USER MOD reduce.3.24.130724 H: found=0, std=0, add=273, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 273 hydrogens (9 hets) HEADER DNA 18-JUL-11 2LG0 TITLE STRUCTURE OF THE DUPLEX CONTAINING (5'S)-8,5'-CYCLO-2'-DEOXYADENOSINE COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA (5'-D(*GP*TP*GP*CP*(02I)P*TP*GP*TP*TP*TP*GP*T)-3'); COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA (5'-D(*AP*CP*AP*AP*AP*CP*AP*TP*GP*CP*AP*C)-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 KEYWDS (5'S)-8,5'-CYCLO-2'-DEOXYADENOSINE, CYCLOPURINE, CYCLO-DA, DNA EXPDTA SOLUTION NMR AUTHOR H.HUANG,R.S.DAS,A.BASU,M.P.STONE REVDAT 1 27-JUN-12 2LG0 0 JRNL AUTH H.HUANG,R.S.DAS,A.K.BASU,M.P.STONE JRNL TITL STRUCTURE OF (5'S)-8,5'-CYCLO-2'-DEOXYGUANOSINE IN DNA. JRNL REF J.AM.CHEM.SOC. V. 133 20357 2011 JRNL REFN ISSN 0002-7863 JRNL PMID 22103478 JRNL DOI 10.1021/JA207407N REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : AMBER 10 REMARK 3 AUTHORS : CASE, DARDEN, CHEATHAM, III, SIMMERLING, WANG, REMARK 3 DUKE, LUO, AND KOLLM REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2LG0 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 28-JUL-11. REMARK 100 THE RCSB ID CODE IS RCSB102346. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303 REMARK 210 PH : 7.0 REMARK 210 IONIC STRENGTH : 100 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1.0 MM DNA (5'-D(*GP*TP*GP*CP* REMARK 210 TP*GP*TP*TP*TP*GP*T)-3'), 1.0 MM DNA (5'-D(*AP*CP*AP*AP*AP*CP*AP* REMARK 210 CP*GP*CP*AP*C)-3'), 100% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H NOESY; 2D 1H-1H COSY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 10 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : BACK CALCULATED DATA AGREE WITH REMARK 210 EXPERIMENTAL NOESY SPECTRUM REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 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: DIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B 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 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 3 O4' - C1' - N9 ANGL. DEV. = 2.0 DEGREES REMARK 500 DC A 4 N3 - C2 - O2 ANGL. DEV. = -4.6 DEGREES REMARK 500 DT A 6 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES REMARK 500 DT A 6 C6 - C5 - C7 ANGL. DEV. = -3.8 DEGREES REMARK 500 DT A 8 C6 - C5 - C7 ANGL. DEV. = -3.7 DEGREES REMARK 500 DT A 9 O4' - C1' - N1 ANGL. DEV. = 2.0 DEGREES REMARK 500 DT A 10 O4' - C1' - N1 ANGL. DEV. = 2.5 DEGREES REMARK 500 DG A 11 O4' - C1' - N9 ANGL. DEV. = 2.1 DEGREES REMARK 500 DG A 11 N1 - C6 - O6 ANGL. DEV. = -3.8 DEGREES REMARK 500 DT A 12 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES REMARK 500 DA B 13 C4 - C5 - C6 ANGL. DEV. = -3.4 DEGREES REMARK 500 DA B 13 C5 - C6 - N1 ANGL. DEV. = 3.4 DEGREES REMARK 500 DA B 13 N1 - C6 - N6 ANGL. DEV. = -4.4 DEGREES REMARK 500 DC B 14 N3 - C2 - O2 