HEADER TRANSFERASE/DNA 11-APR-97 XXXX TITLE DNA POLYMERASE BETA/DNA COMPLEX COMPND DNA POLYMERASE BETA/DNA COMPLEX (EC 2.7.7.7) KEYWDS NUCLEOTIDYLTRANSFERASE, DNA REPAIR, BASE EXCISION REPAIR KEYWDS 2 PATHWAY EXPDTA X-RAY DIFFRACTION AUTHOR M.R.SAWAYA, R.PRASAD, S.H.WILSON, J.KRAUT, H.PELLETIER JRNL AUTH M.R.SAWAYA, R.PRASAD, S.H.WILSON, J.KRAUT, JRNL AUTH 2 H.PELLETIER JRNL TITL CRYSTAL STRUCTURES OF HUMAN DNA POLYMERASE BETA JRNL TITL 2 COMPLEXED WITH GAPPED AND NICKED DNA: EVIDENCE FOR JRNL TITL 3 AN INDUCED FIT MECHANISM. JRNL REF BIOCHEMISTRY V. 36 11205 1997 JRNL REFN ASTM BICHAW US ISSN 0006-2960 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH H.PELLETIER, M.R.SAWAYA REMARK 1 TITL CHARACTERIZATION OF THE METAL ION BINDING REMARK 1 TITL 2 HELIX-HAIRPIN-HELIX MOTIFS IN HUMAN DNA POLYMERASE REMARK 1 TITL 3 BETA BY X-RAY STRUCTURAL ANALYSIS REMARK 1 REF BIOCHEMISTRY V. 35 12778 1996 REMARK 1 REFN ASTM BICHAW US ISSN 0006-2960 REMARK 1 REFERENCE 2 REMARK 1 AUTH H.PELLETIER, M.R.SAWAYA, W.WOLFLE, S.H.WILSON, REMARK 1 AUTH 2 J.KRAUT REMARK 1 TITL A STRUCTURAL BASIS FOR METAL ION MUTAGENICITY AND REMARK 1 TITL 2 NUCLEOTIDE SELECTIVITY IN HUMAN DNA POLYMERASE BETA REMARK 1 REF BIOCHEMISTRY V. 35 12762 1996 REMARK 1 REFN ASTM BICHAW US ISSN 0006-2960 REMARK 1 REFERENCE 3 REMARK 1 AUTH H.PELLETIER, M.R.SAWAYA, W.WOLFLE, S.H.WILSON, REMARK 1 AUTH 2 J.KRAUT REMARK 1 TITL CRYSTAL STRUCTURES OF HUMAN DNA POLYMERASE BETA REMARK 1 TITL 2 COMPLEXED WITH DNA: IMPLICATIONS FOR CATALYTIC REMARK 1 TITL 3 MECHANISM, PROCESSIVITY, AND FIDELITY REMARK 1 REF BIOCHEMISTRY V. 35 12742 1996 REMARK 1 REFN ASTM BICHAW US ISSN 0006-2960 REMARK 1 REFERENCE 4 REMARK 1 AUTH M.R.SAWAYA, H.PELLETIER, A.KUMAR, S.H.WILSON, REMARK 1 AUTH 2 J.KRAUT REMARK 1 TITL CRYSTAL STRUCTURE OF RAT DNA POLYMERASE BETA: REMARK 1 TITL 2 EVIDENCE FOR A COMMON POLYMERASE MECHANISM REMARK 1 REF SCIENCE V. 264 1930 1994 REMARK 1 REFN ASTM SCIEAS US ISSN 0036-8075 REMARK 1 REFERENCE 5 REMARK 1 AUTH H.PELLETIER, M.R.SAWAYA, A.KUMAR, S.H.WILSON, REMARK 1 AUTH 2 J.KRAUT REMARK 1 TITL STRUCTURES OF TERNARY COMPLEXES OF RAT DNA REMARK 1 TITL 2 POLYMERASE BETA, A DNA TEMPLATE- PRIMER, AND DDCTP REMARK 1 REF SCIENCE V. 264 1891 1994 REMARK 1 REFN ASTM SCIEAS US ISSN 0036-8075 SEQRES 1 T 16 DC DC DG DA DC DG DG DC DG DC DA DT DC SEQRES 2 T 16 DA DG DC SEQRES 1 P 10 DG DC DT DG DA DT DG DC DG DC SEQRES 1 D 5 DG DT DC DG DG SEQRES 1 A 335 MET SER LYS ARG LYS ALA PRO GLN GLU THR LEU ASN GLY SEQRES 2 A 335 GLY ILE THR ASP MET LEU THR GLU LEU ALA ASN PHE GLU SEQRES 3 A 335 LYS ASN VAL SER GLN ALA ILE HIS LYS TYR ASN ALA TYR SEQRES 4 A 335 ARG LYS ALA ALA SER VAL ILE ALA LYS TYR PRO HIS LYS SEQRES 5 A 335 ILE LYS SER GLY ALA GLU ALA LYS LYS LEU PRO GLY VAL SEQRES 6 A 335 GLY THR LYS ILE ALA GLU LYS ILE ASP GLU PHE LEU ALA SEQRES 7 A 335 THR GLY LYS LEU ARG LYS LEU GLU LYS ILE ARG GLN ASP SEQRES 8 A 335 ASP THR SER SER SER ILE ASN PHE LEU THR ARG VAL SER SEQRES 9 A 335 GLY ILE GLY PRO SER ALA ALA ARG LYS PHE VAL ASP GLU SEQRES 10 A 335 GLY ILE LYS THR LEU GLU ASP LEU ARG LYS ASN GLU ASP SEQRES 11 A 335 LYS LEU ASN HIS HIS GLN ARG ILE GLY LEU LYS TYR PHE SEQRES 12 A 335 GLY ASP PHE GLU LYS ARG ILE PRO ARG GLU GLU MET LEU SEQRES 13 A 335 GLN MET GLN ASP ILE VAL LEU ASN GLU VAL LYS LYS VAL SEQRES 14 A 335 ASP SER GLU TYR ILE ALA THR VAL CYS GLY SER PHE ARG SEQRES 15 A 335 ARG GLY ALA GLU SER SER GLY ASP MET ASP VAL LEU LEU SEQRES 16 A 335 THR HIS PRO SER PHE THR SER GLU SER THR LYS GLN PRO SEQRES 17 A 335 LYS LEU LEU HIS GLN VAL VAL GLU GLN LEU GLN LYS VAL SEQRES 18 A 335 HIS PHE ILE THR ASP THR LEU SER LYS GLY GLU THR LYS SEQRES 19 A 335 PHE MET GLY VAL CYS GLN LEU PRO SER LYS ASN ASP GLU SEQRES 20 A 335 LYS GLU TYR PRO HIS ARG ARG ILE ASP ILE ARG LEU ILE SEQRES 21 A 335 PRO LYS ASP GLN TYR TYR CYS GLY VAL LEU TYR PHE THR SEQRES 22 A 335 GLY SER ASP ILE PHE ASN LYS ASN MET ARG ALA HIS ALA SEQRES 23 A 335 LEU GLU LYS GLY PHE THR ILE ASN GLU TYR THR ILE ARG SEQRES 24 A 335 PRO LEU GLY VAL THR GLY VAL ALA GLY GLU PRO LEU PRO SEQRES 25 A 335 VAL ASP SER GLU LYS ASP ILE PHE ASP TYR ILE GLN TRP SEQRES 26 A 335 LYS TYR ARG GLU PRO LYS ASP ARG SER GLU HETNAM NA SODIUM ION FORMUL 5 NA 2(NA 1+) FORMUL 7 HOH *81(H2 O) HELIX 1 A GLY A 13 SER A 30 1 18 HELIX 2 B ILE A 33 LYS A 48 1 16 HELIX 3 C GLY A 56 LYS A 61 1 6 HELIX 4 D THR A 67 THR A 79 1SEE REMARK 650 13 HELIX 5 E ARG A 83 GLN A 90 1 8 HELIX 6 F ASP A 92 ARG A 102 1 11 HELIX 7 G PRO A 108 ASP A 116 1SEE REMARK 650 9 HELIX 8 H LEU A 122 LYS A 127 1 6 HELIX 9 I HIS A 134 GLU A 147 1 14 HELIX 10 J ARG A 152 VAL A 169 1 18 HELIX 11 K SER A 180 ARG A 183 1 4 HELIX 12 L PRO A 208 LYS A 220 1 13 HELIX 13 M LYS A 262 THR A 273 1 12 HELIX 14 N ASP A 276 GLU A 288 1 13 HELIX 15 O GLU A 316 ILE A 323 1 8 HELIX 16 P PRO A 330 ASP A 332 5 3 SHEET 1 S1 2 ILE A 150 PRO A 151 0 SHEET 2 S1 2 SER A 187 SER A 188 -1 N SER A 188 O ILE A 150 SHEET 1 S2 5 ILE A 174 CYS A 178 0 SHEET 2 S2 5 MET A 191 THR A 196 -1 N THR A 196 O ILE A 174 SHEET 3 S2 5 ARG A 253 ARG A 258 1 N ASP A 256 O MET A 191 SHEET 4 S2 5 LYS A 234 CYS A 239 -1 N CYS A 239 O ARG A 253 SHEET 5 S2 5 SER A 229 GLY A 231 -1 O SER A 229 N MET A 236 SHEET 1 S3 2 PHE A 291 ASN A 294 0 SHEET 2 S3 2 THR A 297 PRO A 300 -1 N ARG A 299 O THR A 292 CISPEP 1 GLY A 274 SER A 275 1 0.54 SITE 1 ACT 3 ASP A 190 ASP A 192 ASP A 256 CRYST1 52.767 79.395 54.622 90.00 106.35 90.00 P 1 21 1 2 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.018951 0.000000 0.005560 0.00000 SCALE2 0.000000 0.012595 0.000000 0.00000 SCALE3 0.000000 0.000000 0.019079 0.00000 ATOM 1 N1 DC T 1 38.418 11.678 -7.056 1.00 49.23 N ATOM 2 C2 DC T 1 37.169 11.749 -7.640 1.00 46.80 C ATOM 3 O2 DC T 1 36.673 12.871 -7.786 1.00 50.03 O ATOM 4 N3 DC T 1 36.548 10.590 -8.010 1.00 40.60 N ATOM 5 C4 DC T 1 37.165 9.456 -7.789 1.00 38.16 C ATOM 6 N4 DC T 1 36.499 8.346 -8.188 1.00 35.60 N ATOM 7 C5 DC T 1 38.453 9.383 -7.240 1.00 36.02 C ATOM 8 C6 DC T 1 39.057 10.520 -6.906 1.00 40.95 C ATOM 9 O5' DC T 1 41.818 10.618 -6.447 1.00 93.16 O ATOM 10 C5' DC T 1 42.295 11.733 -7.302 1.00 92.21 C ATOM 11 C4' DC T 1 41.445 13.003 -7.188 1.00 85.20 C ATOM 12 O4' DC T 1 40.143 12.857 -7.769 1.00 79.99 O ATOM 13 C3' DC T 1 41.184 13.475 -5.787 1.00 79.29 C ATOM 14 O3' DC T 1 41.031 14.843 -5.923 1.00 82.47 O ATOM 15 C2' DC T 1 39.814 12.912 -5.411 1.00 73.80 C ATOM 16 C1' DC T 1 39.115 12.865 -6.755 1.00 69.47 C ATOM 17 P DC T 2 40.555 15.607 -4.639 1.00 96.18 P ATOM 18 N1 DC T 2 35.400 12.615 -4.461 1.00 41.58 N ATOM 19 C2 DC T 2 34.587 11.676 -4.981 1.00 40.33 C ATOM 20 O2 DC T 2 33.522 12.028 -5.494 1.00 48.92 O ATOM 21 N3 DC T 2 34.970 10.387 -4.919 1.00 29.86 N ATOM 22 C4 DC T 2 36.104 9.978 -4.392 1.00 32.88 C ATOM 23 N4 DC T 2 36.478 8.686 -4.346 1.00 36.68 N ATOM 24 C5 DC T 2 36.976 10.963 -3.884 1.00 35.83 C ATOM 25 C6 DC T 2 36.602 12.252 -3.952 1.00 41.34 C ATOM 26 OP1 DC T 2 40.959 17.032 -4.811 1.00 97.99 O ATOM 27 OP2 DC T 2 41.103 14.802 -3.511 1.00100.00 O ATOM 28 O5' DC T 2 38.918 15.434 -4.561 1.00 91.06 O ATOM 29 C5' DC T 2 37.980 16.034 -5.461 1.00 84.81 C ATOM 30 C4' DC T 2 36.526 15.862 -5.006 1.00 80.71 C ATOM 31 O4' DC T 2 35.940 14.637 -5.498 1.00 78.91 O ATOM 32 C3' DC T 2 36.271 15.874 -3.523 1.00 74.90 C ATOM 33 O3' DC T 2 36.005 17.166 -3.000 1.00 74.05 O ATOM 34 C2' DC T 2 35.164 14.849 -3.270 1.00 68.93 C ATOM 35 C1' DC T 2 35.023 14.066 -4.566 1.00 64.74 C ATOM 36 P DG T 3 34.605 17.915 -2.810 1.00 73.35 P ATOM 37 N9 DG T 3 31.282 13.640 -2.877 1.00 44.49 N ATOM 38 C8 DG T 3 32.529 13.804 -2.321 1.00 39.08 C ATOM 39 N7 DG T 3 33.128 12.663 -2.138 1.00 33.08 N ATOM 40 C5 DG T 3 32.198 11.717 -2.652 1.00 22.12 C ATOM 41 C6 DG T 3 32.294 10.360 -2.717 1.00 31.26 C ATOM 42 O6 DG T 3 33.250 9.655 -2.380 1.00 41.04 O ATOM 43 N1 DG T 3 31.184 9.800 -3.284 1.00 26.70 N ATOM 44 C2 DG T 3 30.126 10.468 -3.725 1.00 27.91 C ATOM 45 N2 DG T 3 29.161 9.724 -4.223 1.00 43.73 N ATOM 46 N3 DG T 3 29.998 11.744 -3.685 1.00 28.19 N ATOM 47 C4 DG T 3 31.072 12.308 -3.124 1.00 28.20 C ATOM 48 OP1 DG T 3 34.589 19.120 -3.638 1.00 81.12 O ATOM 49 OP2 DG T 3 34.528 18.126 -1.350 1.00 81.97 O ATOM 50 O5' DG T 3 33.394 17.004 -3.302 1.00 49.14 O ATOM 51 C5' DG T 3 32.303 17.779 -3.658 1.00 41.34 C ATOM 52 C4' DG T 3 31.011 17.006 -3.685 1.00 57.21 C ATOM 53 O4' DG T 3 31.286 15.621 -4.002 1.00 62.03 O ATOM 54 C3' DG T 3 30.042 17.028 -2.477 1.00 69.36 C ATOM 55 O3' DG T 3 28.759 17.610 -2.915 1.00 72.51 O ATOM 56 C2' DG T 3 29.784 15.547 -2.132 1.00 72.00 C ATOM 57 C1' DG T 3 30.419 14.737 -3.258 1.00 62.49 C ATOM 58 P DA T 4 27.466 17.518 -1.982 1.00 64.19 P ATOM 59 N9 DA T 4 27.342 12.229 -1.094 1.00 21.77 N ATOM 60 C8 DA T 4 28.261 13.103 -0.615 1.00 20.73 C ATOM 61 N7 DA T 4 29.353 12.507 -0.138 1.00 27.46 N ATOM 62 C5 DA T 4 29.119 11.124 -0.375 1.00 9.13 C ATOM 63 C6 DA T 4 29.862 10.023 -0.083 1.00 21.33 C ATOM 64 N6 DA T 4 31.090 10.036 0.498 1.00 34.32 N ATOM 65 N1 DA T 4 29.365 8.896 -0.416 1.00 23.08 N ATOM 66 C2 DA T 4 28.168 8.908 -0.974 1.00 20.95 C ATOM 67 N3 DA T 4 27.365 9.884 -1.286 1.00 23.76 N ATOM 68 C4 DA T 4 27.895 10.966 -0.945 1.00 13.19 C ATOM 69 OP1 DA T 4 26.468 18.570 -2.343 1.00 62.16 O ATOM 70 OP2 DA T 4 28.003 17.475 -0.618 1.00 62.72 O ATOM 71 O5' DA T 4 26.833 16.099 -2.311 1.00 56.59 O ATOM 72 C5' DA T 4 26.300 15.721 -3.518 1.00 54.62 C ATOM 73 C4' DA T 4 25.580 14.390 -3.259 1.00 60.80 C ATOM 74 O4' DA T 4 26.472 13.300 -2.919 1.00 63.36 O ATOM 75 C3' DA T 4 24.567 14.394 -2.132 1.00 63.62 C ATOM 76 O3' DA T 4 23.402 13.813 -2.646 1.00 70.71 O ATOM 77 C2' DA T 4 25.119 13.457 -1.030 1.00 57.28 C ATOM 78 C1' DA T 4 26.080 12.548 -1.743 1.00 47.48 C ATOM 79 P DC T 5 22.139 13.808 -1.710 1.00 72.80 P ATOM 80 N1 DC T 5 25.615 10.358 1.686 1.00 18.51 N ATOM 81 C2 DC T 5 26.534 9.391 1.970 1.00 28.38 C ATOM 82 O2 DC T 5 26.218 8.200 1.770 1.00 43.41 O ATOM 83 N3 DC T 5 27.728 9.754 2.449 1.00 24.22 N ATOM 84 C4 DC T 5 27.973 11.025 2.656 1.00 23.70 C ATOM 85 N4 DC T 5 29.171 11.342 3.115 1.00 44.41 N ATOM 86 C5 DC T 5 27.047 12.039 2.423 1.00 11.83 C ATOM 87 C6 DC T 5 25.864 11.658 1.973 1.00 12.97 C ATOM 88 OP1 DC T 5 20.930 13.387 -2.461 1.00 70.81 O ATOM 89 OP2 DC T 5 22.172 15.110 -1.003 1.00 71.68 O ATOM 90 O5' DC T 5 22.492 12.551 -0.788 1.00 66.52 O ATOM 91 C5' DC T 5 22.280 11.313 -1.370 1.00 58.09 C ATOM 92 C4' DC T 5 22.568 10.237 -0.380 1.00 52.88 C ATOM 93 O4' DC T 5 23.987 10.250 -0.117 1.00 50.87 O ATOM 94 C3' DC T 5 21.851 10.394 0.947 1.00 55.54 C ATOM 95 O3' DC T 5 20.953 9.263 1.200 1.00 68.20 O ATOM 96 C2' DC T 5 22.998 10.396 1.965 1.00 46.95 C ATOM 97 C1' DC T 5 24.219 9.896 1.197 1.00 37.15 C ATOM 98 P DG T 6 19.769 9.322 2.321 1.00 71.62 P ATOM 99 N9 DG T 6 16.310 11.432 4.508 1.00 80.29 N ATOM 100 C8 DG T 6 17.537 10.949 4.941 1.00 77.90 C ATOM 101 N7 DG T 6 17.427 10.307 6.082 1.00 75.03 N ATOM 