Browse entries in the PDBbind-CN Database
HEADER 6CJJ_COMPLEX COMPND 6CJJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 214 GLN GLY GLU THR HIS GLU PHE THR ALA GLU ILE SER GLN SEQRES 2 A 214 LEU MET SER LEU ILE ILE ASN THR VAL TYR SER ASN LYS SEQRES 3 A 214 GLU ILE PHE LEU ARG GLU LEU ILE SER ASN ALA SER ASP SEQRES 4 A 214 ALA LEU ASP LYS ILE ARG TYR GLN ALA LEU SER ASP PRO SEQRES 5 A 214 SER GLN LEU GLU SER GLU PRO GLU LEU PHE ILE ARG ILE SEQRES 6 A 214 ILE PRO GLN LYS ASP GLN LYS VAL LEU GLU ILE ARG ASP SEQRES 7 A 214 SER GLY ILE GLY MET THR LYS ALA ASP LEU VAL ASN ASN SEQRES 8 A 214 LEU GLY THR ILE ALA LYS SER GLY THR LYS SER PHE MET SEQRES 9 A 214 GLU ALA LEU SER ALA GLY ALA ASP VAL SER MET ILE GLY SEQRES 10 A 214 GLN PHE GLY VAL GLY PHE TYR SER LEU PHE LEU VAL ALA SEQRES 11 A 214 ASP HIS VAL GLN VAL ILE SER LYS HIS ASN ASP ASP GLU SEQRES 12 A 214 GLN TYR VAL TRP GLU SER ASN ALA GLY GLY LYS PHE THR SEQRES 13 A 214 VAL THR LEU ASP GLU THR ASN GLU ARG LEU GLY ARG GLY SEQRES 14 A 214 THR MET LEU ARG LEU PHE LEU LYS GLU ASP GLN LEU GLU SEQRES 15 A 214 TYR LEU GLU GLU LYS ARG ILE LYS GLU VAL VAL LYS LYS SEQRES 16 A 214 HIS SER GLU PHE VAL ALA TYR PRO ILE GLN LEU VAL VAL SEQRES 17 A 214 THR LYS GLU VAL GLU LYS HET MG A 1 1 HET MG A 2 1 HET ADP A 436 39 ATOM 1 N GLN A 5 83.220 23.853 110.289 1.00 50.19 N ATOM 2 CA GLN A 5 82.677 23.035 111.378 1.00 63.18 C ATOM 3 C GLN A 5 83.645 22.997 112.550 1.00 49.42 C ATOM 4 O GLN A 5 84.093 21.933 112.969 1.00 67.71 O ATOM 5 CB GLN A 5 82.376 21.606 110.903 1.00 57.83 C ATOM 6 HN3 GLN A 5 84.123 23.447 109.969 1.00 0.00 H ATOM 7 HN2 GLN A 5 83.376 24.823 110.630 1.00 0.00 H ATOM 8 HN1 GLN A 5 82.545 23.867 109.498 1.00 0.00 H ATOM 9 N GLY A 6 83.957 24.173 113.079 1.00 52.71 N ATOM 10 CA GLY A 6 84.859 24.291 114.201 1.00 41.53 C ATOM 11 C GLY A 6 86.193 23.608 113.967 1.00 49.07 C ATOM 12 O GLY A 6 86.540 22.670 114.689 1.00 51.95 O ATOM 13 H GLY A 6 83.540 25.035 112.674 1.00 0.00 H ATOM 14 N GLU A 7 86.942 24.049 112.956 1.00 38.81 N ATOM 15 CA GLU A 7 88.322 23.617 112.760 1.00 35.50 C ATOM 16 C GLU A 7 89.236 24.531 113.574 1.00 33.35 C ATOM 17 O GLU A 7 89.191 25.753 113.404 1.00 30.76 O ATOM 18 CB GLU A 7 88.666 23.680 111.278 1.00 35.06 C ATOM 19 CG GLU A 7 89.751 22.781 110.791 1.00 41.74 C ATOM 20 CD GLU A 7 89.905 22.874 109.276 1.00 45.37 C ATOM 21 OE1 GLU A 7 90.622 23.784 108.798 1.00 40.76 O ATOM 22 OE2 GLU A 7 89.283 22.057 108.561 1.00 45.09 O ATOM 23 H GLU A 7 86.528 24.725 112.283 1.00 0.00 H ATOM 24 N THR A 8 90.058 23.956 114.459 1.00 30.07 N ATOM 25 CA THR A 8 90.951 24.749 115.303 1.00 30.06 C ATOM 26 C THR A 8 92.389 24.604 114.826 1.00 31.66 C ATOM 27 O THR A 8 92.837 23.507 114.474 1.00 30.55 O ATOM 28 CB THR A 8 90.844 24.355 116.787 1.00 31.76 C ATOM 29 OG1 THR A 8 89.505 24.560 117.249 1.00 34.19 O ATOM 30 CG2 THR A 8 91.760 25.206 117.657 1.00 32.48 C ATOM 31 HG1 THR A 8 88.884 24.002 116.716 1.00 0.00 H ATOM 32 H THR A 8 90.062 22.920 114.549 1.00 0.00 H ATOM 33 N HIS A 9 93.096 25.730 114.785 1.00 28.00 N ATOM 34 CA HIS A 9 94.469 25.789 114.321 1.00 30.48 C ATOM 35 C HIS A 9 95.303 26.550 115.335 1.00 31.60 C ATOM 36 O HIS A 9 94.802 27.387 116.087 1.00 29.35 O ATOM 37 CB HIS A 9 94.577 26.475 112.954 1.00 30.56 C ATOM 38 CG HIS A 9 93.829 25.760 111.880 1.00 30.73 C ATOM 39 ND1 HIS A 9 94.445 24.920 110.981 1.00 32.07 N ATOM 40 CD2 HIS A 9 92.510 25.734 111.584 1.00 29.92 C ATOM 41 CE1 HIS A 9 93.537 24.413 110.168 1.00 33.04 C ATOM 42 NE2 HIS A 9 92.355 24.889 110.513 1.00 31.92 N ATOM 43 H HIS A 9 92.642 26.611 115.101 1.00 0.00 H ATOM 44 N GLU A 10 96.594 26.268 115.331 1.00 31.69 N ATOM 45 CA GLU A 10 97.523 26.983 116.186 1.00 31.64 C ATOM 46 C GLU A 10 98.249 28.054 115.389 1.00 27.12 C ATOM 47 O GLU A 10 98.724 27.800 114.280 1.00 31.30 O ATOM 48 CB GLU A 10 98.519 26.010 116.812 1.00 37.38 C ATOM 49 CG GLU A 10 97.865 25.128 117.857 1.00 45.15 C ATOM 50 CD GLU A 10 98.756 23.996 118.296 1.00 57.34 C ATOM 51 OE1 GLU A 10 99.927 23.972 117.867 1.00 58.20 O ATOM 52 OE2 GLU A 10 98.282 23.129 119.059 1.00 64.15 O ATOM 53 H GLU A 10 96.951 25.520 114.703 1.00 0.00 H ATOM 54 N PHE A 11 98.328 29.255 115.958 1.00 30.63 N ATOM 55 CA PHE A 11 99.200 30.268 115.398 1.00 28.77 C ATOM 56 C PHE A 11 100.643 29.795 115.472 1.00 32.26 C ATOM 57 O PHE A 11 101.035 29.134 116.439 1.00 32.44 O ATOM 58 CB PHE A 11 99.080 31.576 116.171 1.00 29.63 C ATOM 59 CG PHE A 11 97.847 32.376 115.842 1.00 29.07 C ATOM 60 CD1 PHE A 11 97.749 33.052 114.643 1.00 29.32 C ATOM 61 CD2 PHE A 11 96.804 32.464 116.740 1.00 30.76 C ATOM 62 CE1 PHE A 11 96.621 33.795 114.347 1.00 27.49 C ATOM 63 CE2 PHE A 11 95.686 33.213 116.449 1.00 30.37 C ATOM 64 CZ PHE A 11 95.608 33.877 115.248 1.00 27.50 C ATOM 65 H PHE A 11 97.763 29.466 116.805 1.00 0.00 H ATOM 66 N THR A 12 101.428 30.134 114.454 1.00 30.72 N ATOM 67 CA THR A 12 102.877 29.984 114.561 1.00 33.78 C ATOM 68 C THR A 12 103.375 30.750 115.772 1.00 35.12 C ATOM 69 O THR A 12 102.787 31.758 116.187 1.00 34.66 O ATOM 70 CB THR A 12 103.598 30.504 113.309 1.00 35.61 C ATOM 71 OG1 THR A 12 103.280 31.886 113.087 1.00 36.03 O ATOM 72 CG2 THR A 12 103.210 29.720 112.110 1.00 36.77 C ATOM 73 HG1 THR A 12 103.567 32.419 113.870 1.00 0.00 H ATOM 74 H THR A 12 101.009 30.507 113.578 1.00 0.00 H ATOM 75 N ALA A 13 104.478 30.274 116.351 1.00 33.26 N ATOM 76 CA ALA A 13 105.016 30.923 117.541 1.00 34.29 C ATOM 77 C ALA A 13 105.258 32.412 117.316 1.00 31.93 C ATOM 78 O ALA A 13 104.983 33.233 118.199 1.00 31.16 O ATOM 79 CB ALA A 13 106.315 30.237 117.968 1.00 38.54 C ATOM 80 H ALA A 13 104.955 29.439 115.954 1.00 0.00 H ATOM 81 N GLU A 14 105.787 32.787 116.154 1.00 31.00 N ATOM 82 CA GLU A 14 106.171 34.186 115.978 1.00 32.76 C ATOM 83 C GLU A 14 104.945 35.089 115.943 1.00 33.85 C ATOM 84 O GLU A 14 104.981 36.225 116.436 1.00 30.19 O ATOM 85 CB GLU A 14 107.002 34.356 114.705 1.00 40.24 C ATOM 86 CG GLU A 14 108.452 33.892 114.828 1.00 44.59 C ATOM 87 CD GLU A 14 109.289 34.287 113.626 1.00 63.40 C ATOM 88 OE1 GLU A 14 108.702 34.608 112.564 1.00 58.11 O ATOM 89 OE2 GLU A 14 110.534 34.287 113.747 1.00 70.03 O ATOM 90 H GLU A 14 105.924 32.099 115.387 1.00 0.00 H ATOM 91 N ILE A 15 103.838 34.613 115.373 1.00 29.51 N ATOM 92 CA ILE A 15 102.637 35.427 115.302 1.00 29.23 C ATOM 93 C ILE A 15 101.979 35.531 116.677 1.00 27.80 C ATOM 94 O ILE A 15 101.520 36.601 117.085 1.00 26.90 O ATOM 95 CB ILE A 15 101.669 34.866 114.247 1.00 27.78 C ATOM 96 CG1 ILE A 15 102.352 34.805 112.875 1.00 29.02 C ATOM 97 CG2 ILE A 15 100.397 35.704 114.185 1.00 28.28 C ATOM 98 CD1 ILE A 15 102.668 36.151 112.268 1.00 29.49 C ATOM 99 H ILE A 15 103.834 33.652 114.976 1.00 0.00 H ATOM 100 N SER A 16 101.929 34.413 117.400 1.00 28.45 N ATOM 101 CA SER A 16 101.475 34.460 118.784 1.00 29.67 C ATOM 102 C SER A 16 102.279 35.490 119.574 1.00 32.16 C ATOM 103 O SER A 16 101.711 36.278 120.342 1.00 27.99 O ATOM 104 CB SER A 16 101.599 33.067 119.412 1.00 37.12 C ATOM 105 OG SER A 16 101.141 33.088 120.747 1.00 52.92 O ATOM 106 HG SER A 16 101.684 33.729 121.271 1.00 0.00 H ATOM 107 H SER A 16 102.214 33.507 116.977 1.00 0.00 H ATOM 108 N GLN A 17 103.601 35.517 119.368 1.00 30.12 N ATOM 109 CA GLN A 17 104.435 36.476 120.087 1.00 31.37 C ATOM 110 C GLN A 17 104.097 37.906 119.683 1.00 30.75 C ATOM 111 O GLN A 17 104.020 38.798 120.540 1.00 28.13 O ATOM 112 CB GLN A 17 105.910 36.173 119.826 1.00 32.02 C ATOM 113 CG GLN A 17 106.872 37.033 120.611 1.00 32.04 C ATOM 114 CD GLN A 17 108.314 36.652 120.354 1.00 33.45 C ATOM 115 OE1 GLN A 17 108.594 35.580 119.815 1.00 35.51 O ATOM 116 NE2 GLN A 17 109.239 37.529 120.728 1.00 31.71 N ATOM 117 HE22 GLN A 17 108.956 38.422 121.180 1.00 0.00 H ATOM 118 HE21 GLN A 17 110.246 37.323 120.569 1.00 0.00 H ATOM 119 H GLN A 17 104.035 34.854 118.695 1.00 0.00 H ATOM 120 N LEU A 18 103.901 38.145 118.385 1.00 29.75 N ATOM 121 CA LEU A 18 103.551 39.478 117.910 1.00 29.07 C ATOM 122 C LEU A 18 102.208 39.928 118.472 1.00 29.39 C ATOM 123 O LEU A 18 102.063 41.074 118.927 1.00 25.82 O ATOM 124 CB LEU A 18 103.541 39.476 116.384 1.00 29.40 C ATOM 125 CG LEU A 18 103.059 40.753 115.696 1.00 29.70 C ATOM 126 CD1 LEU A 18 103.971 41.923 116.020 1.00 29.83 C ATOM 127 CD2 LEU A 18 102.941 40.535 114.184 1.00 32.78 C ATOM 128 H LEU A 18 104.000 37.368 117.701 1.00 0.00 H ATOM 129 N MET A 19 101.215 39.035 118.470 1.00 24.18 N ATOM 130 CA MET A 19 99.899 39.408 118.974 1.00 26.16 C ATOM 131 C MET A 19 99.969 39.828 120.436 1.00 29.06 C ATOM 132 O MET A 19 99.333 40.809 120.841 1.00 28.06 O ATOM 133 CB MET A 19 98.923 38.255 118.793 1.00 28.28 C ATOM 134 CG MET A 19 98.472 38.126 117.357 1.00 28.28 C ATOM 135 SD MET A 19 97.435 36.693 117.038 1.00 30.25 S ATOM 136 CE MET A 19 96.169 36.883 118.260 1.00 36.43 C ATOM 137 H MET A 19 101.381 38.074 118.109 1.00 0.00 H ATOM 138 N SER A 20 100.727 39.090 121.248 1.00 28.71 N ATOM 139 CA SER A 20 100.842 39.444 122.659 1.00 29.40 C ATOM 140 C SER A 20 101.461 40.826 122.817 1.00 29.73 C ATOM 141 O SER A 20 100.993 41.649 123.613 1.00 33.46 O ATOM 142 CB SER A 20 101.674 38.396 123.394 1.00 33.09 C ATOM 143 OG SER A 20 101.069 37.120 123.331 1.00 40.45 O ATOM 144 HG SER A 20 100.981 36.844 122.384 1.00 0.00 H ATOM 145 H SER A 20 101.236 38.263 120.876 1.00 0.00 H ATOM 146 N LEU A 21 102.526 41.092 122.064 1.00 31.01 N ATOM 147 CA LEU A 21 103.166 42.401 122.087 1.00 30.67 C ATOM 148 C LEU A 21 102.175 43.503 121.734 1.00 34.45 C ATOM 149 O LEU A 21 102.086 44.524 122.426 1.00 31.70 O ATOM 150 CB LEU A 21 104.332 42.395 121.106 1.00 31.11 C ATOM 151 CG LEU A 21 105.664 43.068 121.374 1.00 38.39 C ATOM 152 CD1 LEU A 21 106.145 42.871 122.793 1.00 41.29 C ATOM 153 CD2 LEU A 21 106.669 42.479 120.398 1.00 39.52 C ATOM 154 H LEU A 21 102.910 40.349 121.446 1.00 0.00 H ATOM 155 N ILE A 22 101.412 43.306 120.655 1.00 29.58 N ATOM 156 CA ILE A 22 100.531 44.363 120.180 1.00 28.41 C ATOM 157 C ILE A 22 99.351 44.569 121.121 1.00 31.15 C ATOM 158 O ILE A 22 98.924 45.710 121.345 1.00 30.54 O ATOM 159 CB ILE A 22 100.045 44.052 118.757 1.00 24.12 C ATOM 160 CG1 ILE A 22 101.227 44.056 117.800 1.00 24.20 C ATOM 161 CG2 ILE A 22 99.003 45.085 118.327 1.00 24.67 C ATOM 162 CD1 ILE A 22 100.867 43.599 116.400 1.00 32.45 C ATOM 163 H ILE A 22 101.448 42.396 120.153 1.00 0.00 H ATOM 164 N ILE A 23 98.757 43.484 121.634 1.00 29.20 N ATOM 165 CA ILE A 23 97.536 43.675 122.407 1.00 32.30 C ATOM 166 C ILE A 23 97.835 44.379 123.723 1.00 34.47 C ATOM 167 O ILE A 23 96.937 45.015 124.287 1.00 34.72 O ATOM 168 CB ILE A 23 96.785 42.347 122.658 1.00 33.02 C ATOM 169 CG1 ILE A 23 95.277 42.623 122.783 1.00 32.18 C ATOM 170 CG2 ILE A 23 97.296 41.667 123.921 1.00 33.31 C ATOM 171 CD1 ILE A 23 94.419 41.389 122.978 1.00 32.80 C ATOM 172 H ILE A 23 99.155 42.535 121.486 1.00 0.00 H ATOM 173 N ASN A 24 99.072 44.305 124.206 1.00 34.63 N ATOM 174 CA ASN A 24 99.457 44.895 125.479 1.00 38.52 C ATOM 175 C ASN A 24 100.195 46.226 125.351 1.00 43.77 C ATOM 176 O ASN A 24 100.391 46.899 126.369 1.00 41.86 O ATOM 177 CB ASN A 24 100.328 43.899 126.265 1.00 37.88 C ATOM 178 CG ASN A 24 99.548 42.672 126.711 1.00 36.29 C ATOM 179 OD1 ASN A 24 99.902 41.531 126.387 1.00 40.69 O ATOM 180 ND2 ASN A 24 98.462 42.902 127.427 1.00 40.59 N ATOM 181 HD22 ASN A 24 98.201 43.877 127.677 1.00 0.00 H ATOM 182 HD21 ASN A 24 97.868 42.108 127.740 1.00 0.00 H ATOM 183 H ASN A 24 99.795 43.804 123.650 1.00 0.00 H ATOM 184 N THR A 25 100.590 46.643 124.148 1.00 39.59 N ATOM 185 CA THR A 25 101.395 47.855 124.032 1.00 37.38 C ATOM 186 C THR A 25 100.579 49.087 124.399 1.00 38.20 C ATOM 187 O THR A 25 99.377 49.169 124.118 1.00 32.68 O ATOM 188 CB THR A 25 101.949 48.026 122.619 1.00 36.35 C ATOM 189 OG1 THR A 25 102.754 49.208 122.569 1.00 34.68 O ATOM 190 CG2 THR A 25 100.831 48.183 121.609 1.00 31.94 C ATOM 191 HG1 THR A 25 103.502 49.124 123.212 1.00 0.00 H ATOM 192 H THR A 25 100.326 46.107 123.296 1.00 0.00 H ATOM 193 N VAL A 26 101.246 50.055 125.023 1.00 35.12 N ATOM 194 CA VAL A 26 100.623 51.327 125.357 1.00 38.15 C ATOM 195 C VAL A 26 100.971 52.400 124.324 1.00 38.41 C ATOM 196 O VAL A 26 100.797 53.589 124.582 1.00 35.68 O ATOM 197 CB VAL A 26 100.981 51.777 126.782 1.00 37.00 C ATOM 198 CG1 VAL A 26 100.422 50.787 127.791 1.00 35.78 C ATOM 199 CG2 VAL A 26 102.489 51.939 126.950 1.00 31.41 C ATOM 200 H VAL A 26 102.242 49.898 125.279 1.00 0.00 H ATOM 201 N TYR A 27 101.449 51.986 123.150 1.00 34.87 N ATOM 202 CA TYR A 27 101.656 52.886 122.020 1.00 34.72 C ATOM 203 C TYR A 27 100.516 53.886 121.908 1.00 30.95 C ATOM 204 O TYR A 27 99.348 53.534 122.077 1.00 31.91 O ATOM 205 CB TYR A 27 101.761 52.054 120.740 1.00 37.44 C ATOM 206 CG TYR A 27 101.922 52.846 119.467 1.00 35.91 C ATOM 207 CD1 TYR A 27 103.093 53.538 119.205 1.00 36.92 C ATOM 208 CD2 TYR A 27 100.916 52.862 118.508 1.00 35.64 C ATOM 209 CE1 TYR A 27 103.254 54.249 118.036 1.00 37.46 C ATOM 210 CE2 TYR A 27 101.065 53.561 117.338 1.00 33.07 C ATOM 211 CZ TYR A 27 102.240 54.250 117.101 1.00 34.63 C ATOM 212 OH TYR A 27 102.400 54.960 115.937 1.00 33.66 O ATOM 213 HH TYR A 27 103.293 55.388 115.933 1.00 0.00 H ATOM 214 H TYR A 27 101.684 50.979 123.035 1.00 0.00 H ATOM 215 N SER A 28 100.861 55.134 121.591 1.00 30.02 N ATOM 216 CA SER A 28 99.908 56.238 121.696 1.00 35.76 C ATOM 217 C SER A 28 99.032 56.434 120.464 1.00 37.76 C ATOM 218 O SER A 28 97.975 57.065 120.581 1.00 37.83 O ATOM 219 CB SER A 28 100.639 57.564 121.949 1.00 34.61 C ATOM 220 OG SER A 28 101.295 57.562 123.203 1.00 33.75 O ATOM 221 HG SER A 28 100.628 57.428 123.923 1.00 0.00 H ATOM 222 H SER A 28 101.829 55.327 121.262 1.00 0.00 H ATOM 223 N ASN A 29 99.458 55.954 119.295 1.00 29.28 N ATOM 224 CA ASN A 29 98.766 56.269 118.049 1.00 32.90 C ATOM 225 C ASN A 29 98.036 55.036 117.522 1.00 29.44 C ATOM 226 O ASN A 29 98.253 54.594 116.388 1.00 30.29 O ATOM 227 CB ASN A 29 99.757 56.817 117.017 1.00 34.66 C ATOM 228 CG ASN A 29 100.522 58.040 117.529 1.00 35.22 C ATOM 229 OD1 ASN A 29 99.933 58.976 118.075 1.00 33.25 O ATOM 230 ND2 ASN A 29 101.843 58.031 117.356 1.00 33.02 N ATOM 231 HD22 ASN A 29 102.301 57.222 116.890 1.00 0.00 H ATOM 232 HD21 ASN A 29 102.416 58.833 117.687 1.00 0.00 H ATOM 233 H ASN A 29 100.300 55.343 119.271 1.00 0.00 H ATOM 234 N LYS A 30 97.152 54.482 118.352 1.00 27.96 N ATOM 235 CA LYS A 30 96.447 53.253 118.003 1.00 28.33 C ATOM 236 C LYS A 30 95.604 53.388 116.740 1.00 26.67 C ATOM 237 O LYS A 30 95.241 52.363 116.150 1.00 23.29 O ATOM 238 CB LYS A 30 95.543 52.830 119.150 1.00 26.62 C ATOM 239 CG LYS A 30 96.302 52.344 120.392 1.00 29.99 C ATOM 240 CD LYS A 30 95.350 52.168 121.568 1.00 30.68 C ATOM 241 CE LYS A 30 96.080 51.727 122.829 1.00 40.44 C ATOM 242 NZ LYS A 30 96.293 50.280 122.843 1.00 41.98 N ATOM 243 HZ1 LYS A 30 95.374 49.795 122.806 1.00 0.00 H ATOM 244 HZ2 LYS A 30 96.864 50.007 122.018 1.00 0.00 H ATOM 245 HZ3 LYS A 30 96.793 50.013 123.715 1.00 0.00 H ATOM 246 H LYS A 30 96.961 54.936 119.268 1.00 0.00 H ATOM 247 N GLU A 31 95.256 54.613 116.350 1.00 23.77 N ATOM 248 CA GLU A 31 94.357 54.827 115.223 1.00 24.44 C ATOM 249 C GLU A 31 94.932 54.325 113.909 1.00 23.74 C ATOM 250 O GLU A 31 94.179 54.158 112.945 1.00 22.30 O ATOM 251 CB GLU A 31 94.022 56.312 115.090 1.00 26.58 C ATOM 252 CG GLU A 31 95.193 57.186 114.624 1.00 28.00 C ATOM 253 CD GLU A 31 94.903 58.679 114.745 1.00 35.88 C ATOM 254 OE1 GLU A 31 94.525 59.127 115.849 1.00 32.01 O ATOM 255 OE2 GLU A 31 95.046 59.403 113.734 1.00 36.98 O ATOM 256 H GLU A 31 95.634 55.436 116.861 1.00 0.00 H ATOM 257 N ILE A 32 96.241 54.074 113.825 1.00 22.95 N ATOM 258 CA ILE A 32 96.766 53.552 112.570 1.00 23.96 C ATOM 259 C ILE A 32 96.254 52.156 112.245 1.00 23.14 C ATOM 260 O ILE A 32 96.448 51.691 111.113 1.00 22.44 O ATOM 261 CB ILE A 32 98.311 53.569 112.562 1.00 27.14 C ATOM 262 CG1 ILE A 32 98.870 52.696 113.683 1.00 24.97 C ATOM 263 CG2 ILE A 32 98.808 55.011 112.665 1.00 29.51 C ATOM 264 CD1 ILE A 32 99.145 51.278 113.264 1.00 29.24 C ATOM 265 H ILE A 32 96.870 54.247 114.635 1.00 0.00 H ATOM 266 N PHE A 33 95.571 51.476 113.173 1.00 20.51 N ATOM 267 CA PHE A 33 94.980 50.189 112.816 1.00 20.64 C ATOM 268 C PHE A 33 94.060 50.347 111.612 1.00 20.84 C ATOM 269 O PHE A 33 94.020 49.482 110.724 1.00 20.04 O ATOM 270 CB PHE A 33 94.196 49.590 113.992 1.00 19.04 C ATOM 271 CG PHE A 33 92.798 50.129 114.116 1.00 19.70 C ATOM 272 CD1 PHE A 33 91.736 49.457 113.530 1.00 20.81 C ATOM 273 CD2 PHE A 33 92.546 51.317 114.801 1.00 23.60 C ATOM 274 CE1 PHE A 33 90.458 49.954 113.615 1.00 19.78 C ATOM 275 CE2 PHE A 33 91.258 51.823 114.898 1.00 21.64 C ATOM 276 CZ PHE A 33 90.205 51.133 114.280 1.00 20.10 C ATOM 277 H PHE A 33 95.463 51.858 114.134 1.00 0.00 H ATOM 278 N LEU A 34 93.322 51.453 111.556 1.00 19.50 N ATOM 279 CA LEU A 34 92.319 51.599 110.508 1.00 20.46 C ATOM 280 C LEU A 34 92.987 51.798 109.156 1.00 21.70 C ATOM 281 O LEU A 34 92.544 51.238 108.146 1.00 19.36 O ATOM 282 CB LEU A 34 91.363 52.744 110.842 1.00 21.05 C ATOM 283 CG LEU A 34 