ANGL. DEV. = -4.9 DEGREES REMARK 500 DA B 15 C4 - C5 - C6 ANGL. DEV. = -3.2 DEGREES REMARK 500 DA B 15 C5 - C6 - N1 ANGL. DEV. = 3.7 DEGREES REMARK 500 DA B 15 N1 - C6 - N6 ANGL. DEV. = -4.8 DEGREES REMARK 500 DA B 16 C4 - C5 - C6 ANGL. DEV. = -3.5 DEGREES REMARK 500 DA B 16 C5 - C6 - N1 ANGL. DEV. = 3.9 DEGREES REMARK 500 DA B 16 N1 - C6 - N6 ANGL. DEV. = -4.6 DEGREES REMARK 500 DA B 17 C4 - C5 - C6 ANGL. DEV. = -3.2 DEGREES REMARK 500 DA B 17 C5 - C6 - N1 ANGL. DEV. = 3.7 DEGREES REMARK 500 DA B 17 N1 - C6 - N6 ANGL. DEV. = -4.3 DEGREES REMARK 500 DC B 18 N3 - C2 - O2 ANGL. DEV. = -4.5 DEGREES REMARK 500 DA B 19 C4 - C5 - C6 ANGL. DEV. = -3.2 DEGREES REMARK 500 DA B 19 C5 - C6 - N1 ANGL. DEV. = 3.8 DEGREES REMARK 500 DA B 19 N1 - C6 - N6 ANGL. DEV. = -4.4 DEGREES REMARK 500 DC B 22 N3 - C2 - O2 ANGL. DEV. = -4.5 DEGREES REMARK 500 DA B 23 C4 - C5 - C6 ANGL. DEV. = -3.4 DEGREES REMARK 500 DA B 23 C5 - C6 - N1 ANGL. DEV. = 3.7 DEGREES REMARK 500 DA B 23 N1 - C6 - N6 ANGL. DEV. = -4.8 DEGREES REMARK 500 DC B 24 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 DG A 1 0.06 SIDE CHAIN REMARK 500 DT A 2 0.08 SIDE CHAIN REMARK 500 DG A 11 0.06 SIDE CHAIN REMARK 500 DA B 15 0.06 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 17789 RELATED DB: BMRB DBREF 2LG0 A 1 12 PDB 2LG0 2LG0 1 12 DBREF 2LG0 B 13 24 PDB 2LG0 2LG0 13 24 SEQRES 1 A 12 DG DT DG DC 02I DT DG DT DT DT DG DT SEQRES 1 B 12 DA DC DA DA DA DC DA DT DG DC DA DC HET 02I A 5 30 HETNAM 02I (6S,7S,8S,10R)-4-AMINO-8-HYDROXY-7,8,9,10-TETRAHYDRO- HETNAM 2 02I 6H-7,10-EPOXYAZEPINO[1,2-E]PURIN-6-YL DIHYDROGEN HETNAM 3 02I PHOSPHATE FORMUL 1 02I C10 H12 N5 O6 P LINK O3' DC A 4 P 02I A 5 1555 1555 1.61 LINK O3' 02I A 5 P DT A 6 1555 1555 1.60 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 Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 2 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 8 DT C7 :methyl 150:sc=-0.000827 (180deg=-0.000827) USER MOD Single : A 9 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DT O3' : rot 180:sc= 0 USER MOD Single : B 13 DA O5' : rot 180:sc= 0 USER MOD Single : B 20 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 24 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 8.168 -7.501 -1.356 1.00 0.00 O ATOM 2 C5' DG A 1 9.422 -7.069 -1.875 1.00 0.00 C ATOM 3 C4' DG A 1 9.893 -5.707 -1.336 1.00 0.00 C ATOM 4 O4' DG A 1 9.076 -4.662 -1.840 1.00 0.00 O ATOM 5 C3' DG A 1 9.917 -5.609 0.186 1.00 0.00 C ATOM 6 O3' DG A 1 11.111 -4.935 0.535 1.00 0.00 O ATOM 7 C2' DG A 1 8.652 -4.821 0.507 1.00 0.00 C ATOM 8 C1' DG A 1 8.428 -3.995 -0.762 1.00 0.00 C ATOM 9 N9 DG A 1 7.000 -3.844 -1.121 1.00 0.00 N ATOM 10 C8 DG A 1 6.080 -4.827 -1.387 1.00 0.00 C ATOM 11 N7 DG A 1 4.944 -4.394 -1.862 1.00 0.00 N ATOM 12 C5 DG A 1 5.106 -2.997 -1.872 1.00 0.00 C ATOM 13 C6 DG A 1 4.249 -1.923 -2.315 1.00 0.00 C ATOM 