USER MOD reduce.3.24.130724 H: found=0, std=0, add=291, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 287 hydrogens (0 hets) HEADER DNA 30-AUG-93 134D TITLE SOLUTION STRUCTURE OF A PURINE(DOT)PURINE(DOT)PYRIMIDINE DNA TRIPLEX TITLE 2 CONTAINING G(DOT)GC AND T(DOT)AT TRIPLES COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA TRIPLEX; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 4 ORGANISM_TAXID: 32630 KEYWDS DNA, TRIPLEX EXPDTA SOLUTION NMR AUTHOR D.J.PATEL,I.RADHAKRISHNAN REVDAT 4 15-APR-15 134D 1 ATOM VERSN REMARK REVDAT 3 24-FEB-09 134D 1 VERSN REVDAT 2 01-APR-03 134D 1 JRNL REVDAT 1 30-APR-94 134D 0 JRNL AUTH I.RADHAKRISHNAN,D.J.PATEL JRNL TITL SOLUTION STRUCTURE OF A PURINE.PURINE.PYRIMIDINE DNA TRIPLEX JRNL TITL 2 CONTAINING G.GC AND T.AT TRIPLES. JRNL REF STRUCTURE V. 1 135 1993 JRNL REFN ISSN 0969-2126 JRNL PMID 8069626 JRNL DOI 10.1016/0969-2126(93)90028-F REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH I.RADHAKRISHNAN,D.J.PATEL REMARK 1 TITL SOLUTION/STRUCTURE OF AN INTRAMOLECULAR REMARK 1 TITL 2 PURINE-PURINE-PYRIMIDINE DNA TRIPLEX. REMARK 1 REF J.AM.CHEM.SOC. V. 115 1615 1993 REMARK 1 REFN ISSN 0002-7863 REMARK 1 DOI 10.1021/JA00057A078 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: RESTRAINED MOLECULAR DYNAMICS REMARK 3 CALCULATIONS WERE DONE ONIDEALIZED A'- AND B-FORM STARTING REMARK 3 STRUCTURES. ONLY THE TRIPLEX REGION AND THE FIRST AND LAST REMARK 3 RESIDUES OF EACH OF THE TWO LOOPS IN THE SEQUENCE WERE REMARK 3 CONSIDERED. THE REFINEMENT WAS CONDUCTED IN TWO STAGES. IN THE REMARK 3 FIRST STAGE, SIX STRUCTURES WERE CALCULATED (THREE FROM EACH REMARK 3 STARTING STRUCTURE) USING DISTANCE RESTRAINTS. IN THE SECOND REMARK 3 STAGE, TWO OF THE SIX STRUCTURES WERE REFINED DIRECTLY AGAINST REMARK 3 PRIMARY NOE DATA. THE R(1/6) VALUE WAS USED TO MONITOR THE REMARK 3 REFINEMENT DURING THIS STAGE. THE FINAL R(1/6) VALUES FOR THE TWO REMARK 3 AVERAGED MINIMIZED STRUCTURES WERE 0.04 AND 0.045. REMARK 4 REMARK 4 134D COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : NULL REMARK 210 PH : NULL REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL REMARK 210 SPECTROMETER FIELD STRENGTH : NULL REMARK 210 SPECTROMETER MODEL : NULL REMARK 210 SPECTROMETER MANUFACTURER : NULL REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : RESTRAINED MOLECULAR DYNAMICS, REMARK 210 DISTANCE GEOMETRY REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL 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 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 DT A 2L REMARK 465 DT A 3L REMARK 465 DT A 4L REMARK 465 DT A 7L REMARK 465 DT A 8L REMARK 465 DT A 9L REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (RES=RESIDUE NAME; REMARK 470 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 470 RES CSSEQI ATOMS REMARK 470 DT A 5L P OP1 OP2 REMARK 470 DT A 10L P OP1 OP2 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 A 4 C5 DT A 4 C7 0.040 REMARK 500 DC A 5 N1 DC A 5 C6 0.037 REMARK 500 DT A 7 C5 DT A 7 C7 0.038 REMARK 500 DT A 5L C5 DT A 5L C7 0.040 REMARK 500 DG A 9 C4' DG A 9 C3' 0.103 REMARK 500 DG A 9 C3' DG A 9 C2' 0.104 REMARK 500 DA A 11 C3' DA A 11 C2' 0.090 REMARK 500 DT A 6L C2' DT A 6L C1' 0.083 REMARK 500 DT A 15 C3' DT A 15 C2' 0.087 REMARK 500 DT A 15 C2' DT A 15 C1' 0.093 REMARK 500 DG A 17 C2' DG A 17 C1' 0.066 REMARK 500 DT A 18 C3' DT A 18 C2' 0.105 REMARK 500 DT A 18 C2' DT A 18 C1' 0.092 REMARK 500 DT A 18 C5 DT A 18 C7 0.043 REMARK 500 DG A 19 C2' DG A 19 C1' 0.071 REMARK 500 DG A 20 C2' DG A 20 C1' 0.075 REMARK 500 DT A 21 C4' DT A 21 C3' 0.077 REMARK 500 DT A 21 C5 DT A 21 C7 0.065 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 DT A 1 O4' - C1' - C2' ANGL. DEV. = -6.0 DEGREES REMARK 500 DT A 1 O4' - C1' - N1 ANGL. DEV. = 2.6 DEGREES REMARK 500 DC A 2 C4' - C3' - C2' ANGL. DEV. = -4.7 DEGREES REMARK 500 DC A 2 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DC A 2 N1 - C2 - O2 ANGL. DEV. = 3.7 DEGREES REMARK 500 DC A 3 O4' - C1' - N1 ANGL. DEV. = -5.4 DEGREES REMARK 500 DT A 4 C1' - O4' - C4' ANGL. DEV. = -8.0 DEGREES REMARK 500 DT A 4 O4' - C1' - C2' ANGL. DEV. = -6.3 DEGREES REMARK 500 DT A 4 O4' - C1' - N1 ANGL. DEV. = 7.5 DEGREES REMARK 500 DT A 4 N3 - C2 - O2 ANGL. DEV. = -4.0 DEGREES REMARK 500 DC A 5 C1' - O4' - C4' ANGL. DEV. = -6.2 DEGREES REMARK 500 DC A 5 N1 - C2 - O2 ANGL. DEV. = 3.8 DEGREES REMARK 500 DC A 6 C1' - O4' - C4' ANGL. DEV. = -6.4 DEGREES REMARK 500 DC A 6 N1 - C2 - O2 ANGL. DEV. = 4.1 DEGREES REMARK 500 DT A 7 O4' - C1' - N1 ANGL. DEV. = 6.2 DEGREES REMARK 500 DT A 7 C6 - C5 - C7 ANGL. DEV. = -4.2 DEGREES REMARK 500 DT A 5L O4' - C1' - C2' ANGL. DEV. = -5.9 DEGREES REMARK 500 DT A 5L O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 DG A 10 O4' - C1' - C2' ANGL. DEV. = -6.6 DEGREES REMARK 500 DG A 10 O4' - C1' - N9 ANGL. DEV. = 2.7 DEGREES REMARK 500 DA A 11 O4' - C4' - C3' ANGL. DEV. = -3.1 DEGREES REMARK 500 DA A 11 O4' - C1' - N9 ANGL. DEV. = 5.7 DEGREES REMARK 500 DG A 13 O4' - C1' - C2' ANGL. DEV. = -5.5 DEGREES REMARK 500 DG A 13 O4' - C1' - N9 ANGL. DEV. = 2.1 DEGREES REMARK 500 DA A 14 O4' - C1' - C2' ANGL. DEV. = -5.5 DEGREES REMARK 500 DA A 14 O4' - C1' - N9 ANGL. DEV. = 11.5 DEGREES REMARK 500 DT A 6L O4' - C1' - N1 ANGL. DEV. = -5.8 DEGREES REMARK 500 DT A 6L C4 - C5 - C6 ANGL. DEV. = 4.4 DEGREES REMARK 500 DT A 10L O4' - C1' - N1 ANGL. DEV. = 2.9 DEGREES REMARK 500 DT A 10L C6 - C5 - C7 ANGL. DEV. = -4.0 DEGREES REMARK 500 DT A 15 C4' - C3' - C2' ANGL. DEV. = -12.1 DEGREES REMARK 500 DT A 15 O4' - C1' - C2' ANGL. DEV. = -5.5 DEGREES REMARK 500 DT A 15 O4' - C1' - N1 ANGL. DEV. = 2.0 DEGREES REMARK 500 DT A 15 N1 - C2 - N3 ANGL. DEV. = 3.6 DEGREES REMARK 500 DG A 16 O4' - C1' - C2' ANGL. DEV. = -5.1 DEGREES REMARK 500 DG A 16 O4' - C1' - N9 ANGL. DEV. = 2.6 DEGREES REMARK 500 DT A 15 C3' - O3' - P ANGL. DEV. = 9.8 DEGREES REMARK 500 DT A 18 C6 - C5 - C7 ANGL. DEV. = -3.9 DEGREES REMARK 500 DG A 19 N9 - C4 - C5 ANGL. DEV. = 2.5 DEGREES REMARK 500 DG A 20 C1' - O4' - C4' ANGL. DEV. = 4.5 DEGREES REMARK 500 DT A 21 O4' - C4' - C3' ANGL. DEV. = -2.7 DEGREES REMARK 500 DT A 21 C4' - C3' - C2' ANGL. DEV. = -4.8 DEGREES REMARK 500 DT A 21 N3 - C2 - O2 ANGL. DEV. = -5.2 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 