102 C5 DG T 6 16.050 10.395 6.399 1.00 70.09 C ATOM 103 C6 DG T 6 15.346 9.890 7.506 1.00 63.45 C ATOM 104 O6 DG T 6 15.814 9.255 8.449 1.00 59.32 O ATOM 105 N1 DG T 6 13.977 10.194 7.452 1.00 62.39 N ATOM 106 C2 DG T 6 13.343 10.906 6.440 1.00 66.65 C ATOM 107 N2 DG T 6 11.990 11.098 6.567 1.00 73.08 N ATOM 108 N3 DG T 6 13.994 11.398 5.383 1.00 59.15 N ATOM 109 C4 DG T 6 15.340 11.107 5.444 1.00 70.10 C ATOM 110 OP1 DG T 6 20.444 9.794 3.557 1.00 82.08 O ATOM 111 OP2 DG T 6 19.030 8.029 2.314 1.00 63.62 O ATOM 112 O5' DG T 6 18.759 10.500 1.928 1.00 66.47 O ATOM 113 C5' DG T 6 17.741 10.322 0.952 1.00 70.82 C ATOM 114 C4' DG T 6 16.705 11.427 1.115 1.00 74.00 C ATOM 115 O4' DG T 6 15.889 11.160 2.283 1.00 71.13 O ATOM 116 C3' DG T 6 17.325 12.805 1.297 1.00 72.25 C ATOM 117 O3' DG T 6 16.676 13.724 0.421 1.00 76.71 O ATOM 118 C2' DG T 6 17.097 13.166 2.776 1.00 71.34 C ATOM 119 C1' DG T 6 16.027 12.177 3.269 1.00 75.23 C ATOM 120 P DG T 7 17.185 15.253 0.335 1.00 88.22 P ATOM 121 N9 DG T 7 15.072 15.427 5.737 1.00 59.69 N ATOM 122 C8 DG T 7 16.431 15.305 5.773 1.00 61.23 C ATOM 123 N7 DG T 7 16.790 14.502 6.743 1.00 59.96 N ATOM 124 C5 DG T 7 15.575 14.107 7.321 1.00 47.67 C ATOM 125 C6 DG T 7 15.358 13.274 8.352 1.00 45.31 C ATOM 126 O6 DG T 7 16.199 12.708 9.023 1.00 62.08 O ATOM 127 N1 DG T 7 14.055 13.105 8.630 1.00 32.57 N ATOM 128 C2 DG T 7 13.036 13.687 7.998 1.00 44.32 C ATOM 129 N2 DG T 7 11.812 13.334 8.471 1.00 58.57 N ATOM 130 N3 DG T 7 13.188 14.511 6.971 1.00 50.32 N ATOM 131 C4 DG T 7 14.508 14.667 6.711 1.00 53.93 C ATOM 132 OP1 DG T 7 16.769 15.825 -0.964 1.00 90.91 O ATOM 133 OP2 DG T 7 18.594 15.271 0.797 1.00 86.16 O ATOM 134 O5' DG T 7 16.258 15.998 1.378 1.00 90.40 O ATOM 135 C5' DG T 7 14.875 15.787 1.254 1.00 84.65 C ATOM 136 C4' DG T 7 14.125 16.215 2.499 1.00 80.06 C ATOM 137 O4' DG T 7 14.255 15.362 3.650 1.00 69.03 O ATOM 138 C3' DG T 7 14.367 17.617 2.977 1.00 81.39 C ATOM 139 O3' DG T 7 13.118 18.188 2.920 1.00 86.46 O ATOM 140 C2' DG T 7 14.815 17.507 4.425 1.00 70.47 C ATOM 141 C1' DG T 7 14.296 16.146 4.815 1.00 63.39 C ATOM 142 P DC T 8 12.885 19.660 3.423 1.00 89.88 P ATOM 143 N1 DC T 8 13.049 17.598 8.157 1.00 48.94 N ATOM 144 C2 DC T 8 13.104 16.731 9.262 1.00 49.57 C ATOM 145 O2 DC T 8 12.050 16.316 9.738 1.00 48.39 O ATOM 146 N3 DC T 8 14.291 16.349 9.768 1.00 46.31 N ATOM 147 C4 DC T 8 15.384 16.818 9.225 1.00 46.34 C ATOM 148 N4 DC T 8 16.527 16.403 9.767 1.00 48.66 N ATOM 149 C5 DC T 8 15.372 17.718 8.125 1.00 47.77 C ATOM 150 C6 DC T 8 14.177 18.090 7.632 1.00 49.97 C ATOM 151 OP1 DC T 8 12.122 20.358 2.344 1.00 95.34 O ATOM 152 OP2 DC T 8 14.178 20.190 3.964 1.00 86.35 O ATOM 153 O5' DC T 8 11.917 19.361 4.633 1.00 86.07 O ATOM 154 C5' DC T 8 10.832 18.467 4.453 1.00 78.37 C ATOM 155 C4' DC T 8 10.369 18.192 5.833 1.00 65.38 C ATOM 156 O4' DC T 8 11.331 17.343 6.509 1.00 61.98 O ATOM 157 C3' DC T 8 10.333 19.528 6.564 1.00 55.59 C ATOM 158 O3' DC T 8 9.093 19.590 7.188 1.00 58.60 O ATOM 159 C2' DC T 8 11.513 19.513 7.506 1.00 49.66 C ATOM 160 C1' DC T 8 11.757 18.010 7.661 1.00 53.19 C ATOM 161 P DG T 9 8.556 20.938 7.798 1.00 67.12 P ATOM 162 N9 DG T 9 10.336 19.539 12.002 1.00 52.54 N ATOM 163 C8 DG T 9 10.891 20.245 10.921 1.00 54.00 C ATOM 164 N7 DG T 9 12.204 20.114 10.832 1.00 40.63 N ATOM 165 C5 DG T 9 12.498 19.309 11.918 1.00 44.64 C ATOM 166 C6 DG T 9 13.716 18.834 12.338 1.00 46.70 C ATOM 167 O6 DG T 9 14.805 18.993 11.823 1.00 47.55 O ATOM 168 N1 DG T 9 13.577 18.083 13.484 1.00 42.82 N ATOM 169 C2 DG T 9 12.430 17.816 14.106 1.00 37.41 C ATOM 170 N2 DG T 9 12.552 17.085 15.181 1.00 38.79 N ATOM 171 N3 DG T 9 11.251 18.240 13.742 1.00 34.30 N ATOM 172 C4 DG T 9 11.361 18.985 12.669 1.00 41.75 C ATOM 173 OP1 DG T 9 7.310 21.289 7.110 1.00 76.91 O ATOM 174 OP2 DG T 9 9.653 21.923 7.885 1.00 60.54 O ATOM 175 O5' DG T 9 8.173 20.409 9.254 1.00 71.83 O ATOM 176 C5' DG T 9 7.210 19.333 9.470 1.00 62.25 C ATOM 177 C4' DG T 9 7.050 19.112 10.985 1.00 49.91 C ATOM 178 O4' DG T 9 8.232 18.553 11.585 1.00 53.06 O ATOM 179 C3' DG T 9 6.778 20.356 11.759 1.00 38.69 C ATOM 180 O3' DG T 9 5.958 19.871 12.764 1.00 52.08 O ATOM 181 C2' DG T 9 8.105 20.786 12.381 1.00 42.52 C ATOM 182 C1' DG T 9 8.914 19.478 12.434 1.00 52.08 C ATOM 183 P DC T 10 5.263 20.874 13.799 1.00 50.36 P ATOM 184 N1 DC T 10 10.654 21.200 15.452 1.00 45.50 N ATOM 185 C2 DC T 10 11.907 20.812 15.773 1.00 42.97 C ATOM 186 O2 DC T 10 12.017 20.138 16.788 1.00 36.49 O ATOM 187 N3 DC T 10 12.929 21.105 14.970 1.00 43.24 N ATOM 188 C4 DC T 10 12.723 21.842 13.886 1.00 50.20 C ATOM 189 N4 DC T 10 13.780 22.113 13.127 1.00 60.54 N ATOM 190 C5 DC T 10 11.424 22.302 13.524 1.00 48.47 C ATOM 191 C6 DC T 10 10.402 21.963 14.342 1.00 49.73 C ATOM 192 OP1 DC T 10 3.944 20.262 14.101 1.00 44.70 O ATOM 193 OP2 DC T 10 5.344 22.240 13.251 1.00 44.03 O ATOM 194 O5' DC T 10 6.288 20.737 15.014 1.00 45.40 O ATOM 195 C5' DC T 10 6.452 19.502 15.771 1.00 46.84 C ATOM 196 C4' DC T 10 7.637 19.682 16.714 1.00 54.90 C ATOM 197 O4' DC T 10 8.883 19.713 15.978 1.00 60.21 O ATOM 198 C3' DC T 10 7.610 20.983 17.534 1.00 53.43 C ATOM 199 O3' DC T 10 7.736 20.632 18.896 1.00 57.40 O ATOM 200 C2' DC T 10 8.821 21.809 17.085 1.00 53.27 C ATOM 201 C1' DC T 10 9.687 20.773 16.422 1.00 49.42 C ATOM 202 P DA T 11 7.426 21.604 20.147 1.00 44.92 P ATOM 203 N9 DA T 11 12.635 22.996 19.580 1.00 51.25 N ATOM 204 C8 DA T 11 11.634 23.539 18.828 1.00 52.62 C ATOM 205 N7 DA T 11 12.060 23.942 17.650 1.00 50.07 N ATOM 206 C5 DA T 11 13.424 23.593 17.657 1.00 49.43 C ATOM 207 C6 DA T 11 14.452 23.750 16.721 1.00 49.91 C ATOM 208 N6 DA T 11 14.284 24.267 15.474 1.00 55.19 N ATOM 209 N1 DA T 11 15.657 23.321 17.124 1.00 48.95 N ATOM 210 C2 DA T 11 15.833 22.746 18.311 1.00 49.02 C ATOM 211 N3 DA T 11 14.945 22.560 19.260 1.00 51.90 N ATOM 212 C4 DA T 11 13.776 23.026 18.865 1.00 49.89 C ATOM 213 OP1 DA T 11 6.486 20.779 20.934 1.00 52.15 O ATOM 214 OP2 DA T 11 7.106 23.052 19.775 1.00 26.83 O ATOM 215 O5' DA T 11 8.886 21.653 20.790 1.00 30.07 O ATOM 216 C5' DA T 11 9.605 20.486 21.192 1.00 20.38 C ATOM 217 C4' DA T 11 10.933 20.952 21.743 1.00 38.20 C ATOM 218 O4' DA T 11 11.833 21.265 20.677 1.00 48.70 O ATOM 219 C3' DA T 11 11.015 22.128 22.729 1.00 45.89 C ATOM 220 O3' DA T 11 11.947 21.640 23.780 1.00 57.79 O ATOM 221 C2' DA T 11 11.733 23.240 21.931 1.00 43.35 C ATOM 222 C1' DA T 11 12.539 22.447 20.893 1.00 43.20 C ATOM 223 P DT T 12 12.371 22.496 25.066 1.00 55.75 P ATOM 224 N1 DT T 12 15.390 25.309 21.335 1.00 46.34 N ATOM 225 C2 DT T 12 16.281 25.519 20.260 1.00 39.16 C ATOM 226 O2 DT T 12 17.473 25.171 20.287 1.00 38.84 O ATOM 227 N3 DT T 12 15.726 26.146 19.177 1.00 37.51 N ATOM 228 C4 DT T 12 14.393 26.549 19.086 1.00 43.33 C ATOM 229 O4 DT T 12 13.992 27.076 18.060 1.00 48.24 O ATOM 230 C5 DT T 12 13.538 26.289 20.221 1.00 40.55 C ATOM 231 C6 DT T 12 14.073 25.693 21.291 1.00 43.09 C ATOM 232 OP1 DT T 12 12.639 21.468 26.127 1.00 61.72 O ATOM 233 OP2 DT T 12 11.396 23.626 25.117 1.00 48.97 O ATOM 234 O5' DT T 12 13.756 23.111 24.854 1.00 44.65 O ATOM 235 C5' DT T 12 14.774 22.216 24.720 1.00 39.05 C ATOM 236 C4' DT T 12 15.847 23.000 24.067 1.00 46.50 C ATOM 237 O4' DT T 12 15.340 23.430 22.791 1.00 52.80 O ATOM 238 C3' DT T 12 16.284 24.284 24.818 1.00 53.23 C ATOM 239 O3' DT T 12 17.681 24.124 25.042 1.00 66.29 O ATOM 240 C2' DT T 12 16.027 25.421 23.844 1.00 52.49 C ATOM 241 C1' DT T 12 15.891 24.663 22.534 1.00 51.74 C ATOM 242 C7 DT T 12 12.106 26.725 20.179 1.00 31.98 C ATOM 243 P DC T 13 18.628 25.046 25.959 1.00 68.41 P ATOM 244 N1 DC T 13 18.740 28.055 21.451 1.00 50.35 N ATOM 245 C2 DC T 13 18.678 28.497 20.164 1.00 49.79 C ATOM 246 O2 DC T 13 19.717 28.459 19.534 1.00 62.39 O ATOM 247 N3 DC T 13 17.549 28.951 19.638 1.00 45.40 N ATOM 248 C4 DC T 13 16.460 28.983 20.351 1.00 56.67 C ATOM 249 N4 DC T 13 15.350 29.440 19.755 1.00 54.62 N ATOM 250 C5 DC T 13 16.463 28.521 21.728 1.00 61.78 C ATOM 251 C6 DC T 13 17.627 28.061 22.237 1.00 55.50 C ATOM 252 OP1 DC T 13 19.498 24.098 26.756 1.00 62.10 O ATOM 253 OP2 DC T 13 17.813 26.149 26.547 1.00 66.30 O ATOM 254 O5' DC T 13 19.577 25.717 24.892 1.00 77.82 O ATOM 255 C5' DC T 13 20.408 24.901 24.079 1.00 77.86 C ATOM 256 C4' DC T 13 20.998 25.756 23.001 1.00 73.09 C ATOM 257 O4' DC T 13 19.969 26.184 22.075 1.00 70.23 O ATOM 258 C3' DC T 13 21.670 26.993 23.538 1.00 70.56 C ATOM 259 O3' DC T 13 23.015 26.891 23.181 1.00 74.30 O ATOM 260 C2' DC T 13 20.934 28.202 22.923 1.00 67.34 C ATOM 261 C1' DC T 13 20.059 27.558 21.854 1.00 60.56 C ATOM 262 P DA T 14 24.052 27.959 23.704 1.00 86.34 P ATOM 263 N9 DA T 14 21.945 31.590 20.302 1.00 52.31 N ATOM 264 C8 DA T 14 21.271 31.159 21.399 1.00 57.44 C ATOM 265 N7 DA T 14 19.962 31.312 21.259 1.00 60.98 N ATOM 266 C5 DA T 14 19.820 31.848 19.983 1.00 65.63 C ATOM 267 C6 DA T 14 18.694 32.239 19.241 1.00 71.66 C ATOM 268 N6 DA T 14 17.440 32.107 19.700 1.00 76.10 N ATOM 269 N1 DA T 14 18.913 32.750 17.999 1.00 63.43 N ATOM 270 C2 DA T 14 20.164 32.863 17.525 1.00 64.39 C ATOM 271 N3 DA T 14 21.299 32.532 18.126 1.00 66.49 N ATOM 272 C4 DA T 14 21.048 32.035 19.371 1.00 63.00 C ATOM 273 OP1 DA T 14 25.335 27.207 23.958 1.00 84.80 O ATOM 274 OP2 DA T 14 23.409 28.818 24.758 1.00 86.25 O ATOM 275 O5' DA T 14 24.169 28.911 22.411 1.00 86.93 O ATOM 276 C5' DA T 14 24.646 28.449 21.145 1.00 74.20 C ATOM 277 C4' DA T 14 24.789 29.633 20.228 1.00 59.99 C ATOM 278 O4' DA T 14 23.521 30.120 19.814 1.00 55.63 O ATOM 279 C3' DA T 14 25.491 30.804 20.827 1.00 55.21 C ATOM 280 O3' DA T 14 26.377 31.184 19.843 1.00 64.64 O ATOM 281 C2' DA T 14 24.432 31.903 21.039 1.00 47.50 C ATOM 282 C1' DA T 14 23.364 31.516 20.043 1.00 49.64 C ATOM 283 P DG T 15 27.328 32.408 20.128 1.00 72.07 P ATOM 284 N9 DG T 15 22.018 35.324 19.596 1.00 48.58 N ATOM 285 C8 DG T 15 22.154 34.793 20.855 1.00 51.21 C ATOM 286 N7 DG T 15 20.981 34.692 21.425 1.00 49.83 N ATOM 287 C5 DG T 15 20.084 35.194 20.464 1.00 42.16 C ATOM 288 C6 DG T 15 18.679 35.338 20.484 1.00 49.78 C ATOM 289 O6 DG T 15 17.863 35.051 21.371 1.00 60.20 O ATOM 290 N1 DG T 15 18.229 35.902 19.293 1.00 51.05 N ATOM 291 C2 DG T 15 19.035 36.255 18.225 1.00 48.11 C ATOM 292 N2 DG T 15 18.430 36.798 17.187 1.00 50.30 N ATOM 293 N3 DG T 15 20.330 36.118 18.195 1.00 43.71 N ATOM 294 C4 DG T 15 20.754 35.598 19.345 1.00 40.23 C ATOM 295 OP1 DG T 15 28.557 32.160 19.360 1.00 79.49 O ATOM 296 OP2 DG T 15 27.375 32.583 21.596 1.00 83.19 O ATOM 297 O5' DG T 15 26.506 33.648 19.547 1.00 64.10 O ATOM 298 C5' DG T 15 25.963 33.548 18.274 1.00 57.91 C ATOM 299 C4' DG T 15 25.012 34.676 17.964 1.00 53.94 C ATOM 300 O4' DG T 15 23.653 34.403 18.315 1.00 51.78 O ATOM 301 C3' DG T 15 25.352 36.071 18.406 1.00 59.12 C ATOM 302 O3' DG T 15 25.681 36.850 17.235 1.00 74.97 O ATOM 303 C2' DG T 15 24.055 36.621 18.989 1.00 52.60 C ATOM 304 