HEADER DNA 27-APR-99 1QBY TITLE THE SOLUTION STRUCTURE OF A BAY-REGION 1R-BENZ[A]ANTHRACENE TITLE 2 OXIDE ADDUCT AT THE N6 POSITION OF ADENINE OF AN TITLE 3 OLIGODEOXYNUCLEOTIDE CONTAINING THE HUMAN N-RAS CODON 61 TITLE 4 SEQUENCE COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*CP*GP*GP*AP*CP*(BZA)AP*AP*GP*AP*AP*G)-3'; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: 5'-D(*CP*TP*TP*CP*TP*TP*GP*TP*CP*CP* G)-3'; COMPND 7 CHAIN: B; COMPND 8 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 SYNTHETIC: YES; SOURCE 5 OTHER_DETAILS: THIS SEQUENCE WAS SYNTHESIZED BY CHEMICAL SOURCE 6 METHOD KEYWDS BENZ[A]ANTHRACENE-DNA DUPLEX, INTERCALATION EXPDTA SOLUTION NMR AUTHOR Z.LI,H.MAO,H.-Y.KIM,P.J.TAMURA,C.M.HARRIS,T.M.HARRIS, AUTHOR 2 M.P.STONE REVDAT 3 24-FEB-09 1QBY 1 VERSN REVDAT 2 01-APR-03 1QBY 1 JRNL REVDAT 1 06-MAY-99 1QBY 0 JRNL AUTH Z.LI,H.MAO,H.Y.KIM,P.J.TAMURA,C.M.HARRIS, JRNL AUTH 2 T.M.HARRIS,M.P.STONE JRNL TITL INTERCALATION OF THE (-)-(1R,2S,3R, JRNL TITL 2 4S)-N6-[1-BENZ[A]ANTHRACENYL]-2'-DEOXYADENOSYL JRNL TITL 3 ADDUCT IN AN OLIGODEOXYNUCLEOTIDE CONTAINING THE JRNL TITL 4 HUMAN N-RAS CODON 61 SEQUENCE. JRNL REF BIOCHEMISTRY V. 38 2969 1999 JRNL REFN ISSN 0006-2960 JRNL PMID 10074349 JRNL DOI 10.1021/BI982072X REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CORMA 5.2 REMARK 3 AUTHORS : BORGIAS,B.A., THOMAS,P.D., LI,H., KUMAR,A., AND REMARK 3 TONELLI,M. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: THE STRUCTURE IS BASED ON A TOTAL OF REMARK 3 509 NOE-DERIVED DISTANCE CONSTRAINTS, 95 EMPIRICAL SUGAR REMARK 3 PUCKER RESTRAINTS, 36 EMPIRICAL BACKBONE ANGLE DIHEDRAL REMARK 3 RESTRAINTS, AND 16 EMPIRICAL PLANARITY RESTRAINTS. REMARK 4 REMARK 4 1QBY COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY NDB ON 30-APR-99. REMARK 100 THE RCSB ID CODE IS RCSB009054. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 278; 288; 298 REMARK 210 PH : 7.0; 7.0; 7.0 REMARK 210 IONIC STRENGTH : 0.1 M NACL; 0.1 M NACL; 0.1 M REMARK 210 NACL REMARK 210 PRESSURE : 1 ATM; 1 ATM; 1 ATM REMARK 210 SAMPLE CONTENTS : 1.6 MM OLIGODEOXYNUCLEOTIDE; REMARK 210 10 MM PHOSPHATE BUFFER; 0.05 REMARK 210 MM EDTA; 0.1 M NACL; 1.6 MM REMARK 210 OLIGODEOXYNUCLEOTIDE; 10 MM REMARK 210 PHOSPHATE BUFFER; 0.05 MM REMARK 210 EDTA; 0.1 M NACL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY, DQF-COSY, TOCSY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 750 MHZ REMARK 210 SPECTROMETER MODEL : AMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XWINNMR 2.0, X-PLOR 3.1, REMARK 210 FELIX 97.0, MARDIGRAS 3.0 REMARK 210 METHOD USED : NOE-RESTRAINED MOLECULAR REMARK 210 DYNAMICS/SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 1 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : BACK CALCULATED DATA AGREE REMARK 210 WITH EXPERIMENTAL NOESY REMARK 210 SPECTRUM REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 12 REMARK 210 REMARK 210 REMARK: STRUCTURE WAS DETERMINED USING STANDARD 2D HOMONUCLEAR REMARK 210 TECHNIQUES REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 DT B 13 C5 DT B 13 C7 0.036 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DG A 2 O4' - C1' - N9 ANGL. DEV. = 3.8 DEGREES REMARK 500 DG A 2 N7 - C8 - N9 ANGL. DEV. = 4.4 DEGREES REMARK 500 DG A 2 C8 - N9 - C4 ANGL. DEV. = -2.7 DEGREES REMARK 500 DG A 3 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DG A 3 N7 - C8 - N9 ANGL. DEV. = 4.5 DEGREES REMARK 500 DG A 3 C8 - N9 - C4 ANGL. DEV. = -2.6 DEGREES REMARK 500 DA A 4 O4' - C1' - N9 ANGL. DEV. = 1.9 DEGREES REMARK 500 DA A 4 N7 - C8 - N9 ANGL. DEV. = 3.8 DEGREES REMARK 500 DC A 5 O4' - C1' - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA A 6 O4' - C1' - N9 ANGL. DEV. = 4.1 DEGREES REMARK 500 DA A 6 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DA A 7 O4' - C1' - N9 ANGL. DEV. = 3.2 DEGREES REMARK 500 DA A 7 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DG A 8 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES REMARK 500 DG A 8 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG A 8 C8 - N9 - C4 ANGL. DEV. = -2.7 DEGREES REMARK 500 DA A 9 O4' - C1' - N9 ANGL. DEV. = 2.1 DEGREES REMARK 500 DA A 9 N7 - C8 - N9 ANGL. DEV. = 3.8 DEGREES REMARK 500 DA A 10 O4' - C1' - N9 ANGL. DEV. = 2.6 DEGREES REMARK 500 DA A 10 N7 - C8 - N9 ANGL. DEV. = 3.8 DEGREES REMARK 500 DG A 11 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG A 11 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 DT B 13 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DT B 14 O4' - C1' - N1 ANGL. DEV. = 3.1 DEGREES REMARK 500 DC B 15 O4' - C1' - N1 ANGL. DEV. = 2.8 DEGREES REMARK 500 DT B 16 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 DT B 17 C6 - C5 - C7 ANGL. DEV. = -3.8 DEGREES REMARK 500 DG B 18 O4' - C1' - N9 ANGL. DEV. = 3.1 DEGREES REMARK 500 DG B 18 N7 - C8 - N9 ANGL. DEV. = 4.7 DEGREES REMARK 500 DG B 18 C8 - N9 - C4 ANGL. DEV. = -2.7 DEGREES REMARK 500 DT B 19 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DC B 20 O4' - C1' - N1 ANGL. DEV. = 2.9 DEGREES REMARK 500 DC B 21 O4' - C1' - N1 ANGL. DEV. = 2.6 DEGREES REMARK 500 DG B 22 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG B 22 C8 - N9 - C4 ANGL. DEV. = -2.4 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE BZA A 66 DBREF 1QBY A 1 11 PDB 1QBY 1QBY 1 11 DBREF 1QBY B 12 22 PDB 1QBY 1QBY 12 22 SEQRES 1 A 11 DC DG DG DA DC DA DA DG DA DA DG SEQRES 1 B 11 DC DT DT DC DT DT DG DT DC DC DG HET BZA A 66 36 HETNAM BZA 1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE-2,3,4-TRIOL FORMUL 3 BZA C18 H16 O3 LINK N6 DA A 6 C4C BZA A 66 1555 1555 1.34 SITE 1 AC1 6 DC A 5 DA A 6 DA