14 O6 DG A 1 3.120 -1.958 -2.810 1.00 0.00 O ATOM 15 N1 DG A 1 4.838 -0.681 -2.211 1.00 0.00 N ATOM 16 C2 DG A 1 6.075 -0.463 -1.713 1.00 0.00 C ATOM 17 N2 DG A 1 6.474 0.774 -1.632 1.00 0.00 N ATOM 18 N3 DG A 1 6.907 -1.413 -1.301 1.00 0.00 N ATOM 19 C4 DG A 1 6.364 -2.662 -1.408 1.00 0.00 C ATOM 0 H5' DG A 1 9.353 -7.013 -2.961 1.00 0.00 H new ATOM 0 H5'' DG A 1 10.177 -7.820 -1.642 1.00 0.00 H new ATOM 0 H4' DG A 1 10.921 -5.607 -1.683 1.00 0.00 H new ATOM 0 H3' DG A 1 9.919 -6.551 0.734 1.00 0.00 H new ATOM 0 H2' DG A 1 7.808 -5.479 0.714 1.00 0.00 H new ATOM 0 H2'' DG A 1 8.784 -4.186 1.383 1.00 0.00 H new ATOM 0 HO5' DG A 1 7.935 -8.370 -1.744 1.00 0.00 H new ATOM 0 H1' DG A 1 8.828 -2.998 -0.574 1.00 0.00 H new ATOM 0 H8 DG A 1 6.280 -5.875 -1.217 1.00 0.00 H new ATOM 0 H1 DG A 1 4.305 0.127 -2.531 1.00 0.00 H new ATOM 0 H21 DG A 1 7.400 0.988 -1.262 1.00 0.00 H new ATOM 0 H22 DG A 1 5.860 1.529 -1.938 1.00 0.00 H new ATOM 32 P DT A 2 11.614 -4.834 2.056 1.00 0.00 P ATOM 33 OP1 DT A 2 13.092 -4.802 2.012 1.00 0.00 O ATOM 34 OP2 DT A 2 10.910 -5.881 2.825 1.00 0.00 O ATOM 35 O5' DT A 2 11.052 -3.380 2.464 1.00 0.00 O ATOM 36 C5' DT A 2 11.688 -2.217 1.954 1.00 0.00 C ATOM 37 C4' DT A 2 10.953 -0.898 2.226 1.00 0.00 C ATOM 38 O4' DT A 2 9.653 -0.918 1.655 1.00 0.00 O ATOM 39 C3' DT A 2 10.835 -0.491 3.701 1.00 0.00 C ATOM 40 O3' DT A 2 11.380 0.819 3.822 1.00 0.00 O ATOM 41 C2' DT A 2 9.324 -0.514 3.934 1.00 0.00 C ATOM 42 C1' DT A 2 8.789 -0.219 2.532 1.00 0.00 C ATOM 43 N1 DT A 2 7.392 -0.661 2.277 1.00 0.00 N ATOM 44 C2 DT A 2 6.507 0.254 1.683 1.00 0.00 C ATOM 45 O2 DT A 2 6.826 1.397 1.360 1.00 0.00 O ATOM 46 N3 DT A 2 5.246 -0.209 1.381 1.00 0.00 N ATOM 47 C4 DT A 2 4.831 -1.516 1.488 1.00 0.00 C ATOM 48 O4 DT A 2 3.759 -1.833 0.982 1.00 0.00 O ATOM 49 C5 DT A 2 5.787 -2.418 2.131 1.00 0.00 C ATOM 50 C7 DT A 2 5.427 -3.878 2.344 1.00 0.00 C ATOM 51 C6 DT A 2 7.017 -1.971 2.500 1.00 0.00 C ATOM 0 H5' DT A 2 11.809 -2.331 0.877 1.00 0.00 H new ATOM 0 H5'' DT A 2 12.688 -2.152 2.382 1.00 0.00 H new ATOM 0 H4' DT A 2 11.587 -0.147 1.755 1.00 0.00 H new ATOM 0 H3' DT A 2 11.358 -1.124 4.417 1.00 0.00 H new ATOM 0 H2' DT A 2 8.982 -1.479 4.308 1.00 0.00 H new ATOM 0 H2'' DT A 2 9.010 0.238 4.658 1.00 0.00 H new ATOM 0 H1' DT A 2 8.766 0.862 2.394 1.00 0.00 H new ATOM 0 H3 DT A 2 4.563 0.473 1.051 1.00 0.00 H new ATOM 0 H71 DT A 2 6.333 -4.484 2.315 1.00 0.00 H new ATOM 0 H72 DT A 2 4.942 -3.996 3.313 1.00 0.00 H new ATOM 0 H73 DT A 2 4.747 -4.204 1.557 1.00 0.00 H new ATOM 0 H6 DT A 2 7.710 -2.650 2.974 1.00 0.00 H new ATOM 64 P DG A 3 11.772 1.469 5.244 1.00 0.00 P ATOM 65 OP1 DG A 3 12.717 2.576 4.976 1.00 0.00 O ATOM 66 OP2 DG A 3 12.162 0.374 6.151 1.00 0.00 O ATOM 67 O5' DG A 3 10.371 2.092 5.731 1.00 0.00 O ATOM 68 C5' DG A 3 9.912 3.325 5.200 1.00 0.00 C ATOM 69 C4' DG A 3 8.462 3.663 