135D RELATED DB: PDB REMARK 900 MINIMIZED AVERAGE STRUCTURE REMARK 900 RELATED ID: 136D RELATED DB: PDB REMARK 900 ENSEMBLE OF 14 STRUCTURES DBREF 134D A 1 21 PDB 134D 134D 1 21 SEQRES 1 A 31 DT DC DC DT DC DC DT DT DT DT DT DT DA SEQRES 2 A 31 DG DG DA DG DG DA DT DT DT DT DT DT DG SEQRES 3 A 31 DG DT DG DG DT 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 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 1 DT O5' : rot 180:sc= -0.0956 USER MOD Set 1.2: A 10L DT C7 :methyl -30:sc= 0 (180deg=-0.864) USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1L DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1L DT O3' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl 150:sc=-0.000438 (180deg=-0.000438) USER MOD Single : A 5L DT C7 :methyl -30:sc= 0 (180deg=-0.316) USER MOD Single : A 5L DT O5' : rot 180:sc= 0 USER MOD Single : A 6L DT C7 :methyl 150:sc= -5.49! (180deg=-5.49!) USER MOD Single : A 6L DT O3' : rot 180:sc= 0 USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10L DT O5' : rot 17:sc= 1.34 USER MOD Single : A 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 18 DT C7 :methyl -30:sc= -0.145 (180deg=-0.684) USER MOD Single : A 21 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 21 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -9.214 11.618 1.643 1.00 0.72 O ATOM 2 C5' DT A 1 -9.810 12.175 0.468 1.00 0.65 C ATOM 3 C4' DT A 1 -9.199 11.569 -0.790 1.00 0.53 C ATOM 4 O4' DT A 1 -7.791 11.874 -0.909 1.00 0.45 O ATOM 5 C3' DT A 1 -9.298 10.040 -0.739 1.00 0.54 C ATOM 6 O3' DT A 1 -10.408 9.572 -1.512 1.00 0.62 O ATOM 7 C2' DT A 1 -7.979 9.667 -1.537 1.00 0.50 C ATOM 8 C1' DT A 1 -7.282 11.016 -1.940 1.00 0.40 C ATOM 9 N1 DT A 1 -5.815 10.858 -1.818 1.00 0.33 N ATOM 10 C2 DT A 1 -5.084 10.931 -2.987 1.00 0.31 C ATOM 11 O2 DT A 1 -5.577 11.113 -4.095 1.00 0.42 O ATOM 12 N3 DT A 1 -3.735 10.780 -2.866 1.00 0.30 N ATOM 13 C4 DT A 1 -3.043 10.560 -1.693 1.00 0.40 C ATOM 14 O4 DT A 1 -1.828 10.417 -1.689 1.00 0.48 O ATOM 15 C5 DT A 1 -3.871 10.499 -0.523 1.00 0.46 C ATOM 16 C7 DT A 1 -3.222 10.272 0.839 1.00 0.66 C ATOM 17 C6 DT A 1 -5.197 10.645 -0.611 1.00 0.39 C ATOM 0 H5' DT A 1 -9.669 13.256 0.461 1.00 0.65 H new ATOM 0 H5'' DT A 1 -10.885 11.993 0.479 1.00 0.65 H new ATOM 0 H4' DT A 1 -9.750 11.990 -1.631 1.00 0.53 H new ATOM 0 H3' DT A 1 -9.411 9.634 0.266 1.00 0.54 H new ATOM 0 H2' DT A 1 -7.315 9.060 -0.921 1.00 0.50 H new ATOM 0 H2'' DT A 1 -8.219 9.078 -2.423 1.00 0.50 H new ATOM 0 HO5' DT A 1 -9.619 12.022 2.438 1.00 0.72 H new ATOM 0 H1' DT A 1 -7.467 11.368 -2.955 1.00 0.40 H new ATOM 0 H3 DT A 1 -3.185 10.835 -3.723 1.00 0.30 H new ATOM 0 H71 DT A 1 -3.819 10.756 1.612 1.00 0.66 H new ATOM 0 H72 DT A 1 -3.165 9.202 1.041 1.00 0.66 H new ATOM 0 H73 DT A 1 -2.217 10.695 0.838 1.00 0.66 H new ATOM 0 H6 DT A 1 -5.795 10.594 0.287 1.00 0.39 H new ATOM 31 P DC A 2 -10.643 7.992 -1.798 1.00 0.68 P ATOM 32 OP1 DC A 2 -12.097 7.797 -1.972 1.00 0.88 O ATOM 33 OP2 DC A 2 -9.906 7.219 -0.771 1.00 0.78 O ATOM 34 O5' DC A 2 -9.925 7.709 -3.207 1.00 0.52 O ATOM 35 C5' DC A 2 -10.530 8.080 -4.457 1.00 0.53 C ATOM 36 C4' DC A 2 -9.850 7.375 -5.620 1.00 0.43 C ATOM 37 O4' DC A 2 -8.446 7.720 -5.539 1.00 0.37 O ATOM 38 C3' DC A 2 -10.004 5.836 -5.566 1.00 0.42 C ATOM 39 O3' DC A 2 -10.114 5.233 -6.875 1.00 0.48 O ATOM 40 C2' DC A 2 -8.654 5.523 -4.903 1.00 0.37 C ATOM 41 C1' DC A 2 -7.689 6.514 -5.576 1.00 0.32 C ATOM 42 N1 DC A 2 -6.404 6.644 -4.779 1.00 0.28 N ATOM 43 C2 DC A 2 -5.200 6.613 -5.488 1.00 0.24 C ATOM 44 O2 DC A 2 -5.154 6.468 -6.709 1.00 0.30 O ATOM 45 N3 DC A 2 -4.028 6.733 -4.800 1.00 0.23 N ATOM 46 C4 DC A 2 -4.010 6.879 -3.474 1.00 0.24 C ATOM 47 N4 DC A 2 -2.864 6.984 -2.823 1.00 0.27 N ATOM 48 C5 DC A 2 -5.209 6.915 -2.724 1.00 0.30 C ATOM 49 C6 DC A 2 -6.377 6.797 -3.386 1.00 0.33 C ATOM 0 H5' DC A 2 -10.463 9.160 -4.592 1.00 0.53 H new ATOM 0 H5'' DC A 2 -11.590 7.826 -4.442 1.00 0.53 H new ATOM 0 H4' DC A 2 -10.312 7.694 -6.554 1.00 0.43 H new ATOM 0 H3' DC A 2 -10.897 5.466 -5.062 1.00 0.42 H new ATOM 0 H2' DC A 2 -8.693 5.670 -3.824 1.00 0.37 H new ATOM 0 H2'' DC A 2 -8.352 4.490 -5.074 1.00 0.37 H new ATOM 0 H1' DC A 2 -7.373 6.222 -6.577 1.00 0.32 H new ATOM 0 H41 DC A 2 -2.862 7.095 -1.809 1.00 0.27 H new ATOM 0 H42 DC A 2 -1.982 6.954 -3.335 1.00 0.27 H new ATOM 0 H5 DC A 2 -5.189 7.034 -1.651 1.00 0.30 H new ATOM 0 H6 DC A 2 -7.306 6.821 -2.835 1.00 0.33 H new ATOM 61 P DC A 3 -9.812 3.666 -7.192 1.00 0.52 P ATOM 62 OP1 DC A 3 -10.648 3.250 -8.340 1.00 0.69 O ATOM 63 OP2 DC A 3 -9.854 2.907 -5.918 1.00 0.60 O ATOM 64 O5' DC A 3 -8.289 3.787 -7.682 1.00 0.42 O ATOM 65 C5' DC A 3 -8.052 4.588 -8.852 1.00 0.42 C ATOM 66 C4' DC A 3 -6.831 4.149 -9.623 1.00 0.37 C ATOM 67 O4' DC A 3 -5.651 4.293 -8.823 1.00 0.33 O ATOM 68 C3' DC A 3 -6.885 2.674 -10.060 1.00 0.37 C ATOM 69 O3' DC A 3 -6.368 2.583 -11.377 1.00 0.38 O ATOM 70 C2' DC A 3 -5.991 1.931 -9.061 1.00 0.36 C ATOM 71 C1' DC A 3 -4.986 3.032 -8.644 1.00 0.30 C ATOM 72 N1 DC A 3 -4.555 3.091 -7.209 1.00 0.26 N ATOM 73 C2 DC A 3 -3.201 3.238 -7.053 1.00 0.24 C ATOM 74 O2 DC A 3 -2.449 3.182 -8.020 1.00 0.29 O ATOM 75 N3 DC A 3 -2.700 3.410 -5.818 1.00 0.22 N ATOM 76 C4 DC A 3 -3.493 3.437 -4.750 1.00 0.22 C ATOM 77 N4 DC A 3 -2.923 3.610 -3.571 1.00 0.24 N ATOM 78 C5 DC A 3 -4.904 3.283 -4.843 1.00 0.26 C ATOM 79 C6 DC A 3 -5.401 3.101 -6.100 1.00 0.29 C ATOM 0 H5' DC A 3 -7.934 5.630 -8.556 1.00 0.42 H new ATOM 0 H5'' DC A 3 -8.925 4.539 -9.503 1.00 0.42 H new ATOM 0 H4' DC A 3 -6.808 4.787 -10.507 1.00 0.37 H new ATOM 0 H3' DC A 3 -7.891 2.255 -10.067 1.00 0.37 H new ATOM 0 H2' DC A 3 -6.557 1.553 -8.210 1.00 0.36 H new ATOM 0 H2'' DC A 3 -5.493 1.076 -9.518 1.00 0.36 H new ATOM 0 H1' DC A 3 -4.104 2.812 -9.246 1.00 0.30 H new ATOM 0 H41 DC A 3 -3.495 3.637 -2.727 1.00 0.24 H new ATOM 0 H42 DC A 3 -1.911 3.717 -3.505 1.00 0.24 H new ATOM 0 H5 DC A 3 -5.542 3.309 -3.972 1.00 0.26 H new ATOM 0 H6 DC A 3 -6.463 2.963 -6.238 1.00 0.29 H new ATOM 91 P DT A 4 -6.418 1.194 -12.142 1.00 0.43 P ATOM 92 OP1 DT A 4 -6.159 1.480 -13.566 1.00 0.55 O ATOM 93 OP2 DT A 4 -7.659 0.488 -11.753 1.00 0.59 O ATOM 94 O5' DT A 4 -5.170 0.397 -11.514 1.00 0.37 O ATOM 95 C5' DT A 4 -3.813 0.776 -11.751 