C1' DG T 15 23.019 35.604 18.624 1.00 50.19 C ATOM 305 P DC T 16 26.103 38.400 17.376 1.00 73.87 P ATOM 306 N1 DC T 16 21.199 39.672 18.727 1.00 70.59 N ATOM 307 C2 DC T 16 19.914 39.698 19.082 1.00 64.43 C ATOM 308 O2 DC T 16 19.176 40.233 18.276 1.00 64.10 O ATOM 309 N3 DC T 16 19.528 39.158 20.249 1.00 58.65 N ATOM 310 C4 DC T 16 20.406 38.611 21.053 1.00 57.40 C ATOM 311 N4 DC T 16 19.939 38.088 22.176 1.00 48.31 N ATOM 312 C5 DC T 16 21.784 38.548 20.702 1.00 65.71 C ATOM 313 C6 DC T 16 22.139 39.090 19.518 1.00 72.13 C ATOM 314 OP1 DC T 16 27.296 38.575 16.508 1.00 74.54 O ATOM 315 OP2 DC T 16 26.216 38.708 18.825 1.00 70.03 O ATOM 316 O5' DC T 16 24.771 39.195 16.885 1.00 68.59 O ATOM 317 C5' DC T 16 24.043 38.874 15.711 1.00 68.38 C ATOM 318 C4' DC T 16 22.801 39.729 15.665 1.00 74.18 C ATOM 319 O4' DC T 16 21.813 39.227 16.565 1.00 71.99 O ATOM 320 C3' DC T 16 23.042 41.195 16.024 1.00 81.43 C ATOM 321 O3' DC T 16 22.339 42.013 15.070 1.00 86.74 O ATOM 322 C2' DC T 16 22.439 41.374 17.408 1.00 77.10 C ATOM 323 C1' DC T 16 21.445 40.248 17.459 1.00 71.81 C TER 324 DC T 16 ATOM 325 N9 DG P 1 13.057 39.327 21.819 1.00 59.12 N ATOM 326 C8 DG P 1 12.954 38.669 23.013 1.00 57.21 C ATOM 327 N7 DG P 1 14.151 38.248 23.406 1.00 57.67 N ATOM 328 C5 DG P 1 15.005 38.657 22.401 1.00 52.35 C ATOM 329 C6 DG P 1 16.387 38.523 22.224 1.00 50.25 C ATOM 330 O6 DG P 1 17.209 38.023 22.960 1.00 49.73 O ATOM 331 N1 DG P 1 16.804 39.132 21.062 1.00 51.45 N ATOM 332 C2 DG P 1 15.981 39.751 20.185 1.00 59.48 C ATOM 333 N2 DG P 1 16.502 40.252 19.091 1.00 66.70 N ATOM 334 N3 DG P 1 14.707 39.881 20.331 1.00 57.31 N ATOM 335 C4 DG P 1 14.311 39.316 21.438 1.00 56.85 C ATOM 336 O5' DG P 1 9.416 38.237 23.483 1.00 78.45 O ATOM 337 C5' DG P 1 10.100 39.462 23.389 1.00 72.90 C ATOM 338 C4' DG P 1 9.991 39.993 21.989 1.00 70.28 C ATOM 339 O4' DG P 1 11.219 40.683 21.799 1.00 64.14 O ATOM 340 C3' DG P 1 9.985 38.872 20.975 1.00 76.03 C ATOM 341 O3' DG P 1 8.958 38.973 20.062 1.00 89.12 O ATOM 342 C2' DG P 1 11.295 38.930 20.260 1.00 70.02 C ATOM 343 C1' DG P 1 12.067 39.956 20.992 1.00 61.25 C ATOM 344 P DC P 2 8.696 37.663 19.192 1.00 95.70 P ATOM 345 N1 DC P 2 13.561 37.029 18.001 1.00 54.56 N ATOM 346 C2 DC P 2 14.902 36.822 18.135 1.00 54.26 C ATOM 347 O2 DC P 2 15.638 37.155 17.210 1.00 55.15 O ATOM 348 N3 DC P 2 15.356 36.285 19.251 1.00 53.10 N ATOM 349 C4 DC P 2 14.510 35.920 20.224 1.00 61.57 C ATOM 350 N4 DC P 2 15.032 35.397 21.334 1.00 72.12 N ATOM 351 C5 DC P 2 13.096 36.087 20.095 1.00 50.45 C ATOM 352 C6 DC P 2 12.671 36.626 18.952 1.00 49.36 C ATOM 353 OP1 DC P 2 7.402 37.824 18.489 1.00100.00 O ATOM 354 OP2 DC P 2 8.977 36.436 19.996 1.00 94.91 O ATOM 355 O5' DC P 2 9.870 37.799 18.151 1.00 91.05 O ATOM 356 C5' DC P 2 10.042 38.948 17.356 1.00 86.44 C ATOM 357 C4' DC P 2 11.073 38.552 16.322 1.00 77.02 C ATOM 358 O4' DC P 2 12.387 38.734 16.903 1.00 59.98 O ATOM 359 C3' DC P 2 10.953 37.050 16.017 1.00 84.99 C ATOM 360 O3' DC P 2 10.267 36.675 14.836 1.00 95.71 O ATOM 361 C2' DC P 2 12.327 36.461 16.131 1.00 73.94 C ATOM 362 C1' DC P 2 13.141 37.558 16.770 1.00 61.26 C ATOM 363 P DT P 3 10.866 36.817 13.378 1.00 98.09 P ATOM 364 N1 DT P 3 15.659 34.364 14.782 1.00 57.62 N ATOM 365 C2 DT P 3 16.729 33.959 15.498 1.00 56.50 C ATOM 366 O2 DT P 3 17.862 34.075 15.084 1.00 58.08 O ATOM 367 N3 DT P 3 16.426 33.445 16.703 1.00 56.71 N ATOM 368 C4 DT P 3 15.165 33.267 17.247 1.00 64.16 C ATOM 369 O4 DT P 3 15.034 32.785 18.362 1.00 78.13 O ATOM 370 C5 DT P 3 14.068 33.716 16.426 1.00 52.50 C ATOM 371 C6 DT P 3 14.360 34.260 15.243 1.00 49.97 C ATOM 372 OP1 DT P 3 10.857 38.285 13.052 1.00100.00 O ATOM 373 OP2 DT P 3 10.097 35.803 12.619 1.00 90.11 O ATOM 374 O5' DT P 3 12.410 36.364 13.356 1.00 93.56 O ATOM 375 C5' DT P 3 13.320 37.169 12.571 1.00 83.76 C ATOM 376 C4' DT P 3 14.684 36.527 12.318 1.00 80.43 C ATOM 377 O4' DT P 3 15.376 36.240 13.548 1.00 76.29 O ATOM 378 C3' DT P 3 14.718 35.256 11.479 1.00 79.65 C ATOM 379 O3' DT P 3 15.583 35.441 10.397 1.00 75.69 O ATOM 380 C2' DT P 3 15.360 34.190 12.355 1.00 81.01 C ATOM 381 C1' DT P 3 15.936 34.949 13.528 1.00 72.13 C ATOM 382 C7 DT P 3 12.660 33.598 16.941 1.00 45.92 C ATOM 383 P DG P 4 15.710 34.261 9.334 1.00 77.47 P ATOM 384 N9 DG P 4 17.573 31.097 13.186 1.00 61.65 N ATOM 385 C8 DG P 4 16.263 31.423 13.059 1.00 58.44 C ATOM 386 N7 DG P 4 15.612 31.193 14.161 1.00 60.84 N ATOM 387 C5 DG P 4 16.574 30.698 15.036 1.00 58.57 C ATOM 388 C6 DG P 4 16.452 30.280 16.365 1.00 48.51 C ATOM 389 O6 DG P 4 15.451 30.284 17.041 1.00 44.73 O ATOM 390 N1 DG P 4 17.646 29.840 16.886 1.00 47.39 N ATOM 391 C2 DG P 4 18.840 29.821 16.198 1.00 53.05 C ATOM 392 N2 DG P 4 19.889 29.341 16.841 1.00 56.08 N ATOM 393 N3 DG P 4 18.982 30.205 14.939 1.00 51.77 N ATOM 394 C4 DG P 4 17.799 30.625 14.433 1.00 58.90 C ATOM 395 OP1 DG P 4 16.092 34.885 8.049 1.00 90.72 O ATOM 396 OP2 DG P 4 14.498 33.444 9.424 1.00 78.89 O ATOM 397 O5' DG P 4 16.903 33.370 9.872 1.00 64.95 O ATOM 398 C5' DG P 4 18.204 33.919 9.995 1.00 57.58 C ATOM 399 C4' DG P 4 19.122 32.876 10.581 1.00 55.89 C ATOM 400 O4' DG P 4 18.755 32.627 11.940 1.00 62.68 O ATOM 401 C3' DG P 4 19.128 31.505 9.893 1.00 57.94 C ATOM 402 O3' DG P 4 20.505 31.202 9.814 1.00 61.45 O ATOM 403 C2' DG P 4 18.427 30.532 10.844 1.00 59.65 C ATOM 404 C1' DG P 4 18.596 31.238 12.184 1.00 64.05 C ATOM 405 P DA P 5 21.021 29.727 9.538 1.00 55.00 P ATOM 406 N9 DA P 5 19.839 27.399 13.686 1.00 47.82 N ATOM 407 C8 DA P 5 18.956 27.986 12.834 1.00 46.03 C ATOM 408 N7 DA P 5 17.741 28.041 13.359 1.00 52.67 N ATOM 409 C5 DA P 5 17.863 27.473 14.650 1.00 52.59 C ATOM 410 C6 DA P 5 16.953 27.222 15.744 1.00 50.07 C ATOM 411 N6 DA P 5 15.651 27.549 15.777 1.00 51.96 N ATOM 412 N1 DA P 5 17.446 26.653 16.850 1.00 46.40 N ATOM 413 C2 DA P 5 18.739 26.334 16.888 1.00 49.97 C ATOM 414 N3 DA P 5 19.684 26.495 15.977 1.00 53.32 N ATOM 415 C4 DA P 5 19.170 27.079 14.859 1.00 55.50 C ATOM 416 OP1 DA P 5 22.304 29.882 8.812 1.00 56.88 O ATOM 417 OP2 DA P 5 19.866 28.952 9.033 1.00 53.88 O ATOM 418 O5' DA P 5 21.413 29.135 10.984 1.00 50.68 O ATOM 419 C5' DA P 5 22.439 29.771 11.841 1.00 42.76 C ATOM 420 C4' DA P 5 22.950 28.717 12.781 1.00 34.21 C ATOM 421 O4' DA P 5 21.883 28.450 13.687 1.00 42.58 O ATOM 422 C3' DA P 5 23.188 27.410 12.070 1.00 33.73 C ATOM 423 O3' DA P 5 24.290 26.954 12.662 1.00 36.02 O ATOM 424 C2' DA P 5 21.950 26.535 12.319 1.00 41.22 C ATOM 425 C1' DA P 5 21.302 27.189 13.544 1.00 43.89 C ATOM 426 P DT P 6 24.635 25.427 12.537 1.00 55.68 P ATOM 427 N1 DT P 6 20.394 23.171 15.199 1.00 52.45 N ATOM 428 C2 DT P 6 19.350 23.023 16.100 1.00 52.44 C ATOM 429 O2 DT P 6 19.508 22.571 17.231 1.00 45.80 O ATOM 430 N3 DT P 6 18.127 23.418 15.615 1.00 53.41 N ATOM 431 C4 DT P 6 17.884 23.904 14.367 1.00 59.24 C ATOM 432 O4 DT P 6 16.751 24.240 14.072 1.00 64.87 O ATOM 433 C5 DT P 6 18.970 24.058 13.499 1.00 56.18 C ATOM 434 C6 DT P 6 20.195 23.715 13.946 1.00 54.38 C ATOM 435 OP1 DT P 6 26.088 25.315 12.772 1.00 54.31 O ATOM 436 OP2 DT P 6 23.933 24.818 11.391 1.00 62.86 O ATOM 437 O5' DT P 6 23.960 24.810 13.858 1.00 77.07 O ATOM 438 C5' DT P 6 24.434 25.063 15.219 1.00 62.56 C ATOM 439 C4' DT P 6 23.798 23.999 16.041 1.00 45.78 C ATOM 440 O4' DT P 6 22.386 24.145 15.878 1.00 46.05 O ATOM 441 C3' DT P 6 24.073 22.555 15.595 1.00 43.04 C ATOM 442 O3' DT P 6 24.486 21.895 16.726 1.00 52.67 O ATOM 443 C2' DT P 6 22.747 21.940 15.107 1.00 38.28 C ATOM 444 C1' DT P 6 21.747 22.874 15.703 1.00 45.71 C ATOM 445 C7 DT P 6 18.660 24.623 12.150 1.00 51.83 C ATOM 446 P DG P 7 24.723 20.346 16.714 1.00 60.28 P ATOM 447 N9 DG P 7 19.222 18.965 16.785 1.00 40.88 N ATOM 448 C8 DG P 7 19.902 19.575 15.771 1.00 41.34 C ATOM 449 N7 DG P 7 19.109 20.164 14.941 1.00 37.16 N ATOM 450 C5 DG P 7 17.835 20.005 15.465 1.00 38.54 C ATOM 451 C6 DG P 7 16.573 20.455 14.969 1.00 47.76 C ATOM 452 O6 DG P 7 16.321 21.132 13.963 1.00 58.80 O ATOM 453 N1 DG P 7 15.532 20.122 15.814 1.00 43.68 N ATOM 454 C2 DG P 7 15.670 19.385 16.958 1.00 42.82 C ATOM 455 N2 DG P 7 14.531 19.167 17.616 1.00 40.27 N ATOM 456 N3 DG P 7 16.840 18.940 17.447 1.00 45.75 N ATOM 457 C4 DG P 7 17.883 19.287 16.648 1.00 42.16 C ATOM 458 OP1 DG P 7 25.949 20.031 17.483 1.00 56.05 O ATOM 459 OP2 DG P 7 24.682 19.938 15.298 1.00 74.42 O ATOM 460 O5' DG P 7 23.396 19.742 17.433 1.00 56.99 O ATOM 461 C5' DG P 7 22.968 20.097 18.680 1.00 38.31 C ATOM 462 C4' DG P 7 21.875 19.143 19.001 1.00 35.06 C ATOM 463 O4' DG P 7 20.627 19.508 18.390 1.00 41.74 O ATOM 464 C3' DG P 7 22.103 17.673 18.697 1.00 41.25 C ATOM 465 O3' DG P 7 21.918 17.097 19.992 1.00 44.35 O ATOM 466 C2' DG P 7 20.901 17.251 17.782 1.00 40.24 C ATOM 467 C1' DG P 7 19.874 18.361 17.914 1.00 40.01 C ATOM 468 P DC P 8 21.965 15.550 20.316 1.00 42.15 P ATOM 469 N1 DC P 8 17.002 15.697 16.443 1.00 37.50 N ATOM 470 C2 DC P 8 15.832 16.204 15.895 1.00 36.26 C ATOM 471 O2 DC P 8 14.801 15.996 16.427 1.00 40.77 O ATOM 472 N3 DC P 8 15.856 16.896 14.787 1.00 43.41 N ATOM 473 C4 DC P 8 17.009 17.084 14.218 1.00 49.76 C ATOM 474 N4 DC P 8 17.003 17.789 13.115 1.00 48.80 N ATOM 475 C5 DC P 8 18.226 16.613 14.766 1.00 47.04 C ATOM 476 C6 DC P 8 18.183 15.938 15.889 1.00 39.89 C ATOM 477 OP1 DC P 8 21.906 15.357 21.793 1.00 65.42 O ATOM 478 OP2 DC P 8 23.084 14.944 19.599 1.00 46.87 O ATOM 479 O5' DC P 8 20.552 15.085 19.744 1.00 44.15 O ATOM 480 C5' DC P 8 19.406 15.619 20.281 1.00 35.59 C ATOM 481 C4' DC P 8 18.204 14.978 19.666 1.00 37.36 C ATOM 482 O4' DC P 8 17.673 15.799 18.640 1.00 49.13 O ATOM 483 C3' DC P 8 18.270 13.531 19.147 1.00 44.01 C ATOM 484 O3' DC P 8 17.466 12.689 20.005 1.00 43.20 O ATOM 485 C2' DC P 8 17.581 13.590 17.762 1.00 45.90 C ATOM 486 C1' DC P 8 16.976 14.983 17.699 1.00 48.50 C ATOM 487 P DG P 9 17.509 11.091 19.859 1.00 46.39 P ATOM 488 N9 DG P 9 14.866 12.104 15.202 1.00 41.54 N ATOM 489 C8 DG P 9 16.191 11.971 15.371 1.00 41.08 C ATOM 490 N7 DG P 9 16.828 12.703 14.465 1.00 43.50 N ATOM 491 C5 DG P 9 15.827 13.324 13.693 1.00 41.66 C ATOM 492 C6 DG P 9 15.902 14.219 12.565 1.00 45.69 C ATOM 493 O6 DG P 9 16.881 14.668 12.010 1.00 42.68 O ATOM 494 N1 DG P 9 14.656 14.587 12.069 1.00 42.04 N ATOM 495 C2 DG P 9 13.504 14.172 12.589 1.00 37.90 C ATOM 496 N2 DG P 9 12.406 14.625 11.972 1.00 30.76 N ATOM 497 N3 DG P 9 13.415 13.337 13.637 1.00 47.10 N ATOM 498 C4 DG P 9 14.610 12.949 14.126 1.00 37.81 C ATOM 499 OP1 DG P 9 17.498 10.365 21.184 1.00 48.70 O ATOM 500 OP2 DG P 9 18.690 10.745 19.047 1.00 45.94 O ATOM 501 O5' DG P 9 16.155 10.904 19.048 1.00 38.24 O ATOM 502 C5' DG P 9 14.937 11.549 19.438 1.00 42.49 C ATOM 503 C4' DG P 9 13.827 11.327 18.399 1.00 51.91 C ATOM 504 O4' DG P 9 13.975 12.180 17.254 1.00 57.97 O ATOM 505 C3' DG P 9 13.680 9.934 17.829 1.00 52.35 C ATOM 506 O3' DG P 9 12.367 9.620 17.886 1.00 41.70 O ATOM 507 C2' DG P 9 14.070 