90.166 52.906 109.896 1.00 20.38 C ATOM 284 CD1 LEU A 34 89.308 51.652 109.854 1.00 22.98 C ATOM 285 CD2 LEU A 34 89.368 54.102 110.316 1.00 22.33 C ATOM 286 H LEU A 34 93.460 52.209 112.256 1.00 0.00 H ATOM 287 N ARG A 35 94.098 52.530 109.134 1.00 21.02 N ATOM 288 CA ARG A 35 94.884 52.655 107.913 1.00 22.13 C ATOM 289 C ARG A 35 95.326 51.289 107.409 1.00 21.43 C ATOM 290 O ARG A 35 95.249 50.998 106.208 1.00 19.85 O ATOM 291 CB ARG A 35 96.095 53.546 108.172 1.00 25.03 C ATOM 292 CG ARG A 35 96.967 53.782 106.954 1.00 26.01 C ATOM 293 CD ARG A 35 98.335 54.337 107.366 1.00 32.38 C ATOM 294 NE ARG A 35 99.123 53.302 108.030 1.00 32.81 N ATOM 295 CZ ARG A 35 100.132 53.516 108.867 1.00 32.70 C ATOM 296 NH1 ARG A 35 100.509 54.749 109.168 1.00 31.55 N ATOM 297 NH2 ARG A 35 100.752 52.472 109.415 1.00 30.99 N ATOM 298 HE ARG A 35 98.873 52.313 107.830 1.00 0.00 H ATOM 299 HH12 ARG A 35 101.300 54.905 109.825 1.00 0.00 H ATOM 300 HH11 ARG A 35 100.014 55.561 108.748 1.00 0.00 H ATOM 301 HH22 ARG A 35 101.544 52.624 110.072 1.00 0.00 H ATOM 302 HH21 ARG A 35 100.444 51.505 109.186 1.00 0.00 H ATOM 303 H ARG A 35 94.409 53.018 109.998 1.00 0.00 H ATOM 304 N GLU A 36 95.804 50.430 108.312 1.00 21.81 N ATOM 305 CA GLU A 36 96.297 49.128 107.887 1.00 22.08 C ATOM 306 C GLU A 36 95.171 48.265 107.340 1.00 20.76 C ATOM 307 O GLU A 36 95.368 47.503 106.391 1.00 20.02 O ATOM 308 CB GLU A 36 96.977 48.397 109.039 1.00 21.54 C ATOM 309 CG GLU A 36 98.309 48.970 109.442 1.00 24.74 C ATOM 310 CD GLU A 36 99.316 48.951 108.306 1.00 27.70 C ATOM 311 OE1 GLU A 36 99.347 47.970 107.515 1.00 27.44 O ATOM 312 OE2 GLU A 36 100.054 49.942 108.202 1.00 32.78 O ATOM 313 H GLU A 36 95.824 50.691 109.319 1.00 0.00 H ATOM 314 N LEU A 37 93.985 48.333 107.955 1.00 20.05 N ATOM 315 CA LEU A 37 92.906 47.477 107.486 1.00 17.44 C ATOM 316 C LEU A 37 92.316 48.012 106.186 1.00 18.46 C ATOM 317 O LEU A 37 91.941 47.222 105.316 1.00 19.72 O ATOM 318 CB LEU A 37 91.836 47.326 108.563 1.00 17.33 C ATOM 319 CG LEU A 37 92.366 46.788 109.894 1.00 17.81 C ATOM 320 CD1 LEU A 37 91.213 46.586 110.891 1.00 19.69 C ATOM 321 CD2 LEU A 37 93.148 45.486 109.678 1.00 20.16 C ATOM 322 H LEU A 37 93.837 48.984 108.752 1.00 0.00 H ATOM 323 N ILE A 38 92.270 49.336 106.018 1.00 19.36 N ATOM 324 CA ILE A 38 91.846 49.903 104.744 1.00 20.08 C ATOM 325 C ILE A 38 92.856 49.551 103.655 1.00 18.80 C ATOM 326 O ILE A 38 92.480 49.255 102.513 1.00 18.04 O ATOM 327 CB ILE A 38 91.627 51.428 104.892 1.00 20.50 C ATOM 328 CG1 ILE A 38 90.364 51.684 105.731 1.00 20.66 C ATOM 329 CG2 ILE A 38 91.553 52.139 103.529 1.00 20.03 C ATOM 330 CD1 ILE A 38 90.077 53.162 106.042 1.00 19.27 C ATOM 331 H ILE A 38 92.538 49.966 106.801 1.00 0.00 H ATOM 332 N SER A 39 94.144 49.527 103.996 1.00 20.57 N ATOM 333 CA SER A 39 95.159 49.130 103.021 1.00 22.07 C ATOM 334 C SER A 39 94.976 47.679 102.585 1.00 20.17 C ATOM 335 O SER A 39 95.102 47.364 101.396 1.00 22.28 O ATOM 336 CB SER A 39 96.558 49.347 103.597 1.00 23.25 C ATOM 337 OG SER A 39 96.816 50.722 103.687 1.00 22.07 O ATOM 338 HG SER A 39 96.145 51.144 104.279 1.00 0.00 H ATOM 339 H SER A 39 94.429 49.792 104.961 1.00 0.00 H ATOM 340 N ASN A 40 94.670 46.789 103.531 1.00 19.13 N ATOM 341 CA ASN A 40 94.427 45.400 103.160 1.00 19.14 C ATOM 342 C ASN A 40 93.203 45.284 102.262 1.00 20.23 C ATOM 343 O ASN A 40 93.175 44.467 101.336 1.00 19.92 O ATOM 344 CB ASN A 40 94.244 44.548 104.405 1.00 19.87 C ATOM 345 CG ASN A 40 95.542 44.330 105.131 1.00 23.01 C ATOM 346 OD1 ASN A 40 96.592 44.504 104.547 1.00 22.97 O ATOM 347 ND2 ASN A 40 95.474 43.930 106.383 1.00 21.60 N ATOM 348 HD22 ASN A 40 94.548 43.796 106.837 1.00 0.00 H ATOM 349 HD21 ASN A 40 96.347 43.748 106.919 1.00 0.00 H ATOM 350 H ASN A 40 94.605 47.084 104.526 1.00 0.00 H ATOM 351 N ALA A 41 92.172 46.082 102.547 1.00 17.14 N ATOM 352 CA ALA A 41 90.964 46.081 101.734 1.00 17.76 C ATOM 353 C ALA A 41 91.275 46.543 100.325 1.00 18.90 C ATOM 354 O ALA A 41 90.845 45.932 99.324 1.00 16.87 O ATOM 355 CB ALA A 41 89.926 47.001 102.378 1.00 18.45 C ATOM 356 H ALA A 41 92.233 46.718 103.367 1.00 0.00 H ATOM 357 N SER A 42 92.036 47.633 100.231 1.00 18.17 N ATOM 358 CA SER A 42 92.437 48.162 98.937 1.00 17.82 C ATOM 359 C SER A 42 93.253 47.139 98.158 1.00 19.13 C ATOM 360 O SER A 42 93.026 46.934 96.961 1.00 20.58 O ATOM 361 CB SER A 42 93.226 49.450 99.144 1.00 18.62 C ATOM 362 OG SER A 42 93.634 50.022 97.902 1.00 19.98 O ATOM 363 HG SER A 42 94.208 49.378 97.416 1.00 0.00 H ATOM 364 H SER A 42 92.349 48.114 101.098 1.00 0.00 H ATOM 365 N ASP A 43 94.216 46.494 98.825 1.00 18.52 N ATOM 366 CA ASP A 43 95.015 45.462 98.159 1.00 18.75 C ATOM 367 C ASP A 43 94.136 44.336 97.624 1.00 21.32 C ATOM 368 O ASP A 43 94.358 43.838 96.515 1.00 18.30 O ATOM 369 CB ASP A 43 96.052 44.871 99.119 1.00 21.48 C ATOM 370 CG ASP A 43 97.136 45.850 99.528 1.00 22.24 C ATOM 371 OD1 ASP A 43 97.324 46.917 98.906 1.00 23.01 O ATOM 372 OD2 ASP A 43 97.837 45.513 100.507 1.00 23.98 O ATOM 373 H ASP A 43 94.399 46.726 99.822 1.00 0.00 H ATOM 374 N ALA A 44 93.134 43.915 98.398 1.00 17.46 N ATOM 375 CA ALA A 44 92.256 42.841 97.956 1.00 18.45 C ATOM 376 C ALA A 44 91.395 43.281 96.782 1.00 17.10 C ATOM 377 O ALA A 44 91.129 42.481 95.873 1.00 16.97 O ATOM 378 CB ALA A 44 91.394 42.356 99.135 1.00 19.12 C ATOM 379 H ALA A 44 92.979 44.358 99.326 1.00 0.00 H ATOM 380 N LEU A 45 90.984 44.553 96.768 1.00 17.37 N ATOM 381 CA LEU A 45 90.261 45.096 95.627 1.00 17.20 C ATOM 382 C LEU A 45 91.165 45.166 94.395 1.00 17.60 C ATOM 383 O LEU A 45 90.723 44.857 93.284 1.00 17.86 O ATOM 384 CB LEU A 45 89.692 46.464 95.983 1.00 17.34 C ATOM 385 CG LEU A 45 88.519 46.356 96.960 1.00 17.75 C ATOM 386 CD1 LEU A 45 88.323 47.638 97.714 1.00 18.12 C ATOM 387 CD2 LEU A 45 87.253 46.012 96.196 1.00 17.73 C ATOM 388 H LEU A 45 91.184 45.164 97.585 1.00 0.00 H ATOM 389 N ASP A 46 92.438 45.542 94.579 1.00 18.49 N ATOM 390 CA ASP A 46 93.389 45.537 93.465 1.00 19.45 C ATOM 391 C ASP A 46 93.462 44.154 92.825 1.00 21.15 C ATOM 392 O ASP A 46 93.533 44.027 91.595 1.00 21.42 O ATOM 393 CB ASP A 46 94.782 45.957 93.945 1.00 19.46 C ATOM 394 CG ASP A 46 94.902 47.436 94.278 1.00 19.13 C ATOM 395 OD1 ASP A 46 94.023 48.261 93.932 1.00 20.32 O ATOM 396 OD2 ASP A 46 95.953 47.774 94.873 1.00 21.88 O ATOM 397 H ASP A 46 92.754 45.841 95.524 1.00 0.00 H ATOM 398 N LYS A 47 93.438 43.100 93.646 1.00 18.34 N ATOM 399 CA LYS A 47 93.597 41.747 93.121 1.00 19.89 C ATOM 400 C LYS A 47 92.384 41.288 92.310 1.00 20.10 C ATOM 401 O LYS A 47 92.542 40.681 91.244 1.00 19.79 O ATOM 402 CB LYS A 47 93.881 40.776 94.261 1.00 20.30 C ATOM 403 CG LYS A 47 95.261 40.950 94.914 1.00 23.00 C ATOM 404 CD LYS A 47 95.463 39.863 95.953 1.00 23.90 C ATOM 405 CE LYS A 47 96.816 39.971 96.653 1.00 29.89 C ATOM 406 NZ LYS A 47 96.958 41.241 97.359 1.00 32.99 N ATOM 407 HZ1 LYS A 47 96.876 42.025 96.680 1.00 0.00 H ATOM 408 HZ2 LYS A 47 96.210 41.323 98.077 1.00 0.00 H ATOM 409 HZ3 LYS A 47 97.889 41.277 97.821 1.00 0.00 H ATOM 410 H LYS A 47 93.305 43.245 94.667 1.00 0.00 H ATOM 411 N ILE A 48 91.161 41.534 92.792 1.00 19.82 N ATOM 412 CA ILE A 48 90.011 41.178 91.962 1.00 18.15 C ATOM 413 C ILE A 48 89.935 42.072 90.734 1.00 21.66 C ATOM 414 O ILE A 48 89.579 41.600 89.647 1.00 20.47 O ATOM 415 CB ILE A 48 88.682 41.194 92.754 1.00 17.79 C ATOM 416 CG1 ILE A 48 87.578 40.512 91.936 1.00 20.81 C ATOM 417 CG2 ILE A 48 88.243 42.594 93.150 1.00 19.53 C ATOM 418 CD1 ILE A 48 87.795 39.025 91.727 1.00 25.11 C ATOM 419 H ILE A 48 91.032 41.966 93.729 1.00 0.00 H ATOM 420 N ARG A 49 90.312 43.348 90.850 1.00 20.99 N ATOM 421 CA ARG A 49 90.345 44.196 89.662 1.00 23.73 C ATOM 422 C ARG A 49 91.340 43.652 88.639 1.00 23.85 C ATOM 423 O ARG A 49 91.050 43.595 87.428 1.00 25.05 O ATOM 424 CB ARG A 49 90.676 45.633 90.062 1.00 25.26 C ATOM 425 CG ARG A 49 90.675 46.613 88.935 1.00 31.48 C ATOM 426 CD ARG A 49 90.453 48.027 89.488 1.00 34.16 C ATOM 427 NE ARG A 49 91.550 48.444 90.357 1.00 36.79 N ATOM 428 CZ ARG A 49 92.760 48.750 89.914 1.00 35.43 C ATOM 429 NH1 ARG A 49 93.004 48.673 88.613 1.00 41.82 N ATOM 430 NH2 ARG A 49 93.721 49.132 90.758 1.00 33.85 N ATOM 431 HE ARG A 49 91.371 48.504 91.380 1.00 0.00 H ATOM 432 HH12 ARG A 49 93.948 48.909 88.246 1.00 0.00 H ATOM 433 HH11 ARG A 49 92.251 48.376 87.959 1.00 0.00 H ATOM 434 HH22 ARG A 49 94.667 49.369 90.396 1.00 0.00 H ATOM 435 HH21 ARG A 49 93.524 49.192 91.777 1.00 0.00 H ATOM 436 H ARG A 49 90.580 43.734 91.778 1.00 0.00 H ATOM 437 N TYR A 50 92.506 43.221 89.111 1.00 21.86 N ATOM 438 CA TYR A 50 93.487 42.594 88.233 1.00 25.00 C ATOM 439 C TYR A 50 92.890 41.388 87.518 1.00 25.53 C ATOM 440 O TYR A 50 92.996 41.258 86.289 1.00 24.28 O ATOM 441 CB TYR A 50 94.706 42.190 89.055 1.00 25.13 C ATOM 442 CG TYR A 50 95.852 41.666 88.225 1.00 27.54 C ATOM 443 CD1 TYR A 50 96.876 42.512 87.829 1.00 31.00 C ATOM 444 CD2 TYR A 50 95.912 40.333 87.840 1.00 30.32 C ATOM 445 CE1 TYR A 50 97.930 42.043 87.063 1.00 33.92 C ATOM 446 CE2 TYR A 50 96.968 39.860 87.067 1.00 33.48 C ATOM 447 CZ TYR A 50 97.970 40.721 86.693 1.00 35.79 C ATOM 448 OH TYR A 50 99.023 40.261 85.930 1.00 38.78 O ATOM 449 HH TYR A 50 99.650 41.006 85.752 1.00 0.00 H ATOM 450 H TYR A 50 92.722 43.333 90.122 1.00 0.00 H ATOM 451 N GLN A 51 92.241 40.493 88.270 1.00 22.12 N ATOM 452 CA GLN A 51 91.641 39.322 87.639 1.00 24.06 C ATOM 453 C GLN A 51 90.571 39.735 86.651 1.00 27.59 C ATOM 454 O GLN A 51 90.442 39.138 85.578 1.00 27.10 O ATOM 455 CB GLN A 51 91.041 38.376 88.679 1.00 25.13 C ATOM 456 CG GLN A 51 92.082 37.652 89.503 1.00 24.21 C ATOM 457 CD GLN A 51 91.561 36.381 90.166 1.00 25.09 C ATOM 458 OE1 GLN A 51 90.377 36.064 90.100 1.00 27.84 O ATOM 459 NE2 GLN A 51 92.452 35.646 90.788 1.00 27.86 N ATOM 460 HE22 GLN A 51 93.446 35.950 90.821 1.00 0.00 H ATOM 461 HE21 GLN A 51 92.164 34.759 91.248 1.00 0.00 H ATOM 462 H GLN A 51 92.164 40.631 89.298 1.00 0.00 H ATOM 463 N ALA A 52 89.784 40.751 87.008 1.00 23.58 N ATOM 464 CA ALA A 52 88.651 41.159 86.202 1.00 25.62 C ATOM 465 C ALA A 52 89.083 41.835 84.915 1.00 29.62 C ATOM 466 O ALA A 52 88.291 41.906 83.966 1.00 30.12 O ATOM 467 CB ALA A 52 87.757 42.110 86.996 1.00 26.37 C ATOM 468 H ALA A 52 89.989 41.264 87.889 1.00 0.00 H ATOM 469 N LEU A 53 90.310 42.348 84.859 1.00 26.95 N ATOM 470 CA LEU A 53 90.754 42.974 83.621 1.00 33.70 C ATOM 471 C LEU A 53 90.831 41.939 82.509 1.00 33.63 C ATOM 472 O LEU A 53 90.472 42.222 81.362 1.00 36.35 O ATOM 473 CB LEU A 53 92.100 43.663 83.820 1.00 34.66 C ATOM 474 CG LEU A 53 92.573 44.545 82.660 1.00 41.46 C ATOM 475 CD1 LEU A 53 91.608 45.704 82.417 1.00 43.17 C ATOM 476 CD2 LEU A 53 93.970 45.066 82.949 1.00 49.88 C ATOM 477 H LEU A 53 90.941 42.303 85.685 1.00 0.00 H ATOM 478 N SER A 54 91.280 40.730 82.837 1.00 31.67 N ATOM 479 CA SER A 54 91.317 39.649 81.862 1.00 35.64 C ATOM 480 C SER A 54 89.999 38.889 81.805 1.00 37.72 C ATOM 481 O SER A 54 89.568 38.500 80.716 1.00 38.77 O ATOM 482 CB SER A 54 92.464 38.683 82.174 1.00 34.97 C ATOM 483 OG SER A 54 92.254 37.977 83.379 1.00 37.05 O ATOM 484 HG SER A 54 92.180 38.620 84.128 1.00 0.00 H ATOM 485 H SER A 54 91.610 40.554 83.807 1.00 0.00 H ATOM 486 N ASP A 55 89.338 38.682 82.945 1.00 31.03 N ATOM 487 CA ASP A 55 88.094 37.920 82.988 1.00 29.84 C ATOM 488 C ASP A 55 87.038 38.723 83.733 1.00 29.91 C ATOM 489 O ASP A 55 86.869 38.566 84.952 1.00 25.19 O ATOM 490 CB ASP A 55 88.300 36.563 83.653 1.00 30.53 C ATOM 491 CG ASP A 55 87.017 35.756 83.714 1.00 26.96 C ATOM 492 OD1 ASP A 55 86.003 36.223 83.164 1.00 27.36 O ATOM 493 OD2 ASP A 55 87.026 34.656 84.309 1.00 32.01 O ATOM 494 H ASP A 55 89.720 39.075 83.829 1.00 0.00 H ATOM 495 N PRO A 56 86.294 39.572 83.028 1.00 29.42 N ATOM 496 CA PRO A 56 85.289 40.404 83.707 1.00 29.53 C ATOM 497 C PRO A 56 84.238 39.614 84.468 1.00 27.77 C ATOM 498 O PRO A 56 83.631 40.163 85.396 1.00 29.08 O ATOM 499 CB PRO A 56 84.661 41.203 82.559 1.00 34.35 C ATOM 500 CG PRO A 56 85.736 41.243 81.500 1.00 35.98 C ATOM 501 CD PRO A 56 86.429 39.918 81.600 1.00 32.69 C ATOM 502 N SER A 57 83.991 38.353 84.126 1.00 28.48 N ATOM 503 CA SER A 57 82.958 37.620 84.852 1.00 27.37 C ATOM 504 C SER A 57 83.327 37.431 86.322 1.00 26.44 C ATOM 505 O SER A 57 82.452 37.105 87.130 1.00 25.70 O ATOM 506 CB SER A 57 82.694 36.261 84.200 1.00 26.75 C ATOM 507 OG SER A 57 83.701 35.320 84.492 1.00 27.63 O ATOM 508 HG SER A 57 84.571 35.655 84.159 1.00 0.00 H ATOM 509 H SER A 57 84.523 37.898 83.357 1.00 0.00 H ATOM 510 N GLN A 58 84.596 37.631 86.686 1.00 23.80 N ATOM 511 CA GLN A 58 84.983 37.449 88.087 1.00 24.99 C ATOM 512 C GLN A 58 84.309 38.458 89.001 1.00 22.78 C ATOM 513 O GLN A 58 84.252 38.228 90.216 1.00 22.66 O ATOM 514 CB GLN A 58 86.500 37.567 88.265 1.00 24.56 C ATOM 515 CG GLN A 58 87.313 36.438 87.644 1.00 25.83 C ATOM 516 CD GLN A 58 86.838 35.072 88.059 1.00 30.47 C ATOM 517 OE1 GLN A 58 86.642 34.784 89.246 1.00 25.37 O ATOM 518 NE2 GLN A 58 86.623 34.216 87.070 1.00 30.53 N ATOM 519 HE22 GLN A 58 86.802 34.502 86.086 1.00 0.00 H ATOM 520 HE21 GLN A 58 86.275 33.258 87.278 1.00 0.00 H ATOM 521 H GLN A 58 85.305 37.914 85.980 1.00 0.00 H ATOM 522 N LEU A 59 83.792 39.559 88.456 1.00 23.81 N ATOM 523 CA LEU A 59 83.088 40.565 89.239 1.00 24.62 C ATOM 524 C LEU A 59 81.620 40.248 89.458 1.00 26.23 C ATOM 525 O LEU A 59 80.982 40.896 90.299 1.00 25.78 O ATOM 526 CB LEU A 59 83.192 41.938 88.554 1.00 23.52 C ATOM 527 CG LEU A 59 84.556 42.598 88.512 1.00 25.75 C ATOM 528 CD1 LEU A 59 84.459 43.916 87.757 1.00 30.09 C ATOM 529 CD2 LEU A 59 85.072 42.797 89.937 1.00 27.97 C ATOM 530 H LEU A 59 83.895 39.705 87.432 1.00 0.00 H ATOM 531 N GLU A 60 81.055 39.269 88.746 1.00 24.31 N ATOM 532 CA GLU A 60 79.607 39.075 88.806 1.00 26.68 C ATOM 533 C GLU A 60 79.125 38.724 90.209 1.00 28.18 C ATOM 534 O GLU A 60 77.964 38.994 90.543 1.00 25.79 O ATOM 535 CB GLU A 60 79.190 37.996 87.809 1.00 30.82 C ATOM 536 CG GLU A 60 79.452 38.446 86.398 1.00 33.18 C ATOM 537 CD GLU A 60 79.129 37.396 85.350 1.00 36.10 C ATOM 538 OE1 GLU A 60 78.606 36.313 85.695 1.00 34.00 O ATOM 539 OE2 GLU A 60 79.418 37.668 84.167 1.00 40.12 O ATOM 540 H GLU A 60 81.642 38.648 88.152 1.00 0.00 H ATOM 541 N SER A 61 79.995 38.154 91.040 1.00 25.08 N ATOM 542 CA SER A 61 79.630 37.811 92.411 1.00 23.20 C ATOM 543 C SER A 61 79.357 39.039 93.270 1.00 22.84 C ATOM 544 O SER A 61 78.687 38.921 94.308 1.00 22.25 O ATOM 545 CB SER A 61 80.747 36.978 93.042 1.00 24.53 C ATOM 546 OG SER A 61 82.019 37.562 92.793 1.00 21.09 O ATOM 547 HG SER A 61 82.724 37.006 93.210 1.00 0.00 H ATOM 548 H SER A 61 80.958 37.948 90.704 1.00 0.00 H ATOM 549 N GLU A 62 79.863 40.194 92.866 1.00 21.62 N ATOM 550 CA GLU A 62 79.607 41.490 93.477 1.00 23.19 C ATOM 551 C GLU A 62 80.177 42.545 92.542 1.00 23.67 C ATOM 552 O GLU A 62 81.383 42.822 92.576 1.00 21.53 O ATOM 553 CB GLU A 62 80.238 41.607 94.862 1.00 21.92 C ATOM 554 CG GLU A 62 80.144 43.033 95.450 1.00 22.33 C ATOM 555 CD GLU A 62 78.752 43.642 95.327 1.00 28.61 C ATOM 556 OE1 GLU A 62 77.888 43.309 96.167 1.00 26.98 O ATOM 557 OE2 GLU A 62 78.525 44.450 94.401 1.00 26.74 O ATOM 558 H GLU A 62 80.497 40.173 92.042 1.00 0.00 H ATOM 559 N PRO A 63 79.345 43.148 91.689 1.00 23.57 N ATOM 560 CA PRO A 63 79.874 44.027 90.643 1.00 22.49 C ATOM 561 C PRO A 63 80.544 45.273 91.156 1.00 23.87 C ATOM 562 O PRO A 63 81.346 45.863 90.423 1.00 25.04 O ATOM 563 CB PRO A 63 78.622 44.385 89.822 1.00 26.62 C ATOM 564 CG PRO A 63 77.676 43.280 90.072 1.00 28.44 C ATOM 565 CD PRO A 63 77.917 42.856 91.500 1.00 26.77 C ATOM 566 N GLU A 64 80.224 45.722 92.368 1.00 22.05 N ATOM 567 CA GLU A 64 80.730 46.993 92.862 1.00 22.13 C ATOM 568 C GLU A 64 81.997 46.775 93.675 1.00 21.70 C ATOM 569 O GLU A 64 82.088 45.814 94.449 1.00 22.85 O ATOM 570 CB GLU A 64 79.703 47.700 93.734 1.00 24.41 C ATOM 571 CG GLU A 64 78.360 47.937 93.046 1.00 29.14 C ATOM 572 CD GLU A 64 78.486 48.778 91.796 1.00 34.46 C ATOM 573 OE1 GLU A 64 79.310 49.718 91.781 1.00 33.35 O ATOM 574 OE2 GLU A 64 77.762 48.487 90.822 1.00 38.35 O ATOM 575 H GLU A 64 79.599 45.152 92.974 1.00 0.00 H ATOM 576 N LEU A 65 82.941 47.700 93.525 1.00 21.98 N ATOM 577 CA LEU A 65 84.225 47.693 94.226 1.00 20.45 C ATOM 578 C LEU A 65 84.205 48.782 95.294 1.00 21.77 C ATOM 579 O LEU A 65 84.217 49.978 94.978 1.00 21.22 O ATOM 580 CB LEU A 65 85.378 47.917 93.252 1.00 20.61 C ATOM 581 CG LEU A 65 85.488 46.874 92.132 1.00 22.22 C ATOM 582 CD1 LEU A 65 86.694 47.170 91.247 1.00 26.73 C ATOM 583 CD2 LEU A 65 85.565 45.476 92.691 1.00 23.30 C ATOM 584 H LEU A 65 82.754 48.481 92.865 1.00 0.00 H ATOM 585 N PHE A 66 84.209 48.376 96.563 1.00 19.70 N ATOM 586 CA PHE A 66 84.024 49.338 97.632 1.00 19.33 C ATOM 587 C PHE A 66 84.680 48.846 98.915 1.00 17.06 C ATOM 588 O PHE A 66 84.970 47.658 99.090 1.00 16.47 O ATOM 589 CB PHE A 66 82.527 49.600 97.896 1.00 21.01 C ATOM 590 CG PHE A 66 81.789 48.381 98.299 1.00 20.19 C ATOM 591 CD1 PHE A 66 81.783 47.989 99.624 1.00 20.30 C ATOM 592 CD2 PHE A 66 81.110 