 1.00 95.33 C ATOM 1737 NZ LYS A 424 34.385 14.035 67.380 1.00104.09 N ATOM 1738 HZ1 LYS A 424 34.561 15.058 67.442 1.00 0.00 H ATOM 1739 HZ2 LYS A 424 35.136 13.586 66.817 1.00 0.00 H ATOM 1740 HZ3 LYS A 424 33.463 13.867 66.928 1.00 0.00 H ATOM 1741 H LYS A 424 35.885 14.303 73.521 1.00 0.00 H ATOM 1742 N ILE A 425 39.010 13.638 74.145 1.00 68.78 N ATOM 1743 CA ILE A 425 40.357 13.740 74.721 1.00 70.79 C ATOM 1744 C ILE A 425 40.440 12.961 76.044 1.00 76.82 C ATOM 1745 O ILE A 425 41.297 12.084 76.172 1.00 79.19 O ATOM 1746 CB ILE A 425 40.821 15.224 74.862 1.00 73.14 C ATOM 1747 CG1 ILE A 425 40.963 15.902 73.477 1.00 74.05 C ATOM 1748 CG2 ILE A 425 42.134 15.325 75.650 1.00 75.43 C ATOM 1749 CD1 ILE A 425 40.791 17.440 73.484 1.00 78.29 C ATOM 1750 H ILE A 425 38.365 14.444 74.269 1.00 0.00 H ATOM 1751 N HIS A 426 39.546 13.276 77.012 1.00 71.93 N ATOM 1752 CA HIS A 426 39.465 12.656 78.339 1.00 72.32 C ATOM 1753 C HIS A 426 39.126 11.164 78.274 1.00 76.98 C ATOM 1754 O HIS A 426 39.786 10.366 78.944 1.00 78.22 O ATOM 1755 CB HIS A 426 38.491 13.445 79.247 1.00 70.97 C ATOM 1756 CG HIS A 426 37.732 12.630 80.252 1.00 74.37 C ATOM 1757 ND1 HIS A 426 38.359 12.068 81.353 1.00 77.54 N ATOM 1758 CD2 HIS A 426 36.408 12.354 80.316 1.00 75.08 C ATOM 1759 CE1 HIS A 426 37.405 11.450 82.030 1.00 76.40 C ATOM 1760 NE2 HIS A 426 36.213 11.604 81.450 1.00 75.18 N ATOM 1761 H HIS A 426 38.856 14.023 76.795 1.00 0.00 H ATOM 1762 N GLN A 427 38.111 10.793 77.473 1.00 72.23 N ATOM 1763 CA GLN A 427 37.702 9.397 77.329 1.00 73.02 C ATOM 1764 C GLN A 427 37.718 8.930 75.862 1.00 77.88 C ATOM 1765 O GLN A 427 36.648 8.804 75.253 1.00 76.94 O ATOM 1766 CB GLN A 427 36.337 9.150 77.994 1.00 72.53 C ATOM 1767 CG GLN A 427 36.460 8.776 79.465 1.00 83.68 C ATOM 1768 CD GLN A 427 35.125 8.447 80.094 1.00 96.63 C ATOM 1769 OE1 GLN A 427 34.341 7.637 79.594 1.00 91.18 O ATOM 1770 NE2 GLN A 427 34.860 9.051 81.239 1.00 85.86 N ATOM 1771 HE22 GLN A 427 35.539 9.730 81.638 1.00 0.00 H ATOM 1772 HE21 GLN A 427 33.972 8.847 81.741 1.00 0.00 H ATOM 1773 H GLN A 427 37.600 11.524 76.938 1.00 0.00 H ATOM 1774 N PRO A 428 38.906 8.651 75.268 1.00 76.08 N ATOM 1775 CA PRO A 428 38.925 8.140 73.884 1.00 77.13 C ATOM 1776 C PRO A 428 38.472 6.677 73.804 1.00 81.85 C ATOM 1777 O PRO A 428 38.027 6.241 72.742 1.00 81.96 O ATOM 1778 CB PRO A 428 40.393 8.303 73.451 1.00 80.97 C ATOM 1779 CG PRO A 428 41.106 8.959 74.610 1.00 85.07 C ATOM 1780 CD PRO A 428 40.272 8.715 75.823 1.00 79.22 C ATOM 1781 N GLU A 429 38.577 5.936 74.932 1.00 78.79 N ATOM 1782 CA GLU A 429 38.178 4.534 75.093 1.00 80.57 C ATOM 1783 C GLU A 429 36.658 4.373 74.970 1.00 81.37 C ATOM 1784 O GLU A 429 36.196 3.387 74.392 1.00 83.06 O ATOM 1785 CB GLU A 429 38.655 3.997 76.455 1.00 83.31 C ATOM 1786 CG GLU A 429 40.140 3.678 76.511 1.00 99.26 C ATOM 1787 CD GLU A 429 40.794 3.828 77.874 1.00124.26 C ATOM 1788 OE1 GLU A 429 40.315 3.202 78.848 1.00116.71 O ATOM 1789 OE2 GLU A 429 41.808 4.557 77.961 1.00121.10 O ATOM 1790 H GLU A 429 38.980 6.407 75.767 1.00 0.00 H ATOM 1791 N ASN A 430 35.892 5.340 75.518 1.00 73.18 N ATOM 1792 CA ASN A 430 34.431 5.360 75.485 1.00 70.45 C ATOM 1793 C ASN A 430 33.912 6.387 74.456 1.00 70.69 C ATOM 1794 O ASN A 430 33.886 7.586 74.747 1.00 67.94 O ATOM 1795 CB ASN A 430 33.859 5.610 76.896 1.00 68.67 C ATOM 1796 CG ASN A 430 32.351 5.701 76.994 1.00 86.94 C ATOM 1797 OD1 ASN A 430 31.597 5.075 76.240 1.00 77.52 O ATOM 1798 ND2 ASN A 430 31.875 6.471 77.974 1.00 77.78 N ATOM 1799 HD22 ASN A 430 32.531 6.987 78.595 1.00 0.00 H ATOM 1800 HD21 ASN A 430 30.848 6.555 78.117 1.00 0.00 H ATOM 1801 H ASN A 430 36.376 6.126 75.997 1.00 0.00 H ATOM 1802 N PRO A 431 33.493 5.941 73.250 1.00 66.27 N ATOM 1803 CA PRO A 431 32.979 6.904 72.259 1.00 63.86 C ATOM 1804 C PRO A 431 31.547 7.365 72.530 1.00 63.99 C ATOM 1805 O PRO A 431 31.088 8.331 71.918 1.00 62.45 O ATOM 1806 CB PRO A 431 33.122 6.165 70.926 1.00 68.04 C ATOM 1807 CG PRO A 431 33.160 4.724 71.281 1.00 75.11 C ATOM 1808 CD PRO A 431 33.449 4.556 72.739 1.00 70.41 C ATOM 1809 N GLN A 432 30.842 6.688 73.453 1.00 58.81 N ATOM 1810 CA GLN A 432 29.470 7.020 73.846 1.00 56.25 C ATOM 1811 C GLN A 432 29.431 8.130 74.899 1.00 54.51 C ATOM 1812 O GLN A 432 28.345 8.629 75.202 1.00 53.86 O ATOM 1813 CB GLN A 432 28.763 5.761 74.394 1.00 59.47 C ATOM 1814 CG GLN A 432 28.116 4.799 73.383 1.00 76.47 C ATOM 1815 CD GLN A 432 28.489 4.927 71.924 1.00100.95 C ATOM 1816 OE1 GLN A 432 27.962 5.786 71.210 1.00 94.66 O ATOM 1817 NE2 GLN A 432 29.408 4.103 71.469 1.00 98.69 N ATOM 1818 HE22 GLN A 432 29.829 3.393 72.102 1.00 0.00 H ATOM 1819 HE21 GLN A 432 29.714 4.162 70.477 1.00 0.00 H ATOM 1820 H GLN A 432 31.299 5.878 73.917 1.00 0.00 H ATOM 1821 N HIS A 433 30.613 8.519 75.435 1.00 48.19 N ATOM 1822 CA HIS A 433 30.765 9.491 76.517 1.00 44.81 C ATOM 1823 C HIS A 433 30.002 10.809 76.318 1.00 45.15 C ATOM 1824 O HIS A 433 29.298 11.218 77.242 1.00 43.13 O ATOM 1825 CB HIS A 433 32.238 9.763 76.840 1.00 45.21 C ATOM 1826 CG HIS A 433 32.434 10.441 78.159 1.00 46.66 C ATOM 1827 ND1 HIS A 433 32.896 11.743 78.240 1.00 46.88 N ATOM 1828 CD2 HIS A 433 32.177 9.992 79.410 1.00 47.78 C ATOM 1829 CE1 HIS A 433 32.939 12.029 79.529 1.00 45.23 C ATOM 1830 NE2 HIS A 433 32.513 11.009 80.271 1.00 46.15 N ATOM 1831 H HIS A 433 31.479 8.094 75.047 1.00 0.00 H ATOM 1832 N PHE A 434 30.125 11.464 75.144 1.00 41.45 N ATOM 1833 CA PHE A 434 29.431 12.738 74.898 1.00 38.92 C ATOM 1834 C PHE A 434 27.910 12.601 74.876 1.00 44.14 C ATOM 1835 O PHE A 434 27.214 13.456 75.436 1.00 43.11 O ATOM 1836 CB PHE A 434 29.945 13.432 73.632 1.00 40.25 C ATOM 1837 CG PHE A 434 29.257 