1.00 0.34 C ATOM 96 C4' DT A 4 -2.913 0.146 -10.715 1.00 0.31 C ATOM 97 O4' DT A 4 -3.173 0.623 -9.372 1.00 0.32 O ATOM 98 C3' DT A 4 -3.092 -1.386 -10.701 1.00 0.32 C ATOM 99 O3' DT A 4 -1.935 -2.025 -11.254 1.00 0.36 O ATOM 100 C2' DT A 4 -3.204 -1.615 -9.187 1.00 0.30 C ATOM 101 C1' DT A 4 -2.563 -0.383 -8.574 1.00 0.28 C ATOM 102 N1 DT A 4 -2.767 -0.257 -7.108 1.00 0.26 N ATOM 103 C2 DT A 4 -1.579 -0.170 -6.406 1.00 0.24 C ATOM 104 O2 DT A 4 -0.462 -0.173 -6.914 1.00 0.26 O ATOM 105 N3 DT A 4 -1.671 -0.062 -5.069 1.00 0.24 N ATOM 106 C4 DT A 4 -2.799 -0.023 -4.318 1.00 0.27 C ATOM 107 O4 DT A 4 -2.671 0.099 -3.103 1.00 0.30 O ATOM 108 C5 DT A 4 -4.029 -0.116 -5.085 1.00 0.29 C ATOM 109 C7 DT A 4 -5.385 -0.095 -4.364 1.00 0.38 C ATOM 110 C6 DT A 4 -3.993 -0.229 -6.436 1.00 0.29 C ATOM 0 H5' DT A 4 -3.718 1.861 -11.715 1.00 0.34 H new ATOM 0 H5'' DT A 4 -3.508 0.462 -12.749 1.00 0.34 H new ATOM 0 H4' DT A 4 -1.899 0.427 -10.999 1.00 0.31 H new ATOM 0 H3' DT A 4 -3.928 -1.777 -11.282 1.00 0.32 H new ATOM 0 H2' DT A 4 -4.244 -1.719 -8.876 1.00 0.30 H new ATOM 0 H2'' DT A 4 -2.688 -2.525 -8.883 1.00 0.30 H new ATOM 0 H1' DT A 4 -1.473 -0.362 -8.598 1.00 0.28 H new ATOM 0 H3 DT A 4 -0.789 -0.002 -4.560 1.00 0.24 H new ATOM 0 H71 DT A 4 -6.137 0.349 -5.016 1.00 0.38 H new ATOM 0 H72 DT A 4 -5.679 -1.114 -4.112 1.00 0.38 H new ATOM 0 H73 DT A 4 -5.303 0.495 -3.451 1.00 0.38 H new ATOM 0 H6 DT A 4 -4.915 -0.298 -6.995 1.00 0.29 H new ATOM 123 P DC A 5 -1.974 -3.589 -11.645 1.00 0.33 P ATOM 124 OP1 DC A 5 -3.177 -3.792 -12.492 1.00 0.44 O ATOM 125 OP2 DC A 5 -1.802 -4.404 -10.415 1.00 0.37 O ATOM 126 O5' DC A 5 -0.708 -3.806 -12.615 1.00 0.41 O ATOM 127 C5' DC A 5 0.635 -3.331 -12.428 1.00 0.41 C ATOM 128 C4' DC A 5 1.340 -3.825 -11.170 1.00 0.31 C ATOM 129 O4' DC A 5 0.690 -3.321 -9.990 1.00 0.28 O ATOM 130 C3' DC A 5 1.430 -5.359 -11.020 1.00 0.27 C ATOM 131 O3' DC A 5 2.743 -5.869 -11.296 1.00 0.30 O ATOM 132 C2' DC A 5 1.199 -5.506 -9.530 1.00 0.33 C ATOM 133 C1' DC A 5 1.253 -4.093 -8.934 1.00 0.26 C ATOM 134 N1 DC A 5 0.381 -4.008 -7.724 1.00 0.23 N ATOM 135 C2 DC A 5 1.009 -3.497 -6.598 1.00 0.26 C ATOM 136 O2 DC A 5 2.184 -3.150 -6.595 1.00 0.34 O ATOM 137 N3 DC A 5 0.317 -3.383 -5.451 1.00 0.25 N ATOM 138 C4 DC A 5 -0.957 -3.751 -5.377 1.00 0.22 C ATOM 139 N4 DC A 5 -1.562 -3.608 -4.204 1.00 0.26 N ATOM 140 C5 DC A 5 -1.660 -4.283 -6.505 1.00 0.22 C ATOM 141 C6 DC A 5 -0.965 -4.403 -7.670 1.00 0.20 C ATOM 0 H5' DC A 5 0.616 -2.241 -12.408 1.00 0.41 H new ATOM 0 H5'' DC A 5 1.229 -3.624 -13.294 1.00 0.41 H new ATOM 0 H4' DC A 5 2.356 -3.446 -11.280 1.00 0.31 H new ATOM 0 H3' DC A 5 0.749 -5.882 -11.691 1.00 0.27 H new ATOM 0 H2' DC A 5 0.234 -5.973 -9.332 1.00 0.33 H new ATOM 0 H2'' DC A 5 1.960 -6.145 -9.081 1.00 0.33 H new ATOM 0 H1' DC A 5 2.248 -3.777 -8.620 1.00 0.26 H new ATOM 0 H41 DC A 5 -2.540 -3.877 -4.099 1.00 0.26 H new ATOM 0 H42 DC A 5 -1.049 -3.229 -3.408 1.00 0.26 H new ATOM 0 H5 DC A 5 -2.697 -4.577 -6.435 1.00 0.22 H new ATOM 0 H6 DC A 5 -1.448 -4.801 -8.550 1.00 0.20 H new ATOM 153 P DC A 6 3.073 -7.453 -11.202 1.00 0.33 P ATOM 154 OP1 DC A 6 2.512 -8.091 -12.417 1.00 0.42 O ATOM 155 OP2 DC A 6 2.706 -7.976 -9.863 1.00 0.39 O ATOM 156 O5' DC A 6 4.669 -7.506 -11.343 1.00 0.40 O ATOM 157 C5' DC A 6 5.633 -6.795 -10.542 1.00 0.40 C ATOM 158 C4' DC A 6 5.625 -7.076 -9.029 1.00 0.37 C ATOM 159 O4' DC A 6 4.451 -6.602 -8.355 1.00 0.32 O ATOM 160 C3' DC A 6 5.700 -8.565 -8.691 1.00 0.40 C ATOM 161 O3' DC A 6 7.048 -9.037 -8.665 1.00 0.51 O ATOM 162 C2' DC A 6 5.137 -8.569 -7.237 1.00 0.35 C ATOM 163 C1' DC A 6 4.570 -7.158 -7.033 1.00 0.28 C ATOM 164 N1 DC A 6 3.224 -7.262 -6.416 1.00 0.25 N ATOM 165 C2 DC A 6 3.097 -6.788 -5.126 1.00 0.27 C ATOM 166 O2 DC A 6 4.043 -6.348 -4.480 1.00 0.32 O ATOM 167 N3 DC A 6 1.886 -6.832 -4.540 1.00 0.26 N ATOM 168 C4 DC A 6 0.819 -7.317 -5.169 1.00 0.24 C ATOM 169 N4 DC A 6 -0.328 -7.318 -4.497 1.00 0.24 N ATOM 170 C5 DC A 6 0.907 -7.820 -6.505 1.00 0.23 C ATOM 171 C6 DC A 6 2.129 -7.778 -7.092 1.00 0.24 C ATOM 0 H5' DC A 6 5.474 -5.727 -10.689 1.00 0.40 H new ATOM 0 H5'' DC A 6 6.627 -7.025 -10.924 1.00 0.40 H new ATOM 0 H4' DC A 6 6.512 -6.541 -8.690 1.00 0.37 H new ATOM 0 H3' DC A 6 5.175 -9.196 -9.409 1.00 0.40 H new ATOM 0 H2' DC A 6 4.364 -9.328 -7.114 1.00 0.35 H new ATOM 0 H2'' DC A 6 5.919 -8.790 -6.511 1.00 0.35 H new ATOM 0 H1' DC A 6 5.199 -6.545 -6.387 1.00 0.28 H new ATOM 0 H41 DC A 6 -1.175 -7.679 -4.935 1.00 0.24 H new ATOM 0 H42 DC A 6 -0.361 -6.957 -3.543 1.00 0.24 H new ATOM 0 H5 DC A 6 0.044 -8.214 -7.021 1.00 0.23 H new ATOM 0 H6 DC A 6 2.251 -8.151 -8.098 1.00 0.24 H new ATOM 183 P DT A 7 7.433 -10.554 -8.270 1.00 0.57 P ATOM 184 OP1 DT A 7 8.868 -10.746 -8.592 1.00 0.74 O ATOM 185 OP2 DT A 7 6.422 -11.463 -8.858 1.00 0.67 O ATOM 186 O5' DT A 7 7.266 -10.571 -6.699 1.00 0.50 O ATOM 187 C5' DT A 7 8.153 -9.866 -5.837 1.00 0.49 C ATOM 188 C4' DT A 7 7.784 -10.212 -4.418 1.00 0.45 C ATOM 189 O4' DT A 7 6.429 -9.785 -4.152 1.00 0.44 O ATOM 190 C3' DT A 7 7.861 -11.742 -4.239 1.00 0.48 C ATOM 191 O3' DT A 7 8.592 -12.099 -3.064 1.00 0.54 O ATOM 192 C2' DT A 7 6.378 -12.068 -4.136 1.00 0.43 C ATOM 193 C1' DT A 7 5.811 -10.850 -3.444 1.00 0.37 C ATOM 194 N1 DT A 7 4.332 -10.875 -3.541 1.00 0.32 N ATOM 195 C2 DT A 7 3.664 -10.691 -2.360 1.00 0.27 C ATOM 196 O2 DT A 7 4.232 -10.511 -1.290 1.00 0.31 O ATOM 197 N3 DT A 7 2.306 -10.720 -2.421 1.00 0.25 N ATOM 198 C4 DT A 7 1.520 -10.910 -3.527 1.00 0.27 C ATOM 199 O4 DT A 7 0.300 -10.899 -3.382 1.00 0.29 O ATOM 200 C5 DT A 7 2.287 -11.102 -4.749 1.00 0.33 C ATOM 201 C7 DT A 7 1.580 -11.336 -6.090 1.00 0.42 C ATOM 202 C6 DT A 7 3.642 -11.080 -4.722 1.00 0.34 C ATOM 0 H5' DT A 7 8.073 -8.792 -6.002 1.00 0.49 H new ATOM 0 H5'' DT A 7 9.187 -10.144 -6.042 1.00 0.49 H new ATOM 0 H4' DT A 7 8.470 -9.714 -3.733 1.00 0.45 H new ATOM 0 H3' DT A 7 8.384 -12.281 -5.029 1.00 0.48 H new ATOM 0 H2' DT A 7 5.929 -12.221 -5.117 1.00 0.43 H new ATOM 0 H2'' DT A 7 6.203 -12.977 -3.561 1.00 0.43 H new ATOM 0 H1' DT A 7 6.007 -10.774 -2.375 1.00 0.37 H new ATOM 0 H3 DT A 7 1.814 -10.584 -1.538 1.00 0.25 H new ATOM 0 H71 DT A 7 2.194 -10.941 -6.899 1.00 0.42 H new ATOM 0 H72 DT A 7 1.427 -12.405 -6.239 1.00 0.42 H new