5.573 1.00 0.00 C ATOM 70 O4' DG A 3 7.537 2.832 4.886 1.00 0.00 O ATOM 71 C3' DG A 3 8.119 3.613 7.070 1.00 0.00 C ATOM 72 O3' DG A 3 7.734 4.923 7.464 1.00 0.00 O ATOM 73 C2' DG A 3 6.950 2.626 7.106 1.00 0.00 C ATOM 74 C1' DG A 3 6.379 2.760 5.697 1.00 0.00 C ATOM 75 N9 DG A 3 5.519 1.635 5.265 1.00 0.00 N ATOM 76 C8 DG A 3 5.779 0.290 5.311 1.00 0.00 C ATOM 77 N7 DG A 3 4.841 -0.460 4.795 1.00 0.00 N ATOM 78 C5 DG A 3 3.865 0.465 4.386 1.00 0.00 C ATOM 79 C6 DG A 3 2.592 0.305 3.727 1.00 0.00 C ATOM 80 O6 DG A 3 2.032 -0.715 3.330 1.00 0.00 O ATOM 81 N1 DG A 3 1.935 1.496 3.501 1.00 0.00 N ATOM 82 C2 DG A 3 2.430 2.707 3.838 1.00 0.00 C ATOM 83 N2 DG A 3 1.697 3.749 3.569 1.00 0.00 N ATOM 84 N3 DG A 3 3.609 2.914 4.420 1.00 0.00 N ATOM 85 C4 DG A 3 4.280 1.750 4.676 1.00 0.00 C ATOM 0 H5' DG A 3 10.000 3.297 4.114 1.00 0.00 H new ATOM 0 H5'' DG A 3 10.563 4.125 5.552 1.00 0.00 H new ATOM 0 H4' DG A 3 8.374 4.705 5.265 1.00 0.00 H new ATOM 0 H3' DG A 3 8.924 3.306 7.738 1.00 0.00 H new ATOM 0 H2' DG A 3 7.281 1.609 7.317 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.218 2.888 7.870 1.00 0.00 H new ATOM 0 H1' DG A 3 5.717 3.623 5.634 1.00 0.00 H new ATOM 0 H8 DG A 3 6.684 -0.116 5.738 1.00 0.00 H new ATOM 0 H1 DG A 3 1.020 1.461 3.052 1.00 0.00 H new ATOM 0 H21 DG A 3 2.032 4.683 3.806 1.00 0.00 H new ATOM 0 H22 DG A 3 0.788 3.631 3.121 1.00 0.00 H new ATOM 97 P DC A 4 7.418 5.320 8.991 1.00 0.00 P ATOM 98 OP1 DC A 4 8.177 6.554 9.295 1.00 0.00 O ATOM 99 OP2 DC A 4 7.565 4.123 9.841 1.00 0.00 O ATOM 100 O5' DC A 4 5.858 5.697 8.884 1.00 0.00 O ATOM 101 C5' DC A 4 5.469 6.878 8.195 1.00 0.00 C ATOM 102 C4' DC A 4 3.956 7.027 7.994 1.00 0.00 C ATOM 103 O4' DC A 4 3.453 5.909 7.272 1.00 0.00 O ATOM 104 C3' DC A 4 3.142 7.173 9.286 1.00 0.00 C ATOM 105 O3' DC A 4 2.120 8.131 9.037 1.00 0.00 O ATOM 106 C2' DC A 4 2.606 5.761 9.474 1.00 0.00 C ATOM 107 C1' DC A 4 2.392 5.334 8.016 1.00 0.00 C ATOM 108 N1 DC A 4 2.367 3.863 7.785 1.00 0.00 N ATOM 109 C2 DC A 4 1.317 3.317 7.035 1.00 0.00 C ATOM 110 O2 DC A 4 0.456 4.020 6.506 1.00 0.00 O ATOM 111 N3 DC A 4 1.221 1.978 6.859 1.00 0.00 N ATOM 112 C4 DC A 4 2.129 1.203 7.406 1.00 0.00 C ATOM 113 N4 DC A 4 1.974 -0.075 7.229 1.00 0.00 N ATOM 114 C5 DC A 4 3.249 1.695 8.133 1.00 0.00 C ATOM 115 C6 DC A 4 3.341 3.040 8.296 1.00 0.00 C ATOM 0 H5' DC A 4 5.956 6.892 7.220 1.00 0.00 H new ATOM 0 H5'' DC A 4 5.837 7.743 8.747 1.00 0.00 H new ATOM 0 H4' DC A 4 3.835 7.959 7.443 1.00 0.00 H new ATOM 0 H3' DC A 4 3.676 7.519 10.171 1.00 0.00 H new ATOM 0 H2' DC A 4 3.315 5.116 9.993 1.00 0.00 H new ATOM 0 H2'' DC A 4 1.680 5.744 10.049 1.00 0.00 H new ATOM 0 H1' DC A 4 1.404 5.679 7.709 1.00 0.00 H new ATOM 0 H41 DC A 4 2.646 -0.730 7.629 1.00 0.00 H new ATOM 0 H42 DC A 4 1.181 -0.423 6.690 1.00 0.00 H new ATOM 0 H5 DC A 4 3.995 1.027 8.538 1.00 0.00 H new