A 7 DT B 16 SITE 2 AC1 6 DT B 17 DG B 18 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 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 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 ATOM 1 O5' DC A 1 8.732 20.254 -3.516 1.00 0.75 O ATOM 2 C5' DC A 1 9.828 20.691 -2.707 1.00 0.76 C ATOM 3 C4' DC A 1 9.992 19.817 -1.468 1.00 0.62 C ATOM 4 O4' DC A 1 8.760 19.778 -0.705 1.00 0.56 O ATOM 5 C3' DC A 1 10.336 18.388 -1.861 1.00 0.56 C ATOM 6 O3' DC A 1 11.419 17.901 -1.055 1.00 0.50 O ATOM 7 C2' DC A 1 9.057 17.623 -1.647 1.00 0.48 C ATOM 8 C1' DC A 1 8.283 18.416 -0.611 1.00 0.45 C ATOM 9 N1 DC A 1 6.828 18.376 -0.884 1.00 0.46 N ATOM 10 C2 DC A 1 5.959 18.154 0.180 1.00 0.40 C ATOM 11 O2 DC A 1 6.393 17.991 1.318 1.00 0.35 O ATOM 12 N3 DC A 1 4.621 18.133 -0.077 1.00 0.42 N ATOM 13 C4 DC A 1 4.154 18.321 -1.320 1.00 0.48 C ATOM 14 N4 DC A 1 2.839 18.295 -1.538 1.00 0.50 N ATOM 15 C5 DC A 1 5.044 18.550 -2.412 1.00 0.55 C ATOM 16 C6 DC A 1 6.362 18.571 -2.149 1.00 0.54 C ATOM 17 H5' DC A 1 9.652 21.721 -2.397 1.00 0.82 H ATOM 18 H5'' DC A 1 10.742 20.646 -3.296 1.00 0.81 H ATOM 19 H4' DC A 1 10.787 20.222 -0.842 1.00 0.61 H ATOM 20 H3' DC A 1 10.606 18.349 -2.916 1.00 0.65 H ATOM 21 H2' DC A 1 8.502 17.574 -2.581 1.00 0.53 H ATOM 22 H2'' DC A 1 9.262 16.620 -1.280 1.00 0.40 H ATOM 23 H1' DC A 1 8.487 18.008 0.378 1.00 0.36 H ATOM 24 H41 DC A 1 2.202 18.133 -0.771 1.00 1.34 H ATOM 25 H42 DC A 1 2.480 18.437 -2.472 1.00 0.49 H ATOM 26 H5 DC A 1 4.668 18.704 -3.423 1.00 0.62 H ATOM 27 H6 DC A 1 7.069 18.757 -2.953 1.00 0.61 H ATOM 28 HO5' DC A 1 8.857 19.317 -3.683 1.00 0.10 H ATOM 29 P DG A 2 11.708 16.327 -0.892 1.00 0.44 P ATOM 30 OP1 DG A 2 13.051 16.159 -0.293 1.00 1.34 O ATOM 31 OP2 DG A 2 11.377 15.655 -2.169 1.00 1.39 O ATOM 32 O5' DG A 2 10.608 15.910 0.200 1.00 0.29 O ATOM 33 C5' DG A 2 10.659 16.451 1.524 1.00 0.21 C ATOM 34 C4' DG A 2 9.580 15.839 2.407 1.00 0.11 C ATOM 35 O4' DG A 2 8.249 16.209 1.968 1.00 0.14 O ATOM 36 C3' DG A 2 9.668 14.321 2.362 1.00 0.10 C ATOM 37 O3' DG A 2 9.784 13.768 3.680 1.00 0.10 O ATOM 38 C2' DG A 2 8.408 13.878 1.682 1.00 0.10 C ATOM 39 C1' DG A 2 7.443 15.016 1.876 1.00 0.07 C ATOM 40 N9 DG A 2 6.466 15.090 0.772 1.00 0.12 N ATOM 41 C8 DG A 2 6.660 15.222 -0.566 1.00 0.21 C ATOM 42 N7 DG A 2 5.611 15.278 -1.318 1.00 0.22 N ATOM 43 C5 DG A 2 4.580 15.167 -0.379 1.00 0.15 C ATOM 44 C6 DG A 2 3.171 15.160 -0.565 1.00 0.17 C ATOM 45 O6 DG A 2 2.537 15.256 -1.614 1.00 0.20 O ATOM 46 N1 DG A 2 2.499 15.029 0.644 1.00 0.21 N ATOM 47 C2 DG A 2 3.101 14.914 1.881 1.00 0.22 C ATOM 48 N2 DG A 2 2.289 14.786 2.929 1.00 0.33 N ATOM 49 N3 DG A 2 4.422 14.921 2.063 1.00 0.16 N ATOM 50 C4 DG A 2 5.098 15.050 0.901 1.00 0.11 C ATOM 51 H5' DG A 2 10.522 17.534 1.483 1.00 0.26 H ATOM 52 H5'' DG A 2 11.636 16.234 1.957 1.00 0.19 H ATOM 53 H4' DG A 2 9.724 16.175 3.434 1.00 0.08 H ATOM 54 H3' DG A 2 10.515 14.033 1.753 1.00 0.18 H ATOM 55 H2' DG A 2 8.593 13.717 0.620 1.00 0.17 H ATOM 56 H2'' DG A 2 8.025 12.973 2.141 1.00 0.12 H ATOM 57 H1' DG A 2 6.914 14.871 2.817 1.00 0.06 H ATOM 58 H8 DG A 2 7.664 15.267 -0.993 1.00 0.28 H ATOM 59 H1 DG A 2 1.491 15.023 0.588 1.00 0.25 H ATOM 60 H21 DG A 2 1.287 14.785 2.795 1.00 0.37 H ATOM 61 H22 DG A 2 2.674 14.692 3.858 1.00 0.36 H ATOM 62 P DG A 3 10.008 12.186 3.902 1.00 0.21 P ATOM 63 OP1 DG A 3 11.049 12.007 4.939 1.00 1.14 O ATOM 64 OP2 DG A 3 10.171 11.544 2.577 1.00 1.45 O ATOM 65 O5' DG A 3 8.596 11.717 4.518 1.00 0.22 O ATOM 66 C5' DG A 3 8.205 12.129 5.832 1.00 0.24 C ATOM 67 C4' DG A 3 6.791 11.665 6.174 1.00 0.27 C ATOM 68 O4' DG A 3 5.830 12.216 5.243 1.00 0.23 O ATOM 69 C3' DG A 3 6.683 10.144 6.114 1.00 0.32 C ATOM 70 O3' DG A 3 6.173 9.619 7.348 1.00 0.38 O ATOM 71 C2' DG A 3 5.748 9.862 4.968 1.00 0.30 C ATOM 72 C1' DG A 3 5.002 11.158 4.723 1.00 0.25 C ATOM 73 N9 DG A 3 4.744 11.356 3.285 1.00 0.19 N ATOM 74 C8 DG A 3 5.622 11.426 2.255 1.00 0.15 C ATOM 75 N7 DG A 3 5.144 11.640 1.075 1.00 0.11 N ATOM 76 C5 DG A 3 3.773 11.722 1.334 1.00 0.12 C ATOM 77 C6 DG A 3 2.690 11.946 0.442 1.00 0.10 C ATOM 78 O6 DG A 3 2.725 12.123 -0.773 1.00 0.05 O ATOM 79 N1 DG A 3 1.473 11.954 1.110 1.00 0.16 N ATOM 80 C2 DG A 3 1.309 11.768 2.469 1.00 0.23 C ATOM 81 N2 DG A 3 0.056 11.799 2.924 1.00 0.29 N ATOM 82 N3 DG A 3 2.322 11.559 3.315 1.00 0.23 N ATOM 83 C4 DG A 3 3.519 11.548 2.686 1.00 0.18 C ATOM 84 H5' DG A 3 8.245 13.217 5.890 1.00 0.21 H ATOM 85 H5'' DG A 3 8.902 11.709 6.558 1.00 0.28 H ATOM 86 H4' DG A 3 6.540 11.999 7.180 1.00 0.30 H ATOM 87 H3' DG A 3 7.663 9.714 5.897 1.00 0.33 H ATOM 88 H2' DG A 3 6.318 9.581 4.084 1.00 0.28 H ATOM 89 H2'' DG A 3 5.050 9.071 5.231 1.00 0.34 H ATOM 90 H1' DG A 3 4.055 11.139 5.262 1.00 0.28 H ATOM 91 H8 DG A 3 6.692 11.295 2.418 1.00 0.17 H ATOM 92 H1 DG A 3 0.657 12.106 0.535 1.00 0.17 H ATOM 93 H21 DG A 3 -0.709 11.957 2.284 1.00 1.03 H ATOM 94 H22 DG A 3 -0.127 11.664 3.908 1.00 0.81 H ATOM 95 P DA A 4 5.975 8.033 7.562 1.00 0.41 P ATOM 96 OP1 DA A 4 6.140 7.737 9.003 1.00 0.93 O ATOM 97 OP2 DA A 4 6.803 7.319 6.564 1.00 1.67 O ATOM 98 O5' DA A 4 4.425 7.819 7.176 1.00 0.34 O ATOM 99 C5' DA A 4 3.386 8.290 8.042 1.00 0.34 C ATOM 100 C4' DA A 4 2.001 7.967 7.489 1.00 0.28 C ATOM 101 O4' DA A 4 1.797 8.610 6.212 1.00 0.25 O ATOM 102 C3' DA A 4 1.838 6.466 7.289 1.00 0.26 C ATOM 103 O3' DA A 4 0.671 5.981 7.967 1.00 0.24 O ATOM 104 C2' DA A 4 1.728 6.275 5.800 1.00 0.22 C ATOM 105 C1' DA A 4 1.371 7.635 5.241 1.00 0.21 C ATOM 106 N9 DA A 4 2.051 7.865 3.958 1.00 0.20 N ATOM 107 C8 DA A 4 3.364 7.753 3.664 1.00 0.22 C ATOM 108 N7 DA A 4 3.736 8.053 2.465 1.00 0.21 N ATOM 109 