10.011 16.334 1.00 53.56 C ATOM 508 C1' DG P 9 13.876 11.477 16.019 1.00 51.31 C ATOM 509 P DC P 10 12.056 8.134 17.553 1.00 49.87 P ATOM 510 N1 DC P 10 12.449 10.090 12.303 1.00 53.83 N ATOM 511 C2 DC P 10 12.660 10.996 11.261 1.00 49.06 C ATOM 512 O2 DC P 10 11.679 11.538 10.696 1.00 57.93 O ATOM 513 N3 DC P 10 13.926 11.279 10.933 1.00 34.86 N ATOM 514 C4 DC P 10 14.956 10.672 11.558 1.00 38.34 C ATOM 515 N4 DC P 10 16.212 10.949 11.221 1.00 47.89 N ATOM 516 C5 DC P 10 14.748 9.687 12.554 1.00 36.53 C ATOM 517 C6 DC P 10 13.485 9.404 12.866 1.00 44.17 C ATOM 518 OP1 DC P 10 10.781 7.720 18.185 1.00 72.34 O ATOM 519 OP2 DC P 10 13.254 7.323 17.764 1.00 42.68 O ATOM 520 O5' DC P 10 11.714 8.357 16.065 1.00 54.28 O ATOM 521 C5' DC P 10 10.597 9.141 16.079 1.00 66.14 C ATOM 522 C4' DC P 10 10.056 9.126 14.694 1.00 77.13 C ATOM 523 O4' DC P 10 10.670 10.160 13.872 1.00 80.19 O ATOM 524 C3' DC P 10 10.275 7.793 14.029 1.00 76.67 C ATOM 525 O3' DC P 10 9.010 7.173 13.798 1.00 84.96 O ATOM 526 C2' DC P 10 11.017 8.114 12.735 1.00 69.99 C ATOM 527 C1' DC P 10 11.080 9.658 12.643 1.00 68.26 C TER 528 DC P 10 ATOM 529 P DG D 1 36.165 3.476 7.483 1.00 56.61 P ATOM 530 N9 DG D 1 32.328 5.019 4.157 1.00 24.89 N ATOM 531 C8 DG D 1 33.363 5.747 4.642 1.00 31.64 C ATOM 532 N7 DG D 1 33.071 7.048 4.551 1.00 34.84 N ATOM 533 C5 DG D 1 31.731 7.108 4.002 1.00 20.13 C ATOM 534 C6 DG D 1 30.895 8.192 3.676 1.00 37.03 C ATOM 535 O6 DG D 1 31.091 9.413 3.804 1.00 50.73 O ATOM 536 N1 DG D 1 29.696 7.770 3.177 1.00 33.59 N ATOM 537 C2 DG D 1 29.354 6.488 3.006 1.00 38.35 C ATOM 538 N2 DG D 1 28.137 6.275 2.485 1.00 46.22 N ATOM 539 N3 DG D 1 30.132 5.472 3.307 1.00 26.92 N ATOM 540 C4 DG D 1 31.277 5.872 3.787 1.00 14.64 C ATOM 541 OP3 DG D 1 36.189 3.984 8.874 1.00 68.82 O ATOM 542 OP1 DG D 1 37.095 4.201 6.629 1.00 61.50 O ATOM 543 OP2 DG D 1 36.327 2.001 7.557 1.00 46.85 O ATOM 544 O5' DG D 1 34.655 3.618 6.898 1.00 49.62 O ATOM 545 C5' DG D 1 33.767 2.507 7.085 1.00 45.04 C ATOM 546 C4' DG D 1 32.906 2.227 5.865 1.00 47.94 C ATOM 547 O4' DG D 1 32.135 3.357 5.527 1.00 47.79 O ATOM 548 C3' DG D 1 33.607 1.781 4.587 1.00 54.56 C ATOM 549 O3' DG D 1 32.983 0.532 4.196 1.00 57.14 O ATOM 550 C2' DG D 1 33.336 2.885 3.546 1.00 54.32 C ATOM 551 C1' DG D 1 32.186 3.642 4.141 1.00 43.50 C ATOM 552 P DT D 2 33.448 -0.231 2.857 1.00 42.86 P ATOM 553 N1 DT D 2 30.996 4.093 -0.036 1.00 23.80 N ATOM 554 C2 DT D 2 30.241 5.165 -0.305 1.00 22.08 C ATOM 555 O2 DT D 2 29.138 5.045 -0.814 1.00 36.68 O ATOM 556 N3 DT D 2 30.779 6.383 0.029 1.00 16.73 N ATOM 557 C4 DT D 2 32.032 6.523 0.607 1.00 20.16 C ATOM 558 O4 DT D 2 32.485 7.629 0.907 1.00 34.32 O ATOM 559 C5 DT D 2 32.732 5.374 0.855 1.00 16.83 C ATOM 560 C6 DT D 2 32.198 4.203 0.564 1.00 24.20 C ATOM 561 OP1 DT D 2 33.111 -1.677 2.942 1.00 34.26 O ATOM 562 OP2 DT D 2 34.820 0.165 2.602 1.00 36.01 O ATOM 563 O5' DT D 2 32.400 0.486 1.928 1.00 30.43 O ATOM 564 C5' DT D 2 31.171 -0.097 1.903 1.00 26.35 C ATOM 565 C4' DT D 2 30.400 0.637 0.881 1.00 30.61 C ATOM 566 O4' DT D 2 30.600 2.043 1.038 1.00 36.14 O ATOM 567 C3' DT D 2 30.800 0.344 -0.562 1.00 41.63 C ATOM 568 O3' DT D 2 29.734 -0.341 -1.144 1.00 53.03 O ATOM 569 C2' DT D 2 30.971 1.710 -1.270 1.00 43.92 C ATOM 570 C1' DT D 2 30.477 2.706 -0.245 1.00 41.79 C ATOM 571 C7 DT D 2 34.070 5.526 1.502 1.00 31.92 C ATOM 572 P DC D 3 29.873 -0.726 -2.668 1.00 44.31 P ATOM 573 N1 DC D 3 30.280 4.956 -4.235 1.00 18.54 N ATOM 574 C2 DC D 3 30.280 6.309 -4.068 1.00 34.48 C ATOM 575 O2 DC D 3 29.251 6.913 -4.442 1.00 50.42 O ATOM 576 N3 DC D 3 31.360 6.928 -3.521 1.00 27.31 N ATOM 577 C4 DC D 3 32.426 6.231 -3.174 1.00 31.04 C ATOM 578 N4 DC D 3 33.497 6.876 -2.622 1.00 33.81 N ATOM 579 C5 DC D 3 32.456 4.802 -3.342 1.00 24.29 C ATOM 580 C6 DC D 3 31.378 4.217 -3.874 1.00 21.54 C ATOM 581 OP1 DC D 3 28.875 -1.713 -3.083 1.00 33.10 O ATOM 582 OP2 DC D 3 31.330 -1.022 -2.846 1.00 34.40 O ATOM 583 O5' DC D 3 29.390 0.647 -3.307 1.00 41.24 O ATOM 584 C5' DC D 3 27.984 1.041 -3.387 1.00 43.17 C ATOM 585 C4' DC D 3 27.780 2.325 -4.266 1.00 52.12 C ATOM 586 O4' DC D 3 28.467 3.508 -3.766 1.00 53.62 O ATOM 587 C3' DC D 3 28.111 2.284 -5.772 1.00 57.83 C ATOM 588 O3' DC D 3 26.890 2.615 -6.526 1.00 73.76 O ATOM 589 C2' DC D 3 29.171 3.382 -5.999 1.00 47.28 C ATOM 590 C1' DC D 3 29.035 4.312 -4.810 1.00 37.28 C ATOM 591 P DG D 4 26.770 2.560 -8.152 1.00 77.76 P ATOM 592 N9 DG D 4 30.493 6.425 -7.856 1.00 35.71 N ATOM 593 C8 DG D 4 31.209 5.265 -7.713 1.00 24.69 C ATOM 594 N7 DG D 4 32.355 5.551 -7.070 1.00 32.42 N ATOM 595 C5 DG D 4 32.324 6.966 -6.841 1.00 19.42 C ATOM 596 C6 DG D 4 33.218 7.813 -6.225 1.00 26.14 C ATOM 597 O6 DG D 4 34.300 7.531 -5.681 1.00 34.31 O ATOM 598 N1 DG D 4 32.772 9.125 -6.264 1.00 25.27 N ATOM 599 C2 DG D 4 31.610 9.537 -6.798 1.00 36.02 C ATOM 600 N2 DG D 4 31.341 10.847 -6.784 1.00 45.21 N ATOM 601 N3 DG D 4 30.764 8.744 -7.363 1.00 34.20 N ATOM 602 C4 DG D 4 31.200 7.492 -7.363 1.00 28.84 C ATOM 603 OP1 DG D 4 25.335 2.414 -8.523 1.00 80.62 O ATOM 604 OP2 DG D 4 27.800 1.647 -8.699 1.00 76.88 O ATOM 605 O5' DG D 4 27.145 4.034 -8.564 1.00 65.46 O ATOM 606 C5' DG D 4 26.279 5.030 -8.244 1.00 55.06 C ATOM 607 C4' DG D 4 27.029 6.234 -8.597 1.00 59.17 C ATOM 608 O4' DG D 4 28.175 6.261 -7.765 1.00 60.04 O ATOM 609 C3' DG D 4 27.533 6.233 -10.038 1.00 62.51 C ATOM 610 O3' DG D 4 27.018 7.438 -10.631 1.00 79.94 O ATOM 611 C2' DG D 4 29.052 6.244 -9.941 1.00 53.89 C ATOM 612 C1' DG D 4 29.251 6.667 -8.517 1.00 48.12 C ATOM 613 P DG D 5 27.146 7.773 -12.198 1.00 83.15 P ATOM 614 N9 DG D 5 30.738 10.053 -10.988 1.00 41.52 N ATOM 615 C8 DG D 5 30.480 8.733 -11.304 1.00 45.58 C ATOM 616 N7 DG D 5 31.477 7.965 -10.886 1.00 40.11 N ATOM 617 C5 DG D 5 32.358 8.890 -10.313 1.00 18.82 C ATOM 618 C6 DG D 5 33.552 8.694 -9.723 1.00 32.07 C ATOM 619 O6 DG D 5 34.115 7.601 -9.527 1.00 38.31 O ATOM 620 N1 DG D 5 34.085 9.908 -9.309 1.00 29.95 N ATOM 621 C2 DG D 5 33.522 11.145 -9.444 1.00 35.09 C ATOM 622 N2 DG D 5 34.224 12.197 -9.016 1.00 44.47 N ATOM 623 N3 DG D 5 32.377 11.342 -10.014 1.00 27.81 N ATOM 624 C4 DG D 5 31.903 10.160 -10.411 1.00 23.02 C ATOM 625 OP1 DG D 5 25.760 7.825 -12.724 1.00 84.72 O ATOM 626 OP2 DG D 5 28.132 6.818 -12.808 1.00 79.90 O ATOM 627 O5' DG D 5 27.746 9.274 -12.183 1.00 66.09 O ATOM 628 C5' DG D 5 26.867 10.355 -11.896 1.00 48.92 C ATOM 629 C4' DG D 5 27.716 11.556 -11.568 1.00 51.60 C ATOM 630 O4' DG D 5 28.717 11.055 -10.688 1.00 59.50 O ATOM 631 C3' DG D 5 28.480 12.251 -12.706 1.00 56.21 C ATOM 632 O3' DG D 5 28.519 13.675 -12.446 1.00 61.08 O ATOM 633 C2' DG D 5 29.919 11.761 -12.616 1.00 60.25 C ATOM 634 C1' DG D 5 29.997 11.245 -11.218 1.00 55.41 C TER 635 DG D 5 ATOM 636 N LYS A 5 12.755 -12.607 0.326 1.00100.00 N ATOM 637 CA LYS A 5 13.190 -13.806 1.065 1.00100.00 C ATOM 638 C LYS A 5 14.447 -13.541 1.962 1.00100.00 C ATOM 639 O LYS A 5 15.472 -13.060 1.450 1.00100.00 O ATOM 640 CB LYS A 5 13.384 -15.004 0.115 1.00100.00 C ATOM 641 CG LYS A 5 13.772 -16.303 0.821 1.00100.00 C ATOM 642 CD LYS A 5 14.160 -17.405 -0.157 1.00100.00 C ATOM 643 CE LYS A 5 14.320 -18.796 0.477 1.00100.00 C ATOM 644 NZ LYS A 5 15.637 -19.072 1.098 1.00100.00 N ATOM 645 N ALA A 6 14.365 -13.863 3.304 1.00100.00 N ATOM 646 CA ALA A 6 15.471 -13.676 4.286 1.00100.00 C ATOM 647 C ALA A 6 15.523 -14.760 5.422 1.00100.00 C ATOM 648 O ALA A 6 14.577 -14.893 6.243 1.00100.00 O ATOM 649 CB ALA A 6 15.540 -12.219 4.782 1.00 97.64 C ATOM 650 N PRO A 7 16.660 -15.530 5.430 1.00100.00 N ATOM 651 CA PRO A 7 17.027 -16.664 6.339 1.00100.00 C ATOM 652 C PRO A 7 17.668 -16.191 7.627 1.00100.00 C ATOM 653 O PRO A 7 17.048 -16.078 8.686 1.00100.00 O ATOM 654 CB PRO A 7 18.161 -17.374 5.569 1.00100.00 C ATOM 655 CG PRO A 7 18.524 -16.533 4.326 1.00 98.07 C ATOM 656 CD PRO A 7 17.711 -15.258 4.394 1.00 98.36 C ATOM 657 N GLN A 8 18.971 -15.968 7.413 1.00100.00 N ATOM 658 CA GLN A 8 20.117 -15.473 8.207 1.00100.00 C ATOM 659 C GLN A 8 20.679 -15.776 9.601 1.00 95.77 C ATOM 660 O GLN A 8 21.785 -15.218 9.827 1.00 95.52 O ATOM 661 CB GLN A 8 19.917 -13.965 8.184 1.00100.00 C ATOM 662 CG GLN A 8 18.630 -13.622 8.928 1.00100.00 C ATOM 663 CD GLN A 8 18.117 -12.321 8.503 1.00100.00 C ATOM 664 OE1 GLN A 8 17.362 -11.681 9.264 1.00100.00 O ATOM 665 NE2 GLN A 8 18.438 -11.803 7.332 1.00100.00 N ATOM 666 N GLU A 9 20.098 -16.639 10.612 1.00 93.00 N ATOM 667 CA GLU A 9 20.833 -16.543 11.907 1.00 97.96 C ATOM 668 C GLU A 9 22.203 -17.199 12.043 1.00100.00 C ATOM 669 O GLU A 9 23.247 -16.540 12.008 1.00100.00 O ATOM 670 CB GLU A 9 20.064 -16.306 13.204 1.00100.00 C ATOM 671 CG GLU A 9 19.856 -14.679 13.347 1.00100.00 C ATOM 672 CD GLU A 9 19.621 -14.141 14.762 1.00100.00 C ATOM 673 OE1 GLU A 9 19.668 -14.939 15.721 1.00100.00 O ATOM 674 OE2 GLU A 9 19.385 -12.884 14.894 1.00100.00 O ATOM 675 N THR A 10 22.207 -18.537 12.191 1.00100.00 N ATOM 676 CA THR A 10 23.446 -19.316 12.311 1.00100.00 C ATOM 677 C THR A 10 24.356 -19.187 11.071 1.00100.00 C ATOM 678 O THR A 10 25.469 -19.743 10.974 1.00100.00 O ATOM 679 CB THR A 10 23.108 -20.770 12.627 1.00 99.58 C ATOM 680 OG1 THR A 10 24.198 -21.608 12.251 1.00100.00 O ATOM 681 CG2 THR A 10 21.819 -21.114 11.894 1.00 98.78 C ATOM 682 N LEU A 11 23.814 -18.417 10.115 1.00100.00 N ATOM 683 CA LEU A 11 24.369 -18.064 8.844 1.00 88.87 C ATOM 684 C LEU A 11 25.416 -16.969 8.957 1.00 78.07 C ATOM 685 O LEU A 11 26.593 -17.292 9.083 1.00 71.83 O ATOM 686 CB LEU A 11 23.269 -17.547 7.894 1.00 90.72 C ATOM 687 CG LEU A 11 22.924 -18.522 6.779 1.00 90.89 C ATOM 688 CD1 LEU A 11 21.981 -17.834 5.768 1.00 84.00 C ATOM 689 CD2 LEU A 11 24.233 -19.027 6.145 1.00 95.31 C ATOM 690 N ASN A 12 24.961 -15.673 8.917 1.00 73.56 N ATOM 691 CA ASN A 12 25.901 -14.547 8.993 1.00 68.34 C ATOM 692 C ASN A 12 25.684 -13.530 10.109 1.00 69.84 C ATOM 693 O ASN A 12 26.136 -12.394 10.000 1.00 70.52 O ATOM 694 CB ASN A 12 26.016 -13.869 7.590 1.00 61.42 C ATOM 695 CG ASN A 12 26.331 -14.874 6.450 1.00 56.56 C ATOM 696 OD1 ASN A 12 25.445 -15.210 5.600 1.00 55.42 O ATOM 697 ND2 ASN A 12 27.573 -15.395 6.441 1.00 45.58 N ATOM 698 N GLY A 13 25.024 -13.944 11.192 1.00 68.47 N ATOM 699 CA GLY A 13 24.755 -13.069 12.332 1.00 64.18 C ATOM 700 C GLY A 13 26.019 -12.467 12.956 1.00 59.20 C ATOM 701 O GLY A 13 26.026 -11.296 13.348 1.00 62.05 O ATOM 702 N GLY A 14 27.084 -13.280 13.022 1.00 49.27 N ATOM 703 CA GLY A 14 28.343 -12.836 13.586 1.00 47.88 C ATOM 704 C GLY A 14 28.794 -11.524 13.033 1.00 54.71 C ATOM 705 O GLY A 14 29.240 -10.663 13.799 1.00 62.64 O ATOM 706 N ILE A 15 28.645 -11.430 11.685 1.00 52.86 N ATOM 707 CA ILE A 15 28.967 -10.321 10.799 1.00 41.90 C ATOM 708 C ILE A 15 28.011 -9.195 10.868 1.00 40.48 C ATOM 709 O ILE A 15 28.385 -8.044 11.091 1.00 47.10 O ATOM 710 CB ILE A 15 28.872 -10.783 9.375 1.00 42.46 C ATOM 711 CG1 ILE A 15 30.002 -11.709 9.045 