14.739 73.295 1.00 39.07 C ATOM 1838 CD1 PHE A 434 29.318 15.822 74.164 1.00 40.42 C ATOM 1839 CD2 PHE A 434 28.569 14.893 72.098 1.00 41.53 C ATOM 1840 CE1 PHE A 434 28.699 17.035 73.844 1.00 39.65 C ATOM 1841 CE2 PHE A 434 27.961 16.112 71.772 1.00 43.30 C ATOM 1842 CZ PHE A 434 28.024 17.172 72.652 1.00 39.76 C ATOM 1843 H PHE A 434 30.724 11.059 74.396 1.00 0.00 H ATOM 1844 N ALA A 435 27.403 11.535 74.227 1.00 43.68 N ATOM 1845 CA ALA A 435 25.974 11.224 74.135 1.00 44.62 C ATOM 1846 C ALA A 435 25.428 10.793 75.504 1.00 49.37 C ATOM 1847 O ALA A 435 24.265 11.056 75.801 1.00 47.32 O ATOM 1848 CB ALA A 435 25.744 10.131 73.101 1.00 47.61 C ATOM 1849 H ALA A 435 28.071 10.889 73.760 1.00 0.00 H ATOM 1850 N CYS A 436 26.282 10.147 76.332 1.00 48.65 N ATOM 1851 CA CYS A 436 25.976 9.711 77.696 1.00 49.34 C ATOM 1852 C CYS A 436 25.674 10.925 78.563 1.00 48.96 C ATOM 1853 O CYS A 436 24.629 10.949 79.206 1.00 48.53 O ATOM 1854 CB CYS A 436 27.120 8.888 78.283 1.00 51.80 C ATOM 1855 SG CYS A 436 27.089 7.133 77.852 1.00 59.61 S ATOM 1856 H CYS A 436 27.235 9.943 75.969 1.00 0.00 H ATOM 1857 N LEU A 437 26.574 11.949 78.542 1.00 43.20 N ATOM 1858 CA LEU A 437 26.439 13.205 79.297 1.00 40.77 C ATOM 1859 C LEU A 437 25.161 13.934 78.914 1.00 43.38 C ATOM 1860 O LEU A 437 24.388 14.312 79.797 1.00 41.25 O ATOM 1861 CB LEU A 437 27.643 14.157 79.078 1.00 40.21 C ATOM 1862 CG LEU A 437 29.062 13.712 79.451 1.00 45.85 C ATOM 1863 CD1 LEU A 437 30.030 14.863 79.302 1.00 46.71 C ATOM 1864 CD2 LEU A 437 29.143 13.198 80.868 1.00 46.15 C ATOM 1865 H LEU A 437 27.420 11.834 77.948 1.00 0.00 H ATOM 1866 N LEU A 438 24.939 14.122 77.592 1.00 40.64 N ATOM 1867 CA LEU A 438 23.765 14.801 77.042 1.00 40.07 C ATOM 1868 C LEU A 438 22.455 14.104 77.414 1.00 43.88 C ATOM 1869 O LEU A 438 21.464 14.781 77.685 1.00 42.03 O ATOM 1870 CB LEU A 438 23.874 14.944 75.512 1.00 40.86 C ATOM 1871 CG LEU A 438 24.929 15.915 74.957 1.00 44.78 C ATOM 1872 CD1 LEU A 438 24.789 16.037 73.460 1.00 45.95 C ATOM 1873 CD2 LEU A 438 24.835 17.299 75.610 1.00 45.22 C ATOM 1874 H LEU A 438 25.649 13.760 76.924 1.00 0.00 H ATOM 1875 N GLY A 439 22.473 12.773 77.425 1.00 42.96 N ATOM 1876 CA GLY A 439 21.323 11.955 77.786 1.00 44.52 C ATOM 1877 C GLY A 439 20.957 12.070 79.247 1.00 48.21 C ATOM 1878 O GLY A 439 19.776 12.020 79.598 1.00 47.74 O ATOM 1879 H GLY A 439 23.356 12.291 77.162 1.00 0.00 H ATOM 1880 N ARG A 440 21.977 12.250 80.101 1.00 45.10 N ATOM 1881 CA ARG A 440 21.823 12.440 81.539 1.00 45.33 C ATOM 1882 C ARG A 440 21.172 13.799 81.886 1.00 49.68 C ATOM 1883 O ARG A 440 20.759 14.000 83.028 1.00 50.20 O ATOM 1884 CB ARG A 440 23.172 12.239 82.262 1.00 45.89 C ATOM 1885 CG ARG A 440 23.186 11.031 83.206 1.00 55.59 C ATOM 1886 CD ARG A 440 23.258 9.681 82.504 1.00 63.08 C ATOM 1887 NE ARG A 440 22.187 8.785 82.954 1.00 64.08 N ATOM 1888 CZ ARG A 440 22.209 7.459 82.839 1.00 78.86 C ATOM 1889 NH1 ARG A 440 23.256 6.847 82.299 1.00 70.02 N ATOM 1890 NH2 ARG A 440 21.185 6.735 83.272 1.00 61.62 N ATOM 1891 HE ARG A 440 21.350 9.217 83.395 1.00 0.00 H ATOM 1892 HH12 ARG A 440 23.265 5.811 82.213 1.00 0.00 H ATOM 1893 HH11 ARG A 440 24.067 7.404 81.962 1.00 0.00 H ATOM 1894 HH22 ARG A 440 21.205 5.699 83.181 1.00 0.00 H ATOM 1895 HH21 ARG A 440 20.362 7.203 83.703 1.00 0.00 H ATOM 1896 H ARG A 440 22.941 12.254 79.711 1.00 0.00 H ATOM 1897 N LEU A 441 21.050 14.709 80.894 1.00 45.25 N ATOM 1898 CA LEU A 441 20.401 16.011 81.068 1.00 43.52 C ATOM 1899 C LEU A 441 18.879 15.880 81.049 1.00 48.55 C ATOM 1900 O LEU A 441 18.198 16.737 81.615 1.00 48.25 O ATOM 1901 CB LEU A 441 20.865 17.031 80.010 1.00 42.79 C ATOM 1902 CG LEU A 441 22.339 17.443 80.024 1.00 45.95 C ATOM 1903 CD1 LEU A 441 22.588 18.564 79.039 1.00 45.57 C ATOM 1904 CD2 LEU A 441 22.782 17.879 81.406 1.00 46.04 C ATOM 1905 H LEU A 441 21.437 14.473 79.958 1.00 0.00 H ATOM 1906 N THR A 442 18.347 14.816 80.412 1.00 46.30 N ATOM 1907 CA THR A 442 16.899 14.578 80.381 1.00 47.45 C ATOM 1908 C THR A 442 16.433 14.105 81.742 1.00 51.77 C ATOM 1909 O THR A 442 15.374 14.533 82.203 1.00 51.48 O ATOM 1910 CB THR A 442 16.481 13.674 79.200 1.00 59.59 C ATOM 1911 OG1 THR A 442 17.128 12.410 79.307 1.00 60.63 O ATOM 1912 CG2 THR A 442 16.775 14.300 77.844 1.00 59.76 C ATOM 1913 HG1 THR A 442 18.109 12.540 79.289 1.00 0.00 H ATOM 1914 H THR A 442 18.980 14.146 79.930 1.00 0.00 H ATOM 1915 N GLU A 443 17.259 13.274 82.424 1.00 49.10 N ATOM 1916 CA GLU A 443 17.008 12.763 83.777 1.00 48.94 C ATOM 1917 C GLU A 443 17.102 13.934 84.762 1.00 50.37 C ATOM 1918 O GLU A 443 16.324 13.999 85.716 1.00 49.62 O ATOM 1919 CB GLU A 443 18.008 11.642 84.136 1.00 50.89 C ATOM 1920 CG GLU A 443 17.759 10.969 85.480 1.00 61.41 C ATOM 1921 CD GLU A 443 18.776 9.933 85.941 1.00 80.09 C ATOM 1922 OE1 GLU A 443 19.861 9.823 85.322 1.00 78.54 O ATOM 1923 OE2 GLU A 443 18.488 9.235 86.940 1.00 72.72 O ATOM 1924 H GLU A 443 18.137 12.976 81.953 1.00 0.00 H ATOM 1925 N LEU A 444 18.038 14.875 84.496 1.00 45.54 N ATOM 1926 CA LEU A 444 18.243 16.099 85.269 1.00 43.67 C ATOM 1927 C LEU A 444 16.960 16.942 85.245 1.00 46.87 C ATOM 1928 O LEU A 444 16.549 17.448 86.285 1.00 45.92 O ATOM 1929 CB LEU A 444 19.399 16.925 84.670 1.00 42.75 C ATOM 1930 CG LEU A 444 20.514 17.408 85.600 1.00 46.93 C ATOM 1931 CD1 LEU A 444 21.261 18.582 84.988 1.00 46.18 C ATOM 1932 CD2 LEU A 444 19.989 17.800 86.963 1.00 49.76 C ATOM 1933 H LEU A 444 18.660 14.715 83.678 1.00 0.00 H ATOM 1934 N ARG A 445 16.330 17.069 84.057 1.00 44.23 N ATOM 1935 CA ARG A 445 15.089 17.823 83.857 1.00 45.08 C ATOM 1936 C ARG A 445 13.901 17.294 84.684 1.00 49.87 C ATOM 1937 O ARG A 445 13.028 18.085 85.042 