C5 DA A 4 2.519 8.409 1.876 1.00 0.19 C ATOM 110 C6 DA A 4 2.181 8.840 0.590 1.00 0.18 C ATOM 111 N6 DA A 4 3.079 9.007 -0.380 1.00 0.19 N ATOM 112 N1 DA A 4 0.884 9.103 0.347 1.00 0.16 N ATOM 113 C2 DA A 4 -0.028 8.953 1.310 1.00 0.16 C ATOM 114 N3 DA A 4 0.182 8.553 2.560 1.00 0.17 N ATOM 115 C4 DA A 4 1.487 8.295 2.779 1.00 0.18 C ATOM 116 H5' DA A 4 3.480 9.369 8.154 1.00 0.36 H ATOM 117 H5'' DA A 4 3.498 7.821 9.020 1.00 0.36 H ATOM 118 H4' DA A 4 1.244 8.318 8.190 1.00 0.29 H ATOM 119 H3' DA A 4 2.728 5.955 7.654 1.00 0.29 H ATOM 120 H2' DA A 4 2.683 5.940 5.391 1.00 0.24 H ATOM 121 H2'' DA A 4 0.946 5.553 5.567 1.00 0.19 H ATOM 122 H1' DA A 4 0.298 7.699 5.103 1.00 0.18 H ATOM 123 H8 DA A 4 4.077 7.413 4.415 1.00 0.24 H ATOM 124 H61 DA A 4 2.784 9.320 -1.294 1.00 0.77 H ATOM 125 H62 DA A 4 4.056 8.819 -0.201 1.00 1.01 H ATOM 126 H2 DA A 4 -1.059 9.184 1.041 1.00 0.15 H ATOM 127 P DC A 5 0.590 4.459 8.494 1.00 0.24 P ATOM 128 OP1 DC A 5 -0.098 4.460 9.805 1.00 1.52 O ATOM 129 OP2 DC A 5 1.934 3.849 8.368 1.00 1.04 O ATOM 130 O5' DC A 5 -0.380 3.762 7.414 1.00 0.24 O ATOM 131 C5' DC A 5 -1.788 4.027 7.415 1.00 0.24 C ATOM 132 C4' DC A 5 -2.414 3.707 6.062 1.00 0.24 C ATOM 133 O4' DC A 5 -1.785 4.494 5.018 1.00 0.24 O ATOM 134 C3' DC A 5 -2.230 2.226 5.713 1.00 0.23 C ATOM 135 O3' DC A 5 -3.457 1.556 5.368 1.00 0.23 O ATOM 136 C2' DC A 5 -1.314 2.235 4.526 1.00 0.22 C ATOM 137 C1' DC A 5 -1.433 3.628 3.929 1.00 0.23 C ATOM 138 N1 DC A 5 -0.185 4.079 3.237 1.00 0.24 N ATOM 139 C2 DC A 5 -0.323 5.073 2.269 1.00 0.23 C ATOM 140 O2 DC A 5 -1.433 5.530 2.000 1.00 0.23 O ATOM 141 N3 DC A 5 0.794 5.511 1.623 1.00 0.24 N ATOM 142 C4 DC A 5 1.999 5.001 1.904 1.00 0.25 C ATOM 143 N4 DC A 5 3.069 5.452 1.254 1.00 0.26 N ATOM 144 C5 DC A 5 2.155 3.983 2.889 1.00 0.26 C ATOM 145 C6 DC A 5 1.054 3.550 3.528 1.00 0.25 C ATOM 146 H5' DC A 5 -1.952 5.081 7.643 1.00 0.26 H ATOM 147 H5'' DC A 5 -2.265 3.418 8.183 1.00 0.23 H ATOM 148 H4' DC A 5 -3.472 3.941 6.091 1.00 0.24 H ATOM 149 H3' DC A 5 -1.745 1.712 6.550 1.00 0.22 H ATOM 150 H2' DC A 5 -0.306 2.048 4.859 1.00 0.22 H ATOM 151 H2'' DC A 5 -1.619 1.486 3.799 1.00 0.22 H ATOM 152 H1' DC A 5 -2.260 3.632 3.216 1.00 0.23 H ATOM 153 H41 DC A 5 2.969 6.173 0.554 1.00 0.89 H ATOM 154 H42 DC A 5 3.983 5.073 1.460 1.00 0.94 H ATOM 155 H5 DC A 5 3.136 3.567 3.118 1.00 0.27 H ATOM 156 H6 DC A 5 1.156 2.767 4.271 1.00 0.25 H ATOM 157 P DA A 6 -4.863 1.858 6.094 1.00 0.23 P ATOM 158 OP1 DA A 6 -4.607 2.630 7.331 1.00 1.36 O ATOM 159 OP2 DA A 6 -5.628 0.593 6.161 1.00 1.24 O ATOM 160 O5' DA A 6 -5.569 2.829 5.024 1.00 0.24 O ATOM 161 C5' DA A 6 -6.961 2.717 4.709 1.00 0.25 C ATOM 162 C4' DA A 6 -7.235 1.689 3.596 1.00 0.25 C ATOM 163 O4' DA A 6 -6.044 1.410 2.808 1.00 0.24 O ATOM 164 C3' DA A 6 -7.759 0.348 4.128 1.00 0.25 C ATOM 165 O3' DA A 6 -9.077 0.087 3.615 1.00 0.27 O ATOM 166 C2' DA A 6 -6.758 -0.682 3.660 1.00 0.24 C ATOM 167 C1' DA A 6 -5.961 -0.012 2.565 1.00 0.23 C ATOM 168 N9 DA A 6 -4.570 -0.504 2.574 1.00 0.21 N ATOM 169 C8 DA A 6 -3.724 -0.666 3.618 1.00 0.20 C ATOM 170 N7 DA A 6 -2.559 -1.165 3.370 1.00 0.19 N ATOM 171 C5 DA A 6 -2.627 -1.371 1.986 1.00 0.19 C ATOM 172 C6 DA A 6 -1.711 -1.895 1.059 1.00 0.18 C ATOM 173 N6 DA A 6 -0.444 -2.252 1.411 1.00 0.18 N ATOM 174 N1 DA A 6 -2.124 -1.960 -0.246 1.00 0.19 N ATOM 175 C2 DA A 6 -3.341 -1.533 -0.588 1.00 0.20 C ATOM 176 N3 DA A 6 -4.270 -1.023 0.214 1.00 0.21 N ATOM 177 C4 DA A 6 -3.849 -0.970 1.494 1.00 0.21 C ATOM 178 H5' DA A 6 -7.312 3.692 4.370 1.00 0.25 H ATOM 179 H5'' DA A 6 -7.512 2.445 5.608 1.00 0.26 H ATOM 180 H4' DA A 6 -7.990 2.106 2.929 1.00 0.27 H ATOM 181 H3' DA A 6 -7.777 0.360 5.220 1.00 0.25 H ATOM 182 H2' DA A 6 -6.098 -0.965 4.482 1.00 0.23 H ATOM 183 H2'' DA A 6 -7.264 -1.563 3.268 1.00 0.24 H ATOM 184 H1' DA A 6 -6.414 -0.234 1.601 1.00 0.24 H ATOM 185 H8 DA A 6 -4.033 -0.419 4.636 1.00 0.21 H ATOM 186 H61 DA A 6 0.170 -2.631 0.703 1.00 0.17 H ATOM 187 H2 DA A 6 -3.603 -1.612 -1.643 1.00 0.20 H ATOM 188 P DA A 7 -9.699 -1.402 3.583 1.00 0.29 P ATOM 189 OP1 DA A 7 -11.169 -1.288 3.444 1.00 1.14 O ATOM 190 OP2 DA A 7 -9.122 -2.176 4.705 1.00 1.47 O ATOM 191 O5' DA A 7 -9.107 -1.990 2.204 1.00 0.30 O ATOM 192 C5' DA A 7 -9.349 -1.307 0.970 1.00 0.31 C ATOM 193 C4' DA A 7 -8.786 -2.067 -0.228 1.00 0.31 C ATOM 194 O4' DA A 7 -7.345 -2.199 -0.137 1.00 0.29 O ATOM 195 C3' DA A 7 -9.379 -3.471 -0.321 1.00 0.33 C ATOM 196 O3' DA A 7 -10.002 -3.679 -1.596 1.00 0.36 O ATOM 197 C2' DA A 7 -8.211 -4.402 -0.121 1.00 0.31 C ATOM 198 C1' DA A 7 -6.977 -3.565 -0.407 1.00 0.29 C ATOM 199 N9 DA A 7 -5.834 -3.993 0.426 1.00 0.27 N ATOM 200 C8 DA A 7 -5.745 -4.153 1.770 1.00 0.26 C ATOM 201 N7 DA A 7 -4.617 -4.564 2.249 1.00 0.24 N ATOM 202 C5 DA A 7 -3.850 -4.697 1.087 1.00 0.23 C ATOM 203 C6 DA A 7 -2.530 -5.100 0.864 1.00 0.21 C ATOM 204 N6 DA A 7 -1.709 -5.484 1.841 1.00 0.20 N ATOM 205 N1 DA A 7 -2.093 -5.112 -0.406 1.00 0.21 N ATOM 206 C2 DA A 7 -2.903 -4.752 -1.403 1.00 0.23 C ATOM 207 N3 DA A 7 -4.166 -4.356 -1.306 1.00 0.24 N ATOM 208 C4 DA A 7 -4.582 -4.350 -0.024 1.00 0.25 C ATOM 209 H5' DA A 7 -8.886 -0.322 1.013 1.00 0.30 H ATOM 210 H5'' DA A 7 -10.424 -1.187 0.838 1.00 0.33 H ATOM 211 H4' DA A 7 -9.031 -1.521 -1.139 1.00 0.33 H ATOM 212 H3' DA A 7 -10.106 -3.618 0.481 1.00 0.34 H ATOM 213 H2' DA A 7 -8.193 -4.757 0.909 1.00 0.31 H ATOM 214 H2'' DA A 7 -8.272 -5.245 -0.809 1.00 0.33 H ATOM 215 H1' DA A 7 -6.710 -3.661 -1.461 1.00 0.29 H ATOM 216 H8 DA A 7 -6.594 -3.944 2.422 1.00 0.27 H ATOM 217 H61 DA A 7 -0.764 -5.766 1.624 1.00 0.19 H ATOM 218 H62 DA A 7 -2.032 -5.493 2.798 1.00 0.21 H ATOM 