ATOM 0 H73 DT A 7 0.615 -10.829 -6.086 1.00 0.42 H new ATOM 0 H6 DT A 7 4.193 -11.225 -5.639 1.00 0.34 H new ATOM 215 P DT A 1L 8.587 -13.581 -2.418 1.00 0.63 P ATOM 216 OP1 DT A 1L 9.917 -13.791 -1.812 1.00 0.83 O ATOM 217 OP2 DT A 1L 8.064 -14.555 -3.401 1.00 0.74 O ATOM 218 O5' DT A 1L 7.496 -13.464 -1.231 1.00 0.57 O ATOM 219 C5' DT A 1L 7.684 -12.552 -0.130 1.00 0.55 C ATOM 220 C4' DT A 1L 6.755 -12.798 1.070 1.00 0.53 C ATOM 221 O4' DT A 1L 5.369 -12.727 0.675 1.00 0.49 O ATOM 222 C3' DT A 1L 6.942 -14.166 1.761 1.00 0.63 C ATOM 223 O3' DT A 1L 6.726 -14.155 3.175 1.00 0.72 O ATOM 224 C2' DT A 1L 5.888 -14.963 1.101 1.00 0.64 C ATOM 225 C1' DT A 1L 4.732 -13.984 0.943 1.00 0.53 C ATOM 226 N1 DT A 1L 3.797 -14.274 -0.173 1.00 0.50 N ATOM 227 C2 DT A 1L 2.448 -14.096 0.082 1.00 0.46 C ATOM 228 O2 DT A 1L 1.984 -13.738 1.163 1.00 0.44 O ATOM 229 N3 DT A 1L 1.600 -14.339 -0.966 1.00 0.48 N ATOM 230 C4 DT A 1L 1.955 -14.738 -2.228 1.00 0.53 C ATOM 231 O4 DT A 1L 1.091 -14.906 -3.080 1.00 0.58 O ATOM 232 C5 DT A 1L 3.369 -14.905 -2.423 1.00 0.55 C ATOM 233 C7 DT A 1L 3.903 -15.340 -3.791 1.00 0.61 C ATOM 234 C6 DT A 1L 4.231 -14.678 -1.418 1.00 0.53 C ATOM 0 H5' DT A 1L 7.531 -11.534 -0.488 1.00 0.55 H new ATOM 0 H5'' DT A 1L 8.718 -12.619 0.208 1.00 0.55 H new ATOM 0 H4' DT A 1L 7.028 -12.012 1.774 1.00 0.53 H new ATOM 0 H3' DT A 1L 7.964 -14.533 1.663 1.00 0.63 H new ATOM 0 H2' DT A 1L 6.222 -15.346 0.137 1.00 0.64 H new ATOM 0 H2'' DT A 1L 5.602 -15.825 1.704 1.00 0.64 H new ATOM 0 HO3' DT A 1L 6.862 -15.057 3.534 1.00 0.72 H new ATOM 0 H1' DT A 1L 4.115 -14.025 1.841 1.00 0.53 H new ATOM 0 H3 DT A 1L 0.604 -14.210 -0.789 1.00 0.48 H new ATOM 0 H71 DT A 1L 4.900 -14.925 -3.941 1.00 0.61 H new ATOM 0 H72 DT A 1L 3.953 -16.428 -3.833 1.00 0.61 H new ATOM 0 H73 DT A 1L 3.237 -14.977 -4.574 1.00 0.61 H new ATOM 0 H6 DT A 1L 5.289 -14.815 -1.589 1.00 0.53 H new ATOM 247 O5' DT A 5L -6.356 -15.825 4.666 1.00 0.59 O ATOM 248 C5' DT A 5L -5.702 -16.282 5.855 1.00 0.52 C ATOM 249 C4' DT A 5L -4.456 -15.458 6.183 1.00 0.43 C ATOM 250 O4' DT A 5L -3.497 -15.582 5.103 1.00 0.45 O ATOM 251 C3' DT A 5L -4.783 -13.961 6.380 1.00 0.40 C ATOM 252 O3' DT A 5L -4.266 -13.435 7.619 1.00 0.43 O ATOM 253 C2' DT A 5L -4.012 -13.375 5.203 1.00 0.37 C ATOM 254 C1' DT A 5L -2.838 -14.326 4.948 1.00 0.40 C ATOM 255 N1 DT A 5L -2.313 -14.176 3.568 1.00 0.36 N ATOM 256 C2 DT A 5L -0.980 -13.819 3.400 1.00 0.37 C ATOM 257 O2 DT A 5L -0.217 -13.634 4.340 1.00 0.41 O ATOM 258 N3 DT A 5L -0.550 -13.692 2.096 1.00 0.37 N ATOM 259 C4 DT A 5L -1.309 -13.885 0.964 1.00 0.39 C ATOM 260 O4 DT A 5L -0.779 -13.739 -0.136 1.00 0.44 O ATOM 261 C5 DT A 5L -2.684 -14.257 1.222 1.00 0.38 C ATOM 262 C7 DT A 5L -3.639 -14.514 0.047 1.00 0.45 C ATOM 263 C6 DT A 5L -3.131 -14.386 2.490 1.00 0.37 C ATOM 0 H5' DT A 5L -5.422 -17.328 5.734 1.00 0.52 H new ATOM 0 H5'' DT A 5L -6.398 -16.233 6.692 1.00 0.52 H new ATOM 0 H4' DT A 5L -4.047 -15.845 7.116 1.00 0.43 H new ATOM 0 H3' DT A 5L -5.850 -13.743 6.420 1.00 0.40 H new ATOM 0 H2' DT A 5L -4.648 -13.296 4.321 1.00 0.37 H new ATOM 0 H2'' DT A 5L -3.657 -12.370 5.431 1.00 0.37 H new ATOM 0 HO5' DT A 5L -7.145 -16.380 4.493 1.00 0.59 H new ATOM 0 H1' DT A 5L -1.975 -14.169 5.595 1.00 0.40 H new ATOM 0 H3 DT A 5L 0.426 -13.429 1.957 1.00 0.37 H new ATOM 0 H71 DT A 5L -3.342 -13.901 -0.804 1.00 0.45 H new ATOM 0 H72 DT A 5L -3.597 -15.567 -0.232 1.00 0.45 H new ATOM 0 H73 DT A 5L -4.656 -14.257 0.342 1.00 0.45 H new ATOM 0 H6 DT A 5L -4.161 -14.662 2.658 1.00 0.37 H new ATOM 276 P DA A 8 -4.274 -11.852 8.017 1.00 0.43 P ATOM 277 OP1 DA A 8 -4.157 -11.772 9.490 1.00 0.51 O ATOM 278 OP2 DA A 8 -5.411 -11.199 7.332 1.00 0.46 O ATOM 279 O5' DA A 8 -2.914 -11.322 7.323 1.00 0.37 O ATOM 280 C5' DA A 8 -1.624 -11.589 7.885 1.00 0.40 C ATOM 281 C4' DA A 8 -0.502 -10.786 7.238 1.00 0.35 C ATOM 282 O4' DA A 8 -0.353 -11.120 5.832 1.00 0.32 O ATOM 283 C3' DA A 8 -0.728 -9.251 7.310 1.00 0.35 C ATOM 284 O3' DA A 8 0.304 -8.607 8.064 1.00 0.43 O ATOM 285 C2' DA A 8 -0.764 -8.814 5.812 1.00 0.31 C ATOM 286 C1' DA A 8 -0.010 -9.964 5.043 1.00 0.29 C ATOM 287 N9 DA A 8 -0.571 -10.106 3.681 1.00 0.24 N ATOM 288 C8 DA A 8 -1.890 -10.147 3.312 1.00 0.22 C ATOM 289 N7 DA A 8 -2.073 -10.248 2.024 1.00 0.20 N ATOM 290 C5 DA A 8 -0.788 -10.278 1.503 1.00 0.19 C ATOM 291 C6 DA A 8 -0.301 -10.376 0.194 1.00 0.20 C ATOM 292 N6 DA A 8 -1.056 -10.445 -0.897 1.00 0.23 N ATOM 293 N1 DA A 8 1.023 -10.381 0.030 1.00 0.22 N ATOM 294 C2 DA A 8 1.816 -10.292 1.091 1.00 0.25 C ATOM 295 N3 DA A 8 1.484 -10.195 2.371 1.00 0.25 N ATOM 296 C4 DA A 8 0.139 -10.194 2.505 1.00 0.22 C ATOM 0 H5' DA A 8 -1.405 -12.652 7.783 1.00 0.40 H new ATOM 0 H5'' DA A 8 -1.649 -11.369 8.952 1.00 0.40 H new ATOM 0 H4' DA A 8 0.390 -11.051 7.806 1.00 0.35 H new ATOM 0 H3' DA A 8 -1.644 -8.971 7.830 1.00 0.35 H new ATOM 0 H2' DA A 8 -1.788 -8.705 5.456 1.00 0.31 H new ATOM 0 H2'' DA A 8 -0.272 -7.852 5.668 1.00 0.31 H new ATOM 0 H1' DA A 8 1.062 -9.799 4.930 1.00 0.29 H new ATOM 0 H8 DA A 8 -2.703 -10.100 4.022 1.00 0.22 H new ATOM 0 H61 DA A 8 -0.619 -10.515 -1.816 1.00 0.23 H new ATOM 0 H62 DA A 8 -2.073 -10.428 -0.816 1.00 0.23 H new ATOM 0 H2 DA A 8 2.876 -10.300 0.883 1.00 0.25 H new ATOM 308 P DG A 9 0.760 -7.097 7.746 1.00 0.59 P ATOM 309 OP1 DG A 9 1.569 -6.627 8.890 1.00 0.76 O ATOM 310 OP2 DG A 9 -0.416 -6.324 7.280 1.00 0.67 O ATOM 311 O5' DG A 9 1.719 -7.382 6.480 1.00 0.64 O ATOM 312 C5' DG A 9 2.935 -8.146 6.594 1.00 0.58 C ATOM 313 C4' DG A 9 3.909 -7.806 5.479 1.00 0.43 C ATOM 314 O4' DG A 9 3.226 -7.997 4.211 1.00 0.38 O ATOM 315 C3' DG A 9 4.196 -6.201 5.551 1.00 0.33 C ATOM 316 O3' DG A 9 5.559 -5.929 5.873 1.00 0.28 O ATOM 317 C2' DG A 9 3.915 -5.727 4.025 1.00 0.26 C ATOM 318 C1' DG A 9 3.685 -7.056 3.219 1.00 0.25 C ATOM 319 N9 DG A 9 2.574 -6.917 2.237 1.00 0.21 N ATOM 320 C8 DG A 9 1.221 -6.727 2.456 1.00 0.24 C ATOM 321 N7 DG A 9 0.510 -6.675 1.367 1.00 0.23 N ATOM 322 C5 DG A 9 1.445 -6.838 0.354 1.00 0.18 C ATOM 323 C6 DG A 9 1.257 -6.866 -1.046 1.00 0.17 C ATOM 324 O6 DG A 9 0.212 -6.755 -1.684 1.00 0.21 O ATOM 325 N1 DG A 9 2.442 -7.048 -1.718 1.00 0.18 N ATOM 326 C2 DG A 9 3.677 -7.188 -1.127 1.00 0.20 C ATOM 327 N2 DG A 9 4.706 -7.345 -1.944 