1.00 49.14 O ATOM 1938 CB ARG A 445 14.716 17.875 82.367 1.00 46.57 C ATOM 1939 CG ARG A 445 15.509 18.907 81.592 1.00 54.05 C ATOM 1940 CD ARG A 445 15.213 18.859 80.110 1.00 59.32 C ATOM 1941 NE ARG A 445 16.105 19.742 79.359 1.00 63.56 N ATOM 1942 CZ ARG A 445 15.739 20.896 78.809 1.00 74.28 C ATOM 1943 NH1 ARG A 445 14.480 21.314 78.896 1.00 63.36 N ATOM 1944 NH2 ARG A 445 16.622 21.630 78.147 1.00 54.90 N ATOM 1945 HE ARG A 445 17.096 19.446 79.247 1.00 0.00 H ATOM 1946 HH12 ARG A 445 14.201 22.218 78.463 1.00 0.00 H ATOM 1947 HH11 ARG A 445 13.774 20.737 79.397 1.00 0.00 H ATOM 1948 HH22 ARG A 445 16.331 22.532 77.718 1.00 0.00 H ATOM 1949 HH21 ARG A 445 17.605 21.304 78.056 1.00 0.00 H ATOM 1950 H ARG A 445 16.753 16.601 83.230 1.00 0.00 H ATOM 1951 N THR A 446 13.881 15.983 85.009 1.00 47.85 N ATOM 1952 CA THR A 446 12.786 15.363 85.778 1.00 49.89 C ATOM 1953 C THR A 446 12.683 15.914 87.214 1.00 54.63 C ATOM 1954 O THR A 446 11.576 15.972 87.755 1.00 55.50 O ATOM 1955 CB THR A 446 12.839 13.818 85.747 1.00 59.60 C ATOM 1956 OG1 THR A 446 13.865 13.331 86.619 1.00 58.97 O ATOM 1957 CG2 THR A 446 12.995 13.249 84.336 1.00 58.24 C ATOM 1958 HG1 THR A 446 14.741 13.688 86.328 1.00 0.00 H ATOM 1959 H THR A 446 14.674 15.384 84.703 1.00 0.00 H ATOM 1960 N PHE A 447 13.816 16.342 87.808 1.00 50.27 N ATOM 1961 CA PHE A 447 13.854 16.917 89.159 1.00 50.15 C ATOM 1962 C PHE A 447 13.146 18.272 89.263 1.00 56.08 C ATOM 1963 O PHE A 447 12.752 18.655 90.362 1.00 55.42 O ATOM 1964 CB PHE A 447 15.301 17.008 89.691 1.00 50.61 C ATOM 1965 CG PHE A 447 16.005 15.684 89.861 1.00 52.46 C ATOM 1966 CD1 PHE A 447 15.633 14.805 90.873 1.00 56.36 C ATOM 1967 CD2 PHE A 447 17.071 15.335 89.039 1.00 54.09 C ATOM 1968 CE1 PHE A 447 16.286 13.579 91.033 1.00 57.69 C ATOM 1969 CE2 PHE A 447 17.730 14.113 89.204 1.00 57.54 C ATOM 1970 CZ PHE A 447 17.331 13.244 90.200 1.00 56.58 C ATOM 1971 H PHE A 447 14.709 16.261 87.282 1.00 0.00 H ATOM 1972 N ASN A 448 12.961 18.980 88.124 1.00 54.50 N ATOM 1973 CA ASN A 448 12.262 20.271 88.050 1.00 55.34 C ATOM 1974 C ASN A 448 10.786 20.114 88.367 1.00 60.72 C ATOM 1975 O ASN A 448 10.209 20.954 89.064 1.00 60.00 O ATOM 1976 CB ASN A 448 12.375 20.861 86.640 1.00 59.31 C ATOM 1977 CG ASN A 448 13.621 21.648 86.364 1.00 91.78 C ATOM 1978 OD1 ASN A 448 14.598 21.613 87.115 1.00 91.88 O ATOM 1979 ND2 ASN A 448 13.601 22.401 85.277 1.00 85.41 N ATOM 1980 HD22 ASN A 448 12.761 22.408 84.664 1.00 0.00 H ATOM 1981 HD21 ASN A 448 14.426 22.987 85.035 1.00 0.00 H ATOM 1982 H ASN A 448 13.340 18.583 87.240 1.00 0.00 H ATOM 1983 N HIS A 449 10.177 19.054 87.822 1.00 59.22 N ATOM 1984 CA HIS A 449 8.755 18.762 87.953 1.00 61.27 C ATOM 1985 C HIS A 449 8.383 18.362 89.363 1.00 63.16 C ATOM 1986 O HIS A 449 7.242 18.579 89.759 1.00 63.66 O ATOM 1987 CB HIS A 449 8.333 17.657 86.962 1.00 64.25 C ATOM 1988 CG HIS A 449 8.661 17.954 85.530 1.00 68.01 C ATOM 1989 ND1 HIS A 449 9.972 18.121 85.104 1.00 68.25 N ATOM 1990 CD2 HIS A 449 7.838 18.069 84.463 1.00 71.65 C ATOM 1991 CE1 HIS A 449 9.901 18.354 83.802 1.00 68.34 C ATOM 1992 NE2 HIS A 449 8.638 18.326 83.369 1.00 70.63 N ATOM 1993 H HIS A 449 10.758 18.394 87.267 1.00 0.00 H ATOM 1994 N HIS A 450 9.324 17.750 90.110 1.00 57.32 N ATOM 1995 CA HIS A 450 9.036 17.254 91.451 1.00 57.48 C ATOM 1996 C HIS A 450 9.816 17.937 92.586 1.00 56.95 C ATOM 1997 O HIS A 450 9.681 17.501 93.731 1.00 56.70 O ATOM 1998 CB HIS A 450 9.230 15.733 91.500 1.00 59.69 C ATOM 1999 CG HIS A 450 8.303 14.978 90.596 1.00 65.58 C ATOM 2000 ND1 HIS A 450 6.935 14.962 90.811 1.00 69.53 N ATOM 2001 CD2 HIS A 450 8.582 14.245 89.494 1.00 68.13 C ATOM 2002 CE1 HIS A 450 6.427 14.221 89.839 1.00 70.79 C ATOM 2003 NE2 HIS A 450 7.382 13.764 89.023 1.00 70.23 N ATOM 2004 H HIS A 450 10.280 17.628 89.720 1.00 0.00 H ATOM 2005 N HIS A 451 10.585 19.018 92.295 1.00 49.81 N ATOM 2006 CA HIS A 451 11.390 19.737 93.301 1.00 46.72 C ATOM 2007 C HIS A 451 10.544 20.351 94.433 1.00 48.41 C ATOM 2008 O HIS A 451 10.939 20.241 95.591 1.00 46.49 O ATOM 2009 CB HIS A 451 12.335 20.781 92.666 1.00 45.63 C ATOM 2010 CG HIS A 451 11.730 22.128 92.438 1.00 49.01 C ATOM 2011 ND1 HIS A 451 10.943 22.380 91.335 1.00 51.69 N ATOM 2012 CD2 HIS A 451 11.812 23.252 93.186 1.00 50.58 C ATOM 2013 CE1 HIS A 451 10.568 23.642 91.438 1.00 51.51 C ATOM 2014 NE2 HIS A 451 11.060 24.207 92.541 1.00 51.18 N ATOM 2015 H HIS A 451 10.608 19.357 91.312 1.00 0.00 H ATOM 2016 N ALA A 452 9.398 20.977 94.095 1.00 46.36 N ATOM 2017 CA ALA A 452 8.489 21.598 95.070 1.00 47.32 C ATOM 2018 C ALA A 452 7.903 20.558 96.018 1.00 51.69 C ATOM 2019 O ALA A 452 7.884 20.785 97.224 1.00 51.20 O ATOM 2020 CB ALA A 452 7.382 22.352 94.362 1.00 49.45 C ATOM 2021 H ALA A 452 9.143 21.023 93.088 1.00 0.00 H ATOM 2022 N GLU A 453 7.483 19.396 95.473 1.00 49.79 N ATOM 2023 CA GLU A 453 6.929 18.266 96.226 1.00 51.19 C ATOM 2024 C GLU A 453 7.997 17.663 97.123 1.00 53.63 C ATOM 2025 O GLU A 453 7.684 17.244 98.236 1.00 54.18 O ATOM 2026 CB GLU A 453 6.398 17.186 95.278 1.00 54.07 C ATOM 2027 CG GLU A 453 5.073 17.518 94.622 1.00 68.73 C ATOM 2028 CD GLU A 453 4.800 16.803 93.309 1.00101.74 C ATOM 2029 OE1 GLU A 453 5.408 15.735 93.061 1.00 98.93 O ATOM 2030 OE2 GLU A 453 3.951 17.304 92.536 1.00103.98 O ATOM 2031 H GLU A 453 7.558 19.295 94.441 1.00 0.00 H ATOM 2032 N MET A 454 9.253 17.622 96.626 1.00 47.90 N ATOM 2033 CA MET A 454 10.418 17.093 97.341 1.00 46.65 C ATOM 2034 C MET A 454 10.722 17.943 98.579 1.00 48.94 C ATOM 2035 O MET A 454 10.976 17.389 99.651 1.00 48.62 O ATOM 2036 CB MET A 454 11.633 17.046 96.397 1.00 47.51 C ATOM 2037 CG MET A 454 12.792 16.233 96.928 1.00 51.01 