219 H2 DA A 7 -2.480 -4.787 -2.407 1.00 0.22 H ATOM 220 P DG A 8 -10.743 -5.068 -1.946 1.00 0.39 P ATOM 221 OP1 DG A 8 -11.980 -4.754 -2.697 1.00 1.62 O ATOM 222 OP2 DG A 8 -10.818 -5.885 -0.713 1.00 0.99 O ATOM 223 O5' DG A 8 -9.704 -5.772 -2.955 1.00 0.37 O ATOM 224 C5' DG A 8 -9.496 -5.239 -4.266 1.00 0.38 C ATOM 225 C4' DG A 8 -8.463 -6.044 -5.050 1.00 0.34 C ATOM 226 O4' DG A 8 -7.173 -6.023 -4.387 1.00 0.31 O ATOM 227 C3' DG A 8 -8.887 -7.503 -5.183 1.00 0.31 C ATOM 228 O3' DG A 8 -8.780 -7.932 -6.552 1.00 0.30 O ATOM 229 C2' DG A 8 -7.947 -8.254 -4.277 1.00 0.27 C ATOM 230 C1' DG A 8 -6.720 -7.378 -4.177 1.00 0.27 C ATOM 231 N9 DG A 8 -6.061 -7.521 -2.864 1.00 0.26 N ATOM 232 C8 DG A 8 -6.591 -7.468 -1.616 1.00 0.27 C ATOM 233 N7 DG A 8 -5.787 -7.614 -0.617 1.00 0.26 N ATOM 234 C5 DG A 8 -4.560 -7.788 -1.262 1.00 0.24 C ATOM 235 C6 DG A 8 -3.268 -7.998 -0.715 1.00 0.22 C ATOM 236 O6 DG A 8 -2.941 -8.072 0.468 1.00 0.22 O ATOM 237 N1 DG A 8 -2.308 -8.125 -1.709 1.00 0.21 N ATOM 238 C2 DG A 8 -2.554 -8.058 -3.067 1.00 0.21 C ATOM 239 N2 DG A 8 -1.500 -8.211 -3.868 1.00 0.20 N ATOM 240 N3 DG A 8 -3.766 -7.859 -3.590 1.00 0.23 N ATOM 241 C4 DG A 8 -4.719 -7.733 -2.639 1.00 0.24 C ATOM 242 H5' DG A 8 -9.150 -4.208 -4.179 1.00 0.39 H ATOM 243 H5'' DG A 8 -10.441 -5.251 -4.809 1.00 0.41 H ATOM 244 H4' DG A 8 -8.355 -5.613 -6.045 1.00 0.35 H ATOM 245 H3' DG A 8 -9.911 -7.623 -4.829 1.00 0.33 H ATOM 246 H2' DG A 8 -8.400 -8.380 -3.294 1.00 0.29 H ATOM 247 H2'' DG A 8 -7.687 -9.222 -4.700 1.00 0.24 H ATOM 248 H1' DG A 8 -6.023 -7.653 -4.968 1.00 0.25 H ATOM 249 H8 DG A 8 -7.659 -7.315 -1.464 1.00 0.28 H ATOM 250 H1 DG A 8 -1.363 -8.278 -1.390 1.00 0.19 H ATOM 251 H21 DG A 8 -0.583 -8.362 -3.472 1.00 0.88 H ATOM 252 H22 DG A 8 -1.619 -8.178 -4.871 1.00 0.91 H ATOM 253 P DA A 9 -8.701 -9.492 -6.947 1.00 0.25 P ATOM 254 OP1 DA A 9 -9.018 -9.623 -8.387 1.00 1.51 O ATOM 255 OP2 DA A 9 -9.473 -10.268 -5.949 1.00 1.07 O ATOM 256 O5' DA A 9 -7.137 -9.818 -6.740 1.00 0.20 O ATOM 257 C5' DA A 9 -6.157 -9.263 -7.624 1.00 0.21 C ATOM 258 C4' DA A 9 -4.842 -10.036 -7.560 1.00 0.16 C ATOM 259 O4' DA A 9 -4.189 -9.850 -6.283 1.00 0.16 O ATOM 260 C3' DA A 9 -5.091 -11.524 -7.747 1.00 0.08 C ATOM 261 O3' DA A 9 -4.296 -12.037 -8.829 1.00 0.10 O ATOM 262 C2' DA A 9 -4.733 -12.149 -6.424 1.00 0.05 C ATOM 263 C1' DA A 9 -3.875 -11.135 -5.709 1.00 0.09 C ATOM 264 N9 DA A 9 -4.167 -11.137 -4.266 1.00 0.13 N ATOM 265 C8 DA A 9 -5.364 -11.077 -3.637 1.00 0.18 C ATOM 266 N7 DA A 9 -5.361 -11.078 -2.346 1.00 0.22 N ATOM 267 C5 DA A 9 -3.991 -11.147 -2.070 1.00 0.20 C ATOM 268 C6 DA A 9 -3.265 -11.183 -0.874 1.00 0.23 C ATOM 269 N6 DA A 9 -3.840 -11.152 0.329 1.00 0.29 N ATOM 270 N1 DA A 9 -1.925 -11.250 -0.965 1.00 0.19 N ATOM 271 C2 DA A 9 -1.330 -11.280 -2.159 1.00 0.13 C ATOM 272 N3 DA A 9 -1.917 -11.251 -3.350 1.00 0.11 N ATOM 273 C4 DA A 9 -3.258 -11.184 -3.234 1.00 0.14 C ATOM 274 H5' DA A 9 -5.973 -8.224 -7.350 1.00 0.26 H ATOM 275 H5'' DA A 9 -6.539 -9.299 -8.645 1.00 0.21 H ATOM 276 H4' DA A 9 -4.184 -9.686 -8.352 1.00 0.19 H ATOM 277 H3' DA A 9 -6.149 -11.686 -7.943 1.00 0.08 H ATOM 278 H2' DA A 9 -5.639 -12.347 -5.853 1.00 0.09 H ATOM 279 H2'' DA A 9 -4.172 -13.069 -6.571 1.00 0.02 H ATOM 280 H1' DA A 9 -2.825 -11.373 -5.873 1.00 0.08 H ATOM 281 H8 DA A 9 -6.296 -11.033 -4.206 1.00 0.18 H ATOM 282 H61 DA A 9 -3.270 -11.181 1.162 1.00 0.31 H ATOM 283 H62 DA A 9 -4.846 -11.099 0.406 1.00 0.32 H ATOM 284 H2 DA A 9 -0.241 -11.335 -2.157 1.00 0.11 H ATOM 285 P DA A 10 -3.995 -13.613 -8.985 1.00 0.11 P ATOM 286 OP1 DA A 10 -3.476 -13.853 -10.350 1.00 1.21 O ATOM 287 OP2 DA A 10 -5.175 -14.365 -8.501 1.00 1.36 O ATOM 288 O5' DA A 10 -2.790 -13.834 -7.939 1.00 0.12 O ATOM 289 C5' DA A 10 -1.513 -13.224 -8.160 1.00 0.18 C ATOM 290 C4' DA A 10 -0.446 -13.812 -7.241 1.00 0.19 C ATOM 291 O4' DA A 10 -0.712 -13.480 -5.856 1.00 0.11 O ATOM 292 C3' DA A 10 -0.418 -15.331 -7.361 1.00 0.25 C ATOM 293 O3' DA A 10 0.895 -15.806 -7.689 1.00 0.33 O ATOM 294 C2' DA A 10 -0.861 -15.838 -6.017 1.00 0.22 C ATOM 295 C1' DA A 10 -0.681 -14.680 -5.059 1.00 0.14 C ATOM 296 N9 DA A 10 -1.750 -14.664 -4.045 1.00 0.13 N ATOM 297 C8 DA A 10 -3.091 -14.708 -4.213 1.00 0.15 C ATOM 298 N7 DA A 10 -3.829 -14.635 -3.155 1.00 0.21 N ATOM 299 C5 DA A 10 -2.865 -14.534 -2.147 1.00 0.21 C ATOM 300 C6 DA A 10 -2.956 -14.421 -0.756 1.00 0.27 C ATOM 301 N6 DA A 10 -4.117 -14.388 -0.100 1.00 0.35 N ATOM 302 N1 DA A 10 -1.806 -14.344 -0.065 1.00 0.26 N ATOM 303 C2 DA A 10 -0.633 -14.379 -0.702 1.00 0.19 C ATOM 304 N3 DA A 10 -0.432 -14.481 -2.011 1.00 0.13 N ATOM 305 C4 DA A 10 -1.597 -14.554 -2.682 1.00 0.15 C ATOM 306 H5' DA A 10 -1.592 -12.153 -7.975 1.00 0.17 H ATOM 307 H5'' DA A 10 -1.217 -13.386 -9.197 1.00 0.24 H ATOM 308 H4' DA A 10 0.528 -13.413 -7.522 1.00 0.24 H ATOM 309 H3' DA A 10 -1.135 -15.646 -8.122 1.00 0.27 H ATOM 310 H2' DA A 10 -1.909 -16.134 -6.058 1.00 0.23 H ATOM 311 H2'' DA A 10 -0.245 -16.676 -5.708 1.00 0.28 H ATOM 312 H1' DA A 10 0.286 -14.764 -4.566 1.00 0.15 H ATOM 313 H8 DA A 10 -3.526 -14.820 -5.203 1.00 0.15 H ATOM 314 H61 DA A 10 -4.128 -14.306 0.906 1.00 1.05 H ATOM 315 H62 DA A 10 -4.987 -14.444 -0.611 1.00 0.85 H ATOM 316 H2 DA A 10 0.259 -14.318 -0.079 1.00 0.18 H ATOM 317 P DG A 11 1.092 -17.179 -8.512 1.00 0.44 P ATOM 318 OP1 DG A 11 2.047 -16.923 -9.614 1.00 0.97 O ATOM 319 OP2 DG A 11 -0.245 -17.740 -8.814 1.00 1.66 O ATOM 320 O5' DG A 11 1.808 -18.143 -7.437 1.00 0.46 O ATOM 321 C5' DG A 11 3.216 -18.046 -7.193 1.00 0.48 C ATOM 322 C4' DG A 11 3.664 -18.992 -6.081 1.00 0.50 C ATOM 323 O4' DG A 11 3.013 -18.641 -4.838 1.00 0.42 