47.614 97.362 1.00 22.32 C ATOM 593 CE1 PHE A 66 81.124 46.846 100.006 1.00 21.73 C ATOM 594 CE2 PHE A 66 80.453 46.467 97.747 1.00 21.73 C ATOM 595 CZ PHE A 66 80.455 46.090 99.056 1.00 20.63 C ATOM 596 H PHE A 66 84.345 47.369 96.787 1.00 0.00 H ATOM 597 N ILE A 67 84.949 49.814 99.790 1.00 17.49 N ATOM 598 CA ILE A 67 85.326 49.596 101.182 1.00 17.63 C ATOM 599 C ILE A 67 84.221 50.230 102.017 1.00 18.27 C ATOM 600 O ILE A 67 83.775 51.334 101.710 1.00 20.25 O ATOM 601 CB ILE A 67 86.692 50.231 101.510 1.00 18.51 C ATOM 602 CG1 ILE A 67 87.777 49.664 100.594 1.00 17.71 C ATOM 603 CG2 ILE A 67 87.072 50.000 102.976 1.00 17.44 C ATOM 604 CD1 ILE A 67 89.129 50.360 100.691 1.00 20.00 C ATOM 605 H ILE A 67 84.886 50.797 99.456 1.00 0.00 H ATOM 606 N ARG A 68 83.768 49.533 103.054 1.00 17.90 N ATOM 607 CA ARG A 68 82.603 49.989 103.805 1.00 16.49 C ATOM 608 C ARG A 68 82.871 49.780 105.290 1.00 19.07 C ATOM 609 O ARG A 68 83.272 48.688 105.707 1.00 19.16 O ATOM 610 CB ARG A 68 81.342 49.244 103.360 1.00 18.86 C ATOM 611 CG ARG A 68 80.062 49.728 104.051 1.00 21.83 C ATOM 612 CD ARG A 68 78.826 49.061 103.470 1.00 23.51 C ATOM 613 NE ARG A 68 78.742 49.292 102.035 1.00 24.83 N ATOM 614 CZ ARG A 68 78.166 48.477 101.161 1.00 25.09 C ATOM 615 NH1 ARG A 68 77.597 47.355 101.558 1.00 28.64 N ATOM 616 NH2 ARG A 68 78.179 48.785 99.873 1.00 27.79 N ATOM 617 HE ARG A 68 79.168 50.166 101.665 1.00 0.00 H ATOM 618 HH12 ARG A 68 77.149 46.725 100.863 1.00 0.00 H ATOM 619 HH11 ARG A 68 77.597 47.101 102.566 1.00 0.00 H ATOM 620 HH22 ARG A 68 77.729 48.151 99.182 1.00 0.00 H ATOM 621 HH21 ARG A 68 78.639 49.661 99.552 1.00 0.00 H ATOM 622 H ARG A 68 84.249 48.654 103.333 1.00 0.00 H ATOM 623 N ILE A 69 82.678 50.837 106.075 1.00 16.73 N ATOM 624 CA ILE A 69 82.936 50.832 107.515 1.00 16.05 C ATOM 625 C ILE A 69 81.588 50.916 108.205 1.00 18.62 C ATOM 626 O ILE A 69 80.830 51.863 107.962 1.00 17.98 O ATOM 627 CB ILE A 69 83.832 52.003 107.935 1.00 19.02 C ATOM 628 CG1 ILE A 69 85.175 51.907 107.228 1.00 21.30 C ATOM 629 CG2 ILE A 69 84.044 51.995 109.419 1.00 19.54 C ATOM 630 CD1 ILE A 69 86.071 53.166 107.350 1.00 20.77 C ATOM 631 H ILE A 69 82.325 51.714 105.641 1.00 0.00 H ATOM 632 N ILE A 70 81.311 49.953 109.078 1.00 17.94 N ATOM 633 CA ILE A 70 79.991 49.784 109.682 1.00 16.70 C ATOM 634 C ILE A 70 80.159 49.684 111.193 1.00 19.39 C ATOM 635 O ILE A 70 80.422 48.607 111.737 1.00 19.60 O ATOM 636 CB ILE A 70 79.253 48.553 109.142 1.00 19.85 C ATOM 637 CG1 ILE A 70 79.283 48.507 107.618 1.00 20.42 C ATOM 638 CG2 ILE A 70 77.808 48.583 109.610 1.00 21.79 C ATOM 639 CD1 ILE A 70 80.178 47.417 107.102 1.00 24.69 C ATOM 640 H ILE A 70 82.067 49.290 109.343 1.00 0.00 H ATOM 641 N PRO A 71 80.022 50.781 111.907 1.00 20.81 N ATOM 642 CA PRO A 71 79.975 50.704 113.366 1.00 21.41 C ATOM 643 C PRO A 71 78.715 49.994 113.832 1.00 24.48 C ATOM 644 O PRO A 71 77.632 50.194 113.282 1.00 24.07 O ATOM 645 CB PRO A 71 79.966 52.169 113.801 1.00 23.83 C ATOM 646 CG PRO A 71 80.130 52.964 112.608 1.00 23.07 C ATOM 647 CD PRO A 71 79.875 52.147 111.402 1.00 22.98 C ATOM 648 N GLN A 72 78.874 49.155 114.850 1.00 22.03 N ATOM 649 CA GLN A 72 77.774 48.424 115.482 1.00 22.71 C ATOM 650 C GLN A 72 77.802 48.811 116.958 1.00 23.30 C ATOM 651 O GLN A 72 78.372 48.112 117.796 1.00 25.11 O ATOM 652 CB GLN A 72 77.925 46.949 115.282 1.00 23.82 C ATOM 653 CG GLN A 72 78.000 46.504 113.818 1.00 24.89 C ATOM 654 CD GLN A 72 76.636 46.437 113.147 1.00 30.85 C ATOM 655 OE1 GLN A 72 75.608 46.736 113.764 1.00 27.14 O ATOM 656 NE2 GLN A 72 76.619 46.031 111.877 1.00 31.82 N ATOM 657 HE22 GLN A 72 77.509 45.789 111.396 1.00 0.00 H ATOM 658 HE21 GLN A 72 75.716 45.956 111.367 1.00 0.00 H ATOM 659 H GLN A 72 79.835 49.009 115.219 1.00 0.00 H ATOM 660 N LYS A 73 77.185 49.945 117.276 1.00 22.04 N ATOM 661 CA LYS A 73 77.425 50.550 118.582 1.00 26.49 C ATOM 662 C LYS A 73 76.956 49.640 119.698 1.00 25.76 C ATOM 663 O LYS A 73 77.656 49.463 120.702 1.00 27.49 O ATOM 664 CB LYS A 73 76.731 51.906 118.671 1.00 28.64 C ATOM 665 CG LYS A 73 77.525 52.995 118.014 1.00 29.83 C ATOM 666 CD LYS A 73 76.883 54.339 118.227 1.00 37.02 C ATOM 667 CE LYS A 73 77.705 55.450 117.589 1.00 38.62 C ATOM 668 NZ LYS A 73 76.883 56.683 117.394 1.00 50.08 N ATOM 669 HZ1 LYS A 73 76.077 56.466 116.773 1.00 0.00 H ATOM 670 HZ2 LYS A 73 76.533 57.014 118.316 1.00 0.00 H ATOM 671 HZ3 LYS A 73 77.469 57.423 116.958 1.00 0.00 H ATOM 672 H LYS A 73 76.537 50.397 116.600 1.00 0.00 H ATOM 673 N ASP A 74 75.765 49.051 119.538 1.00 29.29 N ATOM 674 CA ASP A 74 75.202 48.246 120.616 1.00 32.54 C ATOM 675 C ASP A 74 76.104 47.063 120.934 1.00 32.83 C ATOM 676 O ASP A 74 76.250 46.685 122.102 1.00 32.24 O ATOM 677 CB ASP A 74 73.803 47.750 120.248 1.00 36.82 C ATOM 678 CG ASP A 74 72.749 48.853 120.254 1.00 38.98 C ATOM 679 OD1 ASP A 74 72.955 49.906 120.887 1.00 36.00 O ATOM 680 OD2 ASP A 74 71.692 48.641 119.625 1.00 37.30 O ATOM 681 H ASP A 74 75.242 49.167 118.647 1.00 0.00 H ATOM 682 N GLN A 75 76.719 46.466 119.904 1.00 28.29 N ATOM 683 CA GLN A 75 77.624 45.332 120.058 1.00 28.26 C ATOM 684 C GLN A 75 79.045 45.740 120.442 1.00 24.42 C ATOM 685 O GLN A 75 79.870 44.864 120.710 1.00 25.17 O ATOM 686 CB GLN A 75 77.696 44.525 118.752 1.00 28.74 C ATOM 687 CG GLN A 75 76.365 44.185 118.075 1.00 29.96 C ATOM 688 CD GLN A 75 76.563 43.372 116.786 1.00 32.38 C ATOM 689 OE1 GLN A 75 77.389 42.455 116.731 1.00 33.44 O ATOM 690 NE2 GLN A 75 75.819 43.724 115.745 1.00 30.57 N ATOM 691 HE22 GLN A 75 75.135 44.502 115.834 1.00 0.00 H ATOM 692 HE21 GLN A 75 75.920 43.222 114.840 1.00 0.00 H ATOM 693 H GLN A 75 76.542 46.830 118.946 1.00 0.00 H ATOM 694 N LYS A 76 79.364 47.033 120.442 1.00 25.53 N ATOM 695 CA LYS A 76 80.743 47.506 120.609 1.00 23.77 C ATOM 696 C LYS A 76 81.667 46.839 119.580 1.00 21.82 C ATOM 697 O LYS A 76 82.779 46.407 119.878 1.00 22.27 O ATOM 698 CB LYS A 76 81.234 47.287 122.043 1.00 24.36 C ATOM 699 CG LYS A 76 80.480 48.174 123.035 1.00 27.95 C ATOM 700 CD LYS A 76 80.949 47.963 124.447 1.00 31.22 C ATOM 701 CE LYS A 76 80.158 48.830 125.431 1.00 39.56 C ATOM 702 NZ LYS A 76 80.400 48.403 126.843 1.00 42.62 N ATOM 703 HZ1 LYS A 76 80.104 47.413 126.960 1.00 0.00 H ATOM 704 HZ2 LYS A 76 81.413 48.491 127.062 1.00 0.00 H ATOM 705 HZ3 LYS A 76 79.851 49.009 127.486 1.00 0.00 H ATOM 706 H LYS A 76 78.606 47.735 120.319 1.00 0.00 H ATOM 707 N VAL A 77 81.190 46.785 118.346 1.00 20.87 N ATOM 708 CA VAL A 77 81.897 46.154 117.234 1.00 20.01 C ATOM 709 C VAL A 77 82.076 47.168 116.113 1.00 19.07 C ATOM 710 O VAL A 77 81.159 47.931 115.791 1.00 20.21 O ATOM 711 CB VAL A 77 81.137 44.915 116.730 1.00 21.03 C ATOM 712 CG1 VAL A 77 81.545 44.539 115.302 1.00 23.41 C ATOM 713 CG2 VAL A 77 81.376 43.748 117.674 1.00 23.28 C ATOM 714 H VAL A 77 80.262 47.215 118.158 1.00 0.00 H ATOM 715 N LEU A 78 83.245 47.146 115.484 1.00 17.54 N ATOM 716 CA LEU A 78 83.488 47.918 114.267 1.00 17.64 C ATOM 717 C LEU A 78 83.768 46.937 113.134 1.00 17.96 C ATOM 718 O LEU A 78 84.652 46.080 113.260 1.00 17.53 O ATOM 719 CB LEU A 78 84.674 48.868 114.451 1.00 18.45 C ATOM 720 CG LEU A 78 84.999 49.740 113.226 1.00 17.17 C ATOM 721 CD1 LEU A 78 83.853 50.705 112.928 1.00 21.13 C ATOM 722 CD2 LEU A 78 86.338 50.485 113.403 1.00 20.59 C ATOM 723 H LEU A 78 84.013 46.560 115.870 1.00 0.00 H ATOM 724 N GLU A 79 82.985 47.039 112.063 1.00 17.62 N ATOM 725 CA GLU A 79 83.116 46.174 110.898 1.00 17.96 C ATOM 726 C GLU A 79 83.794 46.940 109.776 1.00 18.39 C ATOM 727 O GLU A 79 83.444 48.092 109.494 1.00 18.27 O ATOM 728 CB GLU A 79 81.751 45.667 110.428 1.00 18.83 C ATOM 729 CG GLU A 79 81.108 44.738 111.441 1.00 19.85 C ATOM 730 CD GLU A 79 79.704 44.298 111.078 1.00 23.18 C ATOM 731 OE1 GLU A 79 79.008 45.037 110.357 1.00 22.00 O ATOM 732 OE2 GLU A 79 79.307 43.205 111.549 1.00 26.28 O ATOM 733 H GLU A 79 82.245 47.770 112.057 1.00 0.00 H ATOM 734 N ILE A 80 84.731 46.278 109.106 1.00 16.58 N ATOM 735 CA ILE A 80 85.414 46.833 107.943 1.00 17.47 C ATOM 736 C ILE A 80 85.263 45.818 106.816 1.00 18.55 C ATOM 737 O ILE A 80 85.858 44.732 106.857 1.00 17.52 O ATOM 738 CB ILE A 80 86.887 47.149 108.220 1.00 17.21 C ATOM 739 CG1 ILE A 80 87.046 48.135 109.389 1.00 22.97 C ATOM 740 CG2 ILE A 80 87.554 47.708 106.985 1.00 19.70 C ATOM 741 CD1 ILE A 80 87.348 47.452 110.644 1.00 28.17 C ATOM 742 H ILE A 80 84.989 45.322 109.425 1.00 0.00 H ATOM 743 N ARG A 81 84.497 46.200 105.799 1.00 17.09 N ATOM 744 CA ARG A 81 84.110 45.303 104.721 1.00 17.31 C ATOM 745 C ARG A 81 84.689 45.779 103.400 1.00 17.55 C ATOM 746 O ARG A 81 84.753 46.983 103.121 1.00 18.51 O ATOM 747 CB ARG A 81 82.584 45.221 104.613 1.00 18.50 C ATOM 748 CG ARG A 81 82.101 44.281 103.524 1.00 20.53 C ATOM 749 CD ARG A 81 80.595 44.110 103.544 1.00 22.29 C ATOM 750 NE ARG A 81 80.131 43.479 102.314 1.00 21.18 N ATOM 751 CZ ARG A 81 78.857 43.296 102.005 1.00 23.83 C ATOM 752 NH1 ARG A 81 77.909 43.691 102.849 1.00 25.72 N ATOM 753 NH2 ARG A 81 78.536 42.720 100.857 1.00 23.95 N ATOM 754 HE ARG A 81 80.848 43.151 101.635 1.00 0.00 H ATOM 755 HH12 ARG A 81 76.907 43.549 102.609 1.00 0.00 H ATOM 756 HH11 ARG A 81 78.169 44.142 103.749 1.00 0.00 H ATOM 757 HH22 ARG A 81 77.536 42.574 100.610 1.00 0.00 H ATOM 758 HH21 ARG A 81 79.284 42.413 100.202 1.00 0.00 H ATOM 759 H ARG A 81 84.160 47.183 105.773 1.00 0.00 H ATOM 760 N ASP A 82 85.112 44.824 102.571 1.00 17.01 N ATOM 761 CA ASP A 82 85.538 45.131 101.222 1.00 18.09 C ATOM 762 C ASP A 82 84.925 44.107 100.283 1.00 16.48 C ATOM 763 O ASP A 82 84.547 43.001 100.688 1.00 16.18 O ATOM 764 CB ASP A 82 87.068 45.143 101.076 1.00 16.27 C ATOM 765 CG ASP A 82 87.672 43.793 101.267 1.00 15.89 C ATOM 766 OD1 ASP A 82 87.504 42.936 100.377 1.00 18.39 O ATOM 767 OD2 ASP A 82 88.297 43.595 102.317 1.00 17.93 O ATOM 768 H ASP A 82 85.136 43.838 102.901 1.00 0.00 H ATOM 769 N SER A 83 84.810 44.501 99.020 1.00 16.62 N ATOM 770 CA SER A 83 84.399 43.582 97.955 1.00 17.32 C ATOM 771 C SER A 83 85.590 43.140 97.109 1.00 16.42 C ATOM 772 O SER A 83 85.478 42.947 95.890 1.00 16.98 O ATOM 773 CB SER A 83 83.318 44.206 97.083 1.00 16.75 C ATOM 774 OG SER A 83 83.755 45.436 96.555 1.00 20.15 O ATOM 775 HG SER A 83 83.040 45.825 95.992 1.00 0.00 H ATOM 776 H SER A 83 85.018 45.491 98.780 1.00 0.00 H ATOM 777 N GLY A 84 86.732 42.943 97.753 1.00 16.79 N ATOM 778 CA GLY A 84 87.926 42.447 97.097 1.00 17.78 C ATOM 779 C GLY A 84 87.865 40.960 96.777 1.00 18.59 C ATOM 780 O GLY A 84 86.807 40.330 96.737 1.00 17.74 O ATOM 781 H GLY A 84 86.773 43.153 98.771 1.00 0.00 H ATOM 782 N ILE A 85 89.047 40.400 96.546 1.00 17.09 N ATOM 783 CA ILE A 85 89.152 39.044 96.023 1.00 16.73 C ATOM 784 C ILE A 85 88.664 38.013 97.025 1.00 17.01 C ATOM 785 O ILE A 85 88.219 36.926 96.634 1.00 17.91 O ATOM 786 CB ILE A 85 90.607 38.787 95.585 1.00 18.32 C ATOM 787 CG1 ILE A 85 90.700 37.459 94.843 1.00 22.93 C ATOM 788 CG2 ILE A 85 91.555 38.818 96.771 1.00 21.01 C ATOM 789 CD1 ILE A 85 91.825 37.412 93.819 1.00 27.86 C ATOM 790 H ILE A 85 89.914 40.940 96.742 1.00 0.00 H ATOM 791 N GLY A 86 88.749 38.315 98.322 1.00 18.03 N ATOM 792 CA GLY A 86 88.324 37.375 99.336 1.00 17.46 C ATOM 793 C GLY A 86 89.387 36.313 99.563 1.00 18.37 C ATOM 794 O GLY A 86 90.442 36.272 98.912 1.00 20.81 O ATOM 795 H GLY A 86 89.127 39.241 98.608 1.00 0.00 H ATOM 796 N MET A 87 89.072 35.413 100.488 1.00 16.93 N ATOM 797 CA MET A 87 89.946 34.327 100.900 1.00 16.97 C ATOM 798 C MET A 87 89.144 33.040 100.965 1.00 17.22 C ATOM 799 O MET A 87 88.070 33.011 101.568 1.00 18.18 O ATOM 800 CB MET A 87 90.582 34.624 102.259 1.00 18.28 C ATOM 801 CG MET A 87 91.646 35.679 102.213 1.00 19.24 C ATOM 802 SD MET A 87 92.319 36.115 103.824 1.00 21.06 S ATOM 803 CE MET A 87 91.057 37.227 104.429 1.00 21.30 C ATOM 804 H MET A 87 88.142 35.490 100.946 1.00 0.00 H ATOM 805 N THR A 88 89.665 31.978 100.340 1.00 19.87 N ATOM 806 CA THR A 88 89.118 30.645 100.536 1.00 19.06 C ATOM 807 C THR A 88 89.407 30.160 101.960 1.00 21.06 C ATOM 808 O THR A 88 90.183 30.754 102.709 1.00 19.39 O ATOM 809 CB THR A 88 89.742 29.659 99.553 1.00 20.01 C ATOM 810 OG1 THR A 88 91.139 29.525 99.846 1.00 21.87 O ATOM 811 CG2 THR A 88 89.567 30.143 98.123 1.00 22.12 C ATOM 812 HG1 THR A 88 91.548 28.886 99.210 1.00 0.00 H ATOM 813 H THR A 88 90.476 32.108 99.702 1.00 0.00 H ATOM 814 N LYS A 89 88.804 29.034 102.325 1.00 21.10 N ATOM 815 CA LYS A 89 89.143 28.437 103.617 1.00 21.20 C ATOM 816 C LYS A 89 90.655 28.260 103.752 1.00 21.09 C ATOM 817 O LYS A 89 91.256 28.612 104.773 1.00 20.19 O ATOM 818 CB LYS A 89 88.423 27.097 103.767 1.00 23.19 C ATOM 819 CG LYS A 89 88.712 26.397 105.097 1.00 26.12 C ATOM 820 CD LYS A 89 88.146 24.976 105.123 1.00 33.48 C ATOM 821 CE LYS A 89 88.358 24.322 106.473 1.00 43.54 C ATOM 822 NZ LYS A 89 87.701 22.983 106.544 1.00 43.76 N ATOM 823 HZ1 LYS A 89 86.679 23.091 106.388 1.00 0.00 H ATOM 824 HZ2 LYS A 89 88.101 22.363 105.811 1.00 0.00 H ATOM 825 HZ3 LYS A 89 87.867 22.566 107.482 1.00 0.00 H ATOM 826 H LYS A 89 88.103 28.584 101.703 1.00 0.00 H ATOM 827 N ALA A 90 91.287 27.707 102.717 1.00 22.26 N ATOM 828 CA ALA A 90 92.721 27.466 102.767 1.00 23.67 C ATOM 829 C ALA A 90 93.512 28.771 102.856 1.00 22.79 C ATOM 830 O ALA A 90 94.541 28.834 103.538 1.00 22.91 O ATOM 831 CB ALA A 90 93.139 26.650 101.544 1.00 25.96 C ATOM 832 H ALA A 90 90.750 27.445 101.866 1.00 0.00 H ATOM 833 N ASP A 91 93.041 29.825 102.177 1.00 21.09 N ATOM 834 CA ASP A 91 93.678 31.135 102.279 1.00 22.31 C ATOM 835 C ASP A 91 93.619 31.664 103.711 1.00 22.82 C ATOM 836 O ASP A 91 94.599 32.236 104.220 1.00 23.46 O ATOM 837 CB ASP A 91 93.002 32.145 101.336 1.00 22.12 C ATOM 838 CG ASP A 91 93.250 31.868 99.864 1.00 27.01 C ATOM 839 OD1 ASP A 91 94.300 31.290 99.527 1.00 23.95 O ATOM 840 OD2 ASP A 91 92.381 32.254 99.038 1.00 23.43 O ATOM 841 H ASP A 91 92.207 29.708 101.567 1.00 0.00 H ATOM 842 N LEU A 92 92.469 31.514 104.368 1.00 20.97 N ATOM 843 CA LEU A 92 92.339 32.002 105.731 1.00 21.09 C ATOM 844 C LEU A 92 93.326 31.290 106.641 1.00 22.43 C ATOM 845 O LEU A 92 94.050 31.924 107.417 1.00 23.38 O ATOM 846 CB LEU A 92 90.910 31.792 106.225 1.00 19.22 C ATOM 847 CG LEU A 92 89.841 32.705 105.640 1.00 17.98 C ATOM 848 CD1 LEU A 92 88.449 32.198 106.025 1.00 19.37 C ATOM 849 CD2 LEU A 92 90.054 34.113 106.139 1.00 18.99 C ATOM 850 H LEU A 92 91.663 31.047 103.905 1.00 0.00 H ATOM 851 N VAL A 93 93.375 29.960 106.538 1.00 22.57 N ATOM 852 CA VAL A 93 94.274 29.174 107.376 1.00 22.97 C ATOM 853 C VAL A 93 95.718 29.542 107.091 1.00 25.74 C ATOM 854 O VAL A 93 96.514 29.724 108.012 1.00 29.16 O ATOM 855 CB VAL A 93 94.031 27.668 107.162 1.00 24.34 C ATOM 856 CG1 VAL A 93 95.126 26.832 107.868 1.00 30.00 C ATOM 857 CG2 VAL A 93 92.664 27.287 107.652 1.00 25.01 C ATOM 858 H VAL A 93 92.763 29.477 105.850 1.00 0.00 H ATOM 859 N ASN A 94 96.066 29.680 105.810 1.00 24.92 N ATOM 860 CA ASN A 94 97.460 29.903 105.464 1.00 29.71 C ATOM 861 C ASN A 94 97.876 31.359 105.655 1.00 31.40 C ATOM 862 O ASN A 94 98.957 31.606 106.198 1.00 34.42 O ATOM 863 CB ASN A 94 97.725 29.440 104.033 1.00 31.61 C ATOM 864 CG ASN A 94 98.304 28.025 103.970 1.00 33.95 C ATOM 865 OD1 ASN A 94 97.958 27.143 104.768 1.00 33.64 O ATOM 866 ND2 ASN A 94 99.206 27.811 103.021 1.00 35.29 N ATOM 867 HD22 ASN A 94 99.469 28.579 102.371 1.00 0.00 H ATOM 868 HD21 ASN A 94 99.650 26.875 102.927 1.00 0.00 H ATOM 869 H ASN A 94 95.344 29.628 105.063 1.00 0.00 H ATOM 870 N ASN A 95 97.041 32.330 105.266 1.00 27.45 N ATOM 871 CA ASN A 95 97.454 33.734 105.280 1.00 26.40 C ATOM 872 C ASN A 95 97.317 34.405 106.637 1.00 27.94 C ATOM 873 O ASN A 95 97.998 35.412 106.866 1.00 26.06 O ATOM 874 CB ASN A 95 96.646 34.570 104.282 1.00 27.50 C ATOM 875 CG ASN A 95 96.810 34.108 102.860 1.00 32.70 C ATOM 876 OD1 ASN A 95 97.708 33.332 102.552 1.00 34.83 O ATOM 877 ND2 ASN A 95 95.931 34.585 101.979 1.00 33.64 N ATOM 878 HD22 ASN A 95 95.187 35.241 102.290 1.00 0.00 H ATOM 879 HD21 ASN A 95 95.989 34.301 100.980 1.00 0.00 H ATOM 880 H ASN A 95 96.082 32.083 104.948 1.00 0.00 H ATOM 881 N LEU A 96 96.456 33.888 107.522 1.00 25.70 N ATOM 882 CA LEU A 96 96.181 34.504 108.819 1.00 30.85 C ATOM 883 C LEU A 96 96.533 33.601 109.996 1.00 31.69 C ATOM 884 O LEU A 96 95.733 33.442 110.929 1.00 33.31 O ATOM 885 CB LEU A 96 94.706 34.882 108.945 1.00 23.62 C ATOM 886 CG LEU A 96 94.176 35.840 107.892 1.00 23.04 C ATOM 887 CD1 LEU A 96 92.692 36.063 108.146 1.00 24.09 C ATOM 888 CD2 LEU A 96 94.936 37.147 107.902 1.00 26.79 C ATOM 889 H LEU A 96 95.960 33.008 107.276 1.00 0.00 H ATOM 890 N GLY A 97 97.708 32.999 109.982 1.00 29.72 N ATOM 891 CA GLY A 97 98.191 32.503 111.256 1.00 32.95 C ATOM 892 C GLY A 97 99.158 31.342 111.260 1.00 33.66 C ATOM 893 O GLY A 97 100.012 31.269 112.148 1.00 31.75 O ATOM 894 H GLY A 97 98.257 32.887 109.106 1.00 0.00 H ATOM 895 N THR A 98 99.018 30.413 110.319 1.00 35.79 N ATOM 896 CA THR A 98 99.793 29.178 110.377 1.00 38.37 C ATOM 897 C THR A 98 101.151 29.267 109.694 1.00 42.13 C ATOM 898 O THR A 