1.00 0.24 N ATOM 328 N3 DG A 9 3.868 -7.165 0.193 1.00 0.19 N ATOM 329 C4 DG A 9 2.707 -6.986 0.872 1.00 0.18 C ATOM 0 H5' DG A 9 2.702 -9.210 6.564 1.00 0.58 H new ATOM 0 H5'' DG A 9 3.401 -7.949 7.559 1.00 0.58 H new ATOM 0 H4' DG A 9 4.811 -8.412 5.570 1.00 0.43 H new ATOM 0 H3' DG A 9 3.591 -5.702 6.308 1.00 0.33 H new ATOM 0 H2' DG A 9 3.043 -5.076 3.969 1.00 0.26 H new ATOM 0 H2'' DG A 9 4.759 -5.165 3.625 1.00 0.26 H new ATOM 0 H1' DG A 9 4.592 -7.339 2.684 1.00 0.25 H new ATOM 0 H8 DG A 9 0.793 -6.630 3.443 1.00 0.24 H new ATOM 0 H1 DG A 9 2.403 -7.082 -2.737 1.00 0.18 H new ATOM 0 H21 DG A 9 5.647 -7.454 -1.565 1.00 0.24 H new ATOM 0 H22 DG A 9 4.559 -7.357 -2.953 1.00 0.24 H new ATOM 341 P DG A 10 6.078 -4.405 5.951 1.00 0.22 P ATOM 342 OP1 DG A 10 7.367 -4.395 6.681 1.00 0.29 O ATOM 343 OP2 DG A 10 4.968 -3.528 6.394 1.00 0.30 O ATOM 344 O5' DG A 10 6.334 -4.113 4.383 1.00 0.25 O ATOM 345 C5' DG A 10 7.213 -4.906 3.571 1.00 0.22 C ATOM 346 C4' DG A 10 7.297 -4.410 2.126 1.00 0.19 C ATOM 347 O4' DG A 10 6.115 -4.658 1.301 1.00 0.21 O ATOM 348 C3' DG A 10 7.510 -2.888 2.100 1.00 0.20 C ATOM 349 O3' DG A 10 8.778 -2.514 1.554 1.00 0.24 O ATOM 350 C2' DG A 10 6.259 -2.388 1.319 1.00 0.21 C ATOM 351 C1' DG A 10 5.906 -3.550 0.386 1.00 0.19 C ATOM 352 N9 DG A 10 4.473 -3.453 -0.016 1.00 0.17 N ATOM 353 C8 DG A 10 3.404 -3.384 0.850 1.00 0.21 C ATOM 354 N7 DG A 10 2.252 -3.304 0.253 1.00 0.24 N ATOM 355 C5 DG A 10 2.552 -3.324 -1.101 1.00 0.20 C ATOM 356 C6 DG A 10 1.673 -3.265 -2.216 1.00 0.22 C ATOM 357 O6 DG A 10 0.447 -3.189 -2.218 1.00 0.28 O ATOM 358 N1 DG A 10 2.337 -3.307 -3.415 1.00 0.19 N ATOM 359 C2 DG A 10 3.704 -3.395 -3.549 1.00 0.19 C ATOM 360 N2 DG A 10 4.204 -3.394 -4.775 1.00 0.24 N ATOM 361 N3 DG A 10 4.543 -3.454 -2.505 1.00 0.19 N ATOM 362 C4 DG A 10 3.907 -3.413 -1.301 1.00 0.17 C ATOM 0 H5' DG A 10 6.869 -5.940 3.575 1.00 0.22 H new ATOM 0 H5'' DG A 10 8.210 -4.900 4.011 1.00 0.22 H new ATOM 0 H4' DG A 10 8.128 -4.979 1.709 1.00 0.19 H new ATOM 0 H3' DG A 10 7.573 -2.425 3.085 1.00 0.20 H new ATOM 0 H2' DG A 10 5.435 -2.156 1.994 1.00 0.21 H new ATOM 0 H2'' DG A 10 6.477 -1.479 0.758 1.00 0.21 H new ATOM 0 H1' DG A 10 6.469 -3.608 -0.545 1.00 0.19 H new ATOM 0 H8 DG A 10 3.513 -3.395 1.924 1.00 0.21 H new ATOM 0 H1 DG A 10 1.778 -3.270 -4.268 1.00 0.19 H new ATOM 0 H21 DG A 10 5.212 -3.458 -4.915 1.00 0.24 H new ATOM 0 H22 DG A 10 3.581 -3.329 -5.580 1.00 0.24 H new ATOM 374 P DA A 11 9.266 -0.974 1.543 1.00 0.23 P ATOM 375 OP1 DA A 11 10.747 -0.953 1.508 1.00 0.32 O ATOM 376 OP2 DA A 11 8.532 -0.222 2.588 1.00 0.27 O ATOM 377 O5' DA A 11 8.671 -0.557 0.100 1.00 0.26 O ATOM 378 C5' DA A 11 8.955 -1.346 -1.067 1.00 0.26 C ATOM 379 C4' DA A 11 8.017 -1.059 -2.227 1.00 0.25 C ATOM 380 O4' DA A 11 6.615 -1.269 -1.889 1.00 0.27 O ATOM 381 C3' DA A 11 8.034 0.483 -2.536 1.00 0.23 C ATOM 382 O3' DA A 11 9.013 0.871 -3.499 1.00 0.28 O ATOM 383 C2' DA A 11 6.542 0.758 -3.069 1.00 0.22 C ATOM 384 C1' DA A 11 5.780 -0.580 -2.856 1.00 0.23 C ATOM 385 N9 DA A 11 4.435 -0.215 -2.343 1.00 0.23 N ATOM 386 C8 DA A 11 4.089 0.115 -1.069 1.00 0.23 C ATOM 387 N7 DA A 11 2.826 0.367 -0.888 1.00 0.25 N ATOM 388 C5 DA A 11 2.284 0.198 -2.150 1.00 0.24 C ATOM 389 C6 DA A 11 0.980 0.323 -2.631 1.00 0.24 C ATOM 390 N6 DA A 11 -0.072 0.628 -1.875 1.00 0.25 N ATOM 391 N1 DA A 11 0.782 0.092 -3.927 1.00 0.26 N ATOM 392 C2 DA A 11 1.799 -0.242 -4.706 1.00 0.26 C ATOM 393 N3 DA A 11 3.071 -0.396 -4.372 1.00 0.25 N ATOM 394 C4 DA A 11 3.253 -0.156 -3.054 1.00 0.23 C ATOM 0 H5' DA A 11 8.889 -2.403 -0.808 1.00 0.26 H new ATOM 0 H5'' DA A 11 9.981 -1.159 -1.383 1.00 0.26 H new ATOM 0 H4' DA A 11 8.353 -1.712 -3.033 1.00 0.25 H new ATOM 0 H3' DA A 11 8.308 1.066 -1.657 1.00 0.23 H new ATOM 0 H2' DA A 11 6.071 1.572 -2.518 1.00 0.22 H new ATOM 0 H2'' DA A 11 6.546 1.046 -4.120 1.00 0.22 H new ATOM 0 H1' DA A 11 5.620 -1.211 -3.730 1.00 0.23 H new ATOM 0 H8 DA A 11 4.810 0.164 -0.267 1.00 0.23 H new ATOM 0 H61 DA A 11 -0.998 0.703 -2.296 1.00 0.25 H new ATOM 0 H62 DA A 11 0.048 0.787 -0.875 1.00 0.25 H new ATOM 0 H2 DA A 11 1.561 -0.410 -5.746 1.00 0.26 H new ATOM 406 P DG A 12 9.079 2.382 -4.046 1.00 0.27 P ATOM 407 OP1 DG A 12 10.397 2.568 -4.688 1.00 0.38 O ATOM 408 OP2 DG A 12 8.625 3.318 -2.991 1.00 0.32 O ATOM 409 O5' DG A 12 7.966 2.301 -5.166 1.00 0.26 O ATOM 410 C5' DG A 12 8.030 1.265 -6.149 1.00 0.29 C ATOM 411 C4' DG A 12 6.977 1.496 -7.188 1.00 0.25 C ATOM 412 O4' DG A 12 5.693 1.545 -6.537 1.00 0.26 O ATOM 413 C3' DG A 12 7.195 2.906 -7.821 1.00 0.22 C ATOM 414 O3' DG A 12 7.007 2.839 -9.229 1.00 0.28 O ATOM 415 C2' DG A 12 6.099 3.792 -7.175 1.00 0.20 C ATOM 416 C1' DG A 12 5.004 2.730 -6.957 1.00 0.22 C ATOM 417 N9 DG A 12 3.999 3.040 -5.936 1.00 0.20 N ATOM 418 C8 DG A 12 4.115 3.280 -4.599 1.00 0.20 C ATOM 419 N7 DG A 12 2.975 3.447 -3.985 1.00 0.21 N ATOM 420 C5 DG A 12 2.048 3.312 -5.003 1.00 0.19 C ATOM 421 C6 DG A 12 0.644 3.392 -4.964 1.00 0.20 C ATOM 422 O6 DG A 12 -0.078 3.593 -3.989 1.00 0.24 O ATOM 423 N1 DG A 12 0.102 3.196 -6.215 1.00 0.19 N ATOM 424 C2 DG A 12 0.825 2.954 -7.365 1.00 0.19 C ATOM 425 N2 DG A 12 0.186 2.801 -8.508 1.00 0.22 N ATOM 426 N3 DG A 12 2.145 2.878 -7.407 1.00 0.19 N ATOM 427 C4 DG A 12 2.676 3.067 -6.190 1.00 0.18 C ATOM 0 H5' DG A 12 7.884 0.293 -5.678 1.00 0.29 H new ATOM 0 H5'' DG A 12 9.016 1.250 -6.613 1.00 0.29 H new ATOM 0 H4' DG A 12 7.026 0.705 -7.936 1.00 0.25 H new ATOM 0 H3' DG A 12 8.199 3.295 -7.649 1.00 0.22 H new ATOM 0 H2' DG A 12 6.428 4.251 -6.243 1.00 0.20 H new ATOM 0 H2'' DG A 12 5.774 4.600 -7.831 1.00 0.20 H new ATOM 0 H1' DG A 12 4.447 2.648 -7.891 1.00 0.22 H new ATOM 0 H8 DG A 12 5.067 3.328 -4.092 1.00 0.20 H new ATOM 0 H1 DG A 12 -0.914 3.233 -6.298 1.00 0.19 H new ATOM 0 H21 DG A 12 0.709 2.622 -9.365 1.00 0.22 H new ATOM 0 H22 DG A 12 -0.832 2.862 -8.535 1.00 0.22 H new ATOM 439 P DG A 13 7.224 4.149 -10.127 1.00 0.26 P ATOM 440 OP1 DG A 13 7.770 3.699 -11.422 1.00 0.38 O ATOM 441 OP2 DG A 13 7.934 5.180 -9.335 1.00 0.30 O ATOM 442 O5' DG A 13 5.713 4.641 -10.290 1.00 0.31 O ATOM 443 C5' DG A 13 4.808 4.036 -11.209 1.00 0.35 C ATOM 444 C4' DG A 13 3.507 4.797 -11.252 1.00 0.29 C ATOM 445 O4' DG A 13 2.784 4.707 -9.999 1.00 0.29 O ATOM 