O ATOM 324 C3' DG A 11 3.286 -20.432 -6.407 1.00 0.59 C ATOM 325 O3' DG A 11 4.358 -21.326 -6.093 1.00 0.66 O ATOM 326 C2' DG A 11 2.088 -20.706 -5.547 1.00 0.57 C ATOM 327 C1' DG A 11 2.216 -19.753 -4.375 1.00 0.48 C ATOM 328 N9 DG A 11 0.891 -19.273 -3.951 1.00 0.43 N ATOM 329 C8 DG A 11 -0.133 -18.822 -4.712 1.00 0.40 C ATOM 330 N7 DG A 11 -1.193 -18.409 -4.106 1.00 0.37 N ATOM 331 C5 DG A 11 -0.847 -18.604 -2.766 1.00 0.39 C ATOM 332 C6 DG A 11 -1.595 -18.341 -1.590 1.00 0.42 C ATOM 333 O6 DG A 11 -2.723 -17.866 -1.495 1.00 0.43 O ATOM 334 N1 DG A 11 -0.884 -18.682 -0.447 1.00 0.46 N ATOM 335 C2 DG A 11 0.392 -19.210 -0.431 1.00 0.47 C ATOM 336 N2 DG A 11 0.908 -19.473 0.771 1.00 0.51 N ATOM 337 N3 DG A 11 1.105 -19.460 -1.534 1.00 0.45 N ATOM 338 C4 DG A 11 0.430 -19.136 -2.662 1.00 0.42 C ATOM 339 H5' DG A 11 3.451 -17.024 -6.901 1.00 0.42 H ATOM 340 H5'' DG A 11 3.755 -18.290 -8.109 1.00 0.55 H ATOM 341 H4' DG A 11 4.743 -18.919 -5.954 1.00 0.51 H ATOM 342 H3' DG A 11 3.013 -20.517 -7.461 1.00 0.63 H ATOM 343 HO3' DG A 11 4.551 -21.222 -5.158 1.00 0.65 H ATOM 344 H2' DG A 11 1.174 -20.501 -6.104 1.00 0.55 H ATOM 345 H2'' DG A 11 2.094 -21.739 -5.199 1.00 0.63 H ATOM 346 H1' DG A 11 2.715 -20.249 -3.544 1.00 0.50 H ATOM 347 H8 DG A 11 -0.057 -18.804 -5.801 1.00 0.42 H ATOM 348 H1 DG A 11 -1.361 -18.526 0.429 1.00 0.50 H ATOM 349 H21 DG A 11 0.369 -19.287 1.604 1.00 0.55 H ATOM 350 H22 DG A 11 1.838 -19.861 0.847 1.00 0.52 H TER 351 DG A 11 ATOM 352 O5' DC B 12 -5.743 -18.904 6.917 1.00 0.87 O ATOM 353 C5' DC B 12 -5.095 -19.983 7.595 1.00 0.90 C ATOM 354 C4' DC B 12 -3.605 -20.042 7.262 1.00 0.83 C ATOM 355 O4' DC B 12 -3.408 -20.266 5.846 1.00 0.77 O ATOM 356 C3' DC B 12 -2.910 -18.735 7.628 1.00 0.78 C ATOM 357 O3' DC B 12 -1.806 -18.962 8.513 1.00 0.79 O ATOM 358 C2' DC B 12 -2.456 -18.152 6.324 1.00 0.70 C ATOM 359 C1' DC B 12 -2.524 -19.259 5.309 1.00 0.69 C ATOM 360 N1 DC B 12 -3.064 -18.737 4.037 1.00 0.64 N ATOM 361 C2 DC B 12 -2.235 -18.723 2.923 1.00 0.61 C ATOM 362 O2 DC B 12 -1.079 -19.136 2.999 1.00 0.61 O ATOM 363 N3 DC B 12 -2.738 -18.237 1.755 1.00 0.57 N ATOM 364 C4 DC B 12 -3.998 -17.784 1.681 1.00 0.56 C ATOM 365 N4 DC B 12 -4.459 -17.319 0.520 1.00 0.52 N ATOM 366 C5 DC B 12 -4.853 -17.796 2.826 1.00 0.60 C ATOM 367 C6 DC B 12 -4.349 -18.278 3.975 1.00 0.64 C ATOM 368 H5' DC B 12 -5.562 -20.922 7.296 1.00 0.93 H ATOM 369 H5'' DC B 12 -5.218 -19.853 8.671 1.00 0.93 H ATOM 370 H4' DC B 12 -3.146 -20.858 7.818 1.00 0.87 H ATOM 371 H3' DC B 12 -3.627 -18.050 8.088 1.00 0.81 H ATOM 372 H2' DC B 12 -3.115 -17.344 6.031 1.00 0.69 H ATOM 373 H2'' DC B 12 -1.433 -17.798 6.411 1.00 0.65 H ATOM 374 H1' DC B 12 -1.529 -19.663 5.151 1.00 0.67 H ATOM 375 H41 DC B 12 -3.860 -17.308 -0.293 1.00 0.49 H ATOM 376 H42 DC B 12 -5.408 -16.978 0.454 1.00 0.52 H ATOM 377 H5 DC B 12 -5.877 -17.428 2.769 1.00 0.60 H ATOM 378 H6 DC B 12 -4.970 -18.298 4.873 1.00 0.67 H ATOM 379 HO5' DC B 12 -6.646 -18.864 7.241 1.00 1.45 H ATOM 380 P DT B 13 -1.090 -17.730 9.266 1.00 0.76 P ATOM 381 OP1 DT B 13 -0.279 -18.276 10.377 1.00 1.87 O ATOM 382 OP2 DT B 13 -2.111 -16.694 9.538 1.00 1.01 O ATOM 383 O5' DT B 13 -0.088 -17.166 8.138 1.00 0.67 O ATOM 384 C5' DT B 13 1.090 -17.896 7.785 1.00 0.63 C ATOM 385 C4' DT B 13 1.863 -17.216 6.658 1.00 0.54 C ATOM 386 O4' DT B 13 1.063 -17.140 5.456 1.00 0.51 O ATOM 387 C3' DT B 13 2.264 -15.796 7.045 1.00 0.50 C ATOM 388 O3' DT B 13 3.687 -15.620 6.940 1.00 0.44 O ATOM 389 C2' DT B 13 1.512 -14.903 6.097 1.00 0.47 C ATOM 390 C1' DT B 13 1.074 -15.790 4.954 1.00 0.45 C ATOM 391 N1 DT B 13 -0.269 -15.406 4.485 1.00 0.47 N ATOM 392 C2 DT B 13 -0.445 -15.162 3.137 1.00 0.40 C ATOM 393 O2 DT B 13 0.478 -15.236 2.328 1.00 0.33 O ATOM 394 N3 DT B 13 -1.726 -14.824 2.748 1.00 0.42 N ATOM 395 C4 DT B 13 -2.830 -14.711 3.577 1.00 0.50 C ATOM 396 O4 DT B 13 -3.928 -14.411 3.113 1.00 0.52 O ATOM 397 C5 DT B 13 -2.547 -14.978 4.973 1.00 0.57 C ATOM 398 C7 DT B 13 -3.663 -14.844 6.014 1.00 0.67 C ATOM 399 C6 DT B 13 -1.302 -15.313 5.372 1.00 0.55 C ATOM 400 H5' DT B 13 0.804 -18.898 7.464 1.00 0.66 H ATOM 401 H5'' DT B 13 1.735 -17.975 8.661 1.00 0.65 H ATOM 402 H4' DT B 13 2.759 -17.791 6.446 1.00 0.52 H ATOM 403 H3' DT B 13 1.933 -15.591 8.061 1.00 0.56 H ATOM 404 H2' DT B 13 0.644 -14.481 6.598 1.00 0.52 H ATOM 405 H2'' DT B 13 2.154 -14.107 5.729 1.00 0.42 H ATOM 406 H1' DT B 13 1.787 -15.707 4.139 1.00 0.39 H ATOM 407 H3 DT B 13 -1.868 -14.640 1.766 1.00 0.37 H ATOM 408 H71 DT B 13 -4.631 -14.843 5.514 1.00 0.75 H ATOM 409 H72 DT B 13 -3.537 -13.911 6.563 1.00 0.66 H ATOM 410 H73 DT B 13 -3.617 -15.680 6.712 1.00 0.68 H ATOM 411 H6 DT B 13 -1.108 -15.518 6.426 1.00 0.60 H ATOM 412 P DT B 14 4.355 -14.152 6.877 1.00 0.39 P ATOM 413 OP1 DT B 14 5.773 -14.270 7.285 1.00 1.50 O ATOM 414 OP2 DT B 14 3.463 -13.200 7.577 1.00 1.17 O ATOM 415 O5' DT B 14 4.308 -13.823 5.301 1.00 0.31 O ATOM 416 C5' DT B 14 5.012 -14.654 4.372 1.00 0.26 C ATOM 417 C4' DT B 14 4.984 -14.083 2.957 1.00 0.19 C ATOM 418 O4' DT B 14 3.636 -14.061 2.421 1.00 0.21 O ATOM 419 C3' DT B 14 5.517 -12.653 2.927 1.00 0.16 C ATOM 420 O3' DT B 14 6.556 -12.517 1.945 1.00 0.10 O ATOM 421 C2' DT B 14 4.315 -11.809 2.588 1.00 0.19 C ATOM 422 C1' DT B 14 3.360 -12.749 1.890 1.00 0.19 C ATOM 423 N1 DT B 14 1.951 -12.363 2.113 1.00 0.23 N ATOM 424 C2 DT B 14 1.173 -12.096 1.000 1.00 0.19 C ATOM 425 O2 DT B 14 1.620 -12.150 -0.144 1.00 0.12 O ATOM 426 N3 DT B 14 -0.143 -11.759 1.249 1.00 0.24 N ATOM 427 C4 DT B 14 -0.740 -11.665 2.492 1.00 0.33 C ATOM 428 O4 DT B 14 -1.926 -11.359 2.593 1.00 0.36 O ATOM 429 C5 DT B 14 0.151 -11.958 