C ATOM 2038 SD MET A 454 14.246 16.249 95.850 1.00 53.64 S ATOM 2039 CE MET A 454 13.693 15.175 94.525 1.00 51.18 C ATOM 2040 H MET A 454 9.404 17.993 95.666 1.00 0.00 H ATOM 2041 N LEU A 455 10.683 19.287 98.432 1.00 43.12 N ATOM 2042 CA LEU A 455 10.945 20.246 99.515 1.00 41.44 C ATOM 2043 C LEU A 455 9.841 20.258 100.565 1.00 44.74 C ATOM 2044 O LEU A 455 10.144 20.293 101.756 1.00 44.88 O ATOM 2045 CB LEU A 455 11.124 21.666 98.961 1.00 40.55 C ATOM 2046 CG LEU A 455 12.379 21.925 98.152 1.00 43.15 C ATOM 2047 CD1 LEU A 455 12.133 22.981 97.106 1.00 42.62 C ATOM 2048 CD2 LEU A 455 13.545 22.273 99.046 1.00 44.70 C ATOM 2049 H LEU A 455 10.453 19.667 97.492 1.00 0.00 H ATOM 2050 N MET A 456 8.566 20.257 100.132 1.00 41.05 N ATOM 2051 CA MET A 456 7.421 20.298 101.036 1.00 42.66 C ATOM 2052 C MET A 456 7.224 18.987 101.812 1.00 47.87 C ATOM 2053 O MET A 456 6.612 19.011 102.878 1.00 48.47 O ATOM 2054 CB MET A 456 6.130 20.737 100.314 1.00 46.34 C ATOM 2055 CG MET A 456 6.199 22.136 99.682 1.00 48.72 C ATOM 2056 SD MET A 456 6.775 23.479 100.751 1.00 51.45 S ATOM 2057 CE MET A 456 5.368 23.648 101.865 1.00 50.60 C ATOM 2058 H MET A 456 8.389 20.226 99.108 1.00 0.00 H ATOM 2059 N SER A 457 7.773 17.862 101.305 1.00 44.37 N ATOM 2060 CA SER A 457 7.678 16.551 101.954 1.00 46.29 C ATOM 2061 C SER A 457 8.752 16.352 103.042 1.00 50.83 C ATOM 2062 O SER A 457 8.750 15.314 103.715 1.00 51.73 O ATOM 2063 CB SER A 457 7.738 15.428 100.919 1.00 50.40 C ATOM 2064 OG SER A 457 9.046 15.273 100.391 1.00 57.65 O ATOM 2065 HG SER A 457 9.326 16.116 99.954 1.00 0.00 H ATOM 2066 H SER A 457 8.291 17.929 100.406 1.00 0.00 H ATOM 2067 N TRP A 458 9.668 17.344 103.204 1.00 46.62 N ATOM 2068 CA TRP A 458 10.727 17.324 104.214 1.00 46.20 C ATOM 2069 C TRP A 458 10.096 17.230 105.601 1.00 52.62 C ATOM 2070 O TRP A 458 9.138 17.950 105.890 1.00 52.64 O ATOM 2071 CB TRP A 458 11.622 18.569 104.104 1.00 43.11 C ATOM 2072 CG TRP A 458 13.016 18.375 104.618 1.00 42.92 C ATOM 2073 CD1 TRP A 458 13.405 18.284 105.921 1.00 46.24 C ATOM 2074 CD2 TRP A 458 14.215 18.313 103.837 1.00 41.21 C ATOM 2075 NE1 TRP A 458 14.768 18.137 105.999 1.00 44.60 N ATOM 2076 CE2 TRP A 458 15.291 18.146 104.733 1.00 44.88 C ATOM 2077 CE3 TRP A 458 14.482 18.354 102.457 1.00 41.47 C ATOM 2078 CZ2 TRP A 458 16.620 18.047 104.301 1.00 43.56 C ATOM 2079 CZ3 TRP A 458 15.800 18.268 102.030 1.00 42.11 C ATOM 2080 CH2 TRP A 458 16.849 18.100 102.943 1.00 42.73 C ATOM 2081 HE1 TRP A 458 15.315 18.035 106.878 1.00 0.00 H ATOM 2082 H TRP A 458 9.613 18.168 102.571 1.00 0.00 H ATOM 2083 N ARG A 459 10.594 16.295 106.431 1.00 51.01 N ATOM 2084 CA ARG A 459 10.067 15.986 107.760 1.00 53.20 C ATOM 2085 C ARG A 459 10.304 17.108 108.792 1.00 57.41 C ATOM 2086 O ARG A 459 11.007 16.911 109.781 1.00 57.37 O ATOM 2087 CB ARG A 459 10.604 14.626 108.239 1.00 55.01 C ATOM 2088 CG ARG A 459 9.505 13.650 108.636 1.00 67.80 C ATOM 2089 CD ARG A 459 9.364 12.497 107.655 1.00 76.30 C ATOM 2090 NE ARG A 459 8.502 11.444 108.198 1.00 85.22 N ATOM 2091 CZ ARG A 459 7.249 11.212 107.814 1.00 97.15 C ATOM 2092 NH1 ARG A 459 6.545 10.239 108.378 1.00 89.58 N ATOM 2093 NH2 ARG A 459 6.693 11.947 106.856 1.00 75.62 N ATOM 2094 HE ARG A 459 8.899 10.832 108.939 1.00 0.00 H ATOM 2095 HH12 ARG A 459 5.566 10.062 108.074 1.00 0.00 H ATOM 2096 HH11 ARG A 459 6.972 9.653 109.124 1.00 0.00 H ATOM 2097 HH22 ARG A 459 5.713 11.761 106.560 1.00 0.00 H ATOM 2098 HH21 ARG A 459 7.238 12.708 106.402 1.00 0.00 H ATOM 2099 H ARG A 459 11.417 15.750 106.102 1.00 0.00 H ATOM 2100 N VAL A 460 9.681 18.276 108.557 1.00 54.60 N ATOM 2101 CA VAL A 460 9.739 19.494 109.383 1.00 54.70 C ATOM 2102 C VAL A 460 8.316 20.082 109.520 1.00 61.18 C ATOM 2103 O VAL A 460 7.456 19.773 108.697 1.00 61.46 O ATOM 2104 CB VAL A 460 10.749 20.548 108.818 1.00 56.71 C ATOM 2105 CG1 VAL A 460 12.177 20.018 108.840 1.00 55.03 C ATOM 2106 CG2 VAL A 460 10.372 21.017 107.415 1.00 55.56 C ATOM 2107 H VAL A 460 9.095 18.325 107.699 1.00 0.00 H ATOM 2108 N ASN A 461 8.077 20.927 110.547 1.00 60.14 N ATOM 2109 CA ASN A 461 6.776 21.551 110.806 1.00 62.23 C ATOM 2110 C ASN A 461 6.590 22.829 109.982 1.00 65.75 C ATOM 2111 O ASN A 461 5.493 23.065 109.478 1.00 66.70 O ATOM 2112 CB ASN A 461 6.583 21.862 112.300 1.00 65.20 C ATOM 2113 CG ASN A 461 6.823 20.697 113.240 1.00 85.64 C ATOM 2114 OD1 ASN A 461 6.448 19.553 112.972 1.00 79.03 O ATOM 2115 ND2 ASN A 461 7.428 20.980 114.384 1.00 77.82 N ATOM 2116 HD22 ASN A 461 7.734 21.954 114.584 1.00 0.00 H ATOM 2117 HD21 ASN A 461 7.597 20.228 115.083 1.00 0.00 H ATOM 2118 H ASN A 461 8.863 21.148 111.192 1.00 0.00 H ATOM 2119 N ASP A 462 7.657 23.641 109.849 1.00 60.73 N ATOM 2120 CA ASP A 462 7.651 24.908 109.113 1.00 59.90 C ATOM 2121 C ASP A 462 8.579 24.844 107.897 1.00 58.92 C ATOM 2122 O ASP A 462 9.777 24.585 108.053 1.00 57.52 O ATOM 2123 CB ASP A 462 8.030 26.099 110.031 1.00 62.92 C ATOM 2124 CG ASP A 462 8.302 25.749 111.484 1.00 80.94 C ATOM 2125 OD1 ASP A 462 7.342 25.709 112.269 1.00 84.10 O ATOM 2126 OD2 ASP A 462 9.443 25.381 111.799 1.00 88.04 O ATOM 2127 H ASP A 462 8.547 23.348 110.300 1.00 0.00 H ATOM 2128 N HIS A 463 8.035 25.062 106.690 1.00 52.69 N ATOM 2129 CA HIS A 463 8.836 25.071 105.466 1.00 49.44 C ATOM 2130 C HIS A 463 9.101 26.520 105.094 1.00 51.90 C ATOM 2131 O HIS A 463 8.392 27.103 104.268 1.00 52.41 O ATOM 2132 CB HIS A 463 8.155 24.300 104.328 1.00 49.83 C ATOM 2133 CG HIS A 463 8.023 22.839 104.600 1.00 53.04 C ATOM 2134 ND1 HIS A 463 6.962 22.332 105.331 1.00 56.36 N ATOM 2135 CD2 HIS A 463 8.831 21.820 104.236 1.00 53.20 C ATOM 2136 CE1 HIS A 463 7.155 21.026 105.381 1.00 55.72 C ATOM 2137 NE2 