98 102.061 28.523 110.069 1.00 38.81 O ATOM 899 CB THR A 98 99.032 28.029 109.724 1.00 36.92 C ATOM 900 OG1 THR A 98 98.788 28.358 108.353 1.00 36.89 O ATOM 901 CG2 THR A 98 97.727 27.769 110.452 1.00 35.98 C ATOM 902 HG1 THR A 98 98.250 29.188 108.305 1.00 0.00 H ATOM 903 H THR A 98 98.351 30.568 109.536 1.00 0.00 H ATOM 904 N ILE A 99 101.311 30.099 108.681 1.00 41.85 N ATOM 905 CA ILE A 99 102.575 30.128 107.950 1.00 49.84 C ATOM 906 C ILE A 99 103.452 31.221 108.528 1.00 51.99 C ATOM 907 O ILE A 99 102.991 32.338 108.789 1.00 44.49 O ATOM 908 CB ILE A 99 102.368 30.333 106.434 1.00 46.70 C ATOM 909 CG1 ILE A 99 101.918 31.771 106.129 1.00 56.27 C ATOM 910 CG2 ILE A 99 101.431 29.274 105.874 1.00 43.65 C ATOM 911 CD1 ILE A 99 101.628 32.060 104.651 1.00 48.34 C ATOM 912 H ILE A 99 100.536 30.734 108.403 1.00 0.00 H ATOM 913 N ALA A 100 104.725 30.891 108.729 1.00 62.26 N ATOM 914 CA ALA A 100 105.719 31.887 109.094 1.00 70.08 C ATOM 915 C ALA A 100 105.703 33.026 108.088 1.00 66.40 C ATOM 916 O ALA A 100 105.865 32.808 106.884 1.00 68.88 O ATOM 917 CB ALA A 100 107.106 31.242 109.150 1.00 80.21 C ATOM 918 H ALA A 100 105.016 29.898 108.623 1.00 0.00 H ATOM 919 N LYS A 101 105.491 34.239 108.579 1.00 52.69 N ATOM 920 CA LYS A 101 105.438 35.419 107.731 1.00 62.08 C ATOM 921 C LYS A 101 106.793 36.117 107.774 1.00 68.79 C ATOM 922 O LYS A 101 107.335 36.363 108.856 1.00 58.33 O ATOM 923 CB LYS A 101 104.320 36.358 108.189 1.00 53.04 C ATOM 924 H LYS A 101 105.358 34.350 109.604 1.00 0.00 H ATOM 925 N SER A 102 107.356 36.397 106.598 1.00 71.91 N ATOM 926 CA SER A 102 108.610 37.136 106.535 1.00 68.29 C ATOM 927 C SER A 102 108.379 38.546 107.056 1.00 66.77 C ATOM 928 O SER A 102 107.516 39.271 106.546 1.00 59.62 O ATOM 929 CB SER A 102 109.151 37.180 105.109 1.00 59.17 C ATOM 930 OG SER A 102 110.271 38.050 105.028 1.00 53.79 O ATOM 931 HG SER A 102 110.608 38.066 104.097 1.00 0.00 H ATOM 932 H SER A 102 106.896 36.085 105.719 1.00 0.00 H ATOM 933 N GLY A 103 109.143 38.931 108.073 1.00 54.09 N ATOM 934 CA GLY A 103 109.025 40.241 108.675 1.00 50.42 C ATOM 935 C GLY A 103 108.511 40.237 110.090 1.00 46.53 C ATOM 936 O GLY A 103 108.608 41.269 110.760 1.00 39.83 O ATOM 937 H GLY A 103 109.850 38.268 108.449 1.00 0.00 H ATOM 938 N THR A 104 107.964 39.120 110.569 1.00 43.48 N ATOM 939 CA THR A 104 107.384 39.100 111.908 1.00 40.19 C ATOM 940 C THR A 104 108.458 39.288 112.978 1.00 41.42 C ATOM 941 O THR A 104 108.331 40.153 113.860 1.00 33.75 O ATOM 942 CB THR A 104 106.613 37.791 112.118 1.00 42.20 C ATOM 943 OG1 THR A 104 105.692 37.603 111.034 1.00 44.13 O ATOM 944 CG2 THR A 104 105.840 37.824 113.417 1.00 32.75 C ATOM 945 HG1 THR A 104 106.193 37.560 110.181 1.00 0.00 H ATOM 946 H THR A 104 107.950 38.259 109.986 1.00 0.00 H ATOM 947 N LYS A 105 109.523 38.481 112.928 1.00 37.56 N ATOM 948 CA LYS A 105 110.591 38.632 113.907 1.00 39.94 C ATOM 949 C LYS A 105 111.324 39.943 113.686 1.00 34.47 C ATOM 950 O LYS A 105 111.710 40.611 114.650 1.00 34.95 O ATOM 951 CB LYS A 105 111.571 37.454 113.838 1.00 38.14 C ATOM 952 H LYS A 105 109.589 37.748 112.193 1.00 0.00 H ATOM 953 N SER A 106 111.490 40.336 112.419 1.00 39.08 N ATOM 954 CA SER A 106 112.163 41.591 112.102 1.00 38.95 C ATOM 955 C SER A 106 111.412 42.774 112.679 1.00 36.24 C ATOM 956 O SER A 106 112.027 43.728 113.174 1.00 29.79 O ATOM 957 CB SER A 106 112.284 41.765 110.598 1.00 39.49 C ATOM 958 OG SER A 106 113.245 40.882 110.083 1.00 52.75 O ATOM 959 HG SER A 106 114.122 41.069 110.503 1.00 0.00 H ATOM 960 H SER A 106 111.134 39.737 111.647 1.00 0.00 H ATOM 961 N PHE A 107 110.081 42.747 112.593 1.00 29.87 N ATOM 962 CA PHE A 107 109.312 43.843 113.161 1.00 30.74 C ATOM 963 C PHE A 107 109.455 43.875 114.672 1.00 28.48 C ATOM 964 O PHE A 107 109.600 44.953 115.266 1.00 27.37 O ATOM 965 CB PHE A 107 107.844 43.733 112.770 1.00 29.16 C ATOM 966 CG PHE A 107 106.981 44.769 113.423 1.00 27.54 C ATOM 967 CD1 PHE A 107 107.234 46.112 113.227 1.00 27.67 C ATOM 968 CD2 PHE A 107 105.933 44.400 114.248 1.00 30.55 C ATOM 969 CE1 PHE A 107 106.445 47.075 113.825 1.00 26.89 C ATOM 970 CE2 PHE A 107 105.132 45.364 114.847 1.00 28.65 C ATOM 971 CZ PHE A 107 105.393 46.695 114.638 1.00 25.90 C ATOM 972 H PHE A 107 109.599 41.952 112.126 1.00 0.00 H ATOM 973 N MET A 108 109.433 42.703 115.318 1.00 26.11 N ATOM 974 CA MET A 108 109.569 42.680 116.766 1.00 27.23 C ATOM 975 C MET A 108 110.950 43.170 117.188 1.00 28.40 C ATOM 976 O MET A 108 111.088 43.860 118.208 1.00 26.88 O ATOM 977 CB MET A 108 109.285 41.270 117.300 1.00 30.23 C ATOM 978 CG MET A 108 107.816 40.854 117.102 1.00 30.90 C ATOM 979 SD MET A 108 107.331 39.327 117.929 1.00 33.30 S ATOM 980 CE MET A 108 108.004 38.130 116.800 1.00 34.11 C ATOM 981 H MET A 108 109.319 41.815 114.788 1.00 0.00 H ATOM 982 N GLU A 109 111.976 42.843 116.407 1.00 27.42 N ATOM 983 CA GLU A 109 113.309 43.372 116.677 1.00 28.49 C ATOM 984 C GLU A 109 113.358 44.881 116.444 1.00 29.59 C ATOM 985 O GLU A 109 113.997 45.616 117.211 1.00 32.59 O ATOM 986 CB GLU A 109 114.339 42.649 115.808 1.00 33.72 C ATOM 987 CG GLU A 109 114.632 41.234 116.302 1.00 38.82 C ATOM 988 CD GLU A 109 115.471 40.418 115.331 1.00 52.20 C ATOM 989 OE1 GLU A 109 115.605 40.819 114.154 1.00 55.57 O ATOM 990 OE2 GLU A 109 115.988 39.361 115.750 1.00 57.99 O ATOM 991 H GLU A 109 111.827 42.206 115.598 1.00 0.00 H ATOM 992 N ALA A 110 112.682 45.364 115.401 1.00 27.19 N ATOM 993 CA ALA A 110 112.627 46.805 115.173 1.00 26.82 C ATOM 994 C ALA A 110 111.979 47.512 116.356 1.00 28.40 C ATOM 995 O ALA A 110 112.465 48.557 116.814 1.00 28.62 O ATOM 996 CB ALA A 110 111.882 47.102 113.879 1.00 28.06 C ATOM 997 H ALA A 110 112.195 44.715 114.751 1.00 0.00 H ATOM 998 N LEU A 111 110.903 46.934 116.896 1.00 25.88 N ATOM 999 CA LEU A 111 110.242 47.527 118.051 1.00 27.91 C ATOM 1000 C LEU A 111 111.191 47.633 119.235 1.00 28.43 C ATOM 1001 O LEU A 111 111.239 48.662 119.917 1.00 27.88 O ATOM 1002 CB LEU A 111 109.024 46.699 118.439 1.00 27.11 C ATOM 1003 CG LEU A 111 107.802 46.811 117.530 1.00 28.41 C ATOM 1004 CD1 LEU A 111 106.737 45.828 118.014 1.00 29.37 C ATOM 1005 CD2 LEU A 111 107.285 48.236 117.540 1.00 30.33 C ATOM 1006 H LEU A 111 110.533 46.052 116.488 1.00 0.00 H ATOM 1007 N SER A 112 111.927 46.561 119.521 1.00 28.74 N ATOM 1008 CA SER A 112 112.897 46.602 120.610 1.00 31.31 C ATOM 1009 C SER A 112 113.937 47.692 120.398 1.00 29.84 C ATOM 1010 O SER A 112 114.458 48.247 121.371 1.00 32.20 O ATOM 1011 CB SER A 112 113.585 45.248 120.751 1.00 33.94 C ATOM 1012 OG SER A 112 112.669 44.298 121.253 1.00 44.96 O ATOM 1013 HG SER A 112 111.906 44.215 120.628 1.00 0.00 H ATOM 1014 H SER A 112 111.810 45.690 118.965 1.00 0.00 H ATOM 1015 N ALA A 113 114.259 47.999 119.149 1.00 28.24 N ATOM 1016 CA ALA A 113 115.262 49.003 118.825 1.00 28.29 C ATOM 1017 C ALA A 113 114.714 50.427 118.820 1.00 26.62 C ATOM 1018 O ALA A 113 115.490 51.359 118.579 1.00 25.69 O ATOM 1019 CB ALA A 113 115.882 48.694 117.464 1.00 30.61 C ATOM 1020 H ALA A 113 113.777 47.504 118.372 1.00 0.00 H ATOM 1021 N GLY A 114 113.413 50.615 119.053 1.00 28.57 N ATOM 1022 CA GLY A 114 112.809 51.935 119.112 1.00 25.83 C ATOM 1023 C GLY A 114 111.801 52.211 118.031 1.00 26.30 C ATOM 1024 O GLY A 114 111.243 53.309 117.998 1.00 25.75 O ATOM 1025 H GLY A 114 112.807 49.782 119.198 1.00 0.00 H ATOM 1026 N ALA A 115 111.526 51.250 117.156 1.00 25.25 N ATOM 1027 CA ALA A 115 110.655 51.524 116.025 1.00 28.08 C ATOM 1028 C ALA A 115 109.272 51.961 116.481 1.00 23.75 C ATOM 1029 O ALA A 115 108.732 51.471 117.475 1.00 27.41 O ATOM 1030 CB ALA A 115 110.507 50.278 115.145 1.00 27.22 C ATOM 1031 H ALA A 115 111.934 50.301 117.280 1.00 0.00 H ATOM 1032 N ASP A 116 108.680 52.857 115.703 1.00 25.77 N ATOM 1033 CA ASP A 116 107.288 53.223 115.886 1.00 28.67 C ATOM 1034 C ASP A 116 106.374 52.116 115.363 1.00 29.86 C ATOM 1035 O ASP A 116 106.606 51.562 114.284 1.00 27.58 O ATOM 1036 CB ASP A 116 106.993 54.525 115.156 1.00 32.55 C ATOM 1037 CG ASP A 116 105.683 55.131 115.585 1.00 40.52 C ATOM 1038 OD1 ASP A 116 104.642 54.664 115.104 1.00 32.32 O ATOM 1039 OD2 ASP A 116 105.695 56.059 116.430 1.00 53.46 O ATOM 1040 H ASP A 116 109.227 53.309 114.943 1.00 0.00 H ATOM 1041 N VAL A 117 105.326 51.805 116.135 1.00 30.54 N ATOM 1042 CA VAL A 117 104.404 50.727 115.774 1.00 29.57 C ATOM 1043 C VAL A 117 103.763 50.959 114.413 1.00 26.69 C ATOM 1044 O VAL A 117 103.373 49.999 113.737 1.00 26.72 O ATOM 1045 CB VAL A 117 103.333 50.560 116.867 1.00 31.39 C ATOM 1046 CG1 VAL A 117 102.266 49.541 116.447 1.00 30.26 C ATOM 1047 CG2 VAL A 117 103.998 50.141 118.172 1.00 33.23 C ATOM 1048 H VAL A 117 105.163 52.341 117.011 1.00 0.00 H ATOM 1049 N SER A 118 103.633 52.219 113.989 1.00 28.37 N ATOM 1050 CA SER A 118 103.082 52.525 112.673 1.00 29.22 C ATOM 1051 C SER A 118 103.866 51.870 111.537 1.00 31.88 C ATOM 1052 O SER A 118 103.334 51.744 110.422 1.00 30.31 O ATOM 1053 CB SER A 118 103.046 54.040 112.468 1.00 32.61 C ATOM 1054 OG SER A 118 102.668 54.353 111.127 1.00 39.13 O ATOM 1055 HG SER A 118 103.324 53.958 110.500 1.00 0.00 H ATOM 1056 H SER A 118 103.931 52.998 114.610 1.00 0.00 H ATOM 1057 N MET A 119 105.117 51.461 111.793 1.00 29.23 N ATOM 1058 CA MET A 119 105.906 50.799 110.758 1.00 32.35 C ATOM 1059 C MET A 119 105.473 49.362 110.513 1.00 30.79 C ATOM 1060 O MET A 119 106.036 48.711 109.625 1.00 31.52 O ATOM 1061 CB MET A 119 107.392 50.827 111.132 1.00 34.10 C ATOM 1062 CG MET A 119 108.000 52.216 111.072 1.00 34.92 C ATOM 1063 SD MET A 119 108.102 52.897 109.396 1.00 49.83 S ATOM 1064 CE MET A 119 107.088 54.358 109.570 1.00 33.91 C ATOM 1065 H MET A 119 105.528 51.616 112.735 1.00 0.00 H ATOM 1066 N ILE A 120 104.453 48.879 111.226 1.00 25.85 N ATOM 1067 CA ILE A 120 104.088 47.470 111.192 1.00 27.22 C ATOM 1068 C ILE A 120 103.769 47.018 109.769 1.00 27.86 C ATOM 1069 O ILE A 120 104.064 45.882 109.386 1.00 31.10 O ATOM 1070 CB ILE A 120 102.913 47.215 112.155 1.00 26.71 C ATOM 1071 CG1 ILE A 120 102.575 45.732 112.189 1.00 24.77 C ATOM 1072 CG2 ILE A 120 101.709 48.053 111.771 1.00 26.01 C ATOM 1073 CD1 ILE A 120 101.630 45.353 113.318 1.00 24.24 C ATOM 1074 H ILE A 120 103.903 49.528 111.823 1.00 0.00 H ATOM 1075 N GLY A 121 103.162 47.895 108.977 1.00 29.57 N ATOM 1076 CA GLY A 121 102.771 47.504 107.630 1.00 31.70 C ATOM 1077 C GLY A 121 103.964 47.252 106.729 1.00 38.11 C ATOM 1078 O GLY A 121 103.934 46.354 105.878 1.00 35.83 O ATOM 1079 H GLY A 121 102.967 48.858 109.318 1.00 0.00 H ATOM 1080 N GLN A 122 105.036 48.026 106.916 1.00 37.09 N ATOM 1081 CA GLN A 122 106.246 47.853 106.118 1.00 38.48 C ATOM 1082 C GLN A 122 106.849 46.470 106.270 1.00 34.41 C ATOM 1083 O GLN A 122 107.630 46.045 105.405 1.00 40.10 O ATOM 1084 CB GLN A 122 107.296 48.887 106.511 1.00 40.50 C ATOM 1085 CG GLN A 122 106.995 50.286 106.048 1.00 44.27 C ATOM 1086 CD GLN A 122 108.172 51.217 106.256 1.00 47.22 C ATOM 1087 OE1 GLN A 122 108.976 51.032 107.177 1.00 42.95 O ATOM 1088 NE2 GLN A 122 108.291 52.215 105.387 1.00 43.30 N ATOM 1089 HE22 GLN A 122 107.589 52.330 104.628 1.00 0.00 H ATOM 1090 HE21 GLN A 122 109.086 52.881 105.466 1.00 0.00 H ATOM 1091 H GLN A 122 105.008 48.767 107.645 1.00 0.00 H ATOM 1092 N PHE A 123 106.537 45.768 107.353 1.00 32.94 N ATOM 1093 CA PHE A 123 107.043 44.427 107.610 1.00 33.78 C ATOM 1094 C PHE A 123 106.058 43.329 107.227 1.00 38.37 C ATOM 1095 O PHE A 123 106.300 42.155 107.535 1.00 38.61 O ATOM 1096 CB PHE A 123 107.423 44.278 109.083 1.00 37.25 C ATOM 1097 CG PHE A 123 108.634 45.076 109.470 1.00 34.84 C ATOM 1098 CD1 PHE A 123 109.904 44.520 109.396 1.00 38.01 C ATOM 1099 CD2 PHE A 123 108.508 46.387 109.879 1.00 35.07 C ATOM 1100 CE1 PHE A 123 111.028 45.273 109.741 1.00 33.71 C ATOM 1101 CE2 PHE A 123 109.623 47.138 110.216 1.00 38.24 C ATOM 1102 CZ PHE A 123 110.882 46.572 110.144 1.00 33.71 C ATOM 1103 H PHE A 123 105.899 46.198 108.053 1.00 0.00 H ATOM 1104 N GLY A 124 104.945 43.678 106.594 1.00 36.86 N ATOM 1105 CA GLY A 124 104.016 42.661 106.138 1.00 35.56 C ATOM 1106 C GLY A 124 103.203 41.979 107.217 1.00 34.81 C ATOM 1107 O GLY A 124 102.839 40.807 107.056 1.00 35.14 O ATOM 1108 H GLY A 124 104.738 44.683 106.424 1.00 0.00 H ATOM 1109 N VAL A 125 102.883 42.681 108.310 1.00 30.06 N ATOM 1110 CA VAL A 125 102.071 42.086 109.367 1.00 29.53 C ATOM 1111 C VAL A 125 101.077 43.122 109.878 1.00 22.59 C ATOM 1112 O VAL A 125 100.638 43.060 111.031 1.00 22.67 O ATOM 1113 CB VAL A 125 102.928 41.536 110.524 1.00 31.68 C ATOM 1114 CG1 VAL A 125 103.465 40.153 110.180 1.00 36.34 C ATOM 1115 CG2 VAL A 125 104.060 42.519 110.893 1.00 28.39 C ATOM 1116 H VAL A 125 103.216 43.661 108.408 1.00 0.00 H ATOM 1117 N GLY A 126 100.692 44.054 109.002 1.00 23.91 N ATOM 1118 CA GLY A 126 99.795 45.126 109.390 1.00 23.36 C ATOM 1119 C GLY A 126 98.443 44.657 109.895 1.00 21.41 C ATOM 1120 O GLY A 126 97.786 45.373 110.663 1.00 20.45 O ATOM 1121 H GLY A 126 101.042 44.010 108.024 1.00 0.00 H ATOM 1122 N PHE A 127 97.999 43.469 109.473 1.00 20.36 N ATOM 1123 CA PHE A 127 96.707 42.937 109.916 1.00 19.30 C ATOM 1124 C PHE A 127 96.629 42.913 111.430 1.00 21.80 C ATOM 1125 O PHE A 127 95.592 43.241 112.022 1.00 20.51 O ATOM 1126 CB PHE A 127 96.508 41.523 109.345 1.00 22.08 C ATOM 1127 CG PHE A 127 95.354 40.740 109.951 1.00 22.89 C ATOM 1128 CD1 PHE A 127 94.050 40.920 109.493 1.00 19.71 C ATOM 1129 CD2 PHE A 127 95.576 39.799 110.954 1.00 22.41 C ATOM 1130 CE1 PHE A 127 92.987 40.191 110.042 1.00 21.36 C ATOM 1131 CE2 PHE A 127 94.520 39.071 111.510 1.00 20.98 C ATOM 1132 CZ PHE A 127 93.214 39.270 111.045 1.00 23.05 C ATOM 1133 H PHE A 127 98.582 42.911 108.817 1.00 0.00 H ATOM 1134 N TYR A 128 97.729 42.537 112.078 1.00 21.78 N ATOM 1135 CA TYR A 128 97.714 42.356 113.523 1.00 20.84 C ATOM 1136 C TYR A 128 97.659 43.671 114.295 1.00 21.20 C ATOM 1137 O TYR A 128 97.432 43.643 115.516 1.00 22.28 O ATOM 1138 CB TYR A 128 98.928 41.496 113.911 1.00 23.11 C ATOM 1139 CG TYR A 128 98.839 40.141 113.247 1.00 24.07 C ATOM 1140 CD1 TYR A 128 98.067 39.118 113.808 1.00 23.14 C ATOM 1141 CD2 TYR A 128 99.472 39.891 112.027 1.00 23.78 C ATOM 1142 CE1 TYR A 128 97.944 37.887 113.166 1.00 24.14 C ATOM 1143 CE2 TYR A 128 99.351 38.644 111.395 1.00 24.02 C ATOM 1144 CZ TYR A 128 98.583 37.668 111.976 1.00 25.74 C ATOM 1145 OH TYR A 128 98.456 36.439 111.374 1.00 30.09 O ATOM 1146 HH TYR A 128 98.057 36.553 110.475 1.00 0.00 H ATOM 1147 H TYR A 128 98.608 42.371 111.547 1.00 0.00 H ATOM 1148 N SER A 129 97.802 44.816 113.622 1.00 20.74 N ATOM 1149 CA SER A 129 97.564 46.094 114.274 1.00 20.60 C ATOM 1150 C SER A 129 96.142 46.210 114.818 1.00 19.75 C ATOM 1151 O SER A 129 95.885 47.071 115.662 1.00 20.00 O ATOM 1152 CB SER A 129 97.827 47.255 113.314 1.00 21.87 C ATOM 1153 OG SER A 129 96.847 47.324 112.288 1.00 23.03 O ATOM 1154 HG SER A 129 96.856 46.482 111.768 1.00 0.00 H ATOM 1155 H SER A 129 98.086 44.793 112.622 1.00 0.00 H ATOM 1156 N LEU A 130 95.210 45.366 114.364 1.00 19.94 N ATOM 1157 CA LEU A 130 93.853 45.469 114.887 1.00 19.64 C ATOM 1158 C LEU A 130 93.819 45.211 116.382 1.00 20.74 C ATOM 1159 O LEU A 130 92.930 45.717 117.067 1.00 20.69 O ATOM 1160 CB LEU A 130 92.917 44.507 114.153 1.00 19.74 C ATOM 1161 CG LEU A 130 93.095 43.013 114.389 1.00 20.88 C ATOM 1162 CD1 LEU A 130 92.272 42.576 115.595 1.00 23.00 C ATOM 1163 CD2 LEU A 130 92.705 42.222 113.131 1.00 20.97 C ATOM 1164 H LEU A 130 95.449 44.648 113.650 1.00 0.00 H ATOM 1165 N PHE A 131 94.787 44.463 116.906 1.00 21.43 N ATOM 1166 CA PHE A 131 94.807 44.189 118.331 1.00 24.25 C ATOM 1167 C PHE A 131 95.208 45.391 119.162 1.00 23.97 C ATOM 1168 O PHE A 131 95.080 45.327 120.397 1.00 25.91 O ATOM 1169 CB PHE A 131 95.720 42.995 118.586 1.00 22.87 C ATOM 1170 CG PHE A 131 95.110 41.712 118.147 1.00 22.59 C ATOM 1171 CD1 PHE A 131 94.010 41.204 118.805 1.00 26.28 C ATOM 1172 CD2 PHE A 131 95.576 41.051 117.036 1.00 25.25 C ATOM 1173 CE1 PHE A 131 93.425 40.036 118.389 1.00 25.08 C ATOM 1174 CE2 PHE A 131 94.988 39.895 116.615 1.00 25.90 C ATOM 1175 CZ PHE A 131 93.899 39.390 117.298 1.00 27.27 C ATOM 1176 H PHE A 131 95.531 44.074 116.293 1.00 0.00 H ATOM 1177 N LEU A 132 95.620 46.499 118.532 1.00 22.25 N ATOM 1178 CA LEU A 132 95.755 47.754 119.262 1.00 23.55 C ATOM 1179 C LEU A 132 94.427 48.201 119.868 1.00 27.27 C ATOM 1180 O LEU A 132 94.412 48.787 120.961 1.00 26.35 O ATOM 1181 CB LEU A 132 96.299 48.846 118.345 1.00 24.15 C ATOM 1182 CG LEU A 132 97.721 48.671 117.803 1.00 22.16 C ATOM 1183 CD1 LEU A 132 97.968 49.671 116.706 1.00 23.50 C ATOM 1184 CD2 LEU A 132 98.737 48.848 118.938 1.00 27.27 C ATOM 1185 H LEU A 132 95.845 46.464 117.517 1.00 0.00 H ATOM 1186 N VAL A 133 93.309 47.933 119.194 1.00 22.33 N ATOM 1187 CA VAL A 133 92.015 48.478 119.592 1.00 21.15 C ATOM 1188 C VAL A 133 90.981 47.404 119.896 1.00 21.06 C ATOM 1189 O VAL A 133 89.918 47.733 120.452 1.00 22.82 O ATOM 1190 CB VAL A 133 91.447 49.464 118.537 1.00 21.24 C ATOM 1191 CG1 VAL A 133 92.405 50.620 118.285 