3.594 1.00 0.37 C ATOM 430 C7 DT B 14 -0.375 -11.893 5.026 1.00 0.47 C ATOM 431 C6 DT B 14 1.440 -12.290 3.374 1.00 0.32 C ATOM 432 H5' DT B 14 4.555 -15.643 4.364 1.00 0.30 H ATOM 433 H5'' DT B 14 6.049 -14.745 4.695 1.00 0.24 H ATOM 434 H4' DT B 14 5.605 -14.706 2.314 1.00 0.17 H ATOM 435 H3' DT B 14 5.893 -12.378 3.915 1.00 0.19 H ATOM 436 H2' DT B 14 3.864 -11.421 3.501 1.00 0.23 H ATOM 437 H2'' DT B 14 4.593 -10.991 1.928 1.00 0.17 H ATOM 438 H1' DT B 14 3.570 -12.742 0.826 1.00 0.15 H ATOM 439 H3 DT B 14 -0.725 -11.565 0.447 1.00 0.21 H ATOM 440 H71 DT B 14 -1.431 -11.622 5.014 1.00 0.69 H ATOM 441 H72 DT B 14 0.187 -11.145 5.586 1.00 0.86 H ATOM 442 H73 DT B 14 -0.256 -12.867 5.501 1.00 1.38 H ATOM 443 H6 DT B 14 2.091 -12.500 4.217 1.00 0.35 H ATOM 444 P DC B 15 7.080 -11.067 1.472 1.00 0.10 P ATOM 445 OP1 DC B 15 8.424 -11.233 0.876 1.00 1.21 O ATOM 446 OP2 DC B 15 6.879 -10.110 2.582 1.00 1.35 O ATOM 447 O5' DC B 15 6.047 -10.696 0.293 1.00 0.10 O ATOM 448 C5' DC B 15 6.042 -11.447 -0.925 1.00 0.08 C ATOM 449 C4' DC B 15 5.290 -10.723 -2.037 1.00 0.09 C ATOM 450 O4' DC B 15 3.865 -10.693 -1.772 1.00 0.10 O ATOM 451 C3' DC B 15 5.768 -9.280 -2.163 1.00 0.11 C ATOM 452 O3' DC B 15 6.102 -8.953 -3.518 1.00 0.12 O ATOM 453 C2' DC B 15 4.617 -8.459 -1.669 1.00 0.14 C ATOM 454 C1' DC B 15 3.396 -9.332 -1.842 1.00 0.13 C ATOM 455 N1 DC B 15 2.395 -9.059 -0.789 1.00 0.16 N ATOM 456 C2 DC B 15 1.090 -8.814 -1.187 1.00 0.16 C ATOM 457 O2 DC B 15 0.793 -8.812 -2.380 1.00 0.15 O ATOM 458 N3 DC B 15 0.158 -8.570 -0.227 1.00 0.19 N ATOM 459 C4 DC B 15 0.489 -8.566 1.069 1.00 0.21 C ATOM 460 N4 DC B 15 -0.454 -8.324 1.980 1.00 0.24 N ATOM 461 C5 DC B 15 1.834 -8.816 1.486 1.00 0.20 C ATOM 462 C6 DC B 15 2.750 -9.056 0.529 1.00 0.18 C ATOM 463 H5' DC B 15 5.566 -12.409 -0.746 1.00 0.07 H ATOM 464 H5'' DC B 15 7.072 -11.612 -1.243 1.00 0.07 H ATOM 465 H4' DC B 15 5.464 -11.241 -2.978 1.00 0.07 H ATOM 466 H3' DC B 15 6.629 -9.120 -1.510 1.00 0.12 H ATOM 467 H2' DC B 15 4.764 -8.228 -0.616 1.00 0.15 H ATOM 468 H2'' DC B 15 4.518 -7.543 -2.250 1.00 0.16 H ATOM 469 H1' DC B 15 2.954 -9.149 -2.822 1.00 0.13 H ATOM 470 H41 DC B 15 -1.404 -8.147 1.685 1.00 0.89 H ATOM 471 H42 DC B 15 -0.219 -8.317 2.962 1.00 0.93 H ATOM 472 H5 DC B 15 2.108 -8.812 2.542 1.00 0.22 H ATOM 473 H6 DC B 15 3.789 -9.239 0.805 1.00 0.17 H ATOM 474 P DT B 16 6.797 -7.542 -3.880 1.00 0.13 P ATOM 475 OP1 DT B 16 7.700 -7.753 -5.034 1.00 1.18 O ATOM 476 OP2 DT B 16 7.326 -6.948 -2.631 1.00 1.39 O ATOM 477 O5' DT B 16 5.549 -6.648 -4.371 1.00 0.15 O ATOM 478 C5' DT B 16 5.033 -6.790 -5.698 1.00 0.16 C ATOM 479 C4' DT B 16 3.892 -5.813 -5.973 1.00 0.17 C ATOM 480 O4' DT B 16 2.790 -6.039 -5.066 1.00 0.17 O ATOM 481 C3' DT B 16 4.352 -4.370 -5.810 1.00 0.18 C ATOM 482 O3' DT B 16 4.106 -3.618 -7.006 1.00 0.19 O ATOM 483 C2' DT B 16 3.557 -3.824 -4.652 1.00 0.18 C ATOM 484 C1' DT B 16 2.409 -4.798 -4.440 1.00 0.18 C ATOM 485 N1 DT B 16 2.130 -5.003 -3.003 1.00 0.17 N ATOM 486 C2 DT B 16 0.810 -4.950 -2.591 1.00 0.18 C ATOM 487 O2 DT B 16 -0.115 -4.731 -3.371 1.00 0.20 O ATOM 488 N3 DT B 16 0.588 -5.152 -1.244 1.00 0.18 N ATOM 489 C4 DT B 16 1.552 -5.397 -0.285 1.00 0.17 C ATOM 490 O4 DT B 16 1.234 -5.557 0.891 1.00 0.18 O ATOM 491 C5 DT B 16 2.902 -5.433 -0.805 1.00 0.16 C ATOM 492 C7 DT B 16 4.073 -5.659 0.147 1.00 0.15 C ATOM 493 C6 DT B 16 3.144 -5.242 -2.118 1.00 0.16 C ATOM 494 H5' DT B 16 4.667 -7.808 -5.830 1.00 0.16 H ATOM 495 H5'' DT B 16 5.837 -6.607 -6.412 1.00 0.16 H ATOM 496 H4' DT B 16 3.544 -5.955 -6.991 1.00 0.18 H ATOM 497 H3' DT B 16 5.415 -4.351 -5.567 1.00 0.17 H ATOM 498 H2' DT B 16 4.185 -3.778 -3.765 1.00 0.18 H ATOM 499 H2'' DT B 16 3.171 -2.835 -4.887 1.00 0.19 H ATOM 500 H1' DT B 16 1.516 -4.409 -4.928 1.00 0.20 H ATOM 501 H3 DT B 16 -0.371 -5.116 -0.930 1.00 0.19 H ATOM 502 H71 DT B 16 4.544 -4.703 0.375 1.00 0.41 H ATOM 503 H72 DT B 16 4.802 -6.317 -0.322 1.00 0.62 H ATOM 504 H73 DT B 16 3.710 -6.114 1.069 1.00 0.63 H ATOM 505 H6 DT B 16 4.168 -5.291 -2.487 1.00 0.15 H ATOM 506 P DT B 17 4.948 -2.281 -7.328 1.00 0.19 P ATOM 507 OP1 DT B 17 5.071 -2.155 -8.798 1.00 1.17 O ATOM 508 OP2 DT B 17 6.165 -2.283 -6.485 1.00 1.40 O ATOM 509 O5' DT B 17 3.974 -1.112 -6.799 1.00 0.20 O ATOM 510 C5' DT B 17 3.031 -0.489 -7.679 1.00 0.21 C ATOM 511 C4' DT B 17 2.349 0.702 -7.017 1.00 0.23 C ATOM 512 O4' DT B 17 1.572 0.265 -5.879 1.00 0.22 O ATOM 513 C3' DT B 17 3.375 1.716 -6.525 1.00 0.23 C ATOM 514 O3' DT B 17 3.029 3.042 -6.944 1.00 0.24 O ATOM 515 C2' DT B 17 3.328 1.611 -5.031 1.00 0.23 C ATOM 516 C1' DT B 17 1.974 0.994 -4.706 1.00 0.22 C ATOM 517 N1 DT B 17 1.994 0.075 -3.533 1.00 0.21 N ATOM 518 C2 DT B 17 0.762 -0.289 -3.007 1.00 0.21 C ATOM 519 O2 DT B 17 -0.295 0.180 -3.425 1.00 0.21 O ATOM 520 N3 DT B 17 0.786 -1.209 -1.976 1.00 0.19 N ATOM 521 C4 DT B 17 1.913 -1.789 -1.429 1.00 0.19 C ATOM 522 O4 DT B 17 1.814 -2.606 -0.518 1.00 0.18 O ATOM 523 C5 DT B 17 3.151 -1.348 -2.030 1.00 0.20 C ATOM 524 C7 DT B 17 4.476 -1.912 -1.528 1.00 0.19 C ATOM 525 C6 DT B 17 3.159 -0.452 -3.034 1.00 0.20 C ATOM 526 H5' DT B 17 2.272 -1.217 -7.959 1.00 0.22 H ATOM 527 H5'' DT B 17 3.548 -0.153 -8.576 1.00 0.22 H ATOM 528 H4' DT B 17 1.690 1.183 -7.731 1.00 0.24 H ATOM 529 H3' DT B 17 4.372 1.451 -6.885 1.00 0.23 H ATOM 530 H2' DT B 17 4.135 0.987 -4.678 1.00 0.22 H ATOM 531 H2'' DT B 17 3.407 2.594 -4.601 1.00 0.23 H ATOM 532 H1' DT B 17 1.262 1.795 -4.518 1.00 0.23 H ATOM 533 H3 DT B 17 -0.105 -1.479 -1.583 1.00 0.19 H ATOM 534 H71 DT B 17 5.102 -1.097 -1.165 1.00 0.20 H ATOM 535 H72 DT B 17 4.985 -2.423 -2.345 1.00 0.19 H ATOM 536 H73 