HIS A 463 8.268 20.672 104.738 1.00 54.27 N ATOM 2138 H HIS A 463 7.011 25.230 106.622 1.00 0.00 H ATOM 2139 N LYS A 464 10.086 27.122 105.770 1.00 46.85 N ATOM 2140 CA LYS A 464 10.469 28.518 105.572 1.00 46.38 C ATOM 2141 C LYS A 464 11.553 28.633 104.514 1.00 47.22 C ATOM 2142 O LYS A 464 12.562 27.930 104.574 1.00 45.09 O ATOM 2143 CB LYS A 464 10.920 29.169 106.893 1.00 50.33 C ATOM 2144 CG LYS A 464 9.824 29.295 107.949 1.00 70.69 C ATOM 2145 CD LYS A 464 10.312 30.069 109.166 1.00 84.36 C ATOM 2146 CE LYS A 464 9.670 29.597 110.451 1.00 99.11 C ATOM 2147 NZ LYS A 464 10.114 30.403 111.618 1.00109.62 N ATOM 2148 HZ1 LYS A 464 11.146 30.324 111.720 1.00 0.00 H ATOM 2149 HZ2 LYS A 464 9.854 31.399 111.469 1.00 0.00 H ATOM 2150 HZ3 LYS A 464 9.651 30.048 112.479 1.00 0.00 H ATOM 2151 H LYS A 464 10.608 26.565 106.476 1.00 0.00 H ATOM 2152 N PHE A 465 11.326 29.514 103.533 1.00 43.08 N ATOM 2153 CA PHE A 465 12.252 29.759 102.432 1.00 41.39 C ATOM 2154 C PHE A 465 12.653 31.237 102.398 1.00 46.68 C ATOM 2155 O PHE A 465 11.932 32.088 102.920 1.00 49.31 O ATOM 2156 CB PHE A 465 11.622 29.325 101.097 1.00 42.47 C ATOM 2157 CG PHE A 465 11.218 27.872 101.037 1.00 42.96 C ATOM 2158 CD1 PHE A 465 12.115 26.902 100.614 1.00 43.36 C ATOM 2159 CD2 PHE A 465 9.936 27.479 101.388 1.00 45.91 C ATOM 2160 CE1 PHE A 465 11.743 25.559 100.569 1.00 44.09 C ATOM 2161 CE2 PHE A 465 9.565 26.135 101.340 1.00 48.30 C ATOM 2162 CZ PHE A 465 10.469 25.188 100.928 1.00 44.49 C ATOM 2163 H PHE A 465 10.438 30.055 103.556 1.00 0.00 H ATOM 2164 N THR A 466 13.822 31.531 101.813 1.00 41.67 N ATOM 2165 CA THR A 466 14.311 32.908 101.686 1.00 41.61 C ATOM 2166 C THR A 466 13.562 33.582 100.517 1.00 44.73 C ATOM 2167 O THR A 466 13.147 32.866 99.600 1.00 43.03 O ATOM 2168 CB THR A 466 15.837 32.942 101.477 1.00 46.89 C ATOM 2169 OG1 THR A 466 16.166 32.365 100.211 1.00 46.72 O ATOM 2170 CG2 THR A 466 16.616 32.267 102.606 1.00 45.64 C ATOM 2171 HG1 THR A 466 17.147 32.390 100.083 1.00 0.00 H ATOM 2172 H THR A 466 14.403 30.755 101.436 1.00 0.00 H ATOM 2173 N PRO A 467 13.396 34.934 100.488 1.00 42.14 N ATOM 2174 CA PRO A 467 12.699 35.558 99.345 1.00 41.78 C ATOM 2175 C PRO A 467 13.307 35.216 97.978 1.00 41.36 C ATOM 2176 O PRO A 467 12.565 35.096 96.997 1.00 40.06 O ATOM 2177 CB PRO A 467 12.773 37.055 99.660 1.00 45.57 C ATOM 2178 CG PRO A 467 12.925 37.121 101.145 1.00 50.34 C ATOM 2179 CD PRO A 467 13.798 35.954 101.481 1.00 44.19 C ATOM 2180 N LEU A 468 14.643 35.014 97.921 1.00 35.60 N ATOM 2181 CA LEU A 468 15.346 34.653 96.694 1.00 33.46 C ATOM 2182 C LEU A 468 14.965 33.236 96.245 1.00 36.57 C ATOM 2183 O LEU A 468 14.719 33.021 95.054 1.00 35.07 O ATOM 2184 CB LEU A 468 16.872 34.799 96.861 1.00 32.53 C ATOM 2185 CG LEU A 468 17.738 34.478 95.634 1.00 36.10 C ATOM 2186 CD1 LEU A 468 17.437 35.408 94.455 1.00 37.23 C ATOM 2187 CD2 LEU A 468 19.199 34.507 95.993 1.00 38.68 C ATOM 2188 H LEU A 468 15.197 35.121 98.795 1.00 0.00 H ATOM 2189 N LEU A 469 14.899 32.281 97.202 1.00 33.56 N ATOM 2190 CA LEU A 469 14.527 30.890 96.934 1.00 32.60 C ATOM 2191 C LEU A 469 13.090 30.777 96.435 1.00 37.86 C ATOM 2192 O LEU A 469 12.829 29.954 95.562 1.00 35.79 O ATOM 2193 CB LEU A 469 14.742 30.000 98.168 1.00 32.20 C ATOM 2194 CG LEU A 469 16.180 29.567 98.463 1.00 34.84 C ATOM 2195 CD1 LEU A 469 16.251 28.795 99.775 1.00 35.11 C ATOM 2196 CD2 LEU A 469 16.747 28.729 97.336 1.00 35.11 C ATOM 2197 H LEU A 469 15.125 32.550 98.181 1.00 0.00 H ATOM 2198 N CYS A 470 12.178 31.630 96.955 1.00 37.53 N ATOM 2199 CA CYS A 470 10.769 31.687 96.547 1.00 39.55 C ATOM 2200 C CYS A 470 10.613 32.110 95.079 1.00 45.02 C ATOM 2201 O CYS A 470 9.653 31.699 94.432 1.00 45.64 O ATOM 2202 CB CYS A 470 9.962 32.590 97.476 1.00 41.73 C ATOM 2203 SG CYS A 470 9.721 31.918 99.143 1.00 46.04 S ATOM 2204 H CYS A 470 12.496 32.290 97.693 1.00 0.00 H ATOM 2205 N GLU A 471 11.544 32.929 94.559 1.00 42.03 N ATOM 2206 CA GLU A 471 11.532 33.388 93.160 1.00 42.47 C ATOM 2207 C GLU A 471 12.060 32.310 92.206 1.00 46.79 C ATOM 2208 O GLU A 471 11.653 32.254 91.042 1.00 46.80 O ATOM 2209 CB GLU A 471 12.388 34.645 92.997 1.00 43.73 C ATOM 2210 CG GLU A 471 11.710 35.934 93.429 1.00 54.00 C ATOM 2211 CD GLU A 471 12.444 37.213 93.063 1.00 65.98 C ATOM 2212 OE1 GLU A 471 13.410 37.140 92.268 1.00 45.75 O ATOM 2213 OE2 GLU A 471 12.032 38.295 93.544 1.00 55.83 O ATOM 2214 H GLU A 471 12.313 33.256 95.178 1.00 0.00 H ATOM 2215 N ILE A 472 12.997 31.485 92.697 1.00 42.72 N ATOM 2216 CA ILE A 472 13.664 30.439 91.925 1.00 42.05 C ATOM 2217 C ILE A 472 12.900 29.092 91.975 1.00 45.36 C ATOM 2218 O ILE A 472 12.836 28.400 90.953 1.00 45.41 O ATOM 2219 CB ILE A 472 15.156 30.369 92.395 1.00 44.07 C ATOM 2220 CG1 ILE A 472 16.059 31.288 91.530 1.00 44.32 C ATOM 2221 CG2 ILE A 472 15.733 28.960 92.531 1.00 44.31 C ATOM 2222 CD1 ILE A 472 16.058 31.099 89.969 1.00 50.75 C ATOM 2223 H ILE A 472 13.267 31.598 93.695 1.00 0.00 H ATOM 2224 N TRP A 473 12.317 28.748 93.137 1.00 41.22 N ATOM 2225 CA TRP A 473 11.550 27.518 93.347 1.00 41.37 C ATOM 2226 C TRP A 473 10.033 27.776 93.312 1.00 49.13 C ATOM 2227 O TRP A 473 9.598 28.915 93.479 1.00 49.44 O ATOM 2228 CB TRP A 473 11.937 26.869 94.693 1.00 39.27 C ATOM 2229 CG TRP A 473 13.352 26.363 94.812 1.00 38.50 C ATOM 2230 CD1 TRP A 473 14.207 26.042 93.796 1.00 40.38 C ATOM 2231 CD2 TRP A 473 14.029 26.021 96.031 1.00 37.86 C ATOM 2232 NE1 TRP A 473 15.395 25.564 94.309 1.00 38.69 N ATOM 2233 CE2 TRP A 473 15.309 25.534 95.680 1.00 40.64 C ATOM 2234 CE3 TRP A 473 13.694 26.116 97.395 1.00 39.86 C ATOM 2235 CZ2 TRP A 473 16.236 25.103 96.648 1.00 39.46 C ATOM 2236 CZ3 TRP A 473 14.612 