1.00 22.96 C ATOM 1192 CG2 VAL A 133 91.126 48.761 117.214 1.00 19.96 C ATOM 1193 H VAL A 133 93.360 47.316 118.358 1.00 0.00 H ATOM 1194 N ALA A 134 91.234 46.145 119.551 1.00 22.35 N ATOM 1195 CA ALA A 134 90.266 45.076 119.727 1.00 23.82 C ATOM 1196 C ALA A 134 90.922 43.930 120.465 1.00 24.68 C ATOM 1197 O ALA A 134 92.114 43.671 120.295 1.00 25.43 O ATOM 1198 CB ALA A 134 89.748 44.570 118.384 1.00 22.49 C ATOM 1199 H ALA A 134 92.161 45.917 119.139 1.00 0.00 H ATOM 1200 N ASP A 135 90.144 43.214 121.273 1.00 25.22 N ATOM 1201 CA ASP A 135 90.683 42.032 121.918 1.00 26.40 C ATOM 1202 C ASP A 135 90.113 40.748 121.344 1.00 30.26 C ATOM 1203 O ASP A 135 90.450 39.669 121.828 1.00 31.74 O ATOM 1204 CB ASP A 135 90.450 42.069 123.432 1.00 33.42 C ATOM 1205 CG ASP A 135 89.011 42.259 123.793 1.00 34.09 C ATOM 1206 OD1 ASP A 135 88.141 42.091 122.916 1.00 33.37 O ATOM 1207 OD2 ASP A 135 88.754 42.582 124.973 1.00 42.52 O ATOM 1208 H ASP A 135 89.158 43.499 121.441 1.00 0.00 H ATOM 1209 N HIS A 136 89.287 40.839 120.305 1.00 27.57 N ATOM 1210 CA HIS A 136 88.683 39.673 119.685 1.00 27.48 C ATOM 1211 C HIS A 136 88.336 40.086 118.263 1.00 25.67 C ATOM 1212 O HIS A 136 87.969 41.242 118.040 1.00 22.57 O ATOM 1213 CB HIS A 136 87.427 39.235 120.445 1.00 28.79 C ATOM 1214 CG HIS A 136 86.946 37.869 120.075 1.00 33.55 C ATOM 1215 ND1 HIS A 136 87.479 36.723 120.626 1.00 42.08 N ATOM 1216 CD2 HIS A 136 85.980 37.463 119.218 1.00 31.60 C ATOM 1217 CE1 HIS A 136 86.864 35.668 120.119 1.00 43.19 C ATOM 1218 NE2 HIS A 136 85.950 36.090 119.263 1.00 37.31 N ATOM 1219 H HIS A 136 89.066 41.780 119.923 1.00 0.00 H ATOM 1220 N VAL A 137 88.453 39.162 117.309 1.00 23.29 N ATOM 1221 CA VAL A 137 88.178 39.513 115.915 1.00 20.88 C ATOM 1222 C VAL A 137 87.609 38.303 115.185 1.00 21.63 C ATOM 1223 O VAL A 137 88.036 37.167 115.414 1.00 20.44 O ATOM 1224 CB VAL A 137 89.456 40.040 115.218 1.00 22.87 C ATOM 1225 CG1 VAL A 137 90.612 39.037 115.340 1.00 24.79 C ATOM 1226 CG2 VAL A 137 89.200 40.364 113.750 1.00 21.33 C ATOM 1227 H VAL A 137 88.739 38.193 117.555 1.00 0.00 H ATOM 1228 N GLN A 138 86.638 38.563 114.303 1.00 19.05 N ATOM 1229 CA GLN A 138 86.185 37.599 113.311 1.00 18.57 C ATOM 1230 C GLN A 138 86.529 38.138 111.931 1.00 20.05 C ATOM 1231 O GLN A 138 86.390 39.339 111.675 1.00 20.24 O ATOM 1232 CB GLN A 138 84.679 37.348 113.399 1.00 21.97 C ATOM 1233 CG GLN A 138 84.259 36.621 114.676 1.00 22.88 C ATOM 1234 CD GLN A 138 82.766 36.699 114.935 1.00 28.58 C ATOM 1235 OE1 GLN A 138 82.056 37.489 114.315 1.00 27.55 O ATOM 1236 NE2 GLN A 138 82.291 35.906 115.902 1.00 31.96 N ATOM 1237 HE22 GLN A 138 82.929 35.253 116.400 1.00 0.00 H ATOM 1238 HE21 GLN A 138 81.283 35.942 116.156 1.00 0.00 H ATOM 1239 H GLN A 138 86.185 39.499 114.327 1.00 0.00 H ATOM 1240 N VAL A 139 86.987 37.251 111.055 1.00 16.91 N ATOM 1241 CA VAL A 139 87.250 37.589 109.656 1.00 17.69 C ATOM 1242 C VAL A 139 86.325 36.714 108.833 1.00 18.75 C ATOM 1243 O VAL A 139 86.504 35.492 108.780 1.00 18.54 O ATOM 1244 CB VAL A 139 88.717 37.368 109.256 1.00 18.30 C ATOM 1245 CG1 VAL A 139 88.894 37.631 107.763 1.00 16.73 C ATOM 1246 CG2 VAL A 139 89.628 38.283 110.074 1.00 21.48 C ATOM 1247 H VAL A 139 87.166 36.278 111.376 1.00 0.00 H ATOM 1248 N ILE A 140 85.327 37.344 108.220 1.00 17.17 N ATOM 1249 CA ILE A 140 84.360 36.693 107.342 1.00 15.83 C ATOM 1250 C ILE A 140 84.851 36.891 105.918 1.00 17.97 C ATOM 1251 O ILE A 140 85.182 38.020 105.530 1.00 16.95 O ATOM 1252 CB ILE A 140 82.961 37.306 107.520 1.00 15.67 C ATOM 1253 CG1 ILE A 140 82.485 37.227 108.989 1.00 18.87 C ATOM 1254 CG2 ILE A 140 81.956 36.603 106.596 1.00 19.77 C ATOM 1255 CD1 ILE A 140 81.416 38.235 109.310 1.00 24.11 C ATOM 1256 H ILE A 140 85.229 38.367 108.377 1.00 0.00 H ATOM 1257 N SER A 141 84.927 35.814 105.130 1.00 16.02 N ATOM 1258 CA SER A 141 85.464 35.984 103.790 1.00 17.99 C ATOM 1259 C SER A 141 84.808 35.037 102.792 1.00 20.98 C ATOM 1260 O SER A 141 84.464 33.901 103.123 1.00 17.55 O ATOM 1261 CB SER A 141 86.994 35.792 103.790 1.00 18.40 C ATOM 1262 OG SER A 141 87.566 36.344 102.599 1.00 17.89 O ATOM 1263 HG SER A 141 87.362 37.312 102.554 1.00 0.00 H ATOM 1264 H SER A 141 84.611 34.882 105.466 1.00 0.00 H ATOM 1265 N LYS A 142 84.653 35.537 101.568 1.00 18.30 N ATOM 1266 CA LYS A 142 84.054 34.813 100.446 1.00 16.11 C ATOM 1267 C LYS A 142 84.882 35.076 99.197 1.00 18.25 C ATOM 1268 O LYS A 142 84.942 36.211 98.705 1.00 16.67 O ATOM 1269 CB LYS A 142 82.602 35.237 100.220 1.00 18.89 C ATOM 1270 CG LYS A 142 81.911 34.608 98.998 1.00 18.52 C ATOM 1271 CD LYS A 142 81.675 33.122 99.175 1.00 21.01 C ATOM 1272 CE LYS A 142 80.945 32.498 97.969 1.00 23.27 C ATOM 1273 NZ LYS A 142 81.805 32.418 96.734 1.00 21.32 N ATOM 1274 HZ1 LYS A 142 82.106 33.375 96.460 1.00 0.00 H ATOM 1275 HZ2 LYS A 142 82.642 31.834 96.933 1.00 0.00 H ATOM 1276 HZ3 LYS A 142 81.258 31.990 95.960 1.00 0.00 H ATOM 1277 H LYS A 142 84.980 36.509 101.397 1.00 0.00 H ATOM 1278 N HIS A 143 85.494 34.020 98.684 1.00 16.98 N ATOM 1279 CA HIS A 143 86.271 34.016 97.448 1.00 18.57 C ATOM 1280 C HIS A 143 85.453 33.307 96.380 1.00 19.58 C ATOM 1281 O HIS A 143 84.676 32.408 96.691 1.00 19.02 O ATOM 1282 CB HIS A 143 87.576 33.273 97.694 1.00 18.52 C ATOM 1283 CG HIS A 143 88.565 33.354 96.574 1.00 21.86 C ATOM 1284 ND1 HIS A 143 88.453 32.612 95.417 1.00 22.16 N ATOM 1285 CD2 HIS A 143 89.713 34.061 96.457 1.00 21.10 C ATOM 1286 CE1 HIS A 143 89.469 32.889 94.617 1.00 24.03 C ATOM 1287 NE2 HIS A 143 90.258 33.756 95.231 1.00 22.53 N ATOM 1288 H HIS A 143 85.415 33.122 99.203 1.00 0.00 H ATOM 1289 N ASN A 144 85.625 33.703 95.115 1.00 20.02 N ATOM 1290 CA ASN A 144 84.841 33.070 94.054 1.00 20.59 C ATOM 1291 C ASN A 144 85.046 31.553 93.999 1.00 23.60 C ATOM 1292 O ASN A 144 84.153 30.827 93.532 1.00 22.33 O ATOM 1293 CB ASN A 144 85.194 33.688 92.706 1.00 22.21 C ATOM 1294 CG ASN A 144 84.576 35.060 92.488 1.00 23.25 C ATOM 1295 OD1 ASN A 144 83.665 35.505 93.199 1.00 19.99 O ATOM 1296 ND2 ASN A 144 85.085 35.744 91.482 1.00 21.41 N ATOM 1297 HD22 ASN A 144 85.850 35.334 90.909 1.00 0.00 H ATOM 1298 HD21 ASN A 144 84.722 36.693 91.262 1.00 0.00 H ATOM 1299 H ASN A 144 86.309 34.453 94.887 1.00 0.00 H ATOM 1300 N ASP A 145 86.177 31.060 94.471 1.00 21.56 N ATOM 1301 CA ASP A 145 86.483 29.636 94.384 1.00 24.80 C ATOM 1302 C ASP A 145 85.944 28.818 95.555 1.00 25.83 C ATOM 1303 O ASP A 145 86.132 27.598 95.546 1.00 26.09 O ATOM 1304 CB ASP A 145 87.995 29.396 94.310 1.00 24.61 C ATOM 1305 CG ASP A 145 88.606 29.783 92.970 1.00 30.22 C ATOM 1306 OD1 ASP A 145 87.869 29.996 91.998 1.00 28.63 O ATOM 1307 OD2 ASP A 145 89.842 29.872 92.915 1.00 28.05 O ATOM 1308 H ASP A 145 86.865 31.701 94.915 1.00 0.00 H ATOM 1309 N ASP A 146 85.294 29.423 96.561 1.00 22.10 N ATOM 1310 CA ASP A 146 84.945 28.662 97.761 1.00 21.07 C ATOM 1311 C ASP A 146 83.666 29.211 98.398 1.00 21.26 C ATOM 1312 O ASP A 146 83.086 30.204 97.954 1.00 21.53 O ATOM 1313 CB ASP A 146 86.126 28.669 98.761 1.00 23.11 C ATOM 1314 CG ASP A 146 86.134 27.489 99.711 1.00 23.76 C ATOM 1315 OD1 ASP A 146 85.207 26.650 99.686 1.00 23.97 O ATOM 1316 OD2 ASP A 146 87.065 27.426 100.544 1.00 24.02 O ATOM 1317 H ASP A 146 85.039 30.429 96.488 1.00 0.00 H ATOM 1318 N GLU A 147 83.210 28.511 99.434 1.00 21.60 N ATOM 1319 CA GLU A 147 82.089 28.951 100.244 1.00 22.73 C ATOM 1320 C GLU A 147 82.541 30.061 101.186 1.00 21.41 C ATOM 1321 O GLU A 147 83.732 30.300 101.366 1.00 20.65 O ATOM 1322 CB GLU A 147 81.532 27.788 101.061 1.00 25.19 C ATOM 1323 CG GLU A 147 81.159 26.571 100.231 1.00 30.23 C ATOM 1324 CD GLU A 147 79.974 26.817 99.339 1.00 34.62 C ATOM 1325 OE1 GLU A 147 79.170 27.724 99.632 1.00 33.94 O ATOM 1326 OE2 GLU A 147 79.839 26.099 98.330 1.00 51.22 O ATOM 1327 H GLU A 147 83.676 27.612 99.673 1.00 0.00 H ATOM 1328 N GLN A 148 81.568 30.722 101.827 1.00 18.85 N ATOM 1329 CA GLN A 148 81.887 31.740 102.819 1.00 18.62 C ATOM 1330 C GLN A 148 82.317 31.077 104.120 1.00 21.55 C ATOM 1331 O GLN A 148 81.670 30.137 104.592 1.00 18.97 O ATOM 1332 CB GLN A 148 80.682 32.649 103.054 1.00 19.59 C ATOM 1333 CG GLN A 148 80.986 33.879 103.895 1.00 17.20 C ATOM 1334 CD GLN A 148 79.907 34.934 103.768 1.00 17.52 C ATOM 1335 OE1 GLN A 148 79.570 35.387 102.661 1.00 19.44 O ATOM 1336 NE2 GLN A 148 79.337 35.315 104.895 1.00 18.14 N ATOM 1337 HE22 GLN A 148 79.651 34.909 105.800 1.00 0.00 H ATOM 1338 HE21 GLN A 148 78.574 36.021 104.879 1.00 0.00 H ATOM 1339 H GLN A 148 80.573 30.506 101.614 1.00 0.00 H ATOM 1340 N TYR A 149 83.399 31.588 104.704 1.00 18.63 N ATOM 1341 CA TYR A 149 83.974 31.065 105.929 1.00 19.40 C ATOM 1342 C TYR A 149 84.213 32.178 106.933 1.00 19.84 C ATOM 1343 O TYR A 149 84.365 33.347 106.571 1.00 19.65 O ATOM 1344 CB TYR A 149 85.311 30.347 105.649 1.00 20.53 C ATOM 1345 CG TYR A 149 85.113 28.938 105.115 1.00 21.43 C ATOM 1346 CD1 TYR A 149 85.001 28.693 103.755 1.00 23.47 C ATOM 1347 CD2 TYR A 149 85.010 27.864 105.985 1.00 22.92 C ATOM 1348 CE1 TYR A 149 84.787 27.387 103.269 1.00 24.90 C ATOM 1349 CE2 TYR A 149 84.811 26.582 105.519 1.00 25.16 C ATOM 1350 CZ TYR A 149 84.692 26.346 104.177 1.00 24.78 C ATOM 1351 OH TYR A 149 84.495 25.039 103.750 1.00 27.26 O ATOM 1352 HH TYR A 149 84.428 25.022 102.762 1.00 0.00 H ATOM 1353 H TYR A 149 83.857 32.408 104.257 1.00 0.00 H ATOM 1354 N VAL A 150 84.301 31.788 108.212 1.00 18.88 N ATOM 1355 CA VAL A 150 84.618 32.703 109.305 1.00 19.89 C ATOM 1356 C VAL A 150 85.853 32.197 110.033 1.00 20.18 C ATOM 1357 O VAL A 150 85.867 31.065 110.537 1.00 20.37 O ATOM 1358 CB VAL A 150 83.470 32.845 110.317 1.00 22.57 C ATOM 1359 CG1 VAL A 150 83.800 33.994 111.274 1.00 21.14 C ATOM 1360 CG2 VAL A 150 82.148 33.006 109.655 1.00 23.27 C ATOM 1361 H VAL A 150 84.136 30.786 108.437 1.00 0.00 H ATOM 1362 N TRP A 151 86.873 33.045 110.102 1.00 19.37 N ATOM 1363 CA TRP A 151 88.077 32.856 110.896 1.00 20.02 C ATOM 1364 C TRP A 151 87.917 33.663 112.177 1.00 20.38 C ATOM 1365 O TRP A 151 87.429 34.799 112.139 1.00 21.74 O ATOM 1366 CB TRP A 151 89.271 33.355 110.087 1.00 21.22 C ATOM 1367 CG TRP A 151 90.612 33.427 110.685 1.00 19.67 C ATOM 1368 CD1 TRP A 151 91.656 32.598 110.409 1.00 22.09 C ATOM 1369 CD2 TRP A 151 91.129 34.449 111.555 1.00 21.92 C ATOM 1370 NE1 TRP A 151 92.781 33.014 111.077 1.00 22.78 N ATOM 1371 CE2 TRP A 151 92.484 34.142 111.792 1.00 24.57 C ATOM 1372 CE3 TRP A 151 90.572 35.578 112.170 1.00 23.57 C ATOM 1373 CZ2 TRP A 151 93.290 34.920 112.631 1.00 24.82 C ATOM 1374 CZ3 TRP A 151 91.368 36.345 112.991 1.00 24.91 C ATOM 1375 CH2 TRP A 151 92.717 36.013 113.213 1.00 25.50 C ATOM 1376 HE1 TRP A 151 93.710 32.547 111.045 1.00 0.00 H ATOM 1377 H TRP A 151 86.805 33.918 109.541 1.00 0.00 H ATOM 1378 N GLU A 152 88.310 33.090 113.310 1.00 19.46 N ATOM 1379 CA GLU A 152 88.064 33.772 114.570 1.00 20.98 C ATOM 1380 C GLU A 152 89.234 33.613 115.533 1.00 24.39 C ATOM 1381 O GLU A 152 89.800 32.522 115.672 1.00 25.89 O ATOM 1382 CB GLU A 152 86.785 33.260 115.212 1.00 22.95 C ATOM 1383 CG GLU A 152 86.402 34.046 116.450 1.00 24.86 C ATOM 1384 CD GLU A 152 84.961 33.833 116.873 1.00 29.66 C ATOM 1385 OE1 GLU A 152 84.289 32.919 116.348 1.00 32.44 O ATOM 1386 OE2 GLU A 152 84.486 34.611 117.728 1.00 30.93 O ATOM 1387 H GLU A 152 88.787 32.166 113.295 1.00 0.00 H ATOM 1388 N SER A 153 89.586 34.709 116.204 1.00 26.04 N ATOM 1389 CA SER A 153 90.723 34.723 117.119 1.00 28.42 C ATOM 1390 C SER A 153 90.393 35.544 118.355 1.00 38.17 C ATOM 1391 O SER A 153 89.867 36.658 118.246 1.00 26.98 O ATOM 1392 CB SER A 153 91.962 35.302 116.441 1.00 33.52 C ATOM 1393 OG SER A 153 92.995 35.523 117.381 1.00 39.49 O ATOM 1394 HG SER A 153 93.238 34.665 117.810 1.00 0.00 H ATOM 1395 H SER A 153 89.034 35.580 116.072 1.00 0.00 H ATOM 1396 N ASN A 154 90.736 35.003 119.527 1.00 43.02 N ATOM 1397 CA ASN A 154 90.533 35.683 120.802 1.00 42.76 C ATOM 1398 C ASN A 154 91.816 36.279 121.353 1.00 47.08 C ATOM 1399 O ASN A 154 91.892 36.546 122.555 1.00 53.42 O ATOM 1400 CB ASN A 154 89.941 34.721 121.835 1.00 46.51 C ATOM 1401 CG ASN A 154 90.900 33.587 122.203 1.00 50.57 C ATOM 1402 OD1 ASN A 154 92.005 33.482 121.665 1.00 46.14 O ATOM 1403 ND2 ASN A 154 90.478 32.741 123.131 1.00 62.01 N ATOM 1404 HD22 ASN A 154 89.539 32.865 123.560 1.00 0.00 H ATOM 1405 HD21 ASN A 154 91.086 31.952 123.431 1.00 0.00 H ATOM 1406 H ASN A 154 91.166 34.056 119.531 1.00 0.00 H ATOM 1407 N ALA A 155 92.829 36.466 120.511 1.00 42.50 N ATOM 1408 CA ALA A 155 94.138 37.009 120.844 1.00 49.79 C ATOM 1409 C ALA A 155 95.068 35.936 121.413 1.00 58.29 C ATOM 1410 O ALA A 155 96.253 36.215 121.607 1.00 58.62 O ATOM 1411 CB ALA A 155 94.076 38.191 121.831 1.00 53.23 C ATOM 1412 H ALA A 155 92.670 36.198 119.519 1.00 0.00 H ATOM 1413 N GLY A 156 94.582 34.724 121.680 1.00 53.35 N ATOM 1414 CA GLY A 156 95.403 33.662 122.221 1.00 46.80 C ATOM 1415 C GLY A 156 96.241 32.982 121.160 1.00 52.50 C ATOM 1416 O GLY A 156 96.511 33.527 120.085 1.00 50.50 O ATOM 1417 H GLY A 156 93.577 34.535 121.493 1.00 0.00 H ATOM 1418 N GLY A 157 96.660 31.760 121.477 1.00 39.09 N ATOM 1419 CA GLY A 157 97.494 31.002 120.573 1.00 37.85 C ATOM 1420 C GLY A 157 96.744 30.190 119.540 1.00 32.31 C ATOM 1421 O GLY A 157 97.381 29.524 118.715 1.00 31.44 O ATOM 1422 H GLY A 157 96.383 31.344 122.389 1.00 0.00 H ATOM 1423 N LYS A 158 95.413 30.215 119.549 1.00 33.64 N ATOM 1424 CA LYS A 158 94.640 29.430 118.590 1.00 31.06 C ATOM 1425 C LYS A 158 93.615 30.294 117.864 1.00 31.60 C ATOM 1426 O LYS A 158 93.160 31.331 118.369 1.00 32.60 O ATOM 1427 CB LYS A 158 93.925 28.265 119.276 1.00 35.54 C ATOM 1428 CG LYS A 158 94.887 27.300 120.002 1.00 43.37 C ATOM 1429 CD LYS A 158 94.149 26.307 120.874 1.00 54.32 C ATOM 1430 CE LYS A 158 95.105 25.520 121.764 1.00 62.40 C ATOM 1431 NZ LYS A 158 95.968 24.596 120.978 1.00 67.92 N ATOM 1432 HZ1 LYS A 158 95.370 23.918 120.464 1.00 0.00 H ATOM 1433 HZ2 LYS A 158 96.534 25.145 120.299 1.00 0.00 H ATOM 1434 HZ3 LYS A 158 96.601 24.082 121.623 1.00 0.00 H ATOM 1435 H LYS A 158 94.916 30.802 120.249 1.00 0.00 H ATOM 1436 N PHE A 159 93.255 29.844 116.662 1.00 28.38 N ATOM 1437 CA PHE A 159 92.160 30.433 115.905 1.00 24.37 C ATOM 1438 C PHE A 159 91.299 29.314 115.339 1.00 26.40 C ATOM 1439 O PHE A 159 91.715 28.157 115.269 1.00 25.81 O ATOM 1440 CB PHE A 159 92.673 31.361 114.791 1.00 22.83 C ATOM 1441 CG PHE A 159 93.415 30.673 113.679 1.00 24.17 C ATOM 1442 CD1 PHE A 159 92.740 30.197 112.569 1.00 23.34 C ATOM 1443 CD2 PHE A 159 94.795 30.574 113.707 1.00 25.49 C ATOM 1444 CE1 PHE A 159 93.435 29.615 111.521 1.00 26.23 C ATOM 1445 CE2 PHE A 159 95.491 29.991 112.675 1.00 28.66 C ATOM 1446 CZ PHE A 159 94.811 29.518 111.570 1.00 30.69 C ATOM 1447 H PHE A 159 93.775 29.043 116.250 1.00 0.00 H ATOM 1448 N THR A 160 90.072 29.656 114.957 1.00 24.77 N ATOM 1449 CA THR A 160 89.189 28.675 114.342 1.00 23.06 C ATOM 1450 C THR A 160 88.791 29.139 112.951 1.00 24.72 C ATOM 1451 O THR A 160 88.807 30.335 112.656 1.00 21.03 O ATOM 1452 CB THR A 160 87.934 28.444 115.170 1.00 26.77 C ATOM 1453 OG1 THR A 160 87.201 29.667 115.294 1.00 24.55 O ATOM 1454 CG2 THR A 160 88.315 27.946 116.565 1.00 25.79 C ATOM 1455 HG1 THR A 160 86.944 29.989 114.394 1.00 0.00 H ATOM 1456 H THR A 160 89.741 30.632 115.099 1.00 0.00 H ATOM 1457 N VAL A 161 88.446 28.173 112.099 1.00 21.40 N ATOM 1458 CA VAL A 161 87.861 28.431 110.790 1.00 21.44 C ATOM 1459 C VAL A 161 86.627 27.552 110.665 1.00 25.50 C ATOM 1460 O VAL A 161 86.713 26.324 110.822 1.00 26.35 O ATOM 1461 CB VAL A 161 88.843 28.165 109.636 1.00 23.89 C ATOM 1462 CG1 VAL A 161 88.183 28.433 108.304 1.00 27.35 C ATOM 1463 CG2 VAL A 161 90.065 29.040 109.803 1.00 25.55 C ATOM 1464 H VAL A 161 88.603 27.185 112.383 1.00 0.00 H ATOM 1465 N THR A 162 85.494 28.176 110.372 1.00 20.03 N ATOM 1466 CA THR A 162 84.192 27.524 110.350 1.00 23.76 C ATOM 1467 C THR A 162 83.425 27.942 109.104 1.00 23.04 C ATOM 1468 O THR A 162 83.426 29.124 108.745 1.00 21.27 O ATOM 1469 CB THR A 162 83.381 27.937 111.580 1.00 27.17 C ATOM 1470 OG1 THR A 162 84.168 27.766 112.767 1.00 27.91 O ATOM 1471 CG2 THR A 162 82.106 27.138 111.669 1.00 30.99 C ATOM 1472 HG1 THR A 162 84.980 28.329 112.707 1.00 0.00 H ATOM 1473 H THR A 162 85.538 29.190 110.145 1.00 0.00 H ATOM 1474 N LEU A 163 82.765 26.982 108.454 1.00 21.34 N ATOM 1475 CA LEU A 163 81.823 27.309 107.389 1.00 22.88 C ATOM 1476 C LEU A 163 80.804 28.307 107.912 1.00 20.57 C ATOM 1477 O LEU A 163 80.241 28.114 108.992 1.00 20.53 O ATOM 1478 CB LEU A 163 81.111 26.039 106.901 1.00 23.23 C ATOM 1479 CG LEU A 163 80.136 26.186 105.738 1.00 23.45 C ATOM 1480 CD1 LEU A 163 80.858 26.600 104.477 1.00 25.70 C ATOM 1481 CD2 LEU A 163 79.341 24.885 105.542 1.00 26.23 C ATOM 1482 H LEU A 163 82.924 25.987 108.710 1.00 0.00 H ATOM 1483 N ASP A 164 80.587 29.387 107.158 1.00 19.46 N ATOM 1484 CA ASP A 164 79.789 30.504 107.652 1.00 19.30 C ATOM 1485 C ASP A 164 78.319 30.213 107.401 1.00 19.33 C ATOM 1486 O ASP A 164 77.849 30.284 106.258 1.00 19.66 O