1.00 44.22 C ATOM 712 CG2 ILE A 15 28.954 -9.586 8.459 1.00 43.75 C ATOM 713 CD1 ILE A 15 29.625 -12.663 7.925 1.00 50.30 C ATOM 714 N THR A 16 26.766 -9.518 10.649 1.00 33.83 N ATOM 715 CA THR A 16 25.764 -8.465 10.693 1.00 43.61 C ATOM 716 C THR A 16 25.794 -7.753 12.071 1.00 58.67 C ATOM 717 O THR A 16 25.630 -6.532 12.245 1.00 59.99 O ATOM 718 CB THR A 16 24.469 -9.201 10.626 1.00 41.21 C ATOM 719 OG1 THR A 16 24.850 -10.515 10.293 1.00 47.16 O ATOM 720 CG2 THR A 16 23.548 -8.568 9.584 1.00 35.36 C ATOM 721 N ASP A 17 26.007 -8.575 13.084 1.00 56.71 N ATOM 722 CA ASP A 17 26.067 -8.112 14.425 1.00 45.21 C ATOM 723 C ASP A 17 27.220 -7.212 14.652 1.00 44.53 C ATOM 724 O ASP A 17 27.034 -6.098 15.167 1.00 51.83 O ATOM 725 CB ASP A 17 26.036 -9.280 15.392 1.00 52.41 C ATOM 726 CG ASP A 17 24.622 -9.752 15.545 1.00 63.54 C ATOM 727 OD1 ASP A 17 23.687 -9.318 14.854 1.00 69.24 O ATOM 728 OD2 ASP A 17 24.501 -10.624 16.525 1.00 66.28 O ATOM 729 N MET A 18 28.397 -7.682 14.256 1.00 42.04 N ATOM 730 CA MET A 18 29.582 -6.863 14.431 1.00 42.28 C ATOM 731 C MET A 18 29.386 -5.478 13.813 1.00 41.41 C ATOM 732 O MET A 18 29.673 -4.423 14.396 1.00 45.42 O ATOM 733 CB MET A 18 30.848 -7.550 13.906 1.00 50.53 C ATOM 734 CG MET A 18 30.971 -7.642 12.390 1.00 54.24 C ATOM 735 SD MET A 18 32.605 -8.267 11.879 1.00 59.14 S ATOM 736 CE MET A 18 33.751 -7.156 12.756 1.00 45.88 C ATOM 737 N LEU A 19 28.854 -5.521 12.603 1.00 42.23 N ATOM 738 CA LEU A 19 28.565 -4.368 11.816 1.00 39.53 C ATOM 739 C LEU A 19 27.654 -3.376 12.528 1.00 42.44 C ATOM 740 O LEU A 19 27.804 -2.138 12.502 1.00 41.39 O ATOM 741 CB LEU A 19 27.859 -4.840 10.536 1.00 47.51 C ATOM 742 CG LEU A 19 28.691 -5.709 9.584 1.00 54.43 C ATOM 743 CD1 LEU A 19 28.051 -5.644 8.204 1.00 63.30 C ATOM 744 CD2 LEU A 19 30.132 -5.238 9.468 1.00 51.45 C ATOM 745 N THR A 20 26.666 -3.932 13.166 1.00 47.04 N ATOM 746 CA THR A 20 25.735 -3.112 13.865 1.00 46.35 C ATOM 747 C THR A 20 26.430 -2.347 15.002 1.00 37.39 C ATOM 748 O THR A 20 26.202 -1.158 15.235 1.00 33.06 O ATOM 749 CB THR A 20 24.432 -3.888 14.119 1.00 59.58 C ATOM 750 OG1 THR A 20 24.270 -4.877 13.071 1.00 49.64 O ATOM 751 CG2 THR A 20 23.242 -2.906 14.167 1.00 58.94 C ATOM 752 N GLU A 21 27.315 -3.036 15.679 1.00 40.79 N ATOM 753 CA GLU A 21 28.069 -2.416 16.746 1.00 47.97 C ATOM 754 C GLU A 21 28.812 -1.230 16.156 1.00 49.26 C ATOM 755 O GLU A 21 28.844 -0.096 16.690 1.00 49.65 O ATOM 756 CB GLU A 21 29.088 -3.433 17.226 1.00 57.86 C ATOM 757 CG GLU A 21 29.301 -3.429 18.751 1.00 71.80 C ATOM 758 CD GLU A 21 29.550 -4.831 19.280 1.00 73.18 C ATOM 759 OE1 GLU A 21 28.880 -5.800 18.968 1.00 73.00 O ATOM 760 OE2 GLU A 21 30.627 -4.916 20.038 1.00 72.22 O ATOM 761 N LEU A 22 29.394 -1.546 15.003 1.00 51.32 N ATOM 762 CA LEU A 22 30.170 -0.594 14.199 1.00 47.38 C ATOM 763 C LEU A 22 29.337 0.609 13.851 1.00 36.68 C ATOM 764 O LEU A 22 29.747 1.754 13.990 1.00 36.93 O ATOM 765 CB LEU A 22 30.556 -1.225 12.843 1.00 46.97 C ATOM 766 CG LEU A 22 31.943 -1.825 12.792 1.00 48.34 C ATOM 767 CD1 LEU A 22 32.391 -2.109 14.219 1.00 53.10 C ATOM 768 CD2 LEU A 22 31.944 -3.092 11.907 1.00 38.34 C ATOM 769 N ALA A 23 28.145 0.310 13.366 1.00 33.18 N ATOM 770 CA ALA A 23 27.273 1.366 12.980 1.00 37.72 C ATOM 771 C ALA A 23 27.011 2.265 14.119 1.00 51.21 C ATOM 772 O ALA A 23 27.230 3.459 13.992 1.00 58.83 O ATOM 773 CB ALA A 23 25.996 0.823 12.371 1.00 39.43 C ATOM 774 N ASN A 24 26.557 1.666 15.235 1.00 55.63 N ATOM 775 CA ASN A 24 26.260 2.421 16.435 1.00 55.01 C ATOM 776 C ASN A 24 27.398 3.329 16.814 1.00 35.02 C ATOM 777 O ASN A 24 27.248 4.565 16.974 1.00 36.51 O ATOM 778 CB ASN A 24 25.920 1.481 17.582 1.00 72.35 C ATOM 779 CG ASN A 24 24.464 1.131 17.513 1.00 81.00 C ATOM 780 OD1 ASN A 24 23.637 1.949 17.070 1.00 86.57 O ATOM 781 ND2 ASN A 24 24.153 -0.081 17.947 1.00 83.06 N ATOM 782 N PHE A 25 28.537 2.702 16.933 1.00 24.20 N ATOM 783 CA PHE A 25 29.756 3.457 17.280 1.00 34.05 C ATOM 784 C PHE A 25 29.966 4.720 16.392 1.00 46.60 C ATOM 785 O PHE A 25 30.486 5.767 16.790 1.00 44.61 O ATOM 786 CB PHE A 25 30.956 2.471 17.260 1.00 31.05 C ATOM 787 CG PHE A 25 32.335 3.054 17.379 1.00 58.66 C ATOM 788 CD1 PHE A 25 32.853 3.956 16.435 1.00 71.23 C ATOM 789 CD2 PHE A 25 33.172 2.688 18.425 1.00 77.87 C ATOM 790 CE1 PHE A 25 34.141 4.483 16.543 1.00 77.21 C ATOM 791 CE2 PHE A 25 34.459 3.204 18.554 1.00 83.69 C ATOM 792 CZ PHE A 25 34.962 4.108 17.602 1.00 78.30 C ATOM 793 N GLU A 26 29.567 4.623 15.130 1.00 54.55 N ATOM 794 CA GLU A 26 29.751 5.764 14.260 1.00 61.51 C ATOM 795 C GLU A 26 28.790 6.843 14.546 1.00 59.43 C ATOM 796 O GLU A 26 29.123 8.010 14.661 1.00 57.44 O ATOM 797 CB GLU A 26 29.753 5.406 12.766 1.00 65.78 C ATOM 798 CG GLU A 26 30.912 4.425 12.393 1.00 67.67 C ATOM 799 CD GLU A 26 32.299 5.066 12.288 1.00 62.92 C ATOM 800 OE1 GLU A 26 32.468 6.203 11.894 1.00 58.52 O ATOM 801 OE2 GLU A 26 33.309 4.264 12.673 1.00 64.52 O ATOM 802 N LYS A 27 27.581 6.419 14.651 1.00 58.45 N ATOM 803 CA LYS A 27 26.528 7.327 14.914 1.00 57.50 C ATOM 804 C LYS A 27 26.773 8.098 16.186 1.00 61.96 C ATOM 805 O LYS A 27 27.099 9.289 16.174 1.00 60.56 O ATOM 806 CB LYS A 27 25.299 6.490 15.164 1.00 54.60 C ATOM 807 CG LYS A 27 23.996 7.276 15.191 1.00 56.97 C ATOM 808 CD LYS A 27 22.755 6.402 15.436 1.00 59.59 C ATOM 809 CE LYS A 27 22.661 5.786 16.850 1.00 67.27 C ATOM 810 NZ LYS A 27 21.281 5.638 17.392 1.00 71.27 N ATOM 811 N ASN A 28 26.607 7.355 17.276 1.00 62.12 N ATOM 812 CA ASN A 28 26.729 7.802 18.664 1.00 54.00 C ATOM 813 C ASN A 28 28.059 8.312 19.108 1.00 54.40 C ATOM 814 O ASN A 28 28.202 9.444 19.608 1.00 63.42 O ATOM 815 CB ASN A 28 26.356 6.640 19.526 1.00 42.69 C ATOM 816 CG ASN A 28 25.025 6.202 19.076 1.00 47.43 C ATOM 817 OD1 ASN A 28 24.773 4.976 19.024 1.00 55.01 O ATOM 818 ND2 ASN A 28 24.180 7.229 18.715 1.00 47.53 N ATOM 819 N VAL A 29 29.029 7.471 18.953 1.00 34.46 N ATOM 820 CA VAL A 29 30.316 7.873 19.344 1.00 27.09 C ATOM 821 C VAL A 29 30.992 8.713 18.313 1.00 43.05 C ATOM 822 O VAL A 29 31.705 9.672 18.645 1.00 47.06 O ATOM 823 CB VAL A 29 31.101 6.675 19.569 1.00 29.45 C ATOM 824 CG1 VAL A 29 32.372 7.109 20.236 1.00 28.90 C ATOM 825 CG2 VAL A 29 30.216 5.704 20.359 1.00 33.63 C ATOM 826 N SER A 30 30.792 8.318 17.040 1.00 56.09 N ATOM 827 CA SER A 30 31.397 9.022 15.916 1.00 57.81 C ATOM 828 C SER A 30 30.803 10.290 15.370 1.00 56.35 C ATOM 829 O SER A 30 31.492 11.298 15.135 1.00 58.37 O ATOM 830 CB SER A 30 32.358 8.284 15.034 1.00 61.42 C ATOM 831 OG SER A 30 33.500 8.013 15.803 1.00 66.57 O ATOM 832 N GLN A 31 29.515 10.264 15.176 1.00 62.41 N ATOM 833 CA GLN A 31 28.851 11.434 14.652 1.00 70.99 C ATOM 834 C GLN A 31 28.941 11.509 13.125 1.00 72.01 C ATOM 835 O GLN A 31 28.924 12.570 12.479 1.00 70.50 O ATOM 836 CB GLN A 31 29.132 12.739 15.440 1.00 72.33 C ATOM 837 CG GLN A 31 29.459 12.482 16.923 1.00 70.94 C ATOM 838 CD GLN A 31 29.183 13.674 17.799 1.00 76.41 C ATOM 839 OE1 GLN A 31 28.388 14.554 17.432 1.00 79.12 O ATOM 840 NE2 GLN A 31 29.789 13.678 18.986 1.00 77.69 N ATOM 841 N ALA A 32 29.023 10.290 12.590 1.00 69.83 N ATOM 842 CA ALA A 32 29.101 9.941 11.188 1.00 57.62 C ATOM 843 C ALA A 32 27.810 9.169 10.818 1.00 52.08 C ATOM 844 O ALA A 32 27.825 7.931 10.890 1.00 57.64 O ATOM 845 CB ALA A 32 30.310 9.018 11.070 1.00 49.81 C ATOM 846 N ILE A 33 26.695 9.860 10.434 1.00 41.49 N ATOM 847 CA ILE A 33 25.435 9.125 10.087 1.00 48.08 C ATOM 848 C ILE A 33 25.567 8.218 8.869 1.00 50.48 C ATOM 849 O ILE A 33 25.114 7.067 8.816 1.00 53.92 O ATOM 850 CB ILE A 33 24.147 9.951 10.049 1.00 47.70 C ATOM 851 CG1 ILE A 33 24.224 11.038 11.097 1.00 55.60 C ATOM 852 CG2 ILE A 33 22.948 9.052 10.376 1.00 39.46 C ATOM 853 CD1 ILE A 33 25.183 12.183 10.768 1.00 63.09 C ATOM 854 N HIS A 34 26.222 8.780 7.892 1.00 54.48 N ATOM 855 CA HIS A 34 26.530 8.172 6.606 1.00 45.13 C ATOM 856 C HIS A 34 27.197 6.821 6.772 1.00 44.50 C ATOM 857 O HIS A 34 26.855 5.863 6.078 1.00 50.26 O ATOM 858 CB HIS A 34 27.452 9.170 5.893 1.00 33.71 C ATOM 859 CG HIS A 34 26.630 10.394 5.717 1.00 29.21 C ATOM 860 ND1 HIS A 34 25.251 10.294 5.417 1.00 38.80 N ATOM 861 CD2 HIS A 34 26.953 11.719 5.800 1.00 26.76 C ATOM 862 CE1 HIS A 34 24.786 11.555 5.317 1.00 43.90 C ATOM 863 NE2 HIS A 34 25.781 12.435 5.538 1.00 41.09 N ATOM 864 N LYS A 35 28.159 6.799 7.720 1.00 44.45 N ATOM 865 CA LYS A 35 28.962 5.641 8.105 1.00 46.41 C ATOM 866 C LYS A 35 28.169 4.568 8.866 1.00 55.65 C ATOM 867 O LYS A 35 28.422 3.326 8.808 1.00 59.47 O ATOM 868 CB LYS A 35 30.171 6.038 8.884 1.00 42.06 C ATOM 869 CG LYS A 35 31.236 6.828 8.131 1.00 31.76 C ATOM 870 CD LYS A 35 32.555 6.193 8.490 1.00 28.10 C ATOM 871 CE LYS A 35 33.706 7.118 8.706 1.00 31.75 C ATOM 872 NZ LYS A 35 34.905 6.281 8.982 1.00 38.90 N ATOM 873 N TYR A 36 27.210 5.090 9.613 1.00 53.66 N ATOM 874 CA TYR A 36 26.314 4.302 10.400 1.00 41.68 C ATOM 875 C TYR A 36 25.390 3.680 9.375 1.00 28.11 C ATOM 876 O TYR A 36 25.160 2.492 9.330 1.00 29.50 O ATOM 877 CB TYR A 36 25.630 5.218 11.435 1.00 43.64 C ATOM 878 CG TYR A 36 24.190 4.853 11.766 1.00 44.68 C ATOM 879 CD1 TYR A 36 23.846 3.891 12.726 1.00 41.54 C ATOM 880 CD2 TYR A 36 23.170 5.516 11.092 1.00 49.59 C ATOM 881 CE1 TYR A 36 22.506 3.599 12.996 1.00 39.77 C ATOM 882 CE2 TYR A 36 21.830 5.240 11.335 1.00 51.36 C ATOM 883 CZ TYR A 36 21.507 4.279 12.292 1.00 53.01 C ATOM 884 OH TYR A 36 20.175 4.043 12.513 1.00 67.34 O ATOM 885 N ASN A 37 24.861 4.528 8.514 1.00 31.82 N ATOM 886 CA ASN A 37 23.984 4.083 7.451 1.00 42.12 C ATOM 887 C ASN A 37 24.664 3.046 6.526 1.00 44.58 C ATOM 888 O ASN A 37 24.073 2.065 6.017 1.00 41.43 O ATOM 889 CB ASN A 37 23.703 5.293 6.624 1.00 47.77 C ATOM 890 CG ASN A 37 22.711 6.141 7.344 1.00 52.15 C ATOM 891 OD1 ASN A 37 22.990 7.334 7.624 1.00 59.45 O ATOM 892 ND2 ASN A 37 21.549 5.508 7.621 1.00 47.14 N ATOM 893 N ALA A 38 25.956 3.301 6.310 1.00 46.76 N ATOM 894 CA ALA A 38 26.781 2.455 5.482 1.00 46.42 C ATOM 895 C ALA A 38 26.873 1.122 6.156 1.00 43.88 C ATOM 896 O ALA A 38 26.546 0.104 5.581 1.00 51.81 O ATOM 897 CB ALA A 38 28.166 3.061 5.206 1.00 48.94 C ATOM 898 N TYR A 39 27.300 1.109 7.407 1.00 47.18 N ATOM 899 CA TYR A 39 27.382 -0.183 8.087 1.00 42.81 C ATOM 900 C TYR A 39 26.053 -0.911 8.238 1.00 35.73 C ATOM 901 O TYR A 39 25.943 -2.136 8.189 1.00 38.85 O ATOM 902 CB TYR A 39 27.985 -0.015 9.409 1.00 28.85 C ATOM 903 CG TYR A 39 29.468 0.037 9.448 1.00 19.85 C ATOM 904 CD1 TYR A 39 30.194 -1.138 9.364 1.00 21.78 C ATOM 905 CD2 TYR A 39 30.126 1.244 9.613 1.00 19.95 C ATOM 906 CE1 TYR A 39 31.597 -1.131 9.436 1.00 20.83 C ATOM 907 CE2 TYR A 39 31.522 1.261 9.690 1.00 21.61 C ATOM 908 CZ TYR A 39 32.251 0.070 9.597 1.00 23.48 C ATOM 909 OH TYR A 39 33.629 0.103 9.672 1.00 37.50 O ATOM 910 N ARG A 40 25.025 -0.145 8.439 1.00 41.51 N ATOM 911 CA ARG A 40 23.732 -0.774 8.568 1.00 52.09 C ATOM 912 C ARG