446 C3' DG A 13 3.758 6.294 -11.556 1.00 0.25 C ATOM 447 O3' DG A 13 3.031 6.620 -12.735 1.00 0.38 O ATOM 448 C2' DG A 13 3.135 6.956 -10.299 1.00 0.18 C ATOM 449 C1' DG A 13 2.074 5.931 -9.800 1.00 0.20 C ATOM 450 N9 DG A 13 1.783 6.129 -8.373 1.00 0.16 N ATOM 451 C8 DG A 13 2.636 6.287 -7.289 1.00 0.15 C ATOM 452 N7 DG A 13 1.972 6.460 -6.186 1.00 0.15 N ATOM 453 C5 DG A 13 0.637 6.417 -6.524 1.00 0.15 C ATOM 454 C6 DG A 13 -0.511 6.549 -5.708 1.00 0.17 C ATOM 455 O6 DG A 13 -0.568 6.732 -4.494 1.00 0.19 O ATOM 456 N1 DG A 13 -1.671 6.446 -6.445 1.00 0.18 N ATOM 457 C2 DG A 13 -1.725 6.236 -7.805 1.00 0.20 C ATOM 458 N2 DG A 13 -2.923 6.172 -8.362 1.00 0.25 N ATOM 459 N3 DG A 13 -0.644 6.112 -8.569 1.00 0.19 N ATOM 460 C4 DG A 13 0.504 6.213 -7.864 1.00 0.15 C ATOM 0 H5' DG A 13 4.621 3.003 -10.917 1.00 0.35 H new ATOM 0 H5'' DG A 13 5.254 4.011 -12.203 1.00 0.35 H new ATOM 0 H4' DG A 13 2.910 4.343 -12.043 1.00 0.29 H new ATOM 0 H3' DG A 13 4.792 6.593 -11.727 1.00 0.25 H new ATOM 0 H2' DG A 13 3.890 7.148 -9.537 1.00 0.18 H new ATOM 0 H2'' DG A 13 2.677 7.915 -10.542 1.00 0.18 H new ATOM 0 H1' DG A 13 1.109 5.994 -10.303 1.00 0.20 H new ATOM 0 H8 DG A 13 3.714 6.268 -7.354 1.00 0.15 H new ATOM 0 H1 DG A 13 -2.556 6.532 -5.946 1.00 0.18 H new ATOM 0 H21 DG A 13 -3.011 6.018 -9.366 1.00 0.25 H new ATOM 0 H22 DG A 13 -3.759 6.277 -7.787 1.00 0.25 H new ATOM 472 P DA A 14 2.643 8.119 -13.144 1.00 0.52 P ATOM 473 OP1 DA A 14 2.364 8.085 -14.596 1.00 0.70 O ATOM 474 OP2 DA A 14 3.651 9.061 -12.611 1.00 0.65 O ATOM 475 O5' DA A 14 1.283 8.343 -12.330 1.00 0.48 O ATOM 476 C5' DA A 14 0.083 7.746 -12.819 1.00 0.41 C ATOM 477 C4' DA A 14 -1.164 8.303 -12.158 1.00 0.37 C ATOM 478 O4' DA A 14 -1.152 8.002 -10.711 1.00 0.36 O ATOM 479 C3' DA A 14 -1.290 9.862 -12.255 1.00 0.39 C ATOM 480 O3' DA A 14 -2.646 10.336 -12.370 1.00 0.54 O ATOM 481 C2' DA A 14 -0.797 10.273 -10.872 1.00 0.28 C ATOM 482 C1' DA A 14 -1.405 9.198 -9.935 1.00 0.27 C ATOM 483 N9 DA A 14 -0.852 9.317 -8.548 1.00 0.21 N ATOM 484 C8 DA A 14 0.450 9.334 -8.087 1.00 0.18 C ATOM 485 N7 DA A 14 0.582 9.440 -6.807 1.00 0.17 N ATOM 486 C5 DA A 14 -0.719 9.504 -6.363 1.00 0.18 C ATOM 487 C6 DA A 14 -1.238 9.622 -5.091 1.00 0.21 C ATOM 488 N6 DA A 14 -0.480 9.688 -4.008 1.00 0.22 N ATOM 489 N1 DA A 14 -2.560 9.662 -4.993 1.00 0.26 N ATOM 490 C2 DA A 14 -3.339 9.591 -6.056 1.00 0.28 C ATOM 491 N3 DA A 14 -2.960 9.471 -7.322 1.00 0.27 N ATOM 492 C4 DA A 14 -1.609 9.434 -7.403 1.00 0.21 C ATOM 0 H5' DA A 14 0.125 6.669 -12.655 1.00 0.41 H new ATOM 0 H5'' DA A 14 0.018 7.902 -13.896 1.00 0.41 H new ATOM 0 H4' DA A 14 -1.992 7.835 -12.690 1.00 0.37 H new ATOM 0 H3' DA A 14 -0.763 10.251 -13.127 1.00 0.39 H new ATOM 0 H2' DA A 14 0.292 10.281 -10.820 1.00 0.28 H new ATOM 0 H2'' DA A 14 -1.136 11.274 -10.607 1.00 0.28 H new ATOM 0 H1' DA A 14 -2.466 9.258 -9.692 1.00 0.27 H new ATOM 0 H8 DA A 14 1.299 9.264 -8.751 1.00 0.18 H new ATOM 0 H61 DA A 14 -0.912 9.775 -3.088 1.00 0.22 H new ATOM 0 H62 DA A 14 0.536 9.652 -4.094 1.00 0.22 H new ATOM 0 H2 DA A 14 -4.403 9.636 -5.875 1.00 0.28 H new ATOM 504 P DT A 6L -3.034 11.921 -12.261 1.00 0.68 P ATOM 505 OP1 DT A 6L -4.175 12.144 -13.177 1.00 0.94 O ATOM 506 OP2 DT A 6L -1.807 12.735 -12.427 1.00 0.77 O ATOM 507 O5' DT A 6L -3.557 12.152 -10.751 1.00 0.68 O ATOM 508 C5' DT A 6L -4.925 11.846 -10.418 1.00 0.74 C ATOM 509 C4' DT A 6L -5.540 12.722 -9.329 1.00 0.62 C ATOM 510 O4' DT A 6L -4.791 12.601 -8.102 1.00 0.54 O ATOM 511 C3' DT A 6L -5.687 14.215 -9.663 1.00 0.60 C ATOM 512 O3' DT A 6L -6.839 14.664 -8.948 1.00 0.64 O ATOM 513 C2' DT A 6L -4.542 14.869 -8.814 1.00 0.52 C ATOM 514 C1' DT A 6L -4.437 13.884 -7.555 1.00 0.43 C ATOM 515 N1 DT A 6L -3.082 13.625 -6.995 1.00 0.34 N ATOM 516 C2 DT A 6L -2.840 13.709 -5.631 1.00 0.34 C ATOM 517 O2 DT A 6L -3.686 14.034 -4.805 1.00 0.41 O ATOM 518 N3 DT A 6L -1.549 13.381 -5.236 1.00 0.29 N ATOM 519 C4 DT A 6L -0.536 12.996 -6.022 1.00 0.25 C ATOM 520 O4 DT A 6L 0.554 12.729 -5.533 1.00 0.26 O ATOM 521 C5 DT A 6L -0.878 12.939 -7.388 1.00 0.26 C ATOM 522 C7 DT A 6L 0.154 12.469 -8.325 1.00 0.26 C ATOM 523 C6 DT A 6L -2.092 13.249 -7.831 1.00 0.30 C ATOM 0 H5' DT A 6L -4.981 10.805 -10.099 1.00 0.74 H new ATOM 0 H5'' DT A 6L -5.531 11.936 -11.320 1.00 0.74 H new ATOM 0 H4' DT A 6L -6.555 12.337 -9.231 1.00 0.62 H new ATOM 0 H3' DT A 6L -5.703 14.419 -10.734 1.00 0.60 H new ATOM 0 H2' DT A 6L -3.605 14.920 -9.368 1.00 0.52 H new ATOM 0 H2'' DT A 6L -4.791 15.887 -8.513 1.00 0.52 H new ATOM 0 HO3' DT A 6L -6.982 15.618 -9.123 1.00 0.64 H new ATOM 0 H1' DT A 6L -5.036 14.335 -6.764 1.00 0.43 H new ATOM 0 H3 DT A 6L -1.351 13.440 -4.237 1.00 0.29 H new ATOM 0 H71 DT A 6L -0.322 11.977 -9.173 1.00 0.26 H new ATOM 0 H72 DT A 6L 0.738 13.319 -8.679 1.00 0.26 H new ATOM 0 H73 DT A 6L 0.812 11.763 -7.818 1.00 0.26 H new ATOM 0 H6 DT A 6L -2.292 13.198 -8.891 1.00 0.30 H new ATOM 536 O5' DT A 10L -0.833 16.861 -2.444 1.00 1.16 O ATOM 537 C5' DT A 10L 0.075 17.091 -1.357 1.00 1.11 C ATOM 538 C4' DT A 10L -0.171 16.184 -0.173 1.00 1.02 C ATOM 539 O4' DT A 10L -1.506 16.368 0.325 1.00 1.24 O ATOM 540 C3' DT A 10L -0.023 14.726 -0.575 1.00 0.71 C ATOM 541 O3' DT A 10L 1.306 14.300 -0.349 1.00 0.68 O ATOM 542 C2' DT A 10L -0.908 14.097 0.444 1.00 0.91 C ATOM 543 C1' DT A 10L -2.052 15.075 0.599 1.00 1.05 C ATOM 544 N1 DT A 10L -3.276 14.839 -0.182 1.00 0.80 N ATOM 545 C2 DT A 10L -3.202 14.680 -1.549 1.00 0.65 C ATOM 546 O2 DT A 10L -2.172 14.719 -2.211 1.00 0.73 O ATOM 547 N3 DT A 10L -4.381 14.488 -2.176 1.00 0.52 N ATOM 548 C4 DT A 10L -5.627 14.438 -1.607 1.00 0.55 C ATOM 549 O4 DT A 10L -6.612 14.262 -2.312 1.00 0.64 O ATOM 550 C5 DT A 10L -5.622 14.612 -0.178 1.00 0.66 C ATOM 551 C7 DT A 10L -6.922 14.588 0.618 1.00 0.76 C ATOM 552 C6 DT A 10L -4.472 14.802 0.470 1.00 0.78 C ATOM 0 H5' DT A 10L -0.010 18.129 -1.035 1.00 1.11 H new ATOM 0 H5'' DT A 10L 1.097 16.949 -1.709 1.00 1.11 H new ATOM 0 H4' DT A 10L 0.561 16.437 0.594 1.00 1.02 H new ATOM 0 H3' DT A 10L -0.256 14.505 -1.616 1.00 0.71 H new ATOM 0 H2' DT A 10L -1.262 13.120 0.115 1.00 0.91 H new ATOM 0 H2'' DT A 10L -0.384 13.945 1.387 1.00 0.91 H new ATOM 0 HO5' DT A 10L -1.605 16.349 -2.123 1.00 1.16 H new ATOM 0 H1' DT A 10L -2.429 14.955 1.615 1.00 1.05 H new ATOM 0 H3 DT A 10L -4.341 14.366 -3.188 1.00 0.52 H new ATOM 0 H71 DT A 10L -7.737 14.956 -0.005 1.00 0.76 H new ATOM 0 H72 DT A 10L -7.138 13.567 0.931 1.00 0.76 H new ATOM 0 H73 DT A 10L -6.822 15.224 1.498 1.00 0.76 H new ATOM 0 H6 DT A 10L -4.489 14.930 1.542 1.00 0.78 H new ATOM 565 P DT A 15 2.346 14.119 -1.556 1.00 0.37 P ATOM 566 OP1 DT A 15 2.575 15.447 -2.168 1.00 0.65 O ATOM 567 OP2 DT A 15 1.892 12.978 -2.383 1.00 0.38 O ATOM 568 O5' DT A 15 3.655 13.743 -0.708 1.00 0.38 O ATOM 569 C5' DT A 15 3.621 12.754 0.324 1.00 0.41 C ATOM 570 C4' DT A 15 4.193 11.451 -0.167 1.00 0.34 C ATOM 571 O4' DT A 15 3.495 10.944 -1.318 1.00 0.32 O ATOM 572 C3' DT A 15 5.661 11.560 -0.582 1.00 0.33 C ATOM 573 O3' DT A 15 6.403 11.758 0.644 1.00 0.39 O ATOM 574 C2' DT A 15 5.640 10.030 -1.068 1.00 0.34 C ATOM 575 C1' DT A 15 4.281 9.907 -1.926 1.00 0.30 C ATOM 576 N1 DT A 15 4.294 10.071 -3.426 1.00 0.24 N ATOM 577 C2 DT A 15 3.063 9.926 -4.063 1.00 0.21 C ATOM 578 O2 DT A 15 2.042 9.697 -3.443 1.00 0.25 O ATOM 579 N3 DT A 15 3.022 10.043 -5.434 1.00 0.17 N ATOM 580 C4 DT A 15 4.103 10.290 -6.232 1.00 0.21 C ATOM 581 O4 DT A 15 3.945 10.368 -7.445 1.00 0.26 O ATOM 582 C5 DT A 15 5.353 10.430 -5.523 1.00 0.25 C ATOM 583 C7 DT A 15 6.630 10.673 -6.328 1.00 0.33 C ATOM 584 C6 DT A 15 5.419 10.327 -4.176 1.00 0.26 C ATOM 0 H5' DT A 15 2.594 12.603 0.656 1.00 0.41 H new ATOM 0 H5'' DT A 15 4.187 13.103 1.187 1.00 0.41 H new ATOM 0 H4' DT A 15 4.085 10.782 0.687 1.00 0.34 H new ATOM 0 H3' DT A 15 6.050 12.310 -1.271 1.00 0.33 H new ATOM 0 H2' DT A 15 6.515 9.792 -1.672 1.00 0.34 H new ATOM 0 H2'' DT A 15 5.640 9.343 -0.222 1.00 0.34 H new ATOM 0 H1' DT A 15 3.934 8.874 -1.882 1.00 0.30 H new ATOM 0 H3 DT A 15 2.115 9.937 -5.889 1.00 0.17 H new ATOM 0 H71 DT A 15 7.330 11.259 -5.732 1.00 0.33 H new ATOM 0 H72 DT A 15 7.085 9.717 -6.586 1.00 0.33 H new ATOM 0 H73 DT A 15 6.387 11.217 -7.241 1.00 0.33 H new ATOM 0 H6 DT A 15 6.371 10.448 -3.681 1.00 0.26 H new ATOM 597 P DG A 16 7.791 11.069 1.134 1.00 0.39 P ATOM 598 OP1 DG A 16 8.286 11.842 2.297 1.00 0.50 O ATOM 599 OP2 DG A 16 8.658 10.898 -0.056 1.00 0.46 O ATOM 600 O5' DG A 16 7.390 9.582 1.625 1.00 0.40 O ATOM 601 C5' DG A 16 6.280 9.272 2.481 1.00 0.40 C ATOM 602 C4' DG A 16 5.764 7.844 2.247 1.00 0.34 C ATOM 603 O4' DG A 16 5.435 7.688 0.846 1.00 0.34 O ATOM 604 C3' DG A 16 6.792 6.708 2.541 1.00 0.34 C ATOM 605 O3' DG A 16 6.378 5.759 3.524 1.00 0.35 O ATOM 606 C2' DG A 16 6.863 5.954 1.238 1.00 0.33 C ATOM 607 C1' DG A 16 5.562 6.295 0.522 1.00 0.30 C ATOM 608 N9 DG A 16 5.663 6.101 -0.935 1.00 0.27 N ATOM 609 C8 DG A 16 6.757 5.787 -1.735 1.00 0.30 C ATOM 610 N7 DG A 16 6.457 5.746 -2.998 1.00 0.27 N ATOM 611 C5 DG A 16 5.101 6.039 -3.039 1.00 0.22 C ATOM 612 C6 DG A 16 4.243 6.131 -4.143 1.00 0.20 C ATOM 613 O6 DG A 16 4.552 5.990 -5.322 1.00 0.21 O ATOM 614 N1 DG A 16 2.942 6.435 -3.774 1.00 0.17 N ATOM 615 C2 DG A 16 2.512 6.639 -2.502 1.00 0.18 C ATOM 616 N2 DG A 16 1.228 6.927 -2.327 1.00 0.21 N ATOM 617 N3 DG A 16 3.320 6.561 -1.448 1.00 0.21 N ATOM 618 C4 DG A 16 4.600 6.255 -1.789 1.00 0.22 C ATOM 0 H5' DG A 16 5.474 9.984 2.304 1.00 0.40 H new ATOM 0 H5'' DG A 16 6.581 9.384 3.523 1.00 0.40 H new ATOM 0 H4' DG A 16 4.924 7.742 2.934 1.00 0.34 H new ATOM 0 H3' DG A 16 7.714 7.155 2.914 1.00 0.34 H new ATOM 0 H2' DG A 16 7.730 6.259 0.651 1.00 0.33 H new ATOM 0 H2'' DG A 16 6.953 4.881 1.406 1.00 0.33 H new ATOM 0 H1' DG A 16 4.718 5.673 0.819 1.00 0.30 H new ATOM 0 H8 DG A 16 7.747 5.598 -1.348 1.00 0.30 H new ATOM 0 H1 DG A 16 2.250 6.512 -4.520 1.00 0.17 H new ATOM 0 H21 DG A 16 0.865 7.087 -1.387 1.00 0.21 H new ATOM 0 H22 DG A 16 0.605 6.988 -3.132 1.00 0.21 H new ATOM 630 P DG A 17 6.437 5.980 5.112 1.00 0.28 P ATOM 631 OP1 DG A 17 6.571 7.418 5.440 1.00 0.32 O ATOM 632 OP2 DG A 17 7.407 5.002 5.653 1.00 0.34 O ATOM 633 O5' DG A 17 4.948 5.517 5.485 1.00 0.36 O ATOM 634 C5' DG A 17 3.807 6.391 5.579 1.00 0.31 C ATOM 635 C4' DG A 17 2.494 5.630 5.372 1.00 0.29 C ATOM 636 O4' DG A 17 2.300 5.180 3.997 1.00 0.28 O ATOM 637 C3' DG A 17 2.542 4.322 6.194 1.00 0.28 C ATOM 638 O3' DG A 17 1.226 3.960 6.591 1.00 0.33 O ATOM 639 C2' DG A 17 3.101 3.288 5.187 1.00 0.26 C ATOM 640 C1' DG A 17 2.414 3.731 3.829 1.00 0.25 C ATOM 641 N9 DG A 17 3.263 3.481 2.638 1.00 0.23 N ATOM 642 C8 DG A 17 4.633 3.269 2.568 1.00 0.25 C ATOM 643 N7 DG A 17 5.069 3.134 1.353 1.00 0.26 N ATOM 644 C5 DG A 17 3.937 3.255 0.558 1.00 0.23 C ATOM 645 C6 DG A 17 3.830 3.189 -0.846 1.00 0.22 C ATOM 646 O6 DG A 17 4.720 3.007 -1.668 1.00 0.26 O ATOM 647 N1 DG A 17 2.534 3.353 -1.280 1.00 0.20 N ATOM 648 C2 DG A 17 1.451 3.557 -0.476 1.00 0.20 C ATOM 649 N2 DG A 17 0.275 3.657 -1.080 1.00 0.23 N ATOM 650 N3 DG A 17 1.526 3.627 0.861 1.00 0.21 N ATOM 651 C4 DG A 17 2.811 3.467 1.316 1.00 0.22 C ATOM 0 H5' DG A 17 3.891 7.181 4.833 1.00 0.31 H new ATOM 0 H5'' DG A 17 3.798 6.874 6.556 1.00 0.31 H new ATOM 0 H4' DG A 17 1.701 6.320 5.661 1.00 0.29 H new ATOM 0 H3' DG A 17 3.141 4.399 7.102 1.00 0.28 H new ATOM 0 H2' DG A 17 4.188 3.329 5.124 1.00 0.26 H new ATOM 0 H2'' DG A 17 2.835 2.267 5.463 1.00 0.26 H new ATOM 0 H1' DG A 17 1.484 3.188 3.660 1.00 0.25 H new ATOM 0 H8 DG A 17 5.272 3.221 3.437 1.00 0.25 H new ATOM 0 H1 DG A 17 2.370 3.319 -2.286 1.00 0.20 H new ATOM 0 H21 DG A 17 -0.570 3.810 -0.529 1.00 0.23 H new ATOM 0 H22 DG A 17 0.215 3.581 -2.095 1.00 0.23 H new ATOM 663 P DT A 18 0.883 2.673 7.494 1.00 0.28 P ATOM 664 OP1 DT A 18 0.460 3.161 8.824 1.00 0.40 O ATOM 665 OP2 DT A 18 1.973 1.676 7.384 1.00 0.29 O ATOM 666 O5' DT A 18 -0.389 2.106 6.702 1.00 0.34 O ATOM 667 C5' DT A 18 -1.567 2.858 6.363 1.00 0.34 C ATOM 668 C4' DT A 18 -2.264 2.189 5.175 1.00 0.29 C ATOM 669 O4' DT A 18 -1.344 2.238 4.066 1.00 0.31 O ATOM 670 C3' DT A 18 -2.553 0.718 5.531 1.00 0.32 C ATOM 671 O3' DT A 18 -3.957 0.527 5.714 1.00 0.40 O ATOM 672 C2' DT A 18 -2.147 -0.034 4.151 1.00 0.33 C ATOM 673 C1' DT A 18 -1.333 1.044 3.273 1.00 0.28 C ATOM 674 N1 DT A 18 0.071 0.583 3.115 1.00 0.25 N ATOM 675 C2 DT A 18 0.634 0.650 1.858 1.00 0.26 C ATOM 676 O2 DT A 18 0.039 1.018 0.852 1.00 0.30 O ATOM 677 N3 DT A 18 1.930 0.262 1.745 1.00 0.25 N ATOM 678 C4 DT A 18 2.737 -0.194 2.764 