DT B 17 4.289 -2.616 -0.718 1.00 0.19 H ATOM 537 H6 DT B 17 4.112 -0.132 -3.440 1.00 0.21 H ATOM 538 P DG B 18 3.456 3.596 -8.396 1.00 0.26 P ATOM 539 OP1 DG B 18 3.454 2.462 -9.348 1.00 1.11 O ATOM 540 OP2 DG B 18 4.672 4.423 -8.235 1.00 1.48 O ATOM 541 O5' DG B 18 2.229 4.572 -8.770 1.00 0.23 O ATOM 542 C5' DG B 18 0.948 4.033 -9.115 1.00 0.21 C ATOM 543 C4' DG B 18 -0.188 4.757 -8.391 1.00 0.19 C ATOM 544 O4' DG B 18 -0.037 4.647 -6.951 1.00 0.19 O ATOM 545 C3' DG B 18 -0.216 6.244 -8.739 1.00 0.19 C ATOM 546 O3' DG B 18 -1.545 6.649 -9.102 1.00 0.18 O ATOM 547 C2' DG B 18 0.253 6.932 -7.484 1.00 0.19 C ATOM 548 C1' DG B 18 -0.060 5.966 -6.362 1.00 0.18 C ATOM 549 N9 DG B 18 0.933 6.088 -5.278 1.00 0.19 N ATOM 550 C8 DG B 18 2.277 6.221 -5.362 1.00 0.21 C ATOM 551 N7 DG B 18 2.940 6.332 -4.262 1.00 0.22 N ATOM 552 C5 DG B 18 1.921 6.266 -3.309 1.00 0.21 C ATOM 553 C6 DG B 18 2.001 6.331 -1.895 1.00 0.21 C ATOM 554 O6 DG B 18 3.001 6.457 -1.196 1.00 0.22 O ATOM 555 N1 DG B 18 0.748 6.225 -1.306 1.00 0.19 N ATOM 556 C2 DG B 18 -0.442 6.077 -1.990 1.00 0.18 C ATOM 557 N2 DG B 18 -1.543 5.993 -1.242 1.00 0.17 N ATOM 558 N3 DG B 18 -0.528 6.016 -3.325 1.00 0.18 N ATOM 559 C4 DG B 18 0.686 6.116 -3.920 1.00 0.19 C ATOM 560 H5' DG B 18 0.922 2.977 -8.844 1.00 0.22 H ATOM 561 H5'' DG B 18 0.803 4.124 -10.192 1.00 0.22 H ATOM 562 H4' DG B 18 -1.136 4.307 -8.681 1.00 0.17 H ATOM 563 H3' DG B 18 0.476 6.453 -9.559 1.00 0.20 H ATOM 564 H2' DG B 18 1.331 7.111 -7.533 1.00 0.20 H ATOM 565 H2'' DG B 18 -0.279 7.870 -7.335 1.00 0.18 H ATOM 566 H1' DG B 18 -1.055 6.173 -5.970 1.00 0.17 H ATOM 567 H8 DG B 18 2.779 6.236 -6.327 1.00 0.22 H ATOM 568 H1 DG B 18 0.730 6.252 -0.297 1.00 0.20 H ATOM 569 H21 DG B 18 -1.474 6.039 -0.235 1.00 0.78 H ATOM 570 H22 DG B 18 -2.446 5.886 -1.682 1.00 0.98 H ATOM 571 P DT B 19 -1.925 8.202 -9.314 1.00 0.16 P ATOM 572 OP1 DT B 19 -2.858 8.298 -10.459 1.00 1.43 O ATOM 573 OP2 DT B 19 -0.677 9.000 -9.310 1.00 1.13 O ATOM 574 O5' DT B 19 -2.742 8.537 -7.969 1.00 0.16 O ATOM 575 C5' DT B 19 -3.903 7.774 -7.625 1.00 0.17 C ATOM 576 C4' DT B 19 -4.409 8.114 -6.227 1.00 0.18 C ATOM 577 O4' DT B 19 -3.404 7.812 -5.227 1.00 0.18 O ATOM 578 C3' DT B 19 -4.751 9.597 -6.116 1.00 0.18 C ATOM 579 O3' DT B 19 -6.097 9.778 -5.655 1.00 0.20 O ATOM 580 C2' DT B 19 -3.755 10.151 -5.131 1.00 0.18 C ATOM 581 C1' DT B 19 -3.225 8.955 -4.370 1.00 0.18 C ATOM 582 N1 DT B 19 -1.804 9.142 -4.016 1.00 0.17 N ATOM 583 C2 DT B 19 -1.450 9.043 -2.682 1.00 0.17 C ATOM 584 O2 DT B 19 -2.272 8.811 -1.797 1.00 0.18 O ATOM 585 N3 DT B 19 -0.111 9.227 -2.397 1.00 0.17 N ATOM 586 C4 DT B 19 0.888 9.497 -3.314 1.00 0.17 C ATOM 587 O4 DT B 19 2.051 9.641 -2.945 1.00 0.17 O ATOM 588 C5 DT B 19 0.422 9.584 -4.682 1.00 0.17 C ATOM 589 C7 DT B 19 1.415 9.892 -5.800 1.00 0.17 C ATOM 590 C6 DT B 19 -0.879 9.407 -4.982 1.00 0.17 C ATOM 591 H5' DT B 19 -3.654 6.714 -7.663 1.00 0.17 H ATOM 592 H5'' DT B 19 -4.692 7.982 -8.348 1.00 0.17 H ATOM 593 H4' DT B 19 -5.302 7.527 -6.018 1.00 0.19 H ATOM 594 H3' DT B 19 -4.620 10.078 -7.090 1.00 0.18 H ATOM 595 H2' DT B 19 -2.942 10.655 -5.656 1.00 0.18 H ATOM 596 H2'' DT B 19 -4.240 10.839 -4.450 1.00 0.18 H ATOM 597 H1' DT B 19 -3.808 8.820 -3.464 1.00 0.19 H ATOM 598 H3 DT B 19 0.165 9.157 -1.429 1.00 0.17 H ATOM 599 H71 DT B 19 1.100 10.795 -6.326 1.00 1.03 H ATOM 600 H72 DT B 19 1.445 9.057 -6.499 1.00 0.97 H ATOM 601 H73 DT B 19 2.406 10.047 -5.374 1.00 0.75 H ATOM 602 H6 DT B 19 -1.207 9.482 -6.017 1.00 0.17 H ATOM 603 P DC B 20 -6.662 11.248 -5.302 1.00 0.23 P ATOM 604 OP1 DC B 20 -8.141 11.196 -5.339 1.00 1.10 O ATOM 605 OP2 DC B 20 -5.937 12.238 -6.130 1.00 1.48 O ATOM 606 O5' DC B 20 -6.200 11.438 -3.770 1.00 0.31 O ATOM 607 C5' DC B 20 -6.802 10.657 -2.733 1.00 0.40 C ATOM 608 C4' DC B 20 -6.295 11.052 -1.348 1.00 0.47 C ATOM 609 O4' DC B 20 -4.877 10.783 -1.208 1.00 0.42 O ATOM 610 C3' DC B 20 -6.516 12.538 -1.081 1.00 0.51 C ATOM 611 O3' DC B 20 -7.311 12.738 0.096 1.00 0.61 O ATOM 612 C2' DC B 20 -5.138 13.117 -0.916 1.00 0.47 C ATOM 613 C1' DC B 20 -4.223 11.941 -0.652 1.00 0.43 C ATOM 614 N1 DC B 20 -2.894 12.149 -1.265 1.00 0.34 N ATOM 615 C2 DC B 20 -1.777 12.031 -0.447 1.00 0.31 C ATOM 616 O2 DC B 20 -1.906 11.792 0.752 1.00 0.36 O ATOM 617 N3 DC B 20 -0.548 12.197 -1.007 1.00 0.22 N ATOM 618 C4 DC B 20 -0.416 12.468 -2.311 1.00 0.17 C ATOM 619 N4 DC B 20 0.805 12.617 -2.825 1.00 0.10 N ATOM 620 C5 DC B 20 -1.563 12.595 -3.155 1.00 0.21 C ATOM 621 C6 DC B 20 -2.774 12.430 -2.594 1.00 0.29 C ATOM 622 H5' DC B 20 -6.576 9.604 -2.906 1.00 0.39 H ATOM 623 H5'' DC B 20 -7.883 10.797 -2.767 1.00 0.46 H ATOM 624 H4' DC B 20 -6.836 10.476 -0.598 1.00 0.54 H ATOM 625 H3' DC B 20 -7.002 13.000 -1.943 1.00 0.49 H ATOM 626 H2' DC B 20 -4.836 13.635 -1.826 1.00 0.42 H ATOM 627 H2'' DC B 20 -5.118 13.798 -0.073 1.00 0.53 H ATOM 628 H1' DC B 20 -4.109 11.812 0.422 1.00 0.49 H ATOM 629 H41 DC B 20 1.617 12.527 -2.230 1.00 0.90 H ATOM 630 H42 DC B 20 0.919 12.818 -3.809 1.00 0.86 H ATOM 631 H5 DC B 20 -1.463 12.820 -4.216 1.00 0.19 H ATOM 632 H6 DC B 20 -3.668 12.538 -3.203 1.00 0.32 H ATOM 633 P DC B 21 -7.596 14.221 0.660 1.00 0.69 P ATOM 634 OP1 DC B 21 -8.820 14.174 1.491 1.00 0.92 O ATOM 635 OP2 DC B 21 -7.507 15.176 -0.468 1.00 1.85 O ATOM 636 O5' DC B 21 -6.335 14.469 1.631 1.00 0.72 O ATOM 637 C5' DC B 21 -6.212 13.733 2.851 1.00 0.80 C ATOM 638 C4' DC B 21 -4.965 14.130 3.635 1.00 0.82 C ATOM 639 O4' DC B 21 -3.764 13.877 2.865 1.00 0.69 O ATOM 640 C3' DC B 21 -4.985 15.614 3.987 1.00 0.88 C ATOM 641 O3' DC B 21 -4.717 15.809 5.382 1.00 0.98 O ATOM 642 C2' DC B 21 -3.909 16.223 