ATOM 0 H6 DC A 4 4.180 3.463 8.828 1.00 0.00 H new HETATM 127 P 02I A 5 1.192 8.762 10.192 1.00 0.00 P HETATM 128 N1 02I A 5 -2.978 1.829 8.808 1.00 0.00 N HETATM 129 C2 02I A 5 -4.010 2.560 8.419 1.00 0.00 C HETATM 130 N3 02I A 5 -4.071 3.875 8.299 1.00 0.00 N HETATM 131 C4 02I A 5 -2.903 4.453 8.659 1.00 0.00 C HETATM 132 C5 02I A 5 -1.754 3.856 9.096 1.00 0.00 C HETATM 133 C6 02I A 5 -1.846 2.447 9.137 1.00 0.00 C HETATM 134 N6 02I A 5 -0.873 1.629 9.483 1.00 0.00 N HETATM 135 N7 02I A 5 -0.764 4.824 9.371 1.00 0.00 N HETATM 136 C8 02I A 5 -1.385 5.949 9.113 1.00 0.00 C HETATM 137 N9 02I A 5 -2.647 5.788 8.646 1.00 0.00 N HETATM 138 C1' 02I A 5 -3.557 6.883 8.321 1.00 0.00 C HETATM 139 C2' 02I A 5 -4.119 7.436 9.613 1.00 0.00 C HETATM 140 OP2 02I A 5 0.660 10.030 9.650 1.00 0.00 O HETATM 141 C3' 02I A 5 -3.053 8.418 10.123 1.00 0.00 C HETATM 142 O3' 02I A 5 -3.704 9.666 10.262 1.00 0.00 O HETATM 143 C4' 02I A 5 -2.011 8.399 8.979 1.00 0.00 C HETATM 144 O4' 02I A 5 -2.758 7.954 7.842 1.00 0.00 O HETATM 145 C5' 02I A 5 -0.837 7.382 9.150 1.00 0.00 C HETATM 146 O5' 02I A 5 -0.015 7.680 10.284 1.00 0.00 O HETATM 156 OP1 02I A 5 1.969 8.763 11.449 1.00 0.00 O HETATM 0 H2N6 02I A 5 0.036 2.004 9.753 1.00 0.00 H new HETATM 0 H22' 02I A 5 -5.071 7.939 9.446 1.00 0.00 H new HETATM 0 H1N6 02I A 5 -1.029 0.621 9.481 1.00 0.00 H new HETATM 0 H12' 02I A 5 -4.301 6.641 10.336 1.00 0.00 H new HETATM 0 H5' 02I A 5 -0.153 7.478 8.307 1.00 0.00 H new HETATM 0 H4' 02I A 5 -1.550 9.385 8.923 1.00 0.00 H new HETATM 0 H3' 02I A 5 -2.581 8.191 11.079 1.00 0.00 H new HETATM 0 H2 02I A 5 -4.918 2.012 8.167 1.00 0.00 H new HETATM 0 H1' 02I A 5 -4.322 6.535 7.627 1.00 0.00 H new ATOM 157 P DT A 6 -4.343 10.087 11.665 1.00 0.00 P ATOM 158 OP1 DT A 6 -5.183 11.287 11.450 1.00 0.00 O ATOM 159 OP2 DT A 6 -3.260 10.129 12.662 1.00 0.00 O ATOM 160 O5' DT A 6 -5.322 8.871 12.085 1.00 0.00 O ATOM 161 C5' DT A 6 -6.649 8.782 11.583 1.00 0.00 C ATOM 162 C4' DT A 6 -7.343 7.461 11.952 1.00 0.00 C ATOM 163 O4' DT A 6 -6.585 6.346 11.492 1.00 0.00 O ATOM 164 C3' DT A 6 -7.603 7.286 13.454 1.00 0.00 C ATOM 165 O3' DT A 6 -8.955 6.878 13.628 1.00 0.00 O ATOM 166 C2' DT A 6 -6.594 6.206 13.834 1.00 0.00 C ATOM 167 C1' DT A 6 -6.445 5.400 12.539 1.00 0.00 C ATOM 168 N1 DT A 6 -5.142 4.677 12.422 1.00 0.00 N ATOM 169 C2 DT A 6 -5.162 3.297 12.150 1.00 0.00 C ATOM 170 O2 DT A 6 -6.192 2.664 11.941 1.00 0.00 O ATOM 171 N3 DT A 6 -3.951 2.642 12.148 1.00 0.00 N ATOM 172 C4 DT A 6 -2.728 3.223 12.396 1.00 0.00 C ATOM 173 O4 DT A 6 -1.730 2.511 12.401 1.00 0.00 O ATOM 174 C5 DT A 6 -2.763 4.668 12.615 1.00 0.00 C ATOM 175 C7 DT A 6 -1.476 5.437 12.861 1.00 0.00 C ATOM 176 C6 DT A 6 -3.946 5.339 12.616 1.00 0.00 C ATOM 0 H5' DT A 6 -6.629 8.885 10.498 1.00 0.00 H new ATOM 0 H5'' DT A 6 -7.235 9.615 11.971 1.00 0.00 H new ATOM 0 H4' DT A 6 -8.313 