A 40 23.405 -1.483 7.275 1.00 50.31 C ATOM 913 O ARG A 40 23.170 -2.703 7.307 1.00 41.37 O ATOM 914 CB ARG A 40 22.642 0.193 9.011 1.00 56.37 C ATOM 915 CG ARG A 40 22.683 1.574 8.389 1.00 58.59 C ATOM 916 CD ARG A 40 22.203 2.605 9.391 1.00 64.30 C ATOM 917 NE ARG A 40 21.195 2.001 10.280 1.00 70.72 N ATOM 918 CZ ARG A 40 19.886 2.353 10.324 1.00 76.24 C ATOM 919 NH1 ARG A 40 19.375 3.322 9.573 1.00 80.32 N ATOM 920 NH2 ARG A 40 19.057 1.726 11.160 1.00 71.79 N ATOM 921 N LYS A 41 23.453 -0.681 6.155 1.00 56.78 N ATOM 922 CA LYS A 41 23.214 -1.076 4.751 1.00 56.27 C ATOM 923 C LYS A 41 23.909 -2.428 4.440 1.00 45.47 C ATOM 924 O LYS A 41 23.316 -3.432 3.958 1.00 44.06 O ATOM 925 CB LYS A 41 23.821 -0.005 3.873 1.00 61.92 C ATOM 926 CG LYS A 41 24.230 -0.507 2.483 1.00 73.01 C ATOM 927 CD LYS A 41 25.495 0.187 1.912 1.00 76.89 C ATOM 928 CE LYS A 41 26.819 -0.175 2.643 1.00 63.37 C ATOM 929 NZ LYS A 41 28.018 0.640 2.323 1.00 46.56 N ATOM 930 N ALA A 42 25.189 -2.436 4.745 1.00 31.00 N ATOM 931 CA ALA A 42 25.948 -3.620 4.544 1.00 33.96 C ATOM 932 C ALA A 42 25.303 -4.711 5.361 1.00 50.13 C ATOM 933 O ALA A 42 24.888 -5.700 4.793 1.00 58.26 O ATOM 934 CB ALA A 42 27.392 -3.345 4.963 1.00 25.12 C ATOM 935 N ALA A 43 25.178 -4.480 6.699 1.00 58.70 N ATOM 936 CA ALA A 43 24.578 -5.397 7.633 1.00 48.02 C ATOM 937 C ALA A 43 23.319 -5.984 7.081 1.00 41.96 C ATOM 938 O ALA A 43 23.155 -7.187 7.175 1.00 47.51 O ATOM 939 CB ALA A 43 24.307 -4.676 8.933 1.00 48.80 C ATOM 940 N SER A 44 22.434 -5.139 6.480 1.00 41.39 N ATOM 941 CA SER A 44 21.149 -5.635 5.891 1.00 50.60 C ATOM 942 C SER A 44 21.217 -6.656 4.733 1.00 56.40 C ATOM 943 O SER A 44 20.725 -7.803 4.816 1.00 49.48 O ATOM 944 CB SER A 44 20.156 -4.538 5.550 1.00 43.82 C ATOM 945 OG SER A 44 20.876 -3.442 5.083 1.00 54.39 O ATOM 946 N VAL A 45 21.833 -6.213 3.633 1.00 62.04 N ATOM 947 CA VAL A 45 21.981 -7.037 2.447 1.00 65.43 C ATOM 948 C VAL A 45 22.616 -8.354 2.801 1.00 64.12 C ATOM 949 O VAL A 45 22.217 -9.421 2.278 1.00 59.25 O ATOM 950 CB VAL A 45 22.746 -6.342 1.357 1.00 67.78 C ATOM 951 CG1 VAL A 45 22.261 -4.905 1.296 1.00 77.85 C ATOM 952 CG2 VAL A 45 24.204 -6.350 1.731 1.00 68.10 C ATOM 953 N ILE A 46 23.617 -8.281 3.693 1.00 59.48 N ATOM 954 CA ILE A 46 24.234 -9.520 4.068 1.00 59.37 C ATOM 955 C ILE A 46 23.232 -10.349 4.898 1.00 70.64 C ATOM 956 O ILE A 46 23.244 -11.599 4.923 1.00 78.34 O ATOM 957 CB ILE A 46 25.630 -9.488 4.667 1.00 49.22 C ATOM 958 CG1 ILE A 46 25.523 -9.876 6.111 1.00 65.17 C ATOM 959 CG2 ILE A 46 26.314 -8.136 4.589 1.00 31.88 C ATOM 960 CD1 ILE A 46 26.810 -10.524 6.591 1.00 75.55 C ATOM 961 N ALA A 47 22.342 -9.643 5.598 1.00 66.93 N ATOM 962 CA ALA A 47 21.363 -10.346 6.397 1.00 68.87 C ATOM 963 C ALA A 47 20.485 -11.209 5.490 1.00 72.31 C ATOM 964 O ALA A 47 20.169 -12.403 5.729 1.00 72.95 O ATOM 965 CB ALA A 47 20.539 -9.331 7.158 1.00 68.15 C ATOM 966 N LYS A 48 20.085 -10.548 4.430 1.00 71.85 N ATOM 967 CA LYS A 48 19.254 -11.125 3.423 1.00 71.59 C ATOM 968 C LYS A 48 19.927 -12.250 2.655 1.00 66.81 C ATOM 969 O LYS A 48 19.263 -13.103 2.097 1.00 72.25 O ATOM 970 CB LYS A 48 18.847 -10.046 2.438 1.00 77.97 C ATOM 971 CG LYS A 48 17.763 -9.121 2.974 1.00 85.55 C ATOM 972 CD LYS A 48 16.691 -8.882 1.908 1.00 90.07 C ATOM 973 CE LYS A 48 15.271 -8.686 2.448 1.00 88.53 C ATOM 974 NZ LYS A 48 14.203 -9.317 1.628 1.00 83.39 N ATOM 975 N TYR A 49 21.246 -12.228 2.645 1.00 60.25 N ATOM 976 CA TYR A 49 22.140 -13.157 1.950 1.00 53.23 C ATOM 977 C TYR A 49 22.352 -14.586 2.390 1.00 53.80 C ATOM 978 O TYR A 49 23.026 -14.911 3.376 1.00 59.42 O ATOM 979 CB TYR A 49 23.361 -12.393 1.521 1.00 51.86 C ATOM 980 CG TYR A 49 24.426 -13.171 0.881 1.00 54.98 C ATOM 981 CD1 TYR A 49 25.380 -13.783 1.685 1.00 62.04 C ATOM 982 CD2 TYR A 49 24.521 -13.268 -0.502 1.00 49.58 C ATOM 983 CE1 TYR A 49 26.431 -14.512 1.142 1.00 60.42 C ATOM 984 CE2 TYR A 49 25.571 -13.995 -1.061 1.00 49.30 C ATOM 985 CZ TYR A 49 26.519 -14.615 -0.242 1.00 57.55 C ATOM 986 OH TYR A 49 27.563 -15.331 -0.774 1.00 59.33 O ATOM 987 N PRO A 50 21.745 -15.416 1.551 1.00 49.99 N ATOM 988 CA PRO A 50 21.660 -16.839 1.613 1.00 39.72 C ATOM 989 C PRO A 50 22.834 -17.707 1.725 1.00 42.00 C ATOM 990 O PRO A 50 22.712 -18.911 1.466 1.00 48.43 O ATOM 991 CB PRO A 50 20.621 -17.351 0.630 1.00 37.54 C ATOM 992 CG PRO A 50 20.152 -16.111 -0.131 1.00 45.20 C ATOM 993 CD PRO A 50 20.947 -14.917 0.401 1.00 49.50 C ATOM 994 N HIS A 51 23.955 -17.210 2.117 1.00 44.39 N ATOM 995 CA HIS A 51 24.982 -18.219 2.193 1.00 51.59 C ATOM 996 C HIS A 51 25.852 -18.039 3.356 1.00 49.61 C ATOM 997 O HIS A 51 25.988 -16.963 3.957 1.00 54.64 O ATOM 998 CB HIS A 51 25.853 -18.453 0.920 1.00 59.75 C ATOM 999 CG HIS A 51 24.984 -18.877 -0.217 1.00 58.57 C ATOM 1000 ND1 HIS A 51 24.715 -20.214 -0.487 1.00 54.98 N ATOM 1001 CD2 HIS A 51 24.307 -18.120 -1.115 1.00 49.52 C ATOM 1002 CE1 HIS A 51 23.893 -20.245 -1.532 1.00 45.77 C ATOM 1003 NE2 HIS A 51 23.629 -19.010 -1.927 1.00 45.88 N ATOM 1004 N LYS A 52 26.465 -19.119 3.662 1.00 45.61 N ATOM 1005 CA LYS A 52 27.345 -19.009 4.757 1.00 56.70 C ATOM 1006 C LYS A 52 28.590 -18.309 4.155 1.00 52.52 C ATOM 1007 O LYS A 52 29.448 -19.010 3.586 1.00 54.83 O ATOM 1008 CB LYS A 52 27.649 -20.372 5.362 1.00 57.26 C ATOM 1009 CG LYS A 52 27.972 -20.243 6.824 1.00 61.81 C ATOM 1010 CD LYS A 52 29.049 -21.211 7.274 1.00 70.98 C ATOM 1011 CE LYS A 52 29.772 -20.746 8.526 1.00 74.21 C ATOM 1012 NZ LYS A 52 31.126 -21.309 8.638 1.00 78.93 N ATOM 1013 N ILE A 53 28.668 -16.937 4.270 1.00 38.33 N ATOM 1014 CA ILE A 53 29.802 -16.196 3.723 1.00 36.87 C ATOM 1015 C ILE A 53 31.124 -16.855 4.016 1.00 44.79 C ATOM 1016 O ILE A 53 31.197 -17.577 4.955 1.00 49.34 O ATOM 1017 CB ILE A 53 29.832 -14.763 4.136 1.00 38.32 C ATOM 1018 CG1 ILE A 53 28.546 -14.073 3.738 1.00 33.96 C ATOM 1019 CG2 ILE A 53 31.036 -14.080 3.488 1.00 41.40 C ATOM 1020 CD1 ILE A 53 28.650 -12.582 4.032 1.00 27.08 C ATOM 1021 N LYS A 54 32.177 -16.654 3.230 1.00 46.32 N ATOM 1022 CA LYS A 54 33.386 -17.344 3.587 1.00 35.69 C ATOM 1023 C LYS A 54 34.583 -16.511 3.477 1.00 39.46 C ATOM 1024 O LYS A 54 35.674 -17.008 3.697 1.00 43.30 O ATOM 1025 CB LYS A 54 33.638 -18.619 2.874 1.00 44.45 C ATOM 1026 CG LYS A 54 32.447 -19.547 2.819 1.00 59.07 C ATOM 1027 CD LYS A 54 32.971 -20.959 2.574 1.00 69.03 C ATOM 1028 CE LYS A 54 32.000 -21.957 1.966 1.00 67.22 C ATOM 1029 NZ LYS A 54 32.656 -23.255 1.711 1.00 61.91 N ATOM 1030 N SER A 55 34.362 -15.258 3.124 1.00 47.71 N ATOM 1031 CA SER A 55 35.414 -14.289 2.986 1.00 51.38 C ATOM 1032 C SER A 55 34.792 -12.946 2.639 1.00 47.32 C ATOM 1033 O SER A 55 33.564 -12.813 2.420 1.00 44.11 O ATOM 1034 CB SER A 55 36.200 -14.697 1.748 1.00 62.12 C ATOM 1035 OG SER A 55 35.289 -14.836 0.657 1.00 64.04 O ATOM 1036 N GLY A 56 35.679 -11.965 2.526 1.00 46.64 N ATOM 1037 CA GLY A 56 35.289 -10.613 2.198 1.00 45.14 C ATOM 1038 C GLY A 56 34.889 -10.539 0.749 1.00 53.41 C ATOM 1039 O GLY A 56 33.842 -9.950 0.406 1.00 55.09 O ATOM 1040 N ALA A 57 35.762 -11.163 -0.087 1.00 54.46 N ATOM 1041 CA ALA A 57 35.575 -11.196 -1.523 1.00 49.58 C ATOM 1042 C ALA A 57 34.167 -11.566 -1.824 1.00 44.62 C ATOM 1043 O ALA A 57 33.470 -10.890 -2.577 1.00 55.35 O ATOM 1044 CB ALA A 57 36.563 -12.100 -2.205 1.00 51.47 C ATOM 1045 N GLU A 58 33.763 -12.616 -1.185 1.00 41.65 N ATOM 1046 CA GLU A 58 32.420 -13.125 -1.339 1.00 46.08 C ATOM 1047 C GLU A 58 31.429 -12.052 -1.051 1.00 55.98 C ATOM 1048 O GLU A 58 30.492 -11.860 -1.804 1.00 67.47 O ATOM 1049 CB GLU A 58 32.177 -14.309 -0.396 1.00 45.85 C ATOM 1050 CG GLU A 58 30.766 -14.905 -0.449 1.00 41.40 C ATOM 1051 CD GLU A 58 30.824 -16.240 0.217 1.00 44.91 C ATOM 1052 OE1 GLU A 58 31.873 -16.798 0.472 1.00 48.56 O ATOM 1053 OE2 GLU A 58 29.635 -16.722 0.517 1.00 50.02 O ATOM 1054 N ALA A 59 31.631 -11.360 0.060 1.00 53.19 N ATOM 1055 CA ALA A 59 30.726 -10.292 0.446 1.00 47.98 C ATOM 1056 C ALA A 59 30.923 -9.025 -0.330 1.00 43.62 C ATOM 1057 O ALA A 59 29.917 -8.255 -0.526 1.00 29.28 O ATOM 1058 CB ALA A 59 30.817 -10.005 1.943 1.00 51.00 C ATOM 1059 N LYS A 60 32.207 -8.790 -0.755 1.00 45.41 N ATOM 1060 CA LYS A 60 32.473 -7.568 -1.513 1.00 40.00 C ATOM 1061 C LYS A 60 31.475 -7.334 -2.614 1.00 40.04 C ATOM 1062 O LYS A 60 31.009 -6.188 -2.912 1.00 44.08 O ATOM 1063 CB LYS A 60 33.843 -7.091 -1.772 1.00 42.77 C ATOM 1064 CG LYS A 60 33.684 -5.595 -1.986 1.00 55.46 C ATOM 1065 CD LYS A 60 34.990 -4.835 -2.149 1.00 63.48 C ATOM 1066 CE LYS A 60 35.508 -4.785 -3.563 1.00 70.47 C ATOM 1067 NZ LYS A 60 35.776 -6.127 -4.073 1.00 75.60 N ATOM 1068 N LYS A 61 31.143 -8.510 -3.133 1.00 39.73 N ATOM 1069 CA LYS A 61 30.196 -8.720 -4.189 1.00 50.96 C ATOM 1070 C LYS A 61 28.915 -8.019 -3.830 1.00 53.98 C ATOM 1071 O LYS A 61 28.096 -7.591 -4.649 1.00 59.85 O ATOM 1072 CB LYS A 61 29.883 -10.211 -4.339 1.00 58.51 C ATOM 1073 CG LYS A 61 28.372 -10.446 -4.560 1.00 68.50 C ATOM 1074 CD LYS A 61 27.894 -11.913 -4.536 1.00 67.06 C ATOM 1075 CE LYS A 61 26.392 -12.041 -4.806 1.00 57.02 C ATOM 1076 NZ LYS A 61 25.991 -13.359 -5.308 1.00 48.66 N ATOM 1077 N LEU A 62 28.722 -7.919 -2.561 1.00 47.32 N ATOM 1078 CA LEU A 62 27.558 -7.297 -2.203 1.00 36.38 C ATOM 1079 C LEU A 62 27.706 -5.826 -2.442 1.00 27.92 C ATOM 1080 O LEU A 62 28.765 -5.155 -2.376 1.00 34.39 O ATOM 1081 CB LEU A 62 27.112 -7.722 -0.792 1.00 52.85 C ATOM 1082 CG LEU A 62 26.694 -9.204 -0.627 1.00 53.16 C ATOM 1083 CD1 LEU A 62 25.702 -9.611 -1.700 1.00 58.67 C ATOM 1084 CD2 LEU A 62 27.889 -10.141 -0.691 1.00 49.50 C ATOM 1085 N PRO A 63 26.608 -5.344 -2.740 1.00 22.84 N ATOM 1086 CA PRO A 63 26.380 -3.990 -3.024 1.00 33.78 C ATOM 1087 C PRO A 63 26.213 -3.279 -1.737 1.00 52.52 C ATOM 1088 O PRO A 63 25.118 -3.244 -1.220 1.00 54.63 O ATOM 1089 CB PRO A 63 24.961 -3.960 -3.603 1.00 27.95 C ATOM 1090 CG PRO A 63 24.307 -5.289 -3.239 1.00 25.70 C ATOM 1091 CD PRO A 63 25.466 -6.242 -2.939 1.00 27.94 C ATOM 1092 N GLY A 64 27.253 -2.709 -1.210 1.00 59.29 N ATOM 1093 CA GLY A 64 27.116 -2.010 0.039 1.00 55.59 C ATOM 1094 C GLY A 64 28.340 -2.390 0.753 1.00 55.75 C ATOM 1095 O GLY A 64 28.897 -1.665 1.553 1.00 62.47 O ATOM 1096 N VAL A 65 28.741 -3.586 0.406 1.00 50.10 N ATOM 1097 CA VAL A 65 29.904 -4.141 0.962 1.00 42.47 C ATOM 1098 C VAL A 65 31.055 -3.608 0.219 1.00 49.32 C ATOM 1099 O VAL A 65 30.960 -3.277 -0.943 1.00 60.70 O ATOM 1100 CB VAL A 65 29.909 -5.628 0.916 1.00 42.94 C ATOM 1101 CG1 VAL A 65 31.147 -6.111 1.675 1.00 36.06 C ATOM 1102 CG2 VAL A 65 28.581 -6.099 1.511 1.00 39.94 C ATOM 1103 N GLY A 66 32.131 -3.510 0.900 1.00 50.80 N ATOM 1104 CA GLY A 66 33.248 -3.010 0.234 1.00 47.69 C ATOM 1105 C GLY A 66 34.497 -3.447 0.925 1.00 55.08 C ATOM 1106 O GLY A 66 34.523 -4.351 1.780 1.00 65.64 O ATOM 1107 N THR A 67 35.508 -2.722 0.550 1.00 52.34 N ATOM 1108 CA THR A 67 36.838 -2.927 0.988 1.00 51.17 C ATOM 