ATOM 1487 CB ASP A 164 80.184 31.808 106.974 1.00 21.29 C ATOM 1488 CG ASP A 164 79.485 33.006 107.593 1.00 19.56 C ATOM 1489 OD1 ASP A 164 78.405 32.828 108.197 1.00 19.56 O ATOM 1490 OD2 ASP A 164 80.011 34.118 107.488 1.00 18.63 O ATOM 1491 H ASP A 164 80.994 29.433 106.202 1.00 0.00 H ATOM 1492 N GLU A 165 77.588 29.916 108.475 1.00 21.55 N ATOM 1493 CA GLU A 165 76.151 29.685 108.400 1.00 22.89 C ATOM 1494 C GLU A 165 75.385 30.659 109.299 1.00 22.37 C ATOM 1495 O GLU A 165 74.216 30.406 109.644 1.00 22.58 O ATOM 1496 CB GLU A 165 75.847 28.224 108.757 1.00 23.60 C ATOM 1497 CG GLU A 165 76.501 27.235 107.795 1.00 25.97 C ATOM 1498 CD GLU A 165 76.236 25.768 108.140 1.00 27.72 C ATOM 1499 OE1 GLU A 165 76.440 25.380 109.299 1.00 31.97 O ATOM 1500 OE2 GLU A 165 75.833 25.015 107.234 1.00 34.65 O ATOM 1501 H GLU A 165 78.060 29.847 109.399 1.00 0.00 H ATOM 1502 N THR A 166 76.019 31.775 109.676 1.00 20.58 N ATOM 1503 CA THR A 166 75.413 32.734 110.598 1.00 20.61 C ATOM 1504 C THR A 166 75.557 34.203 110.219 1.00 20.73 C ATOM 1505 O THR A 166 74.910 35.028 110.872 1.00 20.15 O ATOM 1506 CB THR A 166 75.994 32.563 112.003 1.00 21.64 C ATOM 1507 OG1 THR A 166 77.407 32.736 111.963 1.00 23.16 O ATOM 1508 CG2 THR A 166 75.659 31.193 112.596 1.00 25.56 C ATOM 1509 HG1 THR A 166 77.804 32.060 111.359 1.00 0.00 H ATOM 1510 H THR A 166 76.971 31.966 109.302 1.00 0.00 H ATOM 1511 N ASN A 167 76.378 34.584 109.238 1.00 19.37 N ATOM 1512 CA ASN A 167 76.530 35.995 108.883 1.00 18.02 C ATOM 1513 C ASN A 167 75.895 36.320 107.540 1.00 21.22 C ATOM 1514 O ASN A 167 75.637 35.443 106.714 1.00 21.31 O ATOM 1515 CB ASN A 167 78.008 36.396 108.852 1.00 20.82 C ATOM 1516 CG ASN A 167 78.651 36.213 110.176 1.00 25.24 C ATOM 1517 OD1 ASN A 167 78.274 36.875 111.156 1.00 23.70 O ATOM 1518 ND2 ASN A 167 79.587 35.269 110.253 1.00 20.97 N ATOM 1519 HD22 ASN A 167 79.867 34.743 109.400 1.00 0.00 H ATOM 1520 HD21 ASN A 167 80.039 35.058 111.166 1.00 0.00 H ATOM 1521 H ASN A 167 76.919 33.865 108.717 1.00 0.00 H ATOM 1522 N GLU A 168 75.671 37.616 107.318 1.00 21.01 N ATOM 1523 CA GLU A 168 75.177 38.074 106.024 1.00 19.98 C ATOM 1524 C GLU A 168 76.093 37.568 104.913 1.00 19.95 C ATOM 1525 O GLU A 168 77.315 37.493 105.085 1.00 19.31 O ATOM 1526 CB GLU A 168 75.106 39.609 105.993 1.00 21.94 C ATOM 1527 CG GLU A 168 74.704 40.195 104.635 1.00 25.51 C ATOM 1528 CD GLU A 168 74.674 41.725 104.623 1.00 29.50 C ATOM 1529 OE1 GLU A 168 74.905 42.347 105.680 1.00 29.00 O ATOM 1530 OE2 GLU A 168 74.415 42.309 103.549 1.00 31.65 O ATOM 1531 H GLU A 168 75.850 38.307 108.075 1.00 0.00 H ATOM 1532 N ARG A 169 75.499 37.218 103.774 1.00 20.06 N ATOM 1533 CA ARG A 169 76.311 36.834 102.620 1.00 19.26 C ATOM 1534 C ARG A 169 77.062 38.046 102.087 1.00 19.60 C ATOM 1535 O ARG A 169 76.469 39.111 101.871 1.00 20.44 O ATOM 1536 CB ARG A 169 75.451 36.241 101.508 1.00 18.85 C ATOM 1537 CG ARG A 169 74.626 35.022 101.892 1.00 21.26 C ATOM 1538 CD ARG A 169 75.493 33.857 102.312 1.00 21.08 C ATOM 1539 NE ARG A 169 75.739 33.873 103.751 1.00 19.09 N ATOM 1540 CZ ARG A 169 76.422 32.937 104.387 1.00 19.03 C ATOM 1541 NH1 ARG A 169 76.930 31.912 103.710 1.00 21.57 N ATOM 1542 NH2 ARG A 169 76.578 33.015 105.696 1.00 20.30 N ATOM 1543 HE ARG A 169 75.356 34.664 104.306 1.00 0.00 H ATOM 1544 HH12 ARG A 169 77.468 31.175 104.209 1.00 0.00 H ATOM 1545 HH11 ARG A 169 76.790 31.847 102.682 1.00 0.00 H ATOM 1546 HH22 ARG A 169 77.115 32.281 106.200 1.00 0.00 H ATOM 1547 HH21 ARG A 169 76.164 33.811 106.223 1.00 0.00 H ATOM 1548 H ARG A 169 74.461 37.218 103.705 1.00 0.00 H ATOM 1549 N LEU A 170 78.361 37.877 101.841 1.00 19.05 N ATOM 1550 CA LEU A 170 79.173 38.966 101.307 1.00 19.84 C ATOM 1551 C LEU A 170 79.111 39.076 99.798 1.00 21.00 C ATOM 1552 O LEU A 170 79.417 40.144 99.259 1.00 21.88 O ATOM 1553 CB LEU A 170 80.638 38.777 101.708 1.00 18.72 C ATOM 1554 CG LEU A 170 80.923 38.799 103.221 1.00 17.45 C ATOM 1555 CD1 LEU A 170 82.419 38.728 103.493 1.00 20.51 C ATOM 1556 CD2 LEU A 170 80.364 40.048 103.853 1.00 22.57 C ATOM 1557 H LEU A 170 78.803 36.955 102.032 1.00 0.00 H ATOM 1558 N GLY A 171 78.782 37.992 99.106 1.00 19.41 N ATOM 1559 CA GLY A 171 78.790 38.012 97.652 1.00 21.71 C ATOM 1560 C GLY A 171 80.197 37.708 97.199 1.00 18.73 C ATOM 1561 O GLY A 171 80.460 36.662 96.592 1.00 19.35 O ATOM 1562 H GLY A 171 78.516 37.121 99.608 1.00 0.00 H ATOM 1563 N ARG A 172 81.116 38.603 97.558 1.00 18.13 N ATOM 1564 CA ARG A 172 82.551 38.411 97.393 1.00 16.30 C ATOM 1565 C ARG A 172 83.251 39.440 98.259 1.00 17.08 C ATOM 1566 O ARG A 172 82.811 40.594 98.322 1.00 18.22 O ATOM 1567 CB ARG A 172 82.989 38.586 95.932 1.00 18.20 C ATOM 1568 CG ARG A 172 84.471 38.280 95.693 1.00 17.88 C ATOM 1569 CD ARG A 172 84.957 38.852 94.363 1.00 18.12 C ATOM 1570 NE ARG A 172 84.826 40.307 94.340 1.00 16.76 N ATOM 1571 CZ ARG A 172 83.940 40.988 93.621 1.00 19.09 C ATOM 1572 NH1 ARG A 172 83.098 40.360 92.796 1.00 20.64 N ATOM 1573 NH2 ARG A 172 83.900 42.315 93.714 1.00 19.45 N ATOM 1574 HE ARG A 172 85.480 40.855 94.935 1.00 0.00 H ATOM 1575 HH12 ARG A 172 82.410 40.907 92.240 1.00 0.00 H ATOM 1576 HH11 ARG A 172 83.130 39.324 92.710 1.00 0.00 H ATOM 1577 HH22 ARG A 172 83.209 42.855 93.154 1.00 0.00 H ATOM 1578 HH21 ARG A 172 84.559 42.812 94.346 1.00 0.00 H ATOM 1579 H ARG A 172 80.789 39.494 97.982 1.00 0.00 H ATOM 1580 N GLY A 173 84.341 39.027 98.902 1.00 17.45 N ATOM 1581 CA GLY A 173 85.154 39.936 99.687 1.00 17.76 C ATOM 1582 C GLY A 173 85.341 39.485 101.118 1.00 16.25 C ATOM 1583 O GLY A 173 85.234 38.301 101.439 1.00 17.85 O ATOM 1584 H GLY A 173 84.617 38.026 98.840 1.00 0.00 H ATOM 1585 N THR A 174 85.637 40.438 101.990 1.00 16.11 N ATOM 1586 CA THR A 174 86.052 40.155 103.346 1.00 16.53 C ATOM 1587 C THR A 174 85.436 41.194 104.271 1.00 17.81 C ATOM 1588 O THR A 174 85.377 42.387 103.937 1.00 17.71 O ATOM 1589 CB THR A 174 87.581 40.166 103.469 1.00 18.16 C ATOM 1590 OG1 THR A 174 88.136 39.169 102.592 1.00 16.46 O ATOM 1591 CG2 THR A 174 88.045 39.844 104.875 1.00 17.59 C ATOM 1592 HG1 THR A 174 87.789 38.277 102.846 1.00 0.00 H ATOM 1593 H THR A 174 85.568 41.430 101.687 1.00 0.00 H ATOM 1594 N MET A 175 85.007 40.747 105.443 1.00 16.38 N ATOM 1595 CA MET A 175 84.596 41.669 106.496 1.00 17.83 C ATOM 1596 C MET A 175 85.314 41.307 107.785 1.00 18.16 C ATOM 1597 O MET A 175 85.202 40.172 108.278 1.00 17.64 O ATOM 1598 CB MET A 175 83.076 41.677 106.701 1.00 18.86 C ATOM 1599 CG MET A 175 82.637 42.803 107.652 1.00 19.35 C ATOM 1600 SD MET A 175 80.864 43.180 107.572 1.00 18.26 S ATOM 1601 CE MET A 175 80.161 41.656 108.205 1.00 20.26 C ATOM 1602 H MET A 175 84.963 39.722 105.614 1.00 0.00 H ATOM 1603 N LEU A 176 86.045 42.272 108.319 1.00 16.80 N ATOM 1604 CA LEU A 176 86.628 42.163 109.646 1.00 17.24 C ATOM 1605 C LEU A 176 85.612 42.677 110.652 1.00 18.98 C ATOM 1606 O LEU A 176 85.029 43.746 110.453 1.00 19.88 O ATOM 1607 CB LEU A 176 87.921 42.978 109.741 1.00 18.81 C ATOM 1608 CG LEU A 176 89.217 42.246 109.371 1.00 21.44 C ATOM 1609 CD1 LEU A 176 89.163 41.764 107.928 1.00 21.88 C ATOM 1610 CD2 LEU A 176 90.395 43.171 109.597 1.00 21.89 C ATOM 1611 H LEU A 176 86.208 43.140 107.769 1.00 0.00 H ATOM 1612 N ARG A 177 85.388 41.906 111.711 1.00 17.87 N ATOM 1613 CA ARG A 177 84.533 42.302 112.821 1.00 20.57 C ATOM 1614 C ARG A 177 85.420 42.462 114.050 1.00 19.40 C ATOM 1615 O ARG A 177 85.894 41.472 114.603 1.00 17.94 O ATOM 1616 CB ARG A 177 83.439 41.262 113.043 1.00 21.76 C ATOM 1617 CG ARG A 177 82.437 41.643 114.089 1.00 23.64 C ATOM 1618 CD ARG A 177 81.294 40.640 114.109 1.00 29.27 C ATOM 1619 NE ARG A 177 80.409 40.767 112.943 1.00 23.84 N ATOM 1620 CZ ARG A 177 79.719 39.750 112.420 1.00 28.20 C ATOM 1621 NH1 ARG A 177 79.839 38.514 112.913 1.00 25.09 N ATOM 1622 NH2 ARG A 177 78.916 39.958 111.389 1.00 27.70 N ATOM 1623 HE ARG A 177 80.314 41.703 112.499 1.00 0.00 H ATOM 1624 HH12 ARG A 177 79.295 37.732 112.495 1.00 0.00 H ATOM 1625 HH11 ARG A 177 80.476 38.334 113.715 1.00 0.00 H ATOM 1626 HH22 ARG A 177 78.378 39.167 110.981 1.00 0.00 H ATOM 1627 HH21 ARG A 177 78.823 40.913 110.987 1.00 0.00 H ATOM 1628 H ARG A 177 85.846 40.973 111.749 1.00 0.00 H ATOM 1629 N LEU A 178 85.642 43.702 114.458 1.00 18.82 N ATOM 1630 CA LEU A 178 86.541 44.041 115.556 1.00 19.41 C ATOM 1631 C LEU A 178 85.724 44.238 116.821 1.00 19.84 C ATOM 1632 O LEU A 178 84.870 45.132 116.874 1.00 20.77 O ATOM 1633 CB LEU A 178 87.313 45.324 115.272 1.00 18.50 C ATOM 1634 CG LEU A 178 88.083 45.420 113.964 1.00 23.38 C ATOM 1635 CD1 LEU A 178 88.982 46.631 114.043 1.00 26.46 C ATOM 1636 CD2 LEU A 178 88.877 44.196 113.719 1.00 22.58 C ATOM 1637 H LEU A 178 85.149 44.476 113.969 1.00 0.00 H ATOM 1638 N PHE A 179 85.997 43.426 117.832 1.00 18.84 N ATOM 1639 CA PHE A 179 85.347 43.578 119.133 1.00 19.65 C ATOM 1640 C PHE A 179 86.223 44.525 119.945 1.00 23.00 C ATOM 1641 O PHE A 179 87.280 44.145 120.452 1.00 23.99 O ATOM 1642 CB PHE A 179 85.149 42.221 119.798 1.00 23.33 C ATOM 1643 CG PHE A 179 84.190 41.322 119.056 1.00 24.29 C ATOM 1644 CD1 PHE A 179 84.575 40.653 117.903 1.00 24.51 C ATOM 1645 CD2 PHE A 179 82.891 41.167 119.496 1.00 28.04 C ATOM 1646 CE1 PHE A 179 83.682 39.842 117.222 1.00 23.70 C ATOM 1647 CE2 PHE A 179 81.998 40.361 118.808 1.00 28.94 C ATOM 1648 CZ PHE A 179 82.401 39.696 117.672 1.00 26.77 C ATOM 1649 H PHE A 179 86.690 42.662 117.697 1.00 0.00 H ATOM 1650 N LEU A 180 85.811 45.783 120.002 1.00 21.66 N ATOM 1651 CA LEU A 180 86.663 46.838 120.518 1.00 21.11 C ATOM 1652 C LEU A 180 86.864 46.695 122.016 1.00 23.80 C ATOM 1653 O LEU A 180 85.958 46.286 122.752 1.00 21.79 O ATOM 1654 CB LEU A 180 86.062 48.210 120.223 1.00 22.05 C ATOM 1655 CG LEU A 180 85.898 48.565 118.745 1.00 22.66 C ATOM 1656 CD1 LEU A 180 85.238 49.916 118.650 1.00 23.31 C ATOM 1657 CD2 LEU A 180 87.243 48.579 118.067 1.00 24.44 C ATOM 1658 H LEU A 180 84.855 46.020 119.669 1.00 0.00 H ATOM 1659 N LYS A 181 88.073 47.045 122.454 1.00 22.41 N ATOM 1660 CA LYS A 181 88.371 47.169 123.879 1.00 25.74 C ATOM 1661 C LYS A 181 87.522 48.280 124.484 1.00 26.47 C ATOM 1662 O LYS A 181 87.138 49.236 123.807 1.00 24.15 O ATOM 1663 CB LYS A 181 89.858 47.478 124.107 1.00 26.49 C ATOM 1664 CG LYS A 181 90.849 46.425 123.643 1.00 24.81 C ATOM 1665 CD LYS A 181 92.289 46.992 123.614 1.00 28.10 C ATOM 1666 CE LYS A 181 93.311 45.988 123.139 1.00 31.58 C ATOM 1667 NZ LYS A 181 94.703 46.581 123.124 1.00 33.55 N ATOM 1668 HZ1 LYS A 181 94.723 47.400 122.484 1.00 0.00 H ATOM 1669 HZ2 LYS A 181 94.960 46.884 124.085 1.00 0.00 H ATOM 1670 HZ3 LYS A 181 95.380 45.865 122.793 1.00 0.00 H ATOM 1671 H LYS A 181 88.826 47.235 121.762 1.00 0.00 H ATOM 1672 N GLU A 182 87.259 48.175 125.792 1.00 25.85 N ATOM 1673 CA GLU A 182 86.316 49.095 126.414 1.00 29.58 C ATOM 1674 C GLU A 182 86.815 50.532 126.397 1.00 28.65 C ATOM 1675 O GLU A 182 86.003 51.461 126.418 1.00 29.65 O ATOM 1676 CB GLU A 182 86.012 48.654 127.851 1.00 30.22 C ATOM 1677 CG GLU A 182 85.256 47.332 127.951 1.00 30.90 C ATOM 1678 CD GLU A 182 83.868 47.361 127.309 1.00 31.97 C ATOM 1679 OE1 GLU A 182 83.317 48.455 127.071 1.00 34.16 O ATOM 1680 OE2 GLU A 182 83.319 46.274 127.038 1.00 36.15 O ATOM 1681 H GLU A 182 87.725 47.440 126.362 1.00 0.00 H ATOM 1682 N ASP A 183 88.127 50.755 126.331 1.00 27.26 N ATOM 1683 CA ASP A 183 88.622 52.125 126.271 1.00 27.71 C ATOM 1684 C ASP A 183 88.859 52.610 124.845 1.00 27.57 C ATOM 1685 O ASP A 183 89.410 53.694 124.659 1.00 26.07 O ATOM 1686 CB ASP A 183 89.900 52.295 127.102 1.00 31.97 C ATOM 1687 CG ASP A 183 91.086 51.493 126.575 1.00 35.99 C ATOM 1688 OD1 ASP A 183 90.898 50.500 125.842 1.00 31.75 O ATOM 1689 OD2 ASP A 183 92.231 51.845 126.949 1.00 39.64 O ATOM 1690 H ASP A 183 88.794 49.957 126.322 1.00 0.00 H ATOM 1691 N GLN A 184 88.412 51.859 123.838 1.00 27.85 N ATOM 1692 CA GLN A 184 88.637 52.231 122.445 1.00 25.96 C ATOM 1693 C GLN A 184 87.329 52.428 121.689 1.00 27.10 C ATOM 1694 O GLN A 184 87.295 52.275 120.470 1.00 24.65 O ATOM 1695 CB GLN A 184 89.498 51.173 121.756 1.00 24.62 C ATOM 1696 CG GLN A 184 90.838 50.983 122.407 1.00 25.18 C ATOM 1697 CD GLN A 184 91.690 52.218 122.347 1.00 29.95 C ATOM 1698 OE1 GLN A 184 91.702 52.938 121.348 1.00 26.70 O ATOM 1699 NE2 GLN A 184 92.420 52.483 123.433 1.00 31.49 N ATOM 1700 HE22 GLN A 184 92.379 51.847 124.255 1.00 0.00 H ATOM 1701 HE21 GLN A 184 93.029 53.325 123.457 1.00 0.00 H ATOM 1702 H GLN A 184 87.889 50.985 124.051 1.00 0.00 H ATOM 1703 N LEU A 185 86.247 52.781 122.390 1.00 23.70 N ATOM 1704 CA LEU A 185 84.945 52.922 121.746 1.00 23.70 C ATOM 1705 C LEU A 185 84.805 54.195 120.928 1.00 24.04 C ATOM 1706 O LEU A 185 83.813 54.340 120.192 1.00 23.82 O ATOM 1707 CB LEU A 185 83.834 52.834 122.800 1.00 26.20 C ATOM 1708 CG LEU A 185 83.872 51.542 123.622 1.00 28.15 C ATOM 1709 CD1 LEU A 185 82.752 51.523 124.658 1.00 30.22 C ATOM 1710 CD2 LEU A 185 83.786 50.298 122.729 1.00 27.34 C ATOM 1711 H LEU A 185 86.334 52.958 123.411 1.00 0.00 H ATOM 1712 N GLU A 186 85.801 55.084 120.957 1.00 23.26 N ATOM 1713 CA GLU A 186 85.769 56.242 120.086 1.00 24.66 C ATOM 1714 C GLU A 186 85.709 55.845 118.613 1.00 23.92 C ATOM 1715 O GLU A 186 85.203 56.622 117.802 1.00 23.50 O ATOM 1716 CB GLU A 186 86.995 57.128 120.338 1.00 24.85 C ATOM 1717 CG GLU A 186 88.291 56.540 119.843 1.00 22.41 C ATOM 1718 CD GLU A 186 89.509 57.211 120.445 1.00 27.39 C ATOM 1719 OE1 GLU A 186 90.265 57.863 119.691 1.00 25.14 O ATOM 1720 OE2 GLU A 186 89.698 57.079 121.683 1.00 28.35 O ATOM 1721 H GLU A 186 86.602 54.945 121.606 1.00 0.00 H ATOM 1722 N TYR A 187 86.188 54.646 118.253 1.00 22.23 N ATOM 1723 CA TYR A 187 86.200 54.245 116.853 1.00 21.28 C ATOM 1724 C TYR A 187 84.847 53.733 116.377 1.00 21.49 C ATOM 1725 O TYR A 187 84.751 53.266 115.235 1.00 22.72 O ATOM 1726 CB TYR A 187 87.311 53.217 116.617 1.00 20.64 C ATOM 1727 CG TYR A 187 88.652 53.837 116.960 1.00 19.27 C ATOM 1728 CD1 TYR A 187 89.193 54.839 116.160 1.00 22.41 C ATOM 1729 CD2 TYR A 187 89.330 53.490 118.106 1.00 21.84 C ATOM 1730 CE1 TYR A 187 90.385 55.449 116.477 1.00 24.88 C ATOM 1731 CE2 TYR A 187 90.540 54.106 118.436 1.00 21.56 C ATOM 1732 CZ TYR A 187 91.051 55.081 117.617 1.00 24.88 C ATOM 1733 OH TYR A 187 92.243 55.696 117.942 1.00 26.57 O ATOM 1734 HH TYR A 187 92.154 56.142 118.821 1.00 0.00 H ATOM 1735 H TYR A 187 86.554 53.997 118.979 1.00 0.00 H ATOM 1736 N LEU A 188 83.806 53.829 117.212 1.00 21.50 N ATOM 1737 CA LEU A 188 82.430 53.654 116.761 1.00 22.68 C ATOM 1738 C LEU A 188 81.766 54.955 116.324 1.00 23.59 C ATOM 1739 O LEU A 188 80.664 54.911 115.766 1.00 24.18 O ATOM 1740 CB LEU A 188 81.592 53.029 117.871 1.00 23.69 C ATOM 1741 CG LEU A 188 82.076 51.692 118.414 1.00 24.31 C ATOM 1742 CD1 LEU A 188 81.388 51.394 119.749 1.00 27.62 C ATOM 1743 CD2 LEU A 188 81.812 50.597 117.398 1.00 23.97 C ATOM 1744 H LEU A 188 83.984 54.035 118.216 1.00 0.00 H ATOM 1745 N GLU A 189 82.416 56.099 116.541 1.00 23.47 N ATOM 1746 CA GLU A 189 81.810 57.404 116.318 1.00 24.36 C ATOM 1747 C GLU A 189 82.079 57.899 114.904 1.00 24.19 C ATOM 1748 O GLU A 189 83.224 57.872 114.435 1.00 24.26 O ATOM 1749 CB GLU A 189 82.351 58.419 117.324 1.00 26.51 C ATOM 1750 CG GLU A 189 82.002 58.114 118.760 1.00 26.27 C ATOM 1751 CD GLU A 189 80.514 58.159 119.017 1.00 28.97 C ATOM 1752 OE1 GLU A 189 79.836 59.064 118.484 1.00 37.57 O ATOM 1753 OE2 GLU A 189 80.019 57.275 119.736 1.00 31.31 O ATOM 1754 H GLU A 189 83.397 56.057 116.884 1.00 0.00 H ATOM 1755 N GLU A 190 81.024 58.374 114.247 1.00 22.34 N ATOM 1756 CA GLU A 190 81.124 58.901 112.889 1.00 24.97 C ATOM 1757 C GLU A 190 82.233 59.942 112.767 1.00 25.41 C ATOM 1758 O GLU A 190 83.071 59.872 111.864 1.00 23.16 O ATOM 1759 CB GLU A 190 79.773 59.496 112.462 1.00 25.24 C ATOM 1760 CG GLU A 190 79.794 60.119 111.076 1.00 27.47 C ATOM 1761 CD GLU A 190 78.479 60.767 110.678 1.00 28.68 C ATOM 1762 OE1 GLU A 190 77.601 60.930 111.561 1.00 29.04 O ATOM 1763 OE2 GLU A 190 78.340 61.118 109.484 1.00 29.01 O ATOM 1764 H GLU A 190 80.096 58.370 114.717 1.00 0.00 H ATOM 1765 N LYS A 191 82.245 60.930 113.662 1.00 25.71 N ATOM 1766 CA LYS A 191 83.223 62.010 113.564 1.00 26.30 C ATOM 1767 C LYS A 191 84.645 61.474 113.655 1.00 25.86 C ATOM 1768 O LYS A 191 85.511 61.851 112.863 1.00 25.96 O ATOM 1769 CB LYS A 191 82.951 63.043 114.663 1.00 31.12 C ATOM 1770 CG LYS A 191 83.903 64.227 114.716 1.00 42.31 C ATOM 1771 CD LYS A 191 83.563 65.112 115.924 1.00 48.64 C ATOM 1772 CE LYS A 191 84.636 66.152 116.203 1.00 49.14 C ATOM 1773 NZ LYS A 191 84.368 66.864 117.483 1.00 53.06 N ATOM 1774 HZ1 LYS A 191 83.446 67.342 117.426 1.00 0.00 H ATOM 1775 HZ2 LYS A 191 84.356 66.178 118.264 1.00 0.00 H ATOM 1776 HZ3 LYS A 191 85.115 67.568 117.650 1.00 0.00 H ATOM 1777 H LYS A 191 81.552 60.932 114.437 1.00 0.00 H ATOM 1778 N ARG A 192 84.895 60.573 114.606 1.00 24.15 N ATOM 1779 CA ARG A 192 86.228 60.014 114.790 1.00 25.28 C ATOM 1780 C ARG A 192 86.652 59.184 113.587 1.00 22.09 C ATOM 1781 O ARG A 192 87.786 59.295 