7.506 11.456 1.00 0.00 H new ATOM 0 H3' DT A 6 -7.482 8.178 14.069 1.00 0.00 H new ATOM 0 H2' DT A 6 -5.644 6.636 14.153 1.00 0.00 H new ATOM 0 H2'' DT A 6 -6.956 5.587 14.655 1.00 0.00 H new ATOM 0 H1' DT A 6 -7.197 4.611 12.507 1.00 0.00 H new ATOM 0 H3 DT A 6 -3.961 1.642 11.946 1.00 0.00 H new ATOM 0 H71 DT A 6 -1.583 6.454 12.485 1.00 0.00 H new ATOM 0 H72 DT A 6 -1.268 5.465 13.931 1.00 0.00 H new ATOM 0 H73 DT A 6 -0.653 4.943 12.344 1.00 0.00 H new ATOM 0 H6 DT A 6 -3.950 6.408 12.771 1.00 0.00 H new ATOM 189 P DG A 7 -9.629 6.668 15.074 1.00 0.00 P ATOM 190 OP1 DG A 7 -11.089 6.835 14.907 1.00 0.00 O ATOM 191 OP2 DG A 7 -8.898 7.505 16.052 1.00 0.00 O ATOM 192 O5' DG A 7 -9.320 5.117 15.372 1.00 0.00 O ATOM 193 C5' DG A 7 -9.887 4.098 14.558 1.00 0.00 C ATOM 194 C4' DG A 7 -9.400 2.688 14.921 1.00 0.00 C ATOM 195 O4' DG A 7 -8.031 2.530 14.584 1.00 0.00 O ATOM 196 C3' DG A 7 -9.571 2.295 16.398 1.00 0.00 C ATOM 197 O3' DG A 7 -10.445 1.173 16.479 1.00 0.00 O ATOM 198 C2' DG A 7 -8.138 1.957 16.815 1.00 0.00 C ATOM 199 C1' DG A 7 -7.473 1.598 15.488 1.00 0.00 C ATOM 200 N9 DG A 7 -5.999 1.738 15.510 1.00 0.00 N ATOM 201 C8 DG A 7 -5.268 2.896 15.564 1.00 0.00 C ATOM 202 N7 DG A 7 -3.976 2.719 15.614 1.00 0.00 N ATOM 203 C5 DG A 7 -3.833 1.321 15.584 1.00 0.00 C ATOM 204 C6 DG A 7 -2.674 0.462 15.632 1.00 0.00 C ATOM 205 O6 DG A 7 -1.479 0.747 15.702 1.00 0.00 O ATOM 206 N1 DG A 7 -2.983 -0.881 15.604 1.00 0.00 N ATOM 207 C2 DG A 7 -4.239 -1.366 15.500 1.00 0.00 C ATOM 208 N2 DG A 7 -4.369 -2.663 15.455 1.00 0.00 N ATOM 209 N3 DG A 7 -5.342 -0.623 15.472 1.00 0.00 N ATOM 210 C4 DG A 7 -5.074 0.718 15.512 1.00 0.00 C ATOM 0 H5' DG A 7 -9.646 4.300 13.514 1.00 0.00 H new ATOM 0 H5'' DG A 7 -10.973 4.134 14.647 1.00 0.00 H new ATOM 0 H4' DG A 7 -10.042 2.028 14.339 1.00 0.00 H new ATOM 0 H3' DG A 7 -10.012 3.059 17.038 1.00 0.00 H new ATOM 0 H2' DG A 7 -7.647 2.803 17.297 1.00 0.00 H new ATOM 0 H2'' DG A 7 -8.108 1.126 17.520 1.00 0.00 H new ATOM 0 H1' DG A 7 -7.647 0.553 15.230 1.00 0.00 H new ATOM 0 H8 DG A 7 -5.724 3.875 15.565 1.00 0.00 H new ATOM 0 H1 DG A 7 -2.215 -1.550 15.666 1.00 0.00 H new ATOM 0 H21 DG A 7 -5.296 -3.080 15.377 1.00 0.00 H new ATOM 0 H22 DG A 7 -3.543 -3.260 15.498 1.00 0.00 H new ATOM 222 P DT A 8 -11.032 0.615 17.874 1.00 0.00 P ATOM 223 OP1 DT A 8 -12.338 -0.021 17.593 1.00 0.00 O ATOM 224 OP2 DT A 8 -10.951 1.691 18.885 1.00 0.00 O ATOM 225 O5' DT A 8 -9.974 -0.538 18.275 1.00 0.00 O ATOM 226 C5' DT A 8 -9.913 -1.752 17.533 1.00 0.00 C ATOM 227 C4' DT A 8 -8.862 -2.755 18.037 1.00 0.00 C ATOM 228 O4' DT A 8 -7.552 -2.286 17.761 1.00 0.00 O ATOM 229 C3' DT A 8 -8.943 -3.105 19.532 1.00 0.00 C ATOM 230 O3' DT A 8 -9.220 -4.494 19.676 1.00 0.00 O ATOM 231 C2' DT A 8 -7.552 -2.731 20.049 1.00 0.00 C ATOM 232 C1' DT A 8 -6.686 -2.730 18.789 1.00 0.00 C ATOM 233 N1 DT