1.00 0.25 C ATOM 679 O4 DT A 18 3.896 -0.513 2.522 1.00 0.29 O ATOM 680 C5 DT A 18 2.086 -0.246 4.058 1.00 0.23 C ATOM 681 C7 DT A 18 2.850 -0.720 5.307 1.00 0.26 C ATOM 682 C6 DT A 18 0.803 0.132 4.184 1.00 0.24 C ATOM 0 H5' DT A 18 -1.299 3.884 6.112 1.00 0.34 H new ATOM 0 H5'' DT A 18 -2.242 2.905 7.217 1.00 0.34 H new ATOM 0 H4' DT A 18 -3.201 2.689 4.929 1.00 0.29 H new ATOM 0 H3' DT A 18 -2.039 0.380 6.431 1.00 0.32 H new ATOM 0 H2' DT A 18 -1.535 -0.913 4.353 1.00 0.33 H new ATOM 0 H2'' DT A 18 -3.034 -0.378 3.620 1.00 0.33 H new ATOM 0 H1' DT A 18 -1.764 1.190 2.283 1.00 0.28 H new ATOM 0 H3 DT A 18 2.347 0.313 0.815 1.00 0.25 H new ATOM 0 H71 DT A 18 3.613 -1.442 5.015 1.00 0.26 H new ATOM 0 H72 DT A 18 3.325 0.135 5.789 1.00 0.26 H new ATOM 0 H73 DT A 18 2.154 -1.189 6.003 1.00 0.26 H new ATOM 0 H6 DT A 18 0.334 0.079 5.155 1.00 0.24 H new ATOM 695 P DG A 19 -4.537 -0.776 6.491 1.00 0.41 P ATOM 696 OP1 DG A 19 -5.828 -0.387 7.105 1.00 0.55 O ATOM 697 OP2 DG A 19 -3.468 -1.361 7.332 1.00 0.46 O ATOM 698 O5' DG A 19 -4.837 -1.806 5.307 1.00 0.36 O ATOM 699 C5' DG A 19 -5.866 -1.532 4.344 1.00 0.35 C ATOM 700 C4' DG A 19 -6.223 -2.748 3.501 1.00 0.31 C ATOM 701 O4' DG A 19 -5.022 -3.271 2.918 1.00 0.30 O ATOM 702 C3' DG A 19 -6.817 -3.932 4.311 1.00 0.30 C ATOM 703 O3' DG A 19 -7.607 -4.714 3.420 1.00 0.32 O ATOM 704 C2' DG A 19 -5.569 -4.740 4.727 1.00 0.29 C ATOM 705 C1' DG A 19 -4.653 -4.570 3.439 1.00 0.27 C ATOM 706 N9 DG A 19 -3.215 -4.468 3.785 1.00 0.22 N ATOM 707 C8 DG A 19 -2.537 -4.612 4.980 1.00 0.26 C ATOM 708 N7 DG A 19 -1.254 -4.368 4.876 1.00 0.30 N ATOM 709 C5 DG A 19 -1.068 -4.052 3.533 1.00 0.24 C ATOM 710 C6 DG A 19 0.110 -3.695 2.800 1.00 0.26 C ATOM 711 O6 DG A 19 1.261 -3.575 3.204 1.00 0.33 O ATOM 712 N1 DG A 19 -0.166 -3.460 1.463 1.00 0.27 N ATOM 713 C2 DG A 19 -1.412 -3.562 0.918 1.00 0.29 C ATOM 714 N2 DG A 19 -1.561 -3.322 -0.359 1.00 0.39 N ATOM 715 N3 DG A 19 -2.503 -3.891 1.587 1.00 0.28 N ATOM 716 C4 DG A 19 -2.262 -4.119 2.880 1.00 0.22 C ATOM 0 H5' DG A 19 -5.539 -0.725 3.689 1.00 0.35 H new ATOM 0 H5'' DG A 19 -6.758 -1.180 4.862 1.00 0.35 H new ATOM 0 H4' DG A 19 -6.963 -2.395 2.783 1.00 0.31 H new ATOM 0 H3' DG A 19 -7.432 -3.633 5.159 1.00 0.30 H new ATOM 0 H2' DG A 19 -5.098 -4.338 5.624 1.00 0.29 H new ATOM 0 H2'' DG A 19 -5.803 -5.785 4.931 1.00 0.29 H new ATOM 0 H1' DG A 19 -4.790 -5.416 2.766 1.00 0.27 H new ATOM 0 H8 DG A 19 -3.016 -4.897 5.905 1.00 0.26 H new ATOM 0 H1 DG A 19 0.606 -3.196 0.852 1.00 0.27 H new ATOM 0 H21 DG A 19 -2.484 -3.393 -0.787 1.00 0.39 H new ATOM 0 H22 DG A 19 -0.754 -3.064 -0.927 1.00 0.39 H new ATOM 728 P DG A 20 -8.847 -5.577 3.945 1.00 0.26 P ATOM 729 OP1 DG A 20 -9.940 -4.669 4.361 1.00 0.36 O ATOM 730 OP2 DG A 20 -8.357 -6.627 4.866 1.00 0.35 O ATOM 731 O5' DG A 20 -9.292 -6.316 2.595 1.00 0.30 O ATOM 732 C5' DG A 20 -9.589 -5.715 1.324 1.00 0.34 C ATOM 733 C4' DG A 20 -9.158 -6.644 0.182 1.00 0.32 C ATOM 734 O4' DG A 20 -7.705 -6.846 0.191 1.00 0.30 O ATOM 735 C3' DG A 20 -9.708 -8.098 0.464 1.00 0.33 C ATOM 736 O3' DG A 20 -9.632 -8.876 -0.727 1.00 0.38 O ATOM 737 C2' DG A 20 -8.595 -8.734 1.348 1.00 0.29 C ATOM 738 C1' DG A 20 -7.269 -8.167 0.669 1.00 0.25 C ATOM 739 N9 DG A 20 -6.151 -7.996 1.632 1.00 0.23 N ATOM 740 C8 DG A 20 -6.119 -8.103 3.014 1.00 0.25 C ATOM 741 N7 DG A 20 -4.943 -7.868 3.521 1.00 0.27 N ATOM 742 C5 DG A 20 -4.140 -7.591 2.422 1.00 0.24 C ATOM 743 C6 DG A 20 -2.759 -7.266 2.367 1.00 0.26 C ATOM 744 O6 DG A 20 -1.958 -7.142 3.286 1.00 0.29 O ATOM 745 N1 DG A 20 -2.327 -7.061 1.082 1.00 0.26 N ATOM 746 C2 DG A 20 -3.117 -7.155 -0.028 1.00 0.26 C ATOM 747 N2 DG A 20 -2.545 -6.930 -1.197 1.00 0.30 N ATOM 748 N3 DG A 20 -4.416 -7.459 -0.005 1.00 0.25 N ATOM 749 C4 DG A 20 -4.862 -7.666 1.261 1.00 0.23 C ATOM 0 H5' DG A 20 -9.074 -4.758 1.237 1.00 0.34 H new ATOM 0 H5'' DG A 20 -10.657 -5.510 1.252 1.00 0.34 H new ATOM 0 H4' DG A 20 -9.518 -6.194 -0.743 1.00 0.32 H new ATOM 0 H3' DG A 20 -10.720 -8.067 0.869 1.00 0.33 H new ATOM 0 H2' DG A 20 -8.680 -8.432 2.392 1.00 0.29 H new ATOM 0 H2'' DG A 20 -8.630 -9.823 1.328 1.00 0.29 H new ATOM 0 H1' DG A 20 -6.885 -8.840 -0.098 1.00 0.25 H new ATOM 0 H8 DG A 20 -6.983 -8.356 3.610 1.00 0.25 H new ATOM 0 H1 DG A 20 -1.345 -6.821 0.945 1.00 0.26 H new ATOM 0 H21 DG A 20 -3.095 -6.989 -2.054 1.00 0.30 H new ATOM 0 H22 DG A 20 -1.553 -6.697 -1.243 1.00 0.30 H new ATOM 761 P DT A 21 -10.865 -9.153 -1.707 1.00 0.49 P ATOM 762 OP1 DT A 21 -11.170 -7.923 -2.480 1.00 0.84 O ATOM 763 OP2 DT A 21 -11.933 -9.852 -0.952 1.00 0.71 O ATOM 764 O5' DT A 21 -10.183 -10.233 -2.700 1.00 0.54 O ATOM 765 C5' DT A 21 -9.236 -9.888 -3.728 1.00 0.59 C ATOM 766 C4' DT A 21 -7.920 -10.641 -3.576 1.00 0.53 C ATOM 767 O4' DT A 21 -7.289 -10.379 -2.324 1.00 0.43 O ATOM 768 C3' DT A 21 -8.146 -12.229 -3.504 1.00 0.56 C ATOM 769 O3' DT A 21 -8.216 -12.761 -4.817 1.00 0.71 O ATOM 770 C2' DT A 21 -6.748 -12.604 -2.915 1.00 0.46 C ATOM 771 C1' DT A 21 -6.192 -11.299 -2.285 1.00 0.38 C ATOM 772 N1 DT A 21 -5.870 -11.434 -0.847 1.00 0.28 N ATOM 773 C2 DT A 21 -4.672 -10.900 -0.427 1.00 0.23 C ATOM 774 O2 DT A 21 -3.823 -10.391 -1.151 1.00 0.30 O ATOM 775 N3 DT A 21 -4.394 -10.973 0.887 1.00 0.21 N ATOM 776 C4 DT A 21 -5.166 -11.519 1.865 1.00 0.27 C ATOM 777 O4 DT A 21 -4.798 -11.515 3.033 1.00 0.38 O ATOM 778 C5 DT A 21 -6.403 -12.070 1.386 1.00 0.32 C ATOM 779 C7 DT A 21 -7.371 -12.709 2.431 1.00 0.46 C ATOM 780 C6 DT A 21 -6.722 -12.021 0.075 1.00 0.31 C ATOM 0 H5' DT A 21 -9.044 -8.815 -3.698 1.00 0.59 H new ATOM 0 H5'' DT A 21 -9.667 -10.107 -4.705 1.00 0.59 H new ATOM 0 H4' DT A 21 -7.333 -10.316 -4.435 1.00 0.53 H new ATOM 0 H3' DT A 21 -9.034 -12.566 -2.969 1.00 0.56 H new ATOM 0 H2' DT A 21 -6.837 -13.392 -2.167 1.00 0.46 H new ATOM 0 H2'' DT A 21 -6.083 -12.977 -3.694 1.00 0.46 H new ATOM 0 HO3' DT A 21 -8.352 -13.730 -4.770 1.00 0.71 H new ATOM 0 H1' DT A 21 -5.288 -11.010 -2.822 1.00 0.38 H new ATOM 0 H3 DT A 21 -3.504 -10.574 1.184 1.00 0.21 H new ATOM 0 H71 DT A 21 -8.400 -12.596 2.090 1.00 0.46 H new ATOM 0 H72 DT A 21 -7.139 -13.768 2.541 1.00 0.46 H new ATOM 0 H73 DT A 21 -7.250 -12.209 3.392 1.00 0.46 H new ATOM 0 H6 DT A 21 -7.656 -12.446 -0.261 1.00 0.31 H new TER 794 DT A 21 END