113.109 1.00 21.15 O ATOM 1782 CB ARG A 192 86.260 59.172 116.065 1.00 23.82 C ATOM 1783 CG ARG A 192 87.635 58.608 116.409 1.00 25.42 C ATOM 1784 CD ARG A 192 88.583 59.701 116.952 1.00 28.08 C ATOM 1785 NE ARG A 192 89.894 59.131 117.243 1.00 25.89 N ATOM 1786 CZ ARG A 192 91.038 59.453 116.649 1.00 25.13 C ATOM 1787 NH1 ARG A 192 91.105 60.413 115.732 1.00 31.13 N ATOM 1788 NH2 ARG A 192 92.138 58.816 117.006 1.00 28.59 N ATOM 1789 HE ARG A 192 89.937 58.404 117.985 1.00 0.00 H ATOM 1790 HH12 ARG A 192 92.015 60.642 115.285 1.00 0.00 H ATOM 1791 HH11 ARG A 192 90.247 60.935 115.462 1.00 0.00 H ATOM 1792 HH22 ARG A 192 93.045 59.051 116.555 1.00 0.00 H ATOM 1793 HH21 ARG A 192 92.098 58.079 117.739 1.00 0.00 H ATOM 1794 H ARG A 192 84.122 60.263 115.229 1.00 0.00 H ATOM 1795 N ILE A 193 85.758 58.333 113.083 1.00 22.22 N ATOM 1796 CA ILE A 193 86.110 57.511 111.934 1.00 22.16 C ATOM 1797 C ILE A 193 86.484 58.404 110.757 1.00 22.57 C ATOM 1798 O ILE A 193 87.493 58.177 110.080 1.00 22.38 O ATOM 1799 CB ILE A 193 84.959 56.549 111.587 1.00 21.47 C ATOM 1800 CG1 ILE A 193 84.784 55.504 112.707 1.00 21.53 C ATOM 1801 CG2 ILE A 193 85.213 55.874 110.223 1.00 21.72 C ATOM 1802 CD1 ILE A 193 83.463 54.748 112.669 1.00 21.41 C ATOM 1803 H ILE A 193 84.812 58.257 113.509 1.00 0.00 H ATOM 1804 N LYS A 194 85.678 59.440 110.500 1.00 23.40 N ATOM 1805 CA LYS A 194 85.975 60.348 109.391 1.00 23.56 C ATOM 1806 C LYS A 194 87.364 60.953 109.539 1.00 24.15 C ATOM 1807 O LYS A 194 88.115 61.063 108.557 1.00 24.80 O ATOM 1808 CB LYS A 194 84.952 61.478 109.322 1.00 29.20 C ATOM 1809 CG LYS A 194 83.621 61.147 108.710 1.00 34.19 C ATOM 1810 CD LYS A 194 82.873 62.455 108.399 1.00 42.84 C ATOM 1811 CE LYS A 194 81.365 62.337 108.613 1.00 54.99 C ATOM 1812 NZ LYS A 194 80.692 61.361 107.702 1.00 57.62 N ATOM 1813 HZ1 LYS A 194 80.839 61.652 106.714 1.00 0.00 H ATOM 1814 HZ2 LYS A 194 81.097 60.415 107.850 1.00 0.00 H ATOM 1815 HZ3 LYS A 194 79.673 61.340 107.910 1.00 0.00 H ATOM 1816 H LYS A 194 84.837 59.601 111.090 1.00 0.00 H ATOM 1817 N GLU A 195 87.701 61.387 110.763 1.00 25.94 N ATOM 1818 CA GLU A 195 89.000 62.014 111.032 1.00 26.42 C ATOM 1819 C GLU A 195 90.144 61.090 110.657 1.00 27.42 C ATOM 1820 O GLU A 195 91.108 61.504 110.000 1.00 24.29 O ATOM 1821 CB GLU A 195 89.134 62.390 112.520 1.00 31.12 C ATOM 1822 CG GLU A 195 88.233 63.497 113.013 1.00 38.96 C ATOM 1823 CD GLU A 195 88.241 63.639 114.544 1.00 40.79 C ATOM 1824 OE1 GLU A 195 88.959 62.875 115.245 1.00 36.84 O ATOM 1825 OE2 GLU A 195 87.511 64.517 115.051 1.00 46.39 O ATOM 1826 H GLU A 195 87.022 61.276 111.543 1.00 0.00 H ATOM 1827 N VAL A 196 90.063 59.834 111.100 1.00 24.38 N ATOM 1828 CA VAL A 196 91.137 58.876 110.902 1.00 22.30 C ATOM 1829 C VAL A 196 91.254 58.523 109.427 1.00 23.08 C ATOM 1830 O VAL A 196 92.357 58.428 108.884 1.00 23.41 O ATOM 1831 CB VAL A 196 90.886 57.630 111.776 1.00 23.29 C ATOM 1832 CG1 VAL A 196 91.904 56.554 111.507 1.00 23.24 C ATOM 1833 CG2 VAL A 196 90.869 58.011 113.281 1.00 25.35 C ATOM 1834 H VAL A 196 89.204 59.531 111.603 1.00 0.00 H ATOM 1835 N VAL A 197 90.117 58.340 108.755 1.00 22.38 N ATOM 1836 CA VAL A 197 90.139 58.027 107.329 1.00 21.90 C ATOM 1837 C VAL A 197 90.785 59.160 106.558 1.00 23.27 C ATOM 1838 O VAL A 197 91.657 58.933 105.714 1.00 23.28 O ATOM 1839 CB VAL A 197 88.715 57.741 106.821 1.00 23.28 C ATOM 1840 CG1 VAL A 197 88.668 57.704 105.295 1.00 26.07 C ATOM 1841 CG2 VAL A 197 88.249 56.426 107.400 1.00 18.95 C ATOM 1842 H VAL A 197 89.206 58.421 109.251 1.00 0.00 H ATOM 1843 N LYS A 198 90.372 60.397 106.838 1.00 25.41 N ATOM 1844 CA LYS A 198 90.891 61.518 106.062 1.00 31.05 C ATOM 1845 C LYS A 198 92.367 61.762 106.349 1.00 27.11 C ATOM 1846 O LYS A 198 93.118 62.162 105.451 1.00 28.57 O ATOM 1847 CB LYS A 198 90.081 62.780 106.344 1.00 29.79 C ATOM 1848 CG LYS A 198 88.662 62.725 105.812 1.00 33.83 C ATOM 1849 CD LYS A 198 87.863 63.907 106.309 1.00 37.50 C ATOM 1850 CE LYS A 198 86.457 63.883 105.764 1.00 45.34 C ATOM 1851 NZ LYS A 198 85.668 65.052 106.241 1.00 61.75 N ATOM 1852 HZ1 LYS A 198 85.620 65.036 107.280 1.00 0.00 H ATOM 1853 HZ2 LYS A 198 86.128 65.930 105.928 1.00 0.00 H ATOM 1854 HZ3 LYS A 198 84.707 65.004 105.847 1.00 0.00 H ATOM 1855 H LYS A 198 89.686 60.561 107.603 1.00 0.00 H ATOM 1856 N LYS A 199 92.804 61.502 107.575 1.00 26.73 N ATOM 1857 CA LYS A 199 94.201 61.727 107.932 1.00 27.76 C ATOM 1858 C LYS A 199 95.116 60.682 107.303 1.00 30.47 C ATOM 1859 O LYS A 199 96.155 61.028 106.721 1.00 28.70 O ATOM 1860 CB LYS A 199 94.351 61.719 109.444 1.00 27.47 C ATOM 1861 CG LYS A 199 95.796 61.804 109.964 1.00 33.18 C ATOM 1862 CD LYS A 199 95.796 62.086 111.468 1.00 38.45 C ATOM 1863 CE LYS A 199 97.171 61.922 112.105 1.00 51.29 C ATOM 1864 NZ LYS A 199 98.100 63.029 111.755 1.00 82.38 N ATOM 1865 HZ1 LYS A 199 98.227 63.060 110.723 1.00 0.00 H ATOM 1866 HZ2 LYS A 199 97.701 63.932 112.083 1.00 0.00 H ATOM 1867 HZ3 LYS A 199 99.019 62.867 112.214 1.00 0.00 H ATOM 1868 H LYS A 199 92.144 61.134 108.289 1.00 0.00 H ATOM 1869 N HIS A 200 94.747 59.399 107.398 1.00 25.06 N ATOM 1870 CA HIS A 200 95.663 58.311 107.078 1.00 26.28 C ATOM 1871 C HIS A 200 95.354 57.586 105.782 1.00 25.89 C ATOM 1872 O HIS A 200 96.223 56.856 105.286 1.00 27.32 O ATOM 1873 CB HIS A 200 95.684 57.283 108.214 1.00 25.85 C ATOM 1874 CG HIS A 200 96.236 57.829 109.488 1.00 27.31 C ATOM 1875 ND1 HIS A 200 97.582 58.047 109.676 1.00 30.02 N ATOM 1876 CD2 HIS A 200 95.627 58.228 110.629 1.00 31.35 C ATOM 1877 CE1 HIS A 200 97.781 58.535 110.888 1.00 30.50 C ATOM 1878 NE2 HIS A 200 96.612 58.662 111.484 1.00 31.93 N ATOM 1879 H HIS A 200 93.781 59.172 107.708 1.00 0.00 H ATOM 1880 N SER A 201 94.170 57.765 105.224 1.00 24.47 N ATOM 1881 CA SER A 201 93.741 57.027 104.033 1.00 24.54 C ATOM 1882 C SER A 201 93.263 57.985 102.951 1.00 23.04 C ATOM 1883 O SER A 201 92.273 57.735 102.244 1.00 24.50 O ATOM 1884 CB SER A 201 92.661 56.008 104.392 1.00 24.07 C ATOM 1885 OG SER A 201 93.161 55.104 105.363 1.00 23.91 O ATOM 1886 HG SER A 201 93.950 54.632 104.997 1.00 0.00 H ATOM 1887 H SER A 201 93.517 58.456 105.646 1.00 0.00 H ATOM 1888 N GLU A 202 94.005 59.083 102.778 1.00 26.47 N ATOM 1889 CA GLU A 202 93.652 60.103 101.795 1.00 29.20 C ATOM 1890 C GLU A 202 93.678 59.564 100.377 1.00 29.38 C ATOM 1891 O GLU A 202 92.849 59.953 99.546 1.00 32.64 O ATOM 1892 CB GLU A 202 94.619 61.285 101.913 1.00 31.54 C ATOM 1893 CG GLU A 202 94.300 62.446 100.977 1.00 37.55 C ATOM 1894 CD GLU A 202 95.240 63.636 101.159 1.00 44.32 C ATOM 1895 OE1 GLU A 202 96.243 63.519 101.899 1.00 44.89 O ATOM 1896 OE2 GLU A 202 94.977 64.687 100.548 1.00 49.09 O ATOM 1897 H GLU A 202 94.857 59.214 103.360 1.00 0.00 H ATOM 1898 N PHE A 203 94.632 58.698 100.068 1.00 22.58 N ATOM 1899 CA PHE A 203 94.871 58.252 98.694 1.00 23.94 C ATOM 1900 C PHE A 203 94.484 56.783 98.579 1.00 21.48 C ATOM 1901 O PHE A 203 95.327 55.895 98.659 1.00 23.84 O ATOM 1902 CB PHE A 203 96.320 58.485 98.292 1.00 27.55 C ATOM 1903 CG PHE A 203 96.728 59.924 98.378 1.00 29.75 C ATOM 1904 CD1 PHE A 203 96.349 60.813 97.395 1.00 30.01 C ATOM 1905 CD2 PHE A 203 97.443 60.391 99.464 1.00 33.82 C ATOM 1906 CE1 PHE A 203 96.707 62.162 97.478 1.00 31.43 C ATOM 1907 CE2 PHE A 203 97.797 61.734 99.548 1.00 34.07 C ATOM 1908 CZ PHE A 203 97.426 62.602 98.564 1.00 31.33 C ATOM 1909 H PHE A 203 95.233 58.321 100.829 1.00 0.00 H ATOM 1910 N VAL A 204 93.203 56.548 98.306 1.00 23.09 N ATOM 1911 CA VAL A 204 92.659 55.207 98.105 1.00 20.98 C ATOM 1912 C VAL A 204 91.832 55.232 96.834 1.00 22.83 C ATOM 1913 O VAL A 204 91.085 56.186 96.607 1.00 24.83 O ATOM 1914 CB VAL A 204 91.808 54.778 99.319 1.00 21.14 C ATOM 1915 CG1 VAL A 204 91.185 53.405 99.126 1.00 22.06 C ATOM 1916 CG2 VAL A 204 92.653 54.753 100.527 1.00 23.14 C ATOM 1917 H VAL A 204 92.557 57.359 98.232 1.00 0.00 H ATOM 1918 N ALA A 205 91.980 54.192 96.000 1.00 19.56 N ATOM 1919 CA ALA A 205 91.393 54.184 94.670 1.00 20.19 C ATOM 1920 C ALA A 205 89.915 53.811 94.673 1.00 25.31 C ATOM 1921 O ALA A 205 89.249 53.956 93.640 1.00 26.43 O ATOM 1922 CB ALA A 205 92.170 53.226 93.768 1.00 20.88 C ATOM 1923 H ALA A 205 92.531 53.367 96.314 1.00 0.00 H ATOM 1924 N TYR A 206 89.384 53.365 95.805 1.00 19.13 N ATOM 1925 CA TYR A 206 88.028 52.852 95.893 1.00 21.12 C ATOM 1926 C TYR A 206 87.227 53.685 96.877 1.00 20.23 C ATOM 1927 O TYR A 206 87.787 54.239 97.825 1.00 20.04 O ATOM 1928 CB TYR A 206 88.045 51.385 96.355 1.00 20.43 C ATOM 1929 CG TYR A 206 89.001 50.559 95.531 1.00 19.17 C ATOM 1930 CD1 TYR A 206 88.617 50.095 94.292 1.00 21.37 C ATOM 1931 CD2 TYR A 206 90.292 50.245 95.982 1.00 18.96 C ATOM 1932 CE1 TYR A 206 89.463 49.364 93.505 1.00 22.14 C ATOM 1933 CE2 TYR A 206 91.153 49.500 95.188 1.00 18.75 C ATOM 1934 CZ TYR A 206 90.726 49.062 93.946 1.00 20.58 C ATOM 1935 OH TYR A 206 91.555 48.327 93.122 1.00 23.99 O ATOM 1936 HH TYR A 206 92.364 48.857 92.912 1.00 0.00 H ATOM 1937 H TYR A 206 89.965 53.384 96.667 1.00 0.00 H ATOM 1938 N PRO A 207 85.918 53.813 96.677 1.00 20.81 N ATOM 1939 CA PRO A 207 85.132 54.585 97.641 1.00 22.84 C ATOM 1940 C PRO A 207 85.188 53.944 99.017 1.00 21.26 C ATOM 1941 O PRO A 207 85.103 52.722 99.160 1.00 21.52 O ATOM 1942 CB PRO A 207 83.716 54.556 97.060 1.00 24.56 C ATOM 1943 CG PRO A 207 83.679 53.321 96.187 1.00 24.77 C ATOM 1944 CD PRO A 207 85.074 53.163 95.655 1.00 21.54 C ATOM 1945 N ILE A 208 85.335 54.788 100.024 1.00 19.99 N ATOM 1946 CA ILE A 208 85.283 54.378 101.421 1.00 21.26 C ATOM 1947 C ILE A 208 83.940 54.871 101.953 1.00 22.19 C ATOM 1948 O ILE A 208 83.725 56.079 102.111 1.00 23.42 O ATOM 1949 CB ILE A 208 86.470 54.935 102.222 1.00 19.37 C ATOM 1950 CG1 ILE A 208 87.811 54.441 101.635 1.00 20.85 C ATOM 1951 CG2 ILE A 208 86.366 54.547 103.690 1.00 21.45 C ATOM 1952 CD1 ILE A 208 89.037 55.091 102.278 1.00 24.69 C ATOM 1953 H ILE A 208 85.495 55.793 99.809 1.00 0.00 H ATOM 1954 N GLN A 209 83.029 53.939 102.190 1.00 18.73 N ATOM 1955 CA GLN A 209 81.664 54.225 102.615 1.00 17.23 C ATOM 1956 C GLN A 209 81.559 54.071 104.120 1.00 23.40 C ATOM 1957 O GLN A 209 82.129 53.148 104.699 1.00 23.90 O ATOM 1958 CB GLN A 209 80.693 53.279 101.919 1.00 20.25 C ATOM 1959 CG GLN A 209 80.674 53.459 100.431 1.00 22.76 C ATOM 1960 CD GLN A 209 80.044 52.283 99.705 1.00 23.73 C ATOM 1961 OE1 GLN A 209 79.826 51.232 100.284 1.00 25.25 O ATOM 1962 NE2 GLN A 209 79.770 52.454 98.411 1.00 31.01 N ATOM 1963 HE22 GLN A 209 79.971 53.366 97.953 1.00 0.00 H ATOM 1964 HE21 GLN A 209 79.356 51.675 97.860 1.00 0.00 H ATOM 1965 H GLN A 209 83.304 52.944 102.065 1.00 0.00 H ATOM 1966 N LEU A 210 80.870 55.005 104.759 1.00 19.90 N ATOM 1967 CA LEU A 210 80.656 54.958 106.193 1.00 17.46 C ATOM 1968 C LEU A 210 79.164 54.808 106.428 1.00 20.41 C ATOM 1969 O LEU A 210 78.363 55.590 105.897 1.00 21.31 O ATOM 1970 CB LEU A 210 81.188 56.232 106.859 1.00 20.44 C ATOM 1971 CG LEU A 210 81.064 56.328 108.370 1.00 20.87 C ATOM 1972 CD1 LEU A 210 81.606 55.107 109.114 1.00 21.10 C ATOM 1973 CD2 LEU A 210 81.801 57.604 108.794 1.00 27.11 C ATOM 1974 H LEU A 210 80.470 55.796 104.216 1.00 0.00 H ATOM 1975 N VAL A 211 78.790 53.819 107.218 1.00 18.71 N ATOM 1976 CA VAL A 211 77.384 53.516 107.444 1.00 19.62 C ATOM 1977 C VAL A 211 77.019 54.111 108.783 1.00 24.75 C ATOM 1978 O VAL A 211 77.603 53.735 109.804 1.00 28.89 O ATOM 1979 CB VAL A 211 77.125 52.002 107.429 1.00 23.18 C ATOM 1980 CG1 VAL A 211 75.661 51.703 107.787 1.00 28.49 C ATOM 1981 CG2 VAL A 211 77.484 51.428 106.084 1.00 26.66 C ATOM 1982 H VAL A 211 79.516 53.243 107.690 1.00 0.00 H ATOM 1983 N VAL A 212 76.077 55.045 108.791 1.00 23.71 N ATOM 1984 CA VAL A 212 75.729 55.751 110.017 1.00 28.74 C ATOM 1985 C VAL A 212 74.249 55.550 110.315 1.00 25.94 C ATOM 1986 O VAL A 212 73.402 55.680 109.426 1.00 23.07 O ATOM 1987 CB VAL A 212 76.090 57.244 109.925 1.00 32.89 C ATOM 1988 CG1 VAL A 212 77.576 57.412 109.646 1.00 32.59 C ATOM 1989 CG2 VAL A 212 75.318 57.925 108.853 1.00 37.96 C ATOM 1990 H VAL A 212 75.579 55.277 107.908 1.00 0.00 H ATOM 1991 N THR A 213 73.950 55.241 111.573 1.00 30.33 N ATOM 1992 CA THR A 213 72.588 54.968 112.030 1.00 27.02 C ATOM 1993 C THR A 213 72.080 56.162 112.841 1.00 30.92 C ATOM 1994 O THR A 213 72.703 56.550 113.834 1.00 31.64 O ATOM 1995 CB THR A 213 72.568 53.679 112.845 1.00 30.13 C ATOM 1996 OG1 THR A 213 73.089 52.604 112.058 1.00 33.47 O ATOM 1997 CG2 THR A 213 71.146 53.327 113.286 1.00 30.20 C ATOM 1998 HG1 THR A 213 74.020 52.812 111.793 1.00 0.00 H ATOM 1999 H THR A 213 74.723 55.191 112.267 1.00 0.00 H ATOM 2000 N LYS A 214 70.977 56.772 112.392 1.00 28.25 N ATOM 2001 CA LYS A 214 70.383 57.936 113.043 1.00 28.15 C ATOM 2002 C LYS A 214 68.892 57.715 113.274 1.00 25.94 C ATOM 2003 O LYS A 214 68.199 57.182 112.407 1.00 25.09 O ATOM 2004 CB LYS A 214 70.556 59.205 112.194 1.00 29.59 C ATOM 2005 H LYS A 214 70.520 56.398 111.536 1.00 0.00 H ATOM 2006 N GLU A 215 68.381 58.184 114.412 1.00 25.00 N ATOM 2007 CA GLU A 215 66.950 58.119 114.665 1.00 25.29 C ATOM 2008 C GLU A 215 66.214 59.171 113.842 1.00 30.51 C ATOM 2009 O GLU A 215 66.708 60.291 113.642 1.00 27.67 O ATOM 2010 CB GLU A 215 66.662 58.310 116.158 1.00 26.34 C ATOM 2011 CG GLU A 215 65.188 58.198 116.505 1.00 28.63 C ATOM 2012 CD GLU A 215 64.918 58.121 118.002 1.00 28.10 C ATOM 2013 OE1 GLU A 215 65.877 57.898 118.775 1.00 30.02 O ATOM 2014 OE2 GLU A 215 63.736 58.276 118.396 1.00 27.00 O ATOM 2015 H GLU A 215 69.012 58.601 115.126 1.00 0.00 H ATOM 2016 N VAL A 216 65.035 58.800 113.343 1.00 24.69 N ATOM 2017 CA VAL A 216 64.131 59.731 112.677 1.00 30.51 C ATOM 2018 C VAL A 216 63.257 60.338 113.764 1.00 36.01 C ATOM 2019 O VAL A 216 62.562 59.613 114.479 1.00 35.59 O ATOM 2020 CB VAL A 216 63.261 59.034 111.615 1.00 27.23 C ATOM 2021 CG1 VAL A 216 62.414 60.061 110.872 1.00 30.56 C ATOM 2022 CG2 VAL A 216 64.106 58.294 110.624 1.00 25.76 C ATOM 2023 H VAL A 216 64.747 57.805 113.432 1.00 0.00 H ATOM 2024 N GLU A 217 63.285 61.657 113.902 1.00 43.21 N ATOM 2025 CA GLU A 217 62.551 62.291 114.991 1.00 52.34 C ATOM 2026 C GLU A 217 61.889 63.564 114.490 1.00 53.34 C ATOM 2027 O GLU A 217 61.999 63.923 113.314 1.00 57.92 O ATOM 2028 CB GLU A 217 63.484 62.571 116.171 1.00 55.70 C ATOM 2029 CG GLU A 217 64.731 63.351 115.789 1.00 58.50 C ATOM 2030 CD GLU A 217 65.814 63.239 116.834 1.00 63.48 C ATOM 2031 OE1 GLU A 217 65.509 62.779 117.956 1.00 60.34 O ATOM 2032 OE2 GLU A 217 66.969 63.602 116.533 1.00 67.67 O ATOM 2033 H GLU A 217 63.830 62.239 113.234 1.00 0.00 H ATOM 2034 N LYS A 218 61.177 64.234 115.399 1.00 67.76 N ATOM 2035 CA LYS A 218 60.610 65.565 115.160 1.00 65.56 C ATOM 2036 C LYS A 218 59.705 65.575 113.936 1.00 73.22 C ATOM 2037 O LYS A 218 59.545 66.601 113.267 1.00 72.16 O ATOM 2038 CB LYS A 218 61.726 66.603 114.994 1.00 58.99 C ATOM 2039 OXT LYS A 218 59.119 64.547 113.592 1.00 72.89 O ATOM 2040 H LYS A 218 61.016 63.789 116.325 1.00 0.00 H TER 2041 LYS A 218 HETATM 2042 MG MG A 1 98.486 44.583 105.058 1.00 24.45 MG HETATM 2043 MG MG A 2 88.494 32.502 90.795 1.00 49.12 MG HETATM 2044 O HOH 3 71.439 47.448 118.088 1.00 39.51 O HETATM 2045 O HOH 4 68.256 55.142 118.594 1.00 34.91 O HETATM 2046 O HOH 5 78.614 40.986 117.404 1.00 42.26 O HETATM 2047 O HOH 6 74.589 47.036 116.219 1.00 34.06 O HETATM 2048 O HOH 7 97.471 62.304 103.303 1.00 44.31 O HETATM 2049 O HOH 8 115.332 40.802 111.018 1.00 45.48 O HETATM 2050 O HOH 9 83.954 61.333 117.638 1.00 35.27 O HETATM 2051 O HOH 10 79.135 59.737 106.966 1.00 38.87 O HETATM 2052 O HOH 11 87.650 22.631 116.785 1.00 39.97 O HETATM 2053 O HOH 12 93.516 33.603 118.978 1.00 42.12 O HETATM 2054 O HOH 13 116.246 42.524 112.606 1.00 44.05 O HETATM 2055 O HOH 14 91.921 23.198 106.838 1.00 42.17 O HETATM 2056 O HOH 15 86.480 66.055 113.428 1.00 44.34 O HETATM 2057 O HOH 16 98.340 49.179 100.300 1.00 40.29 O HETATM 2058 O HOH 17 99.958 57.164 125.281 1.00 40.15 O HETATM 2059 O HOH 18 97.880 46.241 106.439 1.00 24.35 O HETATM 2060 O HOH 19 94.828 61.411 116.877 1.00 44.67 O HETATM 2061 O HOH 20 95.667 26.307 104.120 1.00 32.38 O HETATM 2062 O HOH 21 80.546 39.670 83.092 1.00 43.08 O HETATM 2063 O HOH 22 88.681 25.651 119.391 1.00 43.33 O HETATM 2064 O HOH 23 81.834 41.868 84.818 1.00 38.31 O HETATM 2065 O HOH 24 107.782 44.637 103.289 1.00 34.29 O HETATM 2066 O HOH 25 99.843 32.624 108.361 1.00 42.07 O HETATM 2067 O HOH 26 97.805 37.127 123.434 1.00 45.75 O HETATM 2068 O HOH 27 117.946 51.189 119.361 1.00 33.01 O HETATM 2069 O HOH 28 76.724 42.731 112.648 1.00 40.59 O HETATM 2070 O HOH 29 103.152 50.463 108.182 1.00 40.90 O HETATM 2071 O HOH 30 103.486 42.294 102.433 1.00 40.53 O HETATM 2072 O HOH 31 100.628 47.974 105.265 1.00 33.44 O HETATM 2073 O HOH 32 76.669 59.940 113.766 1.00 34.77 O HETATM 2074 O HOH 33 93.894 52.186 96.499 1.00 19.79 O HETATM 2075 O HOH 34 83.597 31.505 114.269 1.00 28.85 O HETATM 2076 O HOH 35 100.613 38.968 108.103 1.00 29.22 O HETATM 2077 O HOH 36 92.184 56.965 122.483 1.00 40.71 O HETATM 2078 O HOH 37 92.975 55.117 