25.696 98.350 1.00 40.59 C ATOM 2237 CH2 TRP A 473 15.864 25.190 97.977 1.00 40.06 C ATOM 2238 HE1 TRP A 473 16.222 25.273 93.749 1.00 0.00 H ATOM 2239 H TRP A 473 12.418 29.400 93.941 1.00 0.00 H ATOM 2240 N ASP A 474 9.234 26.720 93.113 1.00 48.48 N ATOM 2241 CA ASP A 474 7.767 26.821 93.085 1.00 51.51 C ATOM 2242 C ASP A 474 7.203 26.572 94.501 1.00 55.85 C ATOM 2243 O ASP A 474 6.287 25.766 94.682 1.00 56.95 O ATOM 2244 CB ASP A 474 7.169 25.851 92.034 1.00 54.81 C ATOM 2245 CG ASP A 474 7.662 26.043 90.610 1.00 70.31 C ATOM 2246 OD1 ASP A 474 7.595 27.189 90.104 1.00 72.82 O ATOM 2247 OD2 ASP A 474 8.063 25.040 89.982 1.00 76.86 O ATOM 2248 H ASP A 474 9.670 25.787 92.972 1.00 0.00 H ATOM 2249 N VAL A 475 7.770 27.283 95.505 1.00 51.50 N ATOM 2250 CA VAL A 475 7.437 27.174 96.936 1.00 51.65 C ATOM 2251 C VAL A 475 6.899 28.489 97.538 1.00 56.69 C ATOM 2252 O VAL A 475 7.175 29.564 97.001 1.00 55.98 O ATOM 2253 CB VAL A 475 8.627 26.610 97.776 1.00 53.54 C ATOM 2254 CG1 VAL A 475 8.973 25.182 97.387 1.00 52.59 C ATOM 2255 CG2 VAL A 475 9.855 27.503 97.695 1.00 51.55 C ATOM 2256 H VAL A 475 8.507 27.968 95.242 1.00 0.00 H ATOM 2257 N GLN A 476 6.188 28.379 98.689 1.00 54.99 N ATOM 2258 CA GLN A 476 5.571 29.453 99.485 1.00 82.93 C ATOM 2259 C GLN A 476 4.654 30.353 98.659 1.00117.69 C ATOM 2260 O GLN A 476 3.437 30.218 98.738 1.00 83.88 O ATOM 2261 CB GLN A 476 6.634 30.264 100.246 1.00 83.18 C ATOM 2262 CG GLN A 476 6.129 30.933 101.519 1.00101.74 C ATOM 2263 CD GLN A 476 7.211 31.749 102.186 1.00122.32 C ATOM 2264 OE1 GLN A 476 8.077 31.223 102.890 1.00116.38 O ATOM 2265 NE2 GLN A 476 7.176 33.059 101.982 1.00116.69 N ATOM 2266 HE22 GLN A 476 6.433 33.472 101.383 1.00 0.00 H ATOM 2267 HE21 GLN A 476 7.892 33.673 102.421 1.00 0.00 H ATOM 2268 H GLN A 476 6.063 27.414 99.055 1.00 0.00 H TER 2269 GLN A 476 HETATM 2270 O HOH 1 39.935 23.896 89.402 1.00 50.18 O HETATM 2271 O HOH 2 26.160 26.666 98.361 1.00 30.90 O HETATM 2272 O HOH 3 38.499 20.883 91.379 1.00 43.03 O HETATM 2273 O HOH 4 7.125 41.528 78.822 1.00 51.72 O HETATM 2274 O HOH 5 25.830 7.003 83.391 1.00 38.41 O HETATM 2275 O HOH 6 15.847 23.969 86.655 1.00 31.61 O HETATM 2276 O HOH 7 41.028 23.730 83.320 1.00 53.33 O HETATM 2277 O HOH 8 24.763 15.844 109.078 1.00 53.34 O HETATM 2278 O HOH 9 5.159 17.339 99.177 1.00 38.56 O HETATM 2279 O HOH 10 14.784 27.584 106.069 1.00 55.28 O HETATM 2280 O HOH 11 40.990 18.056 84.772 1.00 42.41 O HETATM 2281 O HOH 12 17.816 27.524 81.132 1.00 38.11 O HETATM 2282 O HOH 13 0.752 30.089 98.362 1.00 59.31 O HETATM 2283 O HOH 14 20.558 21.891 72.229 1.00 41.20 O HETATM 2284 O HOH 15 32.430 14.331 91.071 1.00 45.52 O HETATM 2285 O HOH 16 28.324 7.351 93.074 1.00 56.49 O HETATM 2286 O HOH 17 23.738 44.146 77.575 1.00 59.07 O HETATM 2287 O HOH 18 29.312 24.077 95.698 1.00 48.64 O HETATM 2288 O HOH 19 16.516 10.003 88.651 1.00 51.69 O HETATM 2289 O HOH 20 15.122 11.498 105.226 1.00 45.59 O HETATM 2290 O HOH 21 21.683 13.529 108.526 1.00 59.47 O HETATM 2291 O HOH 22 33.098 19.366 68.525 1.00 46.88 O HETATM 2292 O HOH 23 21.257 43.461 76.602 1.00 59.61 O HETATM 2293 O HOH 24 33.745 16.353 99.030 1.00 48.42 O HETATM 2294 O HOH 25 9.973 35.975 96.998 1.00 50.65 O HETATM 2295 O HOH 26 26.906 22.483 88.486 1.00 32.13 O HETATM 2296 O HOH 27 31.317 7.862 92.652 1.00 75.78 O HETATM 2297 O HOH 28 10.365 34.143 102.011 1.00 56.15 O HETATM 2298 O HOH 29 23.403 22.655 114.666 1.00 61.82 O HETATM 2299 O HOH 30 35.955 34.120 84.380 1.00 44.48 O HETATM 2300 O HOH 31 26.630 28.285 92.250 1.00 47.60 O HETATM 2301 O HOH 32 38.048 31.882 90.325 1.00 62.07 O HETATM 2302 O HOH 33 5.372 25.804 99.238 1.00 50.55 O HETATM 2303 O HOH 34 33.434 26.197 70.326 1.00 39.51 O HETATM 2304 O HOH 35 34.744 27.643 99.664 1.00 62.95 O HETATM 2305 O HOH 36 34.991 17.957 89.913 1.00 43.36 O HETATM 2306 O HOH 37 24.146 37.027 92.427 1.00 41.04 O HETATM 2307 O HOH 38 24.170 10.026 111.468 1.00 53.20 O HETATM 2308 O HOH 39 19.246 22.203 75.170 1.00 64.56 O HETATM 2309 O HOH 40 9.887 21.696 112.509 1.00 58.67 O HETATM 2310 O HOH 41 36.235 31.461 67.159 1.00 46.34 O HETATM 2311 O HOH 42 17.107 35.056 73.738 1.00 39.66 O HETATM 2312 O HOH 43 4.278 24.245 93.482 1.00 55.86 O HETATM 2313 O HOH 44 25.851 24.967 89.410 1.00 55.28 O HETATM 2314 O HOH 45 18.204 3.850 96.823 1.00 65.34 O HETATM 2315 O HOH 46 15.386 14.655 112.886 1.00 57.09 O HETATM 2316 O HOH 47 34.188 16.499 108.566 1.00 48.99 O HETATM 2317 O HOH 48 28.687 31.008 74.571 1.00 53.55 O HETATM 2318 O HOH 49 21.111 23.930 110.977 1.00 52.29 O HETATM 2319 O HOH 50 23.231 34.834 70.179 1.00 36.00 O HETATM 2320 O HOH 51 40.404 26.247 86.870 1.00 42.42 O HETATM 2321 O HOH 52 27.465 29.515 67.390 1.00 50.03 O HETATM 2322 O HOH 53 13.677 37.722 72.777 1.00 61.79 O HETATM 2323 O HOH 54 34.101 16.849 68.157 1.00 73.04 O HETATM 2324 O HOH 55 34.161 25.188 93.375 1.00 63.42 O HETATM 2325 O HOH 56 37.843 33.387 65.620 1.00 58.91 O HETATM 2326 O HOH 57 8.190 21.305 91.362 1.00 44.51 O HETATM 2327 O HOH 58 6.624 19.443 92.521 1.00 45.95 O HETATM 2328 O HOH 59 17.689 37.574 72.849 1.00 53.52 O HETATM 2329 O HOH 60 38.820 16.801 87.259 1.00 40.27 O HETATM 2330 O HOH 61 11.540 29.292 82.699 1.00 53.07 O HETATM 2331 O HOH 62 31.241 2.278 75.231 1.00 70.32 O HETATM 2332 O HOH 63 19.555 41.105 71.316 1.00 56.06 O HETATM 2333 O HOH 64 27.440 22.303 68.740 1.00 46.16 O HETATM 2334 O HOH 65 30.147 33.016 90.231 1.00 47.41 O HETATM 2335 O HOH 66 17.349 10.026 81.184 1.00 70.78 O HETATM 2336 O HOH 67 24.923 33.277 100.814 1.00 54.46 O HETATM 2337 O HOH 68 28.467 19.354 69.407 1.00 51.33 O HETATM 2338 O HOH 69 12.660 22.868 81.612 1.00 46.97 O HETATM 2339 O HOH 70 26.525 37.486 