A 8 -5.523 -1.807 18.887 1.00 0.00 N ATOM 234 C2 DT A 8 -4.231 -2.349 18.906 1.00 0.00 C ATOM 235 O2 DT A 8 -3.995 -3.550 18.901 1.00 0.00 O ATOM 236 N3 DT A 8 -3.188 -1.456 18.975 1.00 0.00 N ATOM 237 C4 DT A 8 -3.301 -0.089 19.073 1.00 0.00 C ATOM 238 O4 DT A 8 -2.279 0.583 19.156 1.00 0.00 O ATOM 239 C5 DT A 8 -4.675 0.414 19.070 1.00 0.00 C ATOM 240 C7 DT A 8 -4.943 1.904 19.182 1.00 0.00 C ATOM 241 C6 DT A 8 -5.725 -0.444 18.969 1.00 0.00 C ATOM 0 H5' DT A 8 -9.701 -1.516 16.490 1.00 0.00 H new ATOM 0 H5'' DT A 8 -10.893 -2.228 17.559 1.00 0.00 H new ATOM 0 H4' DT A 8 -9.089 -3.671 17.491 1.00 0.00 H new ATOM 0 H3' DT A 8 -9.731 -2.588 20.080 1.00 0.00 H new ATOM 0 H2' DT A 8 -7.554 -1.755 20.534 1.00 0.00 H new ATOM 0 H2'' DT A 8 -7.190 -3.451 20.783 1.00 0.00 H new ATOM 0 H1' DT A 8 -6.265 -3.720 18.615 1.00 0.00 H new ATOM 0 H3 DT A 8 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N3 DT A 9 -1.838 -2.657 22.062 1.00 0.00 N ATOM 269 C4 DT A 9 -2.649 -1.572 22.302 1.00 0.00 C ATOM 270 O4 DT A 9 -2.146 -0.457 22.401 1.00 0.00 O ATOM 271 C5 DT A 9 -4.073 -1.888 22.436 1.00 0.00 C ATOM 272 C7 DT A 9 -5.076 -0.779 22.701 1.00 0.00 C ATOM 273 C6 DT A 9 -4.510 -3.171 22.332 1.00 0.00 C ATOM 0 H5' DT A 9 -7.394 -6.452 19.818 1.00 0.00 H new ATOM 0 H5'' DT A 9 -7.916 -7.626 21.011 1.00 0.00 H new ATOM 0 H4' DT A 9 -5.570 -7.713 20.800 1.00 0.00 H new ATOM 0 H3' DT A 9 -6.674 -7.124 23.435 1.00 0.00 H new ATOM 0 H2' DT A 9 -5.194 -5.330 23.867 1.00 0.00 H new ATOM 0 H2'' DT A 9 -3.964 -6.577 23.933 1.00 0.00 H new ATOM 0 H1' DT A 9 -3.253 -6.189 21.695 1.00 0.00 H new ATOM 0 H3 DT A 9 -0.843 -2.474 21.933 1.00 0.00 H new ATOM 0 H71 DT A 9 -6.038 -1.046 22.263 1.00 0.00 H new ATOM 0 H72 DT A 9 -5.192 -0.643 23.776 1.00 0.00 H new ATOM 0 H73 DT A 9 -4.719 0.149 22.254 1.00 0.00 H new ATOM 0 H6 DT A 9 -5.564 -3.383 22.429 1.00 0.00 H new ATOM 286 P DT A 10 -5.105 -9.221 24.441 1.00 0.00 P ATOM 287 OP1 DT A 10 -5.177 -10.686 24.239 1.00 0.00 O ATOM 288 OP2 DT A 10 -6.016 -8.572 25.409 1.00 0.00 O ATOM 289 O5' DT A 10 -3.592 -8.839 24.845 1.00 0.00 O ATOM 290 C5' DT A 10 -2.491 -9.299 24.069 1.00 0.00 C ATOM 291 C4' DT A 10 -1.166 -8.632 24.467 1.00 0.00 C ATOM 292 O4' DT A 10 -1.233 -7.242 24.173 1.00 0.00 O ATOM 293 C3' DT A 10 -0.767 -8.787 25.946 1.00 0.00 C ATOM 294 O3' DT A 10 0.492 -9.446 26.069 1.00 0.00 O ATOM 295 C2' DT A 10 -0.692 -7.334 26.416 1.00 0.00 C ATOM 296 C1' DT A 10 -0.431 -6.568 25.118 1.00 0.00 C ATOM 297 N1 DT A 10 -0.804 -5.129 25.199 1.00 0.00 N ATOM 298 C2 DT A 10 0.203 -4.169 25.034 1.00 0.00 C ATOM 299 O2 DT A 10 1.377 -4.441 24.811 1.00 0.00 O ATOM 300 N3 DT A 10 -0.167 -2.852 25.169 1.00 0.00 N ATOM 301 C4 DT A 10 -1.418 -2.400 25.522 1.00 0.00 C ATOM 302 O4 DT A 10 -1.600 -1.194 25.678 1.00 0.00 O ATOM 303 C5 DT A 10 -2.429 -3.448 25.665 1.00 0.00 C ATOM 304 C7 DT A 