120.650 1.00 28.87 O HETATM 2079 O HOH 38 78.847 29.882 101.087 1.00 32.33 O HETATM 2080 O HOH 39 103.339 45.362 124.580 1.00 37.89 O HETATM 2081 O HOH 40 62.289 57.570 116.316 1.00 27.19 O HETATM 2082 O HOH 41 87.956 55.569 122.955 1.00 26.51 O HETATM 2083 O HOH 42 95.664 55.800 120.622 1.00 36.28 O HETATM 2084 O HOH 43 92.784 28.689 97.964 1.00 30.19 O HETATM 2085 O HOH 44 85.878 30.239 117.508 1.00 34.85 O HETATM 2086 O HOH 45 77.175 44.655 108.446 1.00 31.16 O HETATM 2087 O HOH 46 88.388 56.771 98.345 1.00 31.00 O HETATM 2088 O HOH 47 85.016 24.456 101.176 1.00 34.31 O HETATM 2089 O HOH 48 92.972 31.510 96.551 1.00 33.48 O HETATM 2090 O HOH 49 97.047 24.457 111.321 1.00 42.81 O HETATM 2091 O HOH 50 73.829 44.788 105.823 1.00 37.75 O HETATM 2092 O HOH 51 97.495 42.986 101.602 1.00 21.92 O HETATM 2093 O HOH 52 99.618 36.265 108.971 1.00 35.65 O HETATM 2094 O HOH 53 95.160 63.717 104.675 1.00 41.40 O HETATM 2095 O HOH 54 88.742 40.559 100.255 1.00 17.19 O HETATM 2096 O HOH 55 76.667 45.471 97.184 1.00 39.03 O HETATM 2097 O HOH 56 99.730 57.335 108.224 1.00 31.98 O HETATM 2098 O HOH 57 94.784 50.827 94.238 1.00 23.07 O HETATM 2099 O HOH 58 96.926 31.676 99.995 1.00 39.28 O HETATM 2100 O HOH 59 99.146 26.004 107.087 1.00 40.55 O HETATM 2101 O HOH 60 85.540 30.153 113.225 1.00 23.58 O HETATM 2102 O HOH 61 76.221 63.243 111.407 1.00 40.92 O HETATM 2103 O HOH 62 88.558 35.223 91.909 1.00 28.98 O HETATM 2104 O HOH 63 65.379 57.521 121.408 1.00 47.70 O HETATM 2105 O HOH 64 86.036 53.843 125.134 1.00 27.62 O HETATM 2106 O HOH 65 93.015 35.436 98.788 1.00 30.62 O HETATM 2107 O HOH 66 101.613 27.752 101.779 1.00 48.28 O HETATM 2108 O HOH 67 78.753 34.726 95.768 1.00 29.22 O HETATM 2109 O HOH 68 73.186 28.622 111.406 1.00 27.31 O HETATM 2110 O HOH 69 96.040 48.881 97.346 1.00 21.41 O HETATM 2111 O HOH 70 78.678 35.113 100.114 1.00 22.67 O HETATM 2112 O HOH 71 83.374 33.323 86.300 1.00 42.62 O HETATM 2113 O HOH 72 94.440 37.277 100.492 1.00 36.77 O HETATM 2114 O HOH 73 108.175 38.707 122.933 1.00 43.00 O HETATM 2115 O HOH 74 76.078 40.017 88.876 1.00 36.49 O HETATM 2116 O HOH 75 76.914 36.919 94.818 1.00 41.44 O HETATM 2117 O HOH 76 92.380 59.409 120.432 1.00 37.64 O HETATM 2118 O HOH 77 85.812 31.771 100.387 1.00 18.14 O HETATM 2119 O HOH 78 109.308 50.752 120.045 1.00 30.22 O HETATM 2120 O HOH 79 80.608 30.944 94.768 1.00 42.34 O HETATM 2121 O HOH 80 74.720 25.762 104.846 1.00 42.95 O HETATM 2122 O HOH 81 101.529 57.693 112.509 1.00 42.03 O HETATM 2123 O HOH 82 102.470 39.700 104.321 1.00 36.11 O HETATM 2124 O HOH 83 91.473 64.208 109.742 1.00 30.05 O HETATM 2125 O HOH 84 97.581 47.744 122.612 1.00 30.19 O HETATM 2126 O HOH 85 109.493 36.401 110.549 1.00 46.96 O HETATM 2127 O HOH 86 82.508 34.974 95.629 1.00 21.75 O HETATM 2128 O HOH 87 78.566 55.573 114.126 1.00 27.97 O HETATM 2129 O HOH 88 78.991 29.408 103.912 1.00 27.79 O HETATM 2130 O HOH 89 74.127 49.521 117.374 1.00 35.57 O HETATM 2131 O HOH 90 98.487 41.461 99.640 1.00 33.57 O HETATM 2132 O HOH 91 85.488 32.391 83.971 1.00 38.02 O HETATM 2133 O HOH 92 101.805 45.099 102.127 1.00 41.30 O HETATM 2134 O HOH 93 82.804 51.614 93.263 1.00 28.62 O HETATM 2135 O HOH 94 81.448 55.318 121.224 1.00 31.14 O HETATM 2136 O HOH 95 94.757 53.173 104.197 1.00 24.15 O HETATM 2137 O HOH 96 98.942 57.303 105.494 1.00 33.69 O HETATM 2138 O HOH 97 78.833 26.181 110.428 1.00 30.27 O HETATM 2139 O HOH 98 106.970 31.064 114.190 1.00 40.94 O HETATM 2140 O HOH 99 74.767 55.884 115.550 1.00 35.70 O HETATM 2141 O HOH 100 91.247 39.028 78.566 1.00 42.06 O HETATM 2142 O HOH 101 94.676 46.002 90.004 1.00 30.70 O HETATM 2143 O HOH 102 91.824 29.428 94.816 1.00 33.02 O HETATM 2144 O HOH 103 85.346 64.337 111.623 1.00 31.57 O HETATM 2145 O HOH 104 88.083 44.628 104.894 1.00 17.69 O HETATM 2146 O HOH 105 75.648 46.722 91.244 1.00 36.44 O HETATM 2147 O HOH 106 78.875 38.905 116.645 1.00 38.97 O HETATM 2148 O HOH 107 116.427 44.918 118.407 1.00 36.08 O HETATM 2149 O HOH 108 92.649 42.981 106.947 1.00 20.59 O HETATM 2150 O HOH 109 69.498 50.349 119.233 1.00 33.91 O HETATM 2151 O HOH 110 109.849 43.774 120.727 1.00 36.06 O HETATM 2152 O HOH 111 76.504 30.888 101.124 1.00 39.85 O HETATM 2153 O HOH 112 81.777 32.300 117.462 1.00 40.40 O HETATM 2154 O HOH 113 86.062 24.513 108.765 1.00 38.49 O HETATM 2155 O HOH 114 90.076 34.290 87.932 1.00 39.29 O HETATM 2156 O HOH 115 81.217 45.468 87.636 1.00 40.43 O HETATM 2157 O HOH 116 83.672 44.772 122.092 1.00 29.92 O HETATM 2158 O HOH 117 87.172 35.899 94.220 1.00 20.44 O HETATM 2159 O HOH 118 105.380 38.736 123.016 1.00 33.64 O HETATM 2160 O HOH 119 74.991 44.926 102.648 1.00 33.51 O HETATM 2161 O HOH 120 82.955 48.035 89.590 1.00 40.80 O HETATM 2162 O HOH 121 98.586 46.232 103.460 1.00 26.34 O HETATM 2163 O HOH 122 98.315 54.711 125.346 1.00 40.21 O HETATM 2164 O HOH 123 105.548 27.764 115.604 1.00 34.89 O HETATM 2165 O HOH 124 79.344 42.098 120.997 1.00 35.77 O HETATM 2166 O HOH 125 91.805 63.111 103.046 1.00 39.11 O HETATM 2167 O HOH 126 111.129 34.953 118.058 1.00 42.44 O HETATM 2168 O HOH 127 92.876 61.346 113.724 1.00 38.39 O HETATM 2169 O HOH 128 96.609 59.988 104.113 1.00 32.55 O HETATM 2170 O HOH 129 99.366 35.414 121.703 1.00 37.13 O HETATM 2171 O HOH 130 94.759 40.805 99.113 1.00 26.61 O HETATM 2172 O HOH 131 75.960 56.835 112.815 1.00 37.16 O HETATM 2173 O HOH 132 98.034 45.967 95.607 1.00 37.30 O HETATM 2174 O HOH 133 76.963 41.936 110.530 1.00 38.02 O HETATM 2175 O HOH 134 75.849 45.084 93.608 1.00 32.99 O HETATM 2176 O HOH 135 76.671 46.474 104.124 1.00 35.00 O HETATM 2177 O HOH 136 81.627 31.928 92.738 1.00 41.21 O HETATM 2178 O HOH 137 92.610 55.572 108.140 1.00 24.27 O HETATM 2179 O HOH 138 100.493 45.179 105.712 1.00 21.98 O HETATM 2180 O HOH 139 90.737 44.631 105.693 1.00 20.59 O HETATM 2181 O HOH 140 80.180 61.383 115.623 1.00 29.81 O HETATM 2182 O HOH 141 94.897 48.651 125.127 1.00 39.64 O HETATM 2183 O HOH 142 89.405 45.446 85.943 1.00 39.50 O HETATM 2184 O HOH 143 90.367 63.375 117.722 1.00 41.48 O HETATM 2185 O HOH 144 80.485 34.670 112.945 1.00 29.86 O HETATM 2186 O HOH 145 93.054 34.232 94.623 1.00 34.22 O HETATM 2187 O HOH 146 74.909 47.914 124.365 1.00 46.17 O HETATM 2188 O HOH 147 91.417 36.400 85.683 1.00 31.05 O HETATM 2189 O HOH 148 76.050 51.911 111.455 1.00 33.55 O HETATM 2190 O HOH 149 94.869 42.096 101.506 1.00 20.35 O HETATM 2191 O HOH 150 94.479 54.433 124.130 1.00 39.23 O HETATM 2192 O HOH 151 97.458 24.133 113.534 1.00 41.74 O HETATM 2193 O HOH 152 83.876 24.773 97.886 1.00 41.58 O HETATM 2194 O HOH 153 70.185 58.816 116.628 1.00 38.25 O HETATM 2195 O HOH 154 96.630 57.451 101.808 1.00 38.21 O HETATM 2196 O HOH 155 95.608 57.224 117.797 1.00 31.00 O HETATM 2197 O HOH 156 88.505 45.881 127.125 1.00 32.39 O HETATM 2198 O HOH 157 89.762 26.277 100.646 1.00 25.59 O HETATM 2199 O HOH 158 78.284 58.283 115.369 1.00 30.89 O HETATM 2200 O HOH 159 76.740 39.600 109.201 1.00 28.71 O HETATM 2201 O HOH 160 81.370 62.022 118.218 1.00 40.29 O HETATM 2202 O HOH 161 109.963 31.063 118.778 1.00 35.29 O HETATM 2203 O HOH 162 101.200 41.340 100.384 1.00 40.01 O HETATM 2204 O HOH 163 77.929 35.170 113.546 1.00 36.41 O HETATM 2205 O HOH 164 82.286 49.762 91.507 1.00 28.72 O HETATM 2206 O HOH 165 65.178 63.059 112.111 1.00 46.38 O HETATM 2207 O HOH 166 75.766 51.583 115.259 1.00 26.52 O HETATM 2208 O HOH 167 92.361 33.007 92.130 1.00 37.75 O HETATM 2209 O HOH 168 78.831 30.267 111.150 1.00 30.97 O HETATM 2210 O HOH 169 103.991 46.710 102.936 1.00 45.20 O HETATM 2211 O HOH 170 72.572 37.683 103.398 1.00 23.41 O HETATM 2212 O HOH 171 99.012 51.160 105.677 1.00 35.78 O HETATM 2213 O HOH 172 76.388 45.622 99.430 1.00 35.54 O HETATM 2214 O HOH 173 106.418 52.612 119.009 1.00 31.85 O HETATM 2215 O HOH 174 77.807 44.875 105.609 1.00 37.22 O HETATM 2216 O HOH 175 81.754 35.732 89.733 1.00 32.89 O HETATM 2217 O HOH 176 82.741 28.673 115.275 1.00 36.81 O HETATM 2218 O HOH 177 104.192 49.408 125.494 1.00 38.15 O HETATM 2219 O HOH 178 101.585 41.809 86.577 1.00 35.85 O HETATM 2220 O HOH 179 96.663 34.365 99.012 1.00 43.08 O HETATM 2221 O HOH 180 110.368 54.037 113.411 1.00 31.36 O HETATM 2222 O HOH 181 96.256 53.396 97.048 1.00 27.43 O HETATM 2223 O HOH 182 88.539 57.268 95.128 1.00 41.75 O HETATM 2224 O HOH 183 83.963 37.044 80.905 1.00 32.84 O HETATM 2225 O HOH 184 79.371 36.687 117.081 1.00 46.07 O HETATM 2226 O HOH 185 103.116 34.641 122.864 1.00 38.96 O HETATM 2227 O HOH 186 91.834 55.832 125.147 1.00 44.72 O HETATM 2228 O HOH 187 82.672 32.955 82.441 1.00 37.06 O HETATM 2229 O HOH 188 97.547 50.629 94.389 1.00 37.11 O HETATM 2230 O HOH 189 86.776 64.627 109.327 1.00 38.14 O HETATM 2231 O HOH 190 86.105 62.893 117.634 1.00 42.44 O HETATM 2232 O HOH 191 79.886 51.384 94.710 1.00 41.01 O HETATM 2233 O HOH 192 85.476 31.148 89.845 1.00 46.45 O HETATM 2234 O HOH 193 96.358 55.547 123.190 1.00 36.59 O HETATM 2235 O HOH 194 83.371 33.661 89.249 1.00 42.16 O HETATM 2236 O HOH 195 94.807 58.607 120.128 1.00 46.33 O HETATM 2237 O HOH 196 76.288 54.115 114.021 1.00 30.03 O HETATM 2238 O HOH 197 92.546 61.812 118.920 1.00 44.96 O HETATM 2239 O HOH 198 117.673 46.970 120.389 1.00 44.43 O HETATM 2240 O HOH 199 105.023 52.476 122.969 1.00 43.58 O HETATM 2241 O HOH 200 70.304 55.704 116.447 1.00 39.33 O HETATM 2242 O HOH 201 104.591 40.285 124.982 1.00 40.49 O HETATM 2243 O HOH 202 89.352 31.388 119.164 1.00 39.80 O HETATM 2244 O HOH 203 82.158 38.987 80.935 1.00 36.36 O HETATM 2245 O HOH 204 109.948 52.865 121.473 1.00 38.16 O HETATM 2246 O HOH 205 86.130 57.229 124.044 1.00 39.54 O HETATM 2247 O HOH 206 92.239 24.472 104.477 1.00 42.38 O HETATM 2248 O HOH 207 109.138 45.481 122.222 1.00 40.18 O HETATM 2249 O HOH 208 80.667 63.686 111.471 1.00 40.79 O HETATM 2250 O HOH 209 80.096 42.715 87.006 1.00 36.66 O HETATM 2251 O HOH 210 90.274 23.893 102.107 1.00 36.68 O HETATM 2252 O HOH 211 81.104 32.204 113.601 1.00 37.80 O HETATM 2253 O HOH 212 89.187 66.924 112.211 1.00 45.56 O HETATM 2254 O HOH 213 78.042 27.989 112.437 1.00 41.91 O HETATM 2255 O HOH 214 81.100 41.509 122.821 1.00 46.03 O HETATM 2256 O HOH 215 100.553 63.727 101.100 1.00 44.66 O HETATM 2257 O HOH 216 82.752 65.279 111.398 1.00 40.07 O HETATM 2258 O HOH 217 81.369 55.286 124.084 1.00 45.81 O HETATM 2259 O HOH 218 89.187 65.795 109.910 1.00 39.49 O HETATM 2260 O HOH 219 77.343 41.834 86.676 1.00 39.66 O HETATM 2261 O HOH 220 77.509 32.954 99.014 1.00 36.53 O HETATM 2262 O HOH 221 87.255 46.830 87.513 1.00 41.55 O HETATM 2263 PB ADP A 222 100.341 42.337 104.014 1.00 0.21 P HETATM 2264 O1B ADP A 222 100.376 41.069 103.203 1.00 -0.59 O HETATM 2265 O2B ADP A 222 101.645 43.128 104.051 1.00 -0.59 O HETATM 2266 O3B ADP A 222 99.120 43.191 103.715 1.00 -0.59 O HETATM 2267 O3A ADP A 222 100.215 41.760 105.524 1.00 -0.15 O HETATM 2268 PA ADP A 222 98.907 41.818 106.476 1.00 0.33 P HETATM 2269 O1A ADP A 222 98.298 43.193 106.490 1.00 -0.56 O HETATM 2270 O2A ADP A 222 99.280 41.193 107.800 1.00 -0.56 O HETATM 2271 O5' ADP A 222 97.913 40.789 105.745 1.00 -0.24 O HETATM 2272 C5' ADP A 222 98.255 39.409 105.757 1.00 0.11 C HETATM 2273 C4' ADP A 222 97.559 38.705 104.598 1.00 0.12 C HETATM 2274 O4' ADP A 222 96.182 38.483 104.940 1.00 -0.34 O HETATM 2275 C1' ADP A 222 95.386 38.511 103.752 1.00 0.20 C HETATM 2276 C2' ADP A 222 96.319 38.802 102.590 1.00 0.14 C HETATM 2277 C3' ADP A 222 97.506 39.461 103.271 1.00 0.11 C HETATM 2278 O3' ADP A 222 98.696 39.374 102.468 1.00 -0.39 O HETATM 2279 H5 ADP A 222 99.431 39.730 102.953 1.00 0.21 H HETATM 2280 H4 ADP A 222 97.302 40.526 103.457 1.00 0.06 H HETATM 2281 O2' ADP A 222 96.707 37.560 101.962 1.00 -0.38 O HETATM 2282 H7 ADP A 222 95.950 37.168 101.544 1.00 0.21 H HETATM 2283 H6 ADP A 222 95.855 39.472 101.851 1.00 0.07 H HETATM 2284 N9 ADP A 222 94.363 39.571 103.924 1.00 -0.19 N HETATM 2285 C8 ADP A 222 94.301 40.472 104.940 1.00 0.11 C HETATM 2286 N7 ADP A 222 93.205 41.261 104.802 1.00 -0.30 N HETATM 2287 C5 ADP A 222 92.568 40.846 103.679 1.00 0.10 C HETATM 2288 C6 ADP A 222 91.368 41.249 102.944 1.00 0.13 C HETATM 2289 N6 ADP A 222 90.640 42.280 103.396 1.00 -0.32 N HETATM 2290 H10 ADP A 222 89.793 42.574 102.889 1.00 0.18 H HETATM 2291 H11 ADP A 222 90.927 42.778 104.251 1.00 0.18 H HETATM 2292 N1 ADP A 222 91.037 40.565 101.831 1.00 -0.27 N HETATM 2293 C2 ADP A 222 91.787 39.547 101.358 1.00 0.05 C HETATM 2294 N3 ADP A 222 92.912 39.119 101.972 1.00 -0.27 N HETATM 2295 C4 ADP A 222 93.329 39.731 103.113 1.00 0.16 C HETATM 2296 H12 ADP A 222 91.473 39.052 100.446 1.00 0.10 H HETATM 2297 H9 ADP A 222 95.026 40.550 105.749 1.00 0.13 H HETATM 2298 H8 ADP A 222 94.891 37.541 103.595 1.00 0.10 H HETATM 2299 H3 ADP A 222 98.069 37.744 104.435 1.00 0.07 H HETATM 2300 H1 ADP A 222 97.932 38.959 106.707 1.00 0.06 H HETATM 2301 H2 ADP A 222 99.344 39.300 105.652 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 346 345 2042 CONECT 2042 346 CONECT 2263 2264 2265 2266 2267 CONECT 2264 2263 CONECT 2265 2263 CONECT 2266 2263 CONECT 2267 2263 2268 CONECT 2268 2267 2269 2270 2271 CONECT 2269 2268 CONECT 2270 2268 CONECT 2271 2268 2272 CONECT 2272 2271 2273 2300 2301 CONECT 2273 2272 2274 2277 2299 CONECT 2274 2273 2275 CONECT 2275 2274 2276 2284 2298 CONECT 2276 2275 2277 2281 2283 CONECT 2277 2273 2276 2278 2280 CONECT 2278 2277 2279 CONECT 2279 2278 CONECT 2280 2277 CONECT 2281 2276 2282 CONECT 2282 2281 CONECT 2283 2276 CONECT 2284 2275 2285 2295 CONECT 2285 2284 2286 2297 CONECT 2286 2285 2287 CONECT 2287 2286 2288 2295 CONECT 2288 2287 2289 2292 CONECT 2289 2288 2290 2291 CONECT 2290 2289 CONECT 2291 2289 CONECT 2292 2288 2293 CONECT 2293 2292 2294 2296 CONECT 2294 2293 2295 CONECT 2295 2284 2287 2294 CONECT 2296 2293 CONECT 2297 2285 CONECT 2298 2275 CONECT 2299 2273 CONECT 2300 2272 CONECT 2301 2272 MASTER 0 0 0 0 0 0 0 0 2300 1 45 17 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6cjj
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6cjs
RCSB PDB
PDBbind
230aa, >6CJS_1|Chain... at 100%
6cjr
RCSB PDB
PDBbind
230aa, >6CJR_1|Chains... at 100%
6cjp
RCSB PDB
PDBbind
230aa, >6CJP_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1amw
RCSB PDB
PDBbind
ADP
1ao0
RCSB PDB
PDBbind
ADP
1atr
RCSB PDB
PDBbind
ADP
1e8h
RCSB PDB
PDBbind
ADP
1hi5
RCSB PDB
PDBbind
ADP
1lkx
RCSB PDB
PDBbind
ADP
1m74
RCSB PDB
PDBbind
ADP
1o0h
RCSB PDB
PDBbind
ADP
1t3t
RCSB PDB
PDBbind
ADP
1ucn
RCSB PDB
PDBbind
ADP
1xxi
RCSB PDB
PDBbind
ADP
1y8o
RCSB PDB
PDBbind
ADP
2bfr
RCSB PDB
PDBbind
ADP
2c02
RCSB PDB
PDBbind
ADP
2e2p
RCSB PDB
PDBbind
ADP
2hmv
RCSB PDB
PDBbind
ADP
2ja3
RCSB PDB
PDBbind
ADP
2o1v
RCSB PDB
PDBbind
ADP
2qv7
RCSB PDB
PDBbind
ADP
2r6f
RCSB PDB
PDBbind
ADP
2rio
RCSB PDB
PDBbind
ADP
2vhj
RCSB PDB
PDBbind
ADP
2y8i
RCSB PDB
PDBbind
ADP
2y8l
RCSB PDB
PDBbind
ADP
2y8q
RCSB PDB
PDBbind
ADP
2z4r
RCSB PDB
PDBbind
ADP
2zkj
RCSB PDB
PDBbind
ADP
3a1d
RCSB PDB
PDBbind
ADP
3atu
RCSB PDB
PDBbind
ADP
3atv
RCSB PDB
PDBbind
ADP
3ay9
RCSB PDB
PDBbind
ADP
3bf1
RCSB PDB
PDBbind
ADP
3bxz
RCSB PDB
PDBbind
ADP
3c7n
RCSB PDB
PDBbind
ADP
3cf1
RCSB PDB
PDBbind
ADP
3d2r
RCSB PDB
PDBbind
ADP
3dgn
RCSB PDB
PDBbind
ADP
3i73
RCSB PDB
PDBbind
ADP
3iuc
RCSB PDB
PDBbind
ADP
3k1j
RCSB PDB
PDBbind
ADP
3llm
RCSB PDB
PDBbind
ADP
3mle
RCSB PDB
PDBbind
ADP
3ncr
RCSB PDB
PDBbind
ADP
3p23
RCSB PDB
PDBbind
ADP
3qc9
RCSB PDB
PDBbind
ADP
3qxh
RCSB PDB
PDBbind
ADP
3rup
RCSB PDB
PDBbind
ADP
3rv3
RCSB PDB
PDBbind
ADP
3rv4
RCSB PDB
PDBbind
ADP
3t4n
RCSB PDB
PDBbind
ADP
3ta1
RCSB PDB
PDBbind
ADP
3tif
RCSB PDB
PDBbind
ADP
3vx3
RCSB PDB
PDBbind
ADP
4c3k
RCSB PDB
PDBbind
ADP
4i3z
RCSB PDB
PDBbind
ADP
4kod
RCSB PDB
PDBbind
ADP
4lj5
RCSB PDB
PDBbind
ADP
4lj8
RCSB PDB
PDBbind
ADP
4nxu
RCSB PDB
PDBbind
ADP
4oag
RCSB PDB
PDBbind
ADP
4ocp
RCSB PDB
PDBbind
ADP
4ozj
RCSB PDB
PDBbind
ADP
4u0s
RCSB PDB
PDBbind
ADP
4u0u
RCSB PDB
PDBbind
ADP
4uoh
RCSB PDB
PDBbind
ADP
4zki
RCSB PDB
PDBbind
ADP
5evz
RCSB PDB
PDBbind
ADP
5fsx
RCSB PDB
PDBbind
ADP
6czd
RCSB PDB
PDBbind
ADP
6f3f
RCSB PDB
PDBbind
ADP
6fa5
RCSB PDB
PDBbind
ADP
6faa
RCSB PDB
PDBbind
ADP
6fac
RCSB PDB
PDBbind
ADP
6fhk
RCSB PDB
PDBbind
ADP
6n9l
RCSB PDB
PDBbind
ADP
6mmc
RCSB PDB
PDBbind
ADP
6hys
RCSB PDB
PDBbind
ADP
6bs3
RCSB PDB
PDBbind
ADP
5kk8
RCSB PDB
PDBbind
ADP
Entry Information
PDB ID
6cjj
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Heat shock protein 90 homolog
Ligand Name
ADP
EC.Number
E.C.-.-.-.-
Resolution
1.74(Å)
Affinity (Kd/Ki/IC50)
Kd=125uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Nat Commun Vol. 10: pp. 402-402
Ligand Properties
Formula
C
1
0
H
1
7
N
5
O
1
0
P
2
Molecular Weight
429.217
Exact Mass
429.045
No. of atoms
44
No. of bonds
46
Polar Surface Area
266.1
LOGP Value
-4.89 (
Computed with XLOGP3
)
-2.04 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 3
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(O)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C10H19N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-22,26-27H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P46598
Entrez Gene ID
NCBI Entrez Gene ID:
3636951
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com