3.132 1.00 0.79 C ATOM 643 C1' DC B 21 -2.971 15.079 2.808 1.00 0.68 C ATOM 644 N1 DC B 21 -2.356 15.241 1.475 1.00 0.55 N ATOM 645 C2 DC B 21 -0.975 15.149 1.391 1.00 0.46 C ATOM 646 O2 DC B 21 -0.305 14.955 2.401 1.00 0.47 O ATOM 647 N3 DC B 21 -0.393 15.275 0.169 1.00 0.36 N ATOM 648 C4 DC B 21 -1.132 15.482 -0.927 1.00 0.36 C ATOM 649 N4 DC B 21 -0.525 15.601 -2.108 1.00 0.30 N ATOM 650 C5 DC B 21 -2.558 15.580 -0.844 1.00 0.45 C ATOM 651 C6 DC B 21 -3.124 15.455 0.372 1.00 0.54 C ATOM 652 H5' DC B 21 -6.162 12.669 2.620 1.00 0.77 H ATOM 653 H5'' DC B 21 -7.089 13.923 3.465 1.00 0.90 H ATOM 654 H4' DC B 21 -4.923 13.548 4.555 1.00 0.88 H ATOM 655 H3' DC B 21 -5.954 16.043 3.722 1.00 0.92 H ATOM 656 H2' DC B 21 -4.344 16.628 2.219 1.00 0.76 H ATOM 657 H2'' DC B 21 -3.382 17.004 3.679 1.00 0.83 H ATOM 658 H1' DC B 21 -2.191 15.031 3.562 1.00 0.70 H ATOM 659 H41 DC B 21 0.481 15.532 -2.167 1.00 0.25 H ATOM 660 H42 DC B 21 -1.071 15.758 -2.944 1.00 0.31 H ATOM 661 H5 DC B 21 -3.164 15.747 -1.733 1.00 0.45 H ATOM 662 H6 DC B 21 -4.206 15.531 0.478 1.00 0.61 H ATOM 663 P DG B 22 -4.964 17.238 6.085 1.00 1.10 P ATOM 664 OP1 DG B 22 -5.892 17.041 7.221 1.00 0.78 O ATOM 665 OP2 DG B 22 -5.286 18.230 5.033 1.00 2.29 O ATOM 666 O5' DG B 22 -3.508 17.590 6.677 1.00 1.09 O ATOM 667 C5' DG B 22 -2.976 16.865 7.791 1.00 1.14 C ATOM 668 C4' DG B 22 -1.545 17.279 8.095 1.00 1.12 C ATOM 669 O4' DG B 22 -0.680 16.897 7.005 1.00 0.96 O ATOM 670 C3' DG B 22 -1.441 18.789 8.274 1.00 1.20 C ATOM 671 O3' DG B 22 -0.814 19.120 9.517 1.00 1.29 O ATOM 672 C2' DG B 22 -0.625 19.267 7.110 1.00 1.09 C ATOM 673 C1' DG B 22 0.071 18.038 6.560 1.00 0.94 C ATOM 674 N9 DG B 22 0.088 18.089 5.094 1.00 0.82 N ATOM 675 C8 DG B 22 -0.950 18.258 4.247 1.00 0.83 C ATOM 676 N7 DG B 22 -0.698 18.264 2.982 1.00 0.73 N ATOM 677 C5 DG B 22 0.689 18.077 2.970 1.00 0.64 C ATOM 678 C6 DG B 22 1.583 17.993 1.873 1.00 0.53 C ATOM 679 O6 DG B 22 1.325 18.056 0.675 1.00 0.50 O ATOM 680 N1 DG B 22 2.893 17.807 2.294 1.00 0.47 N ATOM 681 C2 DG B 22 3.300 17.709 3.610 1.00 0.51 C ATOM 682 N2 DG B 22 4.606 17.529 3.814 1.00 0.44 N ATOM 683 N3 DG B 22 2.463 17.784 4.652 1.00 0.63 N ATOM 684 C4 DG B 22 1.179 17.969 4.263 1.00 0.69 C ATOM 685 H5' DG B 22 -2.985 15.803 7.561 1.00 1.09 H ATOM 686 H5'' DG B 22 -3.597 17.049 8.668 1.00 1.26 H ATOM 687 H4' DG B 22 -1.211 16.784 9.006 1.00 1.17 H ATOM 688 H3' DG B 22 -2.436 19.232 8.217 1.00 1.26 H ATOM 689 HO3' DG B 22 0.048 18.698 9.522 1.00 1.93 H ATOM 690 H2' DG B 22 -1.278 19.700 6.352 1.00 1.09 H ATOM 691 H2'' DG B 22 0.110 20.002 7.437 1.00 1.12 H ATOM 692 H1' DG B 22 1.083 17.979 6.941 1.00 0.92 H ATOM 693 H8 DG B 22 -1.965 18.401 4.630 1.00 0.92 H ATOM 694 H1 DG B 22 3.587 17.747 1.562 1.00 0.41 H ATOM 695 H21 DG B 22 5.237 17.472 3.028 1.00 1.21 H ATOM 696 H22 DG B 22 4.963 17.450 4.755 1.00 0.61 H TER 697 DG B 22 HETATM 698 C4C BZA A 66 0.115 -2.084 2.615 1.00 0.18 C HETATM 699 C9C BZA A 66 -0.195 -3.301 3.504 1.00 0.18 C HETATM 700 O3 BZA A 66 -0.404 -2.872 4.851 1.00 0.18 O HETATM 701 C8B BZA A 66 0.911 -4.343 3.453 1.00 0.18 C HETATM 702 O2 BZA A 66 0.537 -5.501 4.204 1.00 0.18 O HETATM 703 C3B BZA A 66 2.191 -3.749 4.004 1.00 0.17 C HETATM 704 O1 BZA A 66 3.232 -4.729 4.033 1.00 0.17 O HETATM 705 C3A BZA A 66 2.602 -2.602 3.118 1.00 0.18 C HETATM 706 C2A BZA A 66 3.980 -2.315 2.944 1.00 0.18 C HETATM 707 C4A BZA A 66 1.617 -1.811 2.454 1.00 0.18 C HETATM 708 C1A BZA A 66 4.388 -1.250 2.113 1.00 0.19 C HETATM 709 C5A BZA A 66 1.079 0.060 0.941 1.00 0.20 C HETATM 710 C4B BZA A 66 2.038 -0.737 1.617 1.00 0.19 C HETATM 711 C6A BZA A 66 0.535 1.901 -0.577 1.00 0.22 C HETATM 712 C7A BZA A 66 0.951 2.962 -1.411 1.00 0.24 C HETATM 713 C8A BZA A 66 2.327 3.239 -1.568 1.00 0.24 C HETATM 714 C5B BZA A 66 1.496 1.115 0.101 1.00 0.21 C HETATM 715 C9B BZA A 66 2.877 1.388 -0.065 1.00 0.21 C HETATM 716 C11 BZA A 66 3.423 -0.461 1.449 1.00 0.19 C HETATM 717 C9A BZA A 66 3.289 2.452 -0.900 1.00 0.23 C HETATM 718 C10 BZA A 66 3.839 0.602 0.611 1.00 0.20 C HETATM 719 H4C1 BZA A 66 -0.335 -1.209 3.076 1.00 0.17 H HETATM 720 H9C BZA A 66 -1.115 -3.759 3.148 1.00 0.20 H HETATM 721 H3 BZA A 66 -1.088 -2.200 4.828 1.00 0.19 H HETATM 722 H8B BZA A 66 1.074 -4.635 2.415 1.00 0.18 H HETATM 723 HO2 BZA A 66 -0.258 -5.279 4.694 1.00 0.67 H HETATM 724 H3B BZA A 66 2.013 -3.380 5.014 1.00 0.18 H HETATM 725 H1 BZA A 66 2.858 -5.532 4.403 1.00 0.23 H HETATM 726 H2A BZA A 66 4.722 -2.916 3.445 1.00 0.19 H HETATM 727 H1A BZA A 66 5.439 -1.036 1.989 1.00 0.20 H HETATM 728 H5A BZA A 66 0.027 -0.137 1.071 1.00 0.20 H HETATM 729 H6A BZA A 66 -0.513 1.680 -0.469 1.00 0.22 H HETATM 730 H7A BZA A 66 0.218 3.565 -1.924 1.00 0.25 H HETATM 731 H8A BZA A 66 2.642 4.054 -2.195 1.00 0.25 H HETATM 732 H9A BZA A 66 4.337 2.656 -1.038 1.00 0.23 H HETATM 733 H10 BZA A 66 4.891 0.810 0.485 1.00 0.21 H CONECT 173 698 CONECT 698 173 699 707 719 CONECT 699 698 700 701 720 CONECT 700 699 721 CONECT 701 699 702 703 722 CONECT 702 701 723 CONECT 703 701 704 705 724 CONECT 704 703 725 CONECT 705 703 706 707 CONECT 706 705 708 726 CONECT 707 698 705 710 CONECT 708 706 716 727 CONECT 709 710 714 728 CONECT 710 707 709 716 CONECT 711 712 714 729 CONECT 712 711 713 730 CONECT 713 712 717 731 CONECT 714 709 711 715 CONECT 715 714 717 718 CONECT 716 708 710 718 CONECT 717 713 715 732 CONECT 718 715 716 733 CONECT 719 698 CONECT 720 699 CONECT 721 700 CONECT 722 701 CONECT 723 702 CONECT 724 703 CONECT 725 704 CONECT 726 706 CONECT 727 708 CONECT 728 709 CONECT 729 711 CONECT 730 712 CONECT 731 713 CONECT 732 717 CONECT 733 718 MASTER 137 0 1 0 0 0 2 6 731 2 37 2 END