1109 C THR A 67 37.115 -3.074 2.450 1.00 53.27 C ATOM 1110 O THR A 67 37.539 -4.134 2.862 1.00 54.10 O ATOM 1111 CB THR A 67 37.927 -2.364 0.025 1.00 51.47 C ATOM 1112 OG1 THR A 67 39.261 -2.590 0.452 1.00 53.42 O ATOM 1113 CG2 THR A 67 37.684 -0.888 -0.266 1.00 56.41 C ATOM 1114 N LYS A 68 36.866 -2.034 3.218 1.00 59.04 N ATOM 1115 CA LYS A 68 37.122 -2.116 4.630 1.00 58.85 C ATOM 1116 C LYS A 68 36.234 -3.132 5.307 1.00 45.39 C ATOM 1117 O LYS A 68 36.713 -3.960 6.044 1.00 44.39 O ATOM 1118 CB LYS A 68 37.202 -0.762 5.270 1.00 65.74 C ATOM 1119 CG LYS A 68 38.254 0.109 4.622 1.00 66.27 C ATOM 1120 CD LYS A 68 38.273 1.508 5.206 1.00 83.05 C ATOM 1121 CE LYS A 68 38.927 1.608 6.590 1.00 96.24 C ATOM 1122 NZ LYS A 68 39.270 2.993 7.012 1.00100.00 N ATOM 1123 N ILE A 69 34.943 -3.071 5.007 1.00 35.03 N ATOM 1124 CA ILE A 69 34.004 -3.992 5.558 1.00 35.67 C ATOM 1125 C ILE A 69 34.383 -5.383 5.212 1.00 47.52 C ATOM 1126 O ILE A 69 34.318 -6.317 6.001 1.00 61.33 O ATOM 1127 CB ILE A 69 32.595 -3.733 5.064 1.00 32.86 C ATOM 1128 CG1 ILE A 69 32.019 -2.545 5.831 1.00 31.49 C ATOM 1129 CG2 ILE A 69 31.789 -4.976 5.365 1.00 30.41 C ATOM 1130 CD1 ILE A 69 30.937 -1.800 5.085 1.00 31.82 C ATOM 1131 N ALA A 70 34.773 -5.565 4.018 1.00 48.15 N ATOM 1132 CA ALA A 70 35.137 -6.910 3.721 1.00 48.93 C ATOM 1133 C ALA A 70 36.435 -7.299 4.436 1.00 44.70 C ATOM 1134 O ALA A 70 36.717 -8.476 4.747 1.00 47.34 O ATOM 1135 CB ALA A 70 35.154 -7.141 2.233 1.00 48.50 C ATOM 1136 N GLU A 71 37.259 -6.296 4.679 1.00 42.53 N ATOM 1137 CA GLU A 71 38.510 -6.551 5.341 1.00 50.13 C ATOM 1138 C GLU A 71 38.214 -7.145 6.694 1.00 52.91 C ATOM 1139 O GLU A 71 38.786 -8.142 7.095 1.00 53.67 O ATOM 1140 CB GLU A 71 39.335 -5.277 5.602 1.00 57.54 C ATOM 1141 CG GLU A 71 39.837 -4.505 4.377 1.00 71.42 C ATOM 1142 CD GLU A 71 41.085 -3.679 4.661 1.00 85.68 C ATOM 1143 OE1 GLU A 71 42.004 -4.105 5.341 1.00 94.10 O ATOM 1144 OE2 GLU A 71 41.098 -2.480 4.093 1.00 85.23 O ATOM 1145 N LYS A 72 37.290 -6.462 7.380 1.00 52.81 N ATOM 1146 CA LYS A 72 36.811 -6.801 8.701 1.00 47.32 C ATOM 1147 C LYS A 72 36.330 -8.212 8.696 1.00 47.71 C ATOM 1148 O LYS A 72 36.764 -9.029 9.533 1.00 54.97 O ATOM 1149 CB LYS A 72 35.714 -5.839 9.132 1.00 46.85 C ATOM 1150 CG LYS A 72 36.238 -4.418 9.008 1.00 53.48 C ATOM 1151 CD LYS A 72 35.814 -3.463 10.101 1.00 57.09 C ATOM 1152 CE LYS A 72 36.952 -2.531 10.516 1.00 61.34 C ATOM 1153 NZ LYS A 72 37.170 -1.422 9.586 1.00 64.31 N ATOM 1154 N ILE A 73 35.446 -8.472 7.736 1.00 37.71 N ATOM 1155 CA ILE A 73 34.883 -9.781 7.545 1.00 41.28 C ATOM 1156 C ILE A 73 35.898 -10.896 7.524 1.00 55.58 C ATOM 1157 O ILE A 73 35.566 -12.029 7.874 1.00 61.66 O ATOM 1158 CB ILE A 73 34.041 -9.834 6.342 1.00 34.02 C ATOM 1159 CG1 ILE A 73 33.033 -8.753 6.585 1.00 27.55 C ATOM 1160 CG2 ILE A 73 33.402 -11.212 6.287 1.00 35.65 C ATOM 1161 CD1 ILE A 73 31.751 -9.023 5.856 1.00 28.93 C ATOM 1162 N ASP A 74 37.136 -10.610 7.104 1.00 55.53 N ATOM 1163 CA ASP A 74 38.163 -11.665 7.088 1.00 62.01 C ATOM 1164 C ASP A 74 38.727 -11.986 8.471 1.00 54.67 C ATOM 1165 O ASP A 74 38.940 -13.159 8.813 1.00 51.55 O ATOM 1166 CB ASP A 74 39.278 -11.449 6.049 1.00 69.69 C ATOM 1167 CG ASP A 74 38.735 -11.456 4.649 1.00 73.16 C ATOM 1168 OD1 ASP A 74 37.924 -12.305 4.228 1.00 71.75 O ATOM 1169 OD2 ASP A 74 39.143 -10.398 3.984 1.00 72.95 O ATOM 1170 N GLU A 75 38.985 -10.914 9.247 1.00 54.21 N ATOM 1171 CA GLU A 75 39.509 -10.984 10.595 1.00 51.30 C ATOM 1172 C GLU A 75 38.480 -11.744 11.373 1.00 58.08 C ATOM 1173 O GLU A 75 38.751 -12.729 12.033 1.00 70.27 O ATOM 1174 CB GLU A 75 39.548 -9.587 11.160 1.00 45.95 C ATOM 1175 CG GLU A 75 40.331 -9.550 12.460 1.00 52.52 C ATOM 1176 CD GLU A 75 40.304 -8.184 13.040 1.00 55.47 C ATOM 1177 OE1 GLU A 75 39.686 -7.278 12.566 1.00 62.70 O ATOM 1178 OE2 GLU A 75 41.052 -8.064 14.095 1.00 58.20 O ATOM 1179 N PHE A 76 37.259 -11.266 11.263 1.00 49.39 N ATOM 1180 CA PHE A 76 36.168 -11.909 11.929 1.00 46.38 C ATOM 1181 C PHE A 76 36.028 -13.368 11.547 1.00 50.89 C ATOM 1182 O PHE A 76 35.740 -14.218 12.358 1.00 57.45 O ATOM 1183 CB PHE A 76 34.874 -11.221 11.598 1.00 48.25 C ATOM 1184 CG PHE A 76 33.766 -11.879 12.344 1.00 59.07 C ATOM 1185 CD1 PHE A 76 33.080 -12.961 11.800 1.00 60.09 C ATOM 1186 CD2 PHE A 76 33.405 -11.414 13.612 1.00 61.30 C ATOM 1187 CE1 PHE A 76 32.036 -13.581 12.478 1.00 59.63 C ATOM 1188 CE2 PHE A 76 32.364 -12.024 14.304 1.00 60.31 C ATOM 1189 CZ PHE A 76 31.678 -13.098 13.738 1.00 58.57 C ATOM 1190 N LEU A 77 36.199 -13.692 10.296 1.00 58.15 N ATOM 1191 CA LEU A 77 36.070 -15.085 9.925 1.00 56.09 C ATOM 1192 C LEU A 77 37.196 -15.849 10.594 1.00 50.92 C ATOM 1193 O LEU A 77 37.011 -16.881 11.230 1.00 55.28 O ATOM 1194 CB LEU A 77 36.129 -15.302 8.394 1.00 52.61 C ATOM 1195 CG LEU A 77 34.776 -15.510 7.691 1.00 46.27 C ATOM 1196 CD1 LEU A 77 33.705 -16.153 8.586 1.00 42.88 C ATOM 1197 CD2 LEU A 77 34.275 -14.306 6.878 1.00 40.18 C ATOM 1198 N ALA A 78 38.368 -15.301 10.427 1.00 46.20 N ATOM 1199 CA ALA A 78 39.583 -15.860 10.969 1.00 59.31 C ATOM 1200 C ALA A 78 39.658 -15.967 12.505 1.00 73.37 C ATOM 1201 O ALA A 78 39.917 -17.056 13.037 1.00 75.57 O ATOM 1202 CB ALA A 78 40.746 -15.022 10.467 1.00 60.78 C ATOM 1203 N THR A 79 39.452 -14.812 13.198 1.00 75.37 N ATOM 1204 CA THR A 79 39.485 -14.666 14.662 1.00 65.01 C ATOM 1205 C THR A 79 38.193 -14.913 15.384 1.00 68.49 C ATOM 1206 O THR A 79 38.178 -15.403 16.506 1.00 80.39 O ATOM 1207 CB THR A 79 39.830 -13.242 15.075 1.00 55.06 C ATOM 1208 OG1 THR A 79 38.708 -12.428 14.737 1.00 47.94 O ATOM 1209 CG2 THR A 79 41.108 -12.806 14.382 1.00 58.89 C ATOM 1210 N GLY A 80 37.099 -14.550 14.780 1.00 60.95 N ATOM 1211 CA GLY A 80 35.853 -14.749 15.483 1.00 62.02 C ATOM 1212 C GLY A 80 35.512 -13.438 16.219 1.00 70.27 C ATOM 1213 O GLY A 80 34.538 -13.370 16.986 1.00 70.46 O ATOM 1214 N LYS A 81 36.345 -12.392 15.947 1.00 75.27 N ATOM 1215 CA LYS A 81 36.235 -11.046 16.516 1.00 72.32 C ATOM 1216 C LYS A 81 36.850 -9.947 15.673 1.00 61.19 C ATOM 1217 O LYS A 81 37.491 -10.169 14.662 1.00 59.58 O ATOM 1218 CB LYS A 81 36.844 -10.977 17.912 1.00 84.54 C ATOM 1219 CG LYS A 81 35.794 -11.093 19.014 1.00 97.17 C ATOM 1220 CD LYS A 81 36.226 -11.971 20.189 1.00100.00 C ATOM 1221 CE LYS A 81 35.056 -12.597 20.950 1.00 99.39 C ATOM 1222 NZ LYS A 81 35.366 -13.946 21.465 1.00 97.32 N ATOM 1223 N LEU A 82 36.649 -8.739 16.132 1.00 53.21 N ATOM 1224 CA LEU A 82 37.151 -7.573 15.481 1.00 55.02 C ATOM 1225 C LEU A 82 37.841 -6.727 16.541 1.00 58.86 C ATOM 1226 O LEU A 82 37.202 -6.030 17.335 1.00 63.29 O ATOM 1227 CB LEU A 82 35.957 -6.829 14.887 1.00 61.73 C ATOM 1228 CG LEU A 82 36.340 -5.754 13.903 1.00 64.45 C ATOM 1229 CD1 LEU A 82 36.659 -6.436 12.588 1.00 70.80 C ATOM 1230 CD2 LEU A 82 35.213 -4.739 13.726 1.00 55.98 C ATOM 1231 N ARG A 83 39.162 -6.806 16.545 1.00 58.11 N ATOM 1232 CA ARG A 83 40.008 -6.100 17.492 1.00 61.61 C ATOM 1233 C ARG A 83 39.606 -4.698 17.808 1.00 60.10 C ATOM 1234 O ARG A 83 39.818 -4.217 18.932 1.00 55.87 O ATOM 1235 CB ARG A 83 41.448 -6.103 17.102 1.00 68.66 C ATOM 1236 CG ARG A 83 42.313 -6.193 18.342 1.00 76.86 C ATOM 1237 CD ARG A 83 43.728 -5.691 18.093 1.00 85.28 C ATOM 1238 NE ARG A 83 43.838 -4.253 18.349 1.00 94.24 N ATOM 1239 CZ ARG A 83 44.199 -3.775 19.547 1.00100.00 C ATOM 1240 NH1 ARG A 83 44.482 -4.616 20.549 1.00100.00 N ATOM 1241 NH2 ARG A 83 44.300 -2.446 19.759 1.00100.00 N ATOM 1242 N LYS A 84 39.057 -4.072 16.775 1.00 57.77 N ATOM 1243 CA LYS A 84 38.606 -2.722 16.875 1.00 51.70 C ATOM 1244 C LYS A 84 37.641 -2.762 17.960 1.00 55.23 C ATOM 1245 O LYS A 84 37.739 -2.026 18.916 1.00 67.48 O ATOM 1246 CB LYS A 84 37.866 -2.265 15.625 1.00 41.89 C ATOM 1247 CG LYS A 84 37.622 -0.766 15.565 1.00 41.90 C ATOM 1248 CD LYS A 84 37.105 -0.340 14.183 1.00 58.55 C ATOM 1249 CE LYS A 84 36.172 0.887 14.110 1.00 66.35 C ATOM 1250 NZ LYS A 84 36.703 2.102 13.461 1.00 71.03 N ATOM 1251 N LEU A 85 36.716 -3.666 17.785 1.00 50.53 N ATOM 1252 CA LEU A 85 35.672 -3.861 18.735 1.00 54.52 C ATOM 1253 C LEU A 85 36.129 -3.995 20.205 1.00 63.19 C ATOM 1254 O LEU A 85 35.584 -3.316 21.097 1.00 61.30 O ATOM 1255 CB LEU A 85 34.667 -4.909 18.262 1.00 45.23 C ATOM 1256 CG LEU A 85 33.408 -4.247 17.764 1.00 44.35 C ATOM 1257 CD1 LEU A 85 33.747 -2.846 17.291 1.00 43.96 C ATOM 1258 CD2 LEU A 85 32.792 -5.088 16.644 1.00 47.64 C ATOM 1259 N GLU A 86 37.126 -4.851 20.464 1.00 65.78 N ATOM 1260 CA GLU A 86 37.592 -4.999 21.826 1.00 72.91 C ATOM 1261 C GLU A 86 38.096 -3.729 22.523 1.00 75.33 C ATOM 1262 O GLU A 86 37.939 -3.576 23.727 1.00 78.24 O ATOM 1263 CB GLU A 86 38.269 -6.318 22.198 1.00 85.49 C ATOM 1264 CG GLU A 86 39.216 -6.889 21.122 1.00 95.69 C ATOM 1265 CD GLU A 86 39.197 -8.381 21.261 1.00 99.46 C ATOM 1266 OE1 GLU A 86 38.220 -8.921 21.729 1.00100.00 O ATOM 1267 OE2 GLU A 86 40.334 -9.007 20.915 1.00 97.33 O ATOM 1268 N LYS A 87 38.724 -2.824 21.759 1.00 73.95 N ATOM 1269 CA LYS A 87 39.240 -1.561 22.281 1.00 67.71 C ATOM 1270 C LYS A 87 38.105 -0.598 22.439 1.00 51.21 C ATOM 1271 O LYS A 87 38.181 0.382 23.148 1.00 53.26 O ATOM 1272 CB LYS A 87 40.418 -0.931 21.518 1.00 75.07 C ATOM 1273 CG LYS A 87 40.714 0.525 21.930 1.00 76.96 C ATOM 1274 CD LYS A 87 40.001 1.567 21.043 1.00 79.83 C ATOM 1275 CE LYS A 87 40.073 3.024 21.531 1.00 74.52 C ATOM 1276 NZ LYS A 87 39.441 4.019 20.634 1.00 65.05 N ATOM 1277 N ILE A 88 37.060 -0.873 21.724 1.00 46.78 N ATOM 1278 CA ILE A 88 35.909 -0.028 21.792 1.00 57.34 C ATOM 1279 C ILE A 88 35.025 -0.389 22.980 1.00 55.38 C ATOM 1280 O ILE A 88 34.446 0.466 23.642 1.00 44.54 O ATOM 1281 CB ILE A 88 35.193 0.051 20.466 1.00 59.75 C ATOM 1282 CG1 ILE A 88 36.138 0.776 19.493 1.00 53.41 C ATOM 1283 CG2 ILE A 88 33.858 0.791 20.643 1.00 55.57 C ATOM 1284 CD1 ILE A 88 35.779 0.582 18.024 1.00 46.94 C ATOM 1285 N ARG A 89 34.962 -1.702 23.190 1.00 56.83 N ATOM 1286 CA ARG A 89 34.225 -2.376 24.235 1.00 56.28 C ATOM 1287 C ARG A 89 34.870 -2.121 25.611 1.00 66.62 C ATOM 1288 O ARG A 89 34.227 -2.156 26.665 1.00 63.22 O ATOM 1289 CB ARG A 89 34.192 -3.865 23.923 1.00 45.14 C ATOM 1290 CG ARG A 89 33.241 -4.262 22.786 1.00 45.37 C ATOM 1291 CD ARG A 89 33.208 -5.775 22.506 1.00 48.59 C ATOM 1292 NE ARG A 89 32.084 -6.158 21.642 1.00 55.77 N ATOM 1293 CZ ARG A 89 31.828 -7.393 21.188 1.00 70.57 C ATOM 1294 NH1 ARG A 89 32.601 -8.443 21.471 1.00 80.40 N ATOM 1295 NH2 ARG A 89 30.760 -7.583 20.410 1.00 74.77 N ATOM 1296 N GLN A 90 36.183 -1.900 25.546 1.00 72.46 N ATOM 1297 CA GLN A 90 37.047 -1.628 26.669 1.00 73.44 C ATOM 1298 C GLN A 90 37.235 -0.143 26.866 1.00 71.93 C ATOM 1299 O GLN A 90 37.733 0.333 27.867 1.00 75.87 O ATOM 1300 CB GLN A 90 38.400 -2.365 26.544 1.00 82.46 C ATOM 1301 CG GLN A 90 39.317 -1.832 25.420 1.00 91.57 C ATOM 1302 CD GLN A 90 40.140 -0.596 25.785 1.00 99.27 C ATOM 1303 OE1 GLN A 90 41.321 -0.734 26.158 1.00100.00 O ATOM 1304 NE2 GLN A 90 39.580 0.608 25.569 1.00100.00 N ATOM 1305 N ASP A 91 36.866 0.634 25.893 1.00 74.04 N ATOM 1306 CA ASP A 91 37.049 2.038 26.104 1.00 77.01 C ATOM 1307 C ASP A 91 35.845 2.573 26.864 1.00 86.56 C ATOM 1308 O ASP A 91 34.696 2.456 26.435 1.00 87.86 O ATOM 1309 CB ASP A 91 37.250 2.825 24.839 1.00 73.43 C ATOM 1310 CG ASP A 91 37.095 4.231 25.235 1.00 78.50 C ATOM 1311 OD1 ASP A 91 37.706 4.707 26.181 1.00 81.29 O ATOM 1312 OD2 ASP A 91 36.069 4.787 24.634 1.00 82.11 O ATOM 1313 N ASP A 92 36.117 3.167 27.999 1.00 90.21 N ATOM 1314 CA ASP A 92 35.074 3.704 28.844 1.00 89.89 C ATOM 1315 C ASP A 92 34.036 4.548 28.162 1.00 76.78 C ATOM 1316 O ASP A 92 32.934 4.085 27.846 1.00 76.98 O ATOM 1317 CB ASP A 92 35.676 4.566 29.981 1.00 97.74 C ATOM 1318 CG ASP A 92 36.880 3.950 30.667 1.00100.00 C ATOM 1319 OD1 ASP A 92 36.891 2.781 31.088 1.00100.00 O ATOM 1320 OD2 ASP A 92 37.927 4.786 30.709 1.00100.00 O ATOM 1321 N THR A 93 34.444 5.773 27.949 1.00 63.90 N ATOM 1322 CA THR A 93 33.625 6.780 27.351 1.00 61.79 C ATOM 1323 C THR A 93 32.711 6.339 26.257 1.00 57.60 C ATOM 1324 O THR A 93 31.523 6.661 26.262 1.00 57.63 O ATOM 1325 CB THR A 93 34.506 7.888 26.861 1.00 64.99 C ATOM 1326 OG1 THR A 93 35.412 7.278 25.971 1.00 70.76 O ATOM 1327 CG2 THR A 93 35.231 8.456 28.075 1.00 62.64 C ATOM 1328 N SER A 94 33.275 5.601 25.351 1.00 51.02 N ATOM 1329 CA SER A 94 32.523 5.118 24.242 1.00 49.61 C ATOM 1330 C SER A 94 31.269 4.406 24.658 1.00 41.35 C ATOM 1331 O SER A 94 30.156 4.791 24.301 1.00 41.32 O ATOM 1332 CB SER A 94 33.408 4.194 23.479 1.00 57.84 C ATOM 1333 OG SER A 94 34.077 3.416 24.451 1.00 68.05 O ATOM 1334 N SER A 95 31.444 3.391 25.428 1.00 42.07 N ATOM 1335 CA SER A 95 30.307 2.624 25.876 1.00 53.43 C ATOM 1336 C SER A 95 29.207 3.421 26.538 1.00 55.15 C ATOM 1337 O SER A 95 28.009 3.268 26.223 1.00 57.42 O ATOM 1338 CB SER A 95 30.790 1.541 26.766 1.00 67.16 C ATOM 1339 OG SER A 95 32.048 1.160 26.257 1.00 79.91 O ATOM 1340 N SER A 96 29.621 4.266 27.462 1.00 53.78 N ATOM 1341 CA SER A 96 28.695 5.109 28.189 1.00 52.65 C ATOM 1342 C SER A 96 28.030 6.014 27.207 1.00 54.89 C ATOM 1343 O SER A 96 26.845 6.373 27.346 1.00 56.96 O ATOM 1344 CB SER A 96 29.410 5.947 29.219 1.00 54.12 C ATOM 1345 OG SER A 96 30.373 5.146 29.848 1.00 58.82 O ATOM 1346 N ILE A 97 28.845 6.392 26.209 1.00 56.09 N ATOM 1347 CA ILE A 97 28.390 7.263 25.158 1.00 47.02 C ATOM 1348 C ILE A 97 27.366 6.548 24.343 1.00 41.30 C ATOM 1349 O ILE A 97 26.337 7.098 23.947 1.00 46.02 O ATOM 1350 CB ILE A 97 29.480 7.953 24.404 1.00 47.17 C ATOM 1351 CG1 ILE A 97 30.128 8.903 25.384 1.00 34.48 C ATOM 1352 CG2 ILE A 97 28.848 8.773 23.279 1.00 55.27 C ATOM 1353 CD1 ILE A 97 31.299 9.622 24.784 1.00 31.27 C ATOM 1354 N ASN A 98 27.617 5.291 24.102 1.00 40.66 N ATOM 1355 CA ASN A 98 26.628 4.553 23.341 1.00 50.33 C ATOM 1356 C ASN A 98 25.352 4.318 24.168 1.00 49.50 C ATOM 1357 O ASN A 98 24.214 4.394 23.659 1.00 52.33 O ATOM 1358 CB ASN A 98 27.154 3.203 22.771 1.00 64.15 C ATOM 1359 CG ASN A 98 27.568 3.206 21.299 1.00 70.34 C ATOM 1360 OD1 ASN A 98 28.469 2.428 20.908 1.00 78.76 O ATOM 1361 ND2 ASN A 98 26.921 4.067 20.485 1.00 64.04 N ATOM 1362 N PHE A 99 25.537 3.999 25.452 1.00 40.69 N ATOM 1363 CA PHE A 99 24.408 3.755 26.296 1.00 40.18 C ATOM 1364 C PHE A 99 23.422 4.906 26.399 1.00 31.38 C ATOM 1365 O PHE A 99 22.241 4.804 26.013 1.00 30.95 O ATOM 1366 CB PHE A 99 24.865 3.343 27.676 1.00 55.37 C ATOM 1367 CG PHE A 99 23.676 2.932 28.455 1.00 65.67 C ATOM 1368 CD1 PHE A 99 22.789 2.006 27.913 1.00 73.69 C ATOM 1369 CD2 PHE A 99 23.430 3.469 29.714 1.00 71.49 C ATOM 1370 CE1 PHE A 99 21.650 1.609 28.623 1.00 80.70 C ATOM 1371 CE2 PHE A 99 22.297 3.079 30.437 1.00 80.08 C ATOM 1372 CZ PHE A 99 21.413 2.152 29.885 1.00 83.67 C ATOM 1373 N LEU A 100 23.908 6.016 26.889 1.00 25.78 N ATOM 1374 CA LEU A 100 23.048 7.209 27.029 1.00 25.27 C ATOM 1375 C LEU A 100 22.181 7.580 25.822 1.00 37.69 C ATOM 1376 O LEU A 100 21.027 8.039 25.930 1.00 41.30 O ATOM 1377 CB LEU A 100 23.954 8.432 27.247 1.00 30.61 C ATOM 1378 CG LEU A 100 24.158 8.907 28.693 1.00 44.32 C ATOM 1379 CD1 LEU A 100 24.276 7.766 29.699 1.00 48.90 C ATOM 1380 CD2 LEU A 100 25.325 9.899 28.813 1.00 39.22 C ATOM 1381 N THR A 101 22.726 7.425 24.632 1.00 44.84 N ATOM 1382 CA THR A 101 21.974 7.772 23.439 1.00 43.57 C ATOM 1383 C THR A 101 20.708 6.955 23.327 1.00 41.38 C ATOM 1384 O THR A 101 19.714 7.379 22.656 1.00 37.62 O ATOM 1385 CB THR A 101 22.868 7.712 22.235 1.00 35.03 C ATOM 1386 OG1 THR A 101 23.179 6.350 22.131 1.00 38.94 O ATOM 1387 CG2 THR A 101 24.119 8.511 22.626 1.00 24.92 C ATOM 1388 N ARG A 102 20.763 5.771 23.994 1.00 27.98 N ATOM 1389 CA ARG A 102 19.619 4.898 23.997 1.00 27.49 C ATOM 1390 C ARG A 102 18.440 5.682 24.458 1.00 33.56 C ATOM 1391 O ARG A 102 17.297 5.528 24.027 1.00 36.25 O ATOM 1392 CB ARG A 102 19.874 3.772 24.929 1.00 28.52 C ATOM 1393 CG ARG A 102 21.002 2.993 24.339 1.00 28.83 C ATOM 1394 CD ARG A 102 21.352 1.758 25.131 1.00 33.06 C ATOM 1395 NE ARG A 102 20.186 0.939 25.351 1.00 38.60 N ATOM 1396 CZ ARG A 102 20.249 -0.202 26.058 1.00 45.69 C ATOM 1397 NH1 ARG A 102 21.415 -0.613 26.592 1.00 40.27 N ATOM 1398 NH2 ARG A 102 19.119 -0.923 26.233 1.00 34.68 N ATOM 1399 N VAL A 103 18.763 6.599 25.332 1.00 35.93 N ATOM 1400 CA VAL A 103 17.763 7.470 25.882 1.00 45.13 C ATOM 1401 C VAL A 103 17.145 8.492 24.921 1.00 47.69 C ATOM 1402 O VAL A 103 17.791 9.464 24.509 1.00 53.60 O ATOM 1403 CB VAL A 103 18.257 8.220 27.136 1.00 43.82 C ATOM 1404 CG1 VAL A 103 17.195 9.203 27.637 1.00 32.35 C ATOM 1405 CG2 VAL A 103 18.733 7.299 28.259 1.00 41.86 C ATOM 1406 N SER A 104 15.867 8.311 24.596 1.00 41.38 N ATOM 1407 CA SER A 104 15.168 9.229 23.734 1.00 32.31 C ATOM 1408 C SER A 104 15.197 10.722 24.151 1.00 41.03 C ATOM 1409 O SER A 104 14.586 11.165 25.129 1.00 46.84 O ATOM 1410 CB SER A 104 13.738 8.774 23.482 1.00 32.48 C ATOM 1411 OG SER A 104 13.143 9.517 22.400 1.00 33.20 O ATOM 1412 N GLY A 105 15.922 11.502 23.342 1.00 38.75 N ATOM 1413 CA GLY A 105 16.144 12.944 23.420 1.00 25.36 C ATOM 1414 C GLY A 105 17.652 13.245 23.442 1.00 34.82 C ATOM 1415 O GLY A 105 18.123 14.351 23.073 1.00 38.52 O ATOM 1416 N ILE A 106 18.370 12.206 23.902 1.00 27.61 N ATOM 1417 CA ILE A 106 19.786 12.177 24.056 1.00 32.64 C ATOM 1418 C ILE A 106 20.383 11.558 22.841 1.00 38.30 C ATOM 1419 O ILE A 106 20.128 10.358 22.545 1.00 28.23 O ATOM 1420 CB ILE A 106 20.264 11.358 25.257 1.00 37.54 C ATOM 1421 CG1 ILE A 106 19.929 12.083 26.578 1.00 45.01 C ATOM 1422 CG2 ILE A 106 21.768 11.074 25.153 1.00 33.76 C ATOM 1423 CD1 ILE A 106 20.074 11.282 27.890 1.00 34.08 C ATOM 1424 N GLY A 107 21.152 12.442 22.216 1.00 35.27 N ATOM 1425 CA GLY A 107 21.870 12.225 21.032 1.00 47.76 C ATOM 1426 C GLY A 107 23.303 12.147 21.341 1.00 53.77 C ATOM 1427 O GLY A 107 23.627 11.954 22.483 1.00 57.20 O ATOM 1428 N PRO A 108 24.139 12.292 20.301 1.00 53.31 N ATOM 1429 CA PRO A 108 25.531 12.224 20.515 1.00 42.13 C ATOM 1430 C PRO A 108 26.107 13.451 21.122 1.00 33.83 C ATOM 1431 O PRO A 108 27.032 13.296 21.869 1.00 41.12 O ATOM 1432 CB PRO A 108 26.241 11.630 19.299 1.00 50.33 C ATOM 1433 CG PRO A 108 25.117 11.126 18.408 1.00 44.88 C ATOM 1434 CD PRO A 108 23.821 11.740 18.933 1.00 51.72 C ATOM 1435 N SER A 109 25.602 14.669 20.845 1.00 33.09 N ATOM 1436 CA SER A 109 26.238 15.818 21.542 1.00 43.80 C ATOM 1437 C SER A 109 26.022 15.680 23.056 1.00 46.77 C ATOM 1438 O SER A 109 26.965 15.522 23.820 1.00 48.77 O ATOM 1439 CB SER A 109 25.860 17.216 21.045 1.00 45.06 C ATOM 1440 OG SER A 109 24.656 17.139 20.304 1.00 52.94 O ATOM 1441 N ALA A 110 24.732 15.714 23.438 1.00 49.74 N ATOM 1442 CA ALA A 110 24.210 15.596 24.801 1.00 34.52 C ATOM 1443 C ALA A 110 24.938 14.485 25.469 1.00 28.11 C ATOM 1444 O ALA A 110 25.637 14.680 26.446 1.00 39.35 O ATOM 1445 CB ALA A 110 22.754 15.178 24.633 1.00 29.74 C ATOM 1446 N ALA A 111 24.792 13.324 24.882 1.00 31.96 N ATOM 1447 CA ALA A 111 25.448 12.174 25.407 1.00 38.02 C ATOM 1448 C ALA A 111 26.950 12.384 25.600 1.00 45.61 C ATOM 1449 O ALA A 111 27.578 11.893 26.516 1.00 59.82 O ATOM 1450 CB ALA A 111 25.135 10.956 24.593 1.00 23.99 C ATOM 1451 N ARG A 112 27.577 13.111 24.753 1.00 41.99 N ATOM 1452 CA ARG A 112 28.977 13.255 25.007 1.00 42.53 C ATOM 1453 C ARG A 112 29.247 14.312 26.008 1.00 41.86 C ATOM 1454 O ARG A 112 30.248 14.296 26.678 1.00 43.33 O ATOM 1455 CB ARG A 112 29.736 13.564 23.773 1.00 48.88 C ATOM 1456 CG ARG A 112 31.232 13.575 23.998 1.00 65.76 C ATOM 1457 CD ARG A 112 31.883 13.825 22.661 1.00 81.07 C ATOM 1458 NE ARG A 112 33.308 14.080 22.657 1.00 93.44 N ATOM 1459 CZ ARG A 112 33.880 14.476 21.520 1.00 98.93 C ATOM 1460 NH1 ARG A 112 33.143 14.633 20.401 1.00 96.38 N ATOM 1461 NH2 ARG A 112 35.202 14.721 21.501 1.00100.00 N ATOM 1462 N LYS A 113 28.359 15.259 26.047 1.00 45.38 N ATOM 1463 CA LYS A 113 28.456 16.374 26.954 1.00 49.28 C ATOM 1464 C LYS A 113 28.364 15.738 28.317 1.00 47.81 C ATOM 1465 O LYS A 113 29.278 15.840 29.107 1.00 51.78 O ATOM 1466 CB LYS A 113 27.217 17.202 26.685 1.00 64.93 C ATOM 1467 CG LYS A 113 26.983 18.434 27.537 1.00 77.02 C ATOM 1468 CD LYS A 113 25.558 18.976 27.360 1.00 79.17 C ATOM 1469 CE LYS A 113 24.489 17.925 27.661 1.00 74.81 C ATOM 1470 NZ LYS A 113 23.122 18.349 27.292 1.00 68.74 N ATOM 1471 N PHE A 114 27.242 15.063 28.551 1.00 42.49 N ATOM 1472 CA PHE A 114 26.994 14.380 29.795 1.00 37.46 C ATOM 1473 C PHE A 114 28.181 13.606 30.279 1.00 37.86 C ATOM 1474 O PHE A 114 28.685 13.871 31.333 1.00 51.48 O ATOM 1475 CB PHE A 114 25.882 13.350 29.623 1.00 34.47 C ATOM 1476 CG PHE A 114 24.495 13.950 29.613 1.00 33.05 C ATOM 1477 CD1 PHE A 114 24.230 15.170 30.229 1.00 38.09 C ATOM 1478 CD2 PHE A 114 23.433 13.279 29.022 1.00 33.28 C ATOM 1479 CE1 PHE A 114 22.954 15.726 30.236 1.00 37.37 C ATOM 1480 CE2 PHE A 114 22.149 13.820 29.023 1.00 39.47 C ATOM 1481 CZ PHE A 114 21.907 15.047 29.626 1.00 37.96 C ATOM 1482 N VAL A 115 28.637 12.680 29.495 1.00 42.04 N ATOM 1483 CA VAL A 115 29.778 11.876 29.865 1.00 48.58 C ATOM 1484 C VAL A 115 30.985 12.671 30.307 1.00 56.69 C ATOM 1485 O VAL A 115 31.782 12.214 31.135 1.00 57.16 O ATOM 1486 CB VAL A 115 30.122 10.882 28.812 1.00 46.18 C ATOM 1487 CG1 VAL A 115 31.308 10.067 29.323 1.00 51.39 C ATOM 1488 CG2 VAL A 115 28.893 10.017 28.557 1.00 36.77 C ATOM 1489 N ASP A 116 31.115 13.860 29.736 1.00 61.59 N ATOM 1490 CA ASP A 116 32.219 14.728 30.104 1.00 64.26 C ATOM 1491 C ASP A 116 31.826 15.378 31.453 1.00 54.44 C ATOM 1492 O ASP A 116 32.621 15.557 32.372 1.00 53.53 O ATOM 1493 CB ASP A 116 32.735 15.733 29.009 1.00 71.15 C ATOM 1494 CG ASP A 116 33.318 15.127 27.720 1.00 72.05 C ATOM 1495 OD1 ASP A 116 33.857 14.016 27.648 1.00 71.07 O ATOM 1496 OD2 ASP A 116 33.179 15.934 26.678 1.00 67.99 O ATOM 1497 N