71.428 1.00 55.43 O HETATM 2340 O HOH 71 34.528 3.686 100.776 1.00 66.19 O HETATM 2341 O HOH 72 34.929 22.350 89.263 1.00 97.90 O HETATM 2342 O HOH 73 33.420 9.989 109.490 1.00 60.06 O HETATM 2343 O HOH 74 12.339 23.901 88.229 1.00 59.76 O HETATM 2344 O HOH 75 29.131 26.251 67.198 1.00 64.28 O HETATM 2345 O HOH 76 31.607 8.444 95.670 1.00 52.66 O HETATM 2346 O HOH 77 18.861 29.543 106.110 1.00 71.21 O HETATM 2347 O HOH 78 13.375 2.008 96.457 1.00 53.43 O HETATM 2348 O HOH 79 19.865 38.280 71.352 1.00 44.06 O HETATM 2349 O HOH 80 10.978 5.346 95.944 1.00 51.89 O HETATM 2350 O HOH 81 35.506 29.372 97.661 1.00 79.51 O HETATM 2351 O HOH 82 38.376 35.231 83.885 1.00 53.16 O HETATM 2352 O HOH 83 32.254 26.224 67.856 1.00 59.17 O HETATM 2353 O HOH 84 1.865 14.099 91.647 1.00 57.06 O HETATM 2354 O HOH 85 29.319 20.878 120.271 1.00 63.87 O HETATM 2355 O HOH 86 27.081 25.580 95.952 1.00 44.65 O HETATM 2356 O HOH 87 25.670 38.295 94.271 1.00 62.31 O HETATM 2357 O HOH 88 37.596 18.356 91.065 1.00 60.28 O HETATM 2358 O HOH 89 14.751 45.816 78.874 1.00 61.33 O HETATM 2359 O HOH 90 21.989 26.772 109.382 1.00 59.57 O HETATM 2360 O HOH 91 14.940 15.905 116.502 1.00 77.58 O HETATM 2361 O HOH 92 21.073 29.876 107.701 1.00 70.30 O HETATM 2362 O HOH 93 26.774 32.581 107.305 1.00 87.05 O HETATM 2363 O HOH 94 23.592 23.935 112.107 1.00 65.20 O HETATM 2364 O HOH 95 25.944 35.043 69.499 1.00 50.97 O HETATM 2365 O HOH 96 17.468 15.758 117.511 1.00 69.03 O HETATM 2366 O HOH 97 46.106 13.099 72.172 1.00 68.47 O HETATM 2367 O HOH 98 25.924 45.631 76.953 1.00 57.14 O HETATM 2368 O HOH 99 6.375 38.155 103.270 1.00 62.82 O HETATM 2369 O HOH 100 12.653 47.472 79.254 1.00 53.15 O HETATM 2370 O HOH 101 25.432 41.705 65.319 1.00 54.92 O HETATM 2371 O HOH 102 14.385 44.388 90.404 1.00 38.11 O HETATM 2372 O HOH 103 9.938 46.477 95.436 1.00 60.60 O HETATM 2373 C4 UNN A 104 23.936 17.267 99.210 1.00 0.08 C HETATM 2374 C5 UNN A 104 23.834 16.262 98.250 1.00 0.02 C HETATM 2375 C6 UNN A 104 24.992 15.627 97.788 1.00 -0.07 C HETATM 2376 C1 UNN A 104 26.235 16.012 98.298 1.00 -0.04 C HETATM 2377 C2 UNN A 104 26.275 17.032 99.265 1.00 0.12 C HETATM 2378 C3 UNN A 104 25.155 17.674 99.739 1.00 -0.01 C HETATM 2379 H18 UNN A 104 25.220 18.457 100.486 1.00 0.05 H HETATM 2380 F18 UNN A 104 27.481 17.408 99.765 1.00 -0.19 F HETATM 2381 H17 UNN A 104 27.147 15.536 97.956 1.00 0.05 H HETATM 2382 H1 UNN A 104 24.926 14.844 97.041 1.00 0.05 H HETATM 2383 N7 UNN A 104 22.499 16.056 97.901 1.00 -0.32 N HETATM 2384 C9 UNN A 104 21.824 16.914 98.631 1.00 0.16 C HETATM 2385 N8 UNN A 104 22.611 17.682 99.454 1.00 -0.21 N HETATM 2386 C10 UNN A 104 22.178 18.755 100.400 1.00 0.16 C HETATM 2387 C11 UNN A 104 22.907 20.075 100.047 1.00 0.21 C HETATM 2388 O12 UNN A 104 23.517 20.714 100.900 1.00 -0.39 O HETATM 2389 N13 UNN A 104 22.824 20.452 98.760 1.00 -0.28 N HETATM 2390 C22 UNN A 104 23.444 21.663 98.216 1.00 0.04 C HETATM 2391 C21 UNN A 104 24.693 21.289 97.373 1.00 -0.03 C HETATM 2392 C20 UNN A 104 25.324 22.544 96.693 1.00 -0.05 C HETATM 2393 C19 UNN A 104 24.272 23.329 95.878 1.00 -0.05 C HETATM 2394 C17 UNN A 104 23.075 23.697 96.749 1.00 -0.05 C HETATM 2395 C16 UNN A 104 22.434 22.449 97.384 1.00 -0.03 C HETATM 2396 H20 UNN A 104 22.047 21.800 96.585 1.00 0.03 H HETATM 2397 H21 UNN A 104 21.604 22.765 98.034 1.00 0.03 H HETATM 2398 H5 UNN A 104 23.410 24.373 97.549 1.00 0.03 H HETATM 2399 H6 UNN A 104 22.324 24.207 96.128 1.00 0.03 H HETATM 2400 H22 UNN A 104 24.731 24.250 95.489 1.00 0.03 H HETATM 2401 H23 UNN A 104 23.929 22.707 95.038 1.00 0.03 H HETATM 2402 H7 UNN A 104 26.130 22.219 96.019 1.00 0.03 H HETATM 2403 H8 UNN A 104 25.739 23.202 97.470 1.00 0.03 H HETATM 2404 H9 UNN A 104 25.442 20.825 98.031 1.00 0.03 H HETATM 2405 H10 UNN A 104 24.396 20.572 96.593 1.00 0.03 H HETATM 2406 H11 UNN A 104 23.769 22.297 99.055 1.00 0.06 H HETATM 2407 H19 UNN A 104 22.306 19.869 98.134 1.00 0.19 H HETATM 2408 C27 UNN A 104 22.312 18.382 101.893 1.00 0.01 C HETATM 2409 C15 UNN A 104 21.444 19.309 102.794 1.00 -0.05 C HETATM 2410 C23 UNN A 104 21.608 18.977 104.282 1.00 -0.05 C HETATM 2411 C24 UNN A 104 21.263 17.516 104.571 1.00 -0.05 C HETATM 2412 C25 UNN A 104 22.074 16.553 103.669 1.00 -0.05 C HETATM 2413 C26 UNN A 104 21.926 16.920 102.163 1.00 -0.05 C HETATM 2414 H14 UNN A 104 22.580 16.264 101.570 1.00 0.03 H HETATM 2415 H15 UNN A 104 20.880 16.766 101.860 1.00 0.03 H HETATM 2416 H27 UNN A 104 21.710 15.527 103.824 1.00 0.03 H HETATM 2417 H28 UNN A 104 23.136 16.611 103.948 1.00 0.03 H HETATM 2418 H12 UNN A 104 20.190 17.359 104.388 1.00 0.03 H HETATM 2419 H13 UNN A 104 21.491 17.296 105.624 1.00 0.03 H HETATM 2420 H25 UNN A 104 20.940 19.625 104.869 1.00 0.03 H HETATM 2421 H26 UNN A 104 22.651 19.163 104.577 1.00 0.03 H HETATM 2422 H3 UNN A 104 20.387 19.186 102.517 1.00 0.03 H HETATM 2423 H4 UNN A 104 21.748 20.353 102.627 1.00 0.03 H HETATM 2424 H24 UNN A 104 23.366 18.515 102.176 1.00 0.04 H HETATM 2425 H2 UNN A 104 21.105 18.921 100.222 1.00 0.09 H HETATM 2426 C33 UNN A 104 20.345 17.048 98.584 1.00 0.15 C HETATM 2427 O30 UNN A 104 20.037 18.344 98.082 1.00 -0.30 O HETATM 2428 C14 UNN A 104 18.712 18.637 97.792 1.00 0.10 C HETATM 2429 C28 UNN A 104 17.633 18.259 98.595 1.00 -0.04 C HETATM 2430 C31 UNN A 104 16.340 18.602 98.216 1.00 -0.06 C HETATM 2431 C34 UNN A 104 16.148 19.313 97.050 1.00 0.02 C HETATM 2432 C32 UNN A 104 17.207 19.693 96.250 1.00 -0.06 C HETATM 2433 C29 UNN A 104 18.512 19.361 96.607 1.00 -0.02 C HETATM 2434 C36 UNN A 104 19.670 19.773 95.733 1.00 -0.03 C HETATM 2435 H33 UNN A 104 20.611 19.421 96.181 1.00 0.04 H HETATM 2436 H34 UNN A 104 19.693 20.869 95.647 1.00 0.04 H HETATM 2437 H35 UNN A 104 19.551 19.329 94.734 1.00 0.04 H HETATM 2438 H32 UNN A 104 17.022 20.252 95.340 1.00 0.05 H HETATM 2439 CL35 UNN A 104 14.533 19.744 96.572 1.00 -0.08 CL HETATM 2440 H31 UNN A 104 15.494 18.314 98.829 1.00 0.05 H HETATM 2441 H16 UNN A 104 17.803 17.701 99.509 1.00 0.05 H HETATM 2442 H29 UNN A 104 19.927 16.930 99.595 1.00 0.09 H HETATM 2443 H30 UNN A 104 19.921 16.280 97.920 1.00 0.09 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 2373 2374 2378 2385 CONECT 2374 2373 2375 2383 CONECT 2375 2374 2376 2382 CONECT 2376 2375 2377 2381 CONECT 2377 2376 2378 2380 CONECT 2378 2373 2377 2379 CONECT 2379 2378 CONECT 2380 2377 CONECT 2381 2376 CONECT 2382 2375 CONECT 2383 2374 2384 CONECT 2384 2383 2385 2426 CONECT 2385 2373 2384 2386 CONECT 2386 2385 2387 2408 2425 CONECT 2387 2386 2388 2389 CONECT 2388 2387 CONECT 2389 2387 2390 2407 CONECT 2390 2389 2391 2395 2406 CONECT 2391 2390 2392 2404 2405 CONECT 2392 2391 2393 2402 2403 CONECT 2393 2392 2394 2400 2401 CONECT 2394 2393 2395 2398 2399 CONECT 2395 2390 2394 2396 2397 CONECT 2396 2395 CONECT 2397 2395 CONECT 2398 2394 CONECT 2399 2394 CONECT 2400 2393 CONECT 2401 2393 CONECT 2402 2392 CONECT 2403 2392 CONECT 2404 2391 CONECT 2405 2391 CONECT 2406 2390 CONECT 2407 2389 CONECT 2408 2386 2409 2413 2424 CONECT 2409 2408 2410 2422 2423 CONECT 2410 2409 2411 2420 2421 CONECT 2411 2410 2412 2418 2419 CONECT 2412 2411 2413 2416 2417 CONECT 2413 2408 2412 2414 2415 CONECT 2414 2413 CONECT 2415 2413 CONECT 2416 2412 CONECT 2417 2412 CONECT 2418 2411 CONECT 2419 2411 CONECT 2420 2410 CONECT 2421 2410 CONECT 2422 2409 CONECT 2423 2409 CONECT 2424 2408 CONECT 2425 2386 CONECT 2426 2384 2427 2442 2443 CONECT 2427 2426 2428 CONECT 2428 2427 2429 2433 CONECT 2429 2428 2430 2441 CONECT 2430 2429 2431 2440 CONECT 2431 2430 2432 2439 CONECT 2432 2431 2433 2438 CONECT 2433 2428 2432 2434 CONECT 2434 2433 2435 2436 2437 CONECT 2435 2434 CONECT 2436 2434 CONECT 2437 2434 CONECT 2438 2432 CONECT 2439 2431 CONECT 2440 2430 CONECT 2441 2429 CONECT 2442 2426 CONECT 2443 2426 MASTER 0 0 0 0 0 0 0 0 2442 1 75 18 END
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3ook
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5q0j
RCSB PDB
PDBbind
14aa, >5Q0J_2|Chains... at 100%
5q0l
RCSB PDB
PDBbind
14aa, >5Q0L_2|Chains... at 100%
5q0m
RCSB PDB
PDBbind
14aa, >5Q0M_2|Chain... at 100%
5q0n
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14aa, >5Q0N_2|Chains... at 100%
5q0o
RCSB PDB
PDBbind
14aa, >5Q0O_2|Chains... at 100%
5q0p
RCSB PDB
PDBbind
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5q0q
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5q0r
RCSB PDB
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5q0s
RCSB PDB
PDBbind
14aa, >5Q0S_2|Chains... at 100%
5q0t
RCSB PDB
PDBbind
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5q0u
RCSB PDB
PDBbind
14aa, >5Q0U_2|Chains... at 100%
5q0v
RCSB PDB
PDBbind
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5q0w
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PDBbind
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5q0x
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PDBbind
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5q0y
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PDBbind
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5q0z
RCSB PDB
PDBbind
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5q10
RCSB PDB
PDBbind
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5q11
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PDBbind
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5q12
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PDBbind
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5q13
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5q14
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5q15
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5q18
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5q19
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PDBbind
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5q1a
RCSB PDB
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5q1b
RCSB PDB
PDBbind
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5q1e
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5q1f
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5q1g
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PDBbind
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5q1h
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5q16
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Bile acid receptor
Ligand Name
9MS
EC.Number
E.C.2.3.1.48
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
IC50=0.0135uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Comput. Aided Mol. Des. Vol. : pp. -
Ligand Properties
Formula
C
2
9
H
3
5
ClFN
3
O
2
Molecular Weight
512.059
Exact Mass
511.240
No. of atoms
71
No. of bonds
75
Polar Surface Area
56.15
LOGP Value
7.69 (
Computed with XLOGP3
)
7.68 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 5
Canonical SMILES
O=C([C@@H](n1c(COc2ccc(cc2C)Cl)nc2c1cc(F)cc2)C1CCCCC1)NC1CCCCC1
InChI String
InChI=1S/C29H35ClFN3O2/c1-19-16-21(30)12-15-26(19)36-18-27-33-24-14-13-22(31)17-25(24)34(27)28(20-8-4-2-5-9-20)29(35)32-23-10-6-3-7-11-23/h12-17,20,23,28H,2-11,18H2,1H3,(H,32,35)/t28-/m0/s1
Links to External Databases
RCSB PDB
The mother database
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UniProt accession number (AC):
Q96RI1
Q15788
Entrez Gene ID
NCBI Entrez Gene ID:
9971
8648
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娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
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