10 -3.863 -3.081 26.009 1.00 0.00 C ATOM 305 C6 DT A 10 -2.098 -4.756 25.495 1.00 0.00 C ATOM 0 H5' DT A 10 -2.688 -9.105 23.015 1.00 0.00 H new ATOM 0 H5'' DT A 10 -2.398 -10.379 24.182 1.00 0.00 H new ATOM 0 H4' DT A 10 -0.403 -9.151 23.887 1.00 0.00 H new ATOM 0 H3' DT A 10 -1.460 -9.393 26.530 1.00 0.00 H new ATOM 0 H2' DT A 10 -1.619 -7.016 26.894 1.00 0.00 H new ATOM 0 H2'' DT A 10 0.108 -7.185 27.141 1.00 0.00 H new ATOM 0 H1' DT A 10 0.630 -6.555 24.868 1.00 0.00 H new ATOM 0 H3 DT A 10 0.549 -2.147 24.992 1.00 0.00 H new ATOM 0 H71 DT A 10 -4.541 -3.816 25.575 1.00 0.00 H new ATOM 0 H72 DT A 10 -3.986 -3.069 27.092 1.00 0.00 H new ATOM 0 H73 DT A 10 -4.092 -2.094 25.607 1.00 0.00 H new ATOM 0 H6 DT A 10 -2.861 -5.514 25.593 1.00 0.00 H new ATOM 318 P DG A 11 1.108 -9.886 27.500 1.00 0.00 P ATOM 319 OP1 DG A 11 1.960 -11.077 27.289 1.00 0.00 O ATOM 320 OP2 DG A 11 0.014 -9.938 28.494 1.00 0.00 O ATOM 321 O5' DG A 11 2.064 -8.643 27.881 1.00 0.00 O ATOM 322 C5' DG A 11 3.266 -8.396 27.161 1.00 0.00 C ATOM 323 C4' DG A 11 4.086 -7.220 27.721 1.00 0.00 C ATOM 324 O4' DG A 11 3.473 -5.988 27.357 1.00 0.00 O ATOM 325 C3' DG A 11 4.272 -7.244 29.251 1.00 0.00 C ATOM 326 O3' DG A 11 5.656 -7.142 29.596 1.00 0.00 O ATOM 327 C2' DG A 11 3.446 -6.029 29.672 1.00 0.00 C ATOM 328 C1' DG A 11 3.533 -5.102 28.456 1.00 0.00 C ATOM 329 N9 DG A 11 2.417 -4.123 28.393 1.00 0.00 N ATOM 330 C8 DG A 11 1.070 -4.387 28.392 1.00 0.00 C ATOM 331 N7 DG A 11 0.309 -3.328 28.475 1.00 0.00 N ATOM 332 C5 DG A 11 1.225 -2.265 28.485 1.00 0.00 C ATOM 333 C6 DG A 11 1.040 -0.838 28.592 1.00 0.00 C ATOM 334 O6 DG A 11 0.010 -0.177 28.734 1.00 0.00 O ATOM 335 N1 DG A 11 2.221 -0.126 28.577 1.00 0.00 N ATOM 336 C2 DG A 11 3.441 -0.697 28.462 1.00 0.00 C ATOM 337 N2 DG A 11 4.464 0.110 28.399 1.00 0.00 N ATOM 338 N3 DG A 11 3.672 -2.006 28.429 1.00 0.00 N ATOM 339 C4 DG A 11 2.519 -2.747 28.423 1.00 0.00 C ATOM 0 H5' DG A 11 3.021 -8.194 26.118 1.00 0.00 H new ATOM 0 H5'' DG A 11 3.880 -9.296 27.175 1.00 0.00 H new ATOM 0 H4' DG A 11 5.078 -7.321 27.282 1.00 0.00 H new ATOM 0 H3' DG A 11 3.953 -8.161 29.746 1.00 0.00 H new ATOM 0 H2' DG A 11 2.415 -6.302 29.896 1.00 0.00 H new ATOM 0 H2'' DG A 11 3.852 -5.557 30.567 1.00 0.00 H new ATOM 0 H1' DG A 11 4.436 -4.493 28.484 1.00 0.00 H new ATOM 0 H8 DG A 11 0.671 -5.389 28.328 1.00 0.00 H new ATOM 0 H1 DG A 11 2.171 0.890 28.657 1.00 0.00 H new ATOM 0 H21 DG A 11 5.407 -0.268 28.312 1.00 0.00 H new ATOM 0 H22 DG A 11 4.321 1.119 28.437 1.00 0.00 H new ATOM 351 P DT A 12 6.193 -7.192 31.120 1.00 0.00 P ATOM 352 OP1 DT A 12 7.596 -7.664 31.138 1.00 0.00 O ATOM 353 OP2 DT A 12 5.192 -7.827 32.000 1.00 0.00 O ATOM 354 O5' DT A 12 6.233 -5.637 31.504 1.00 0.00 O ATOM 355 C5' DT A 12 7.170 -4.766 30.897 1.00 0.00 C ATOM 356 C4' DT A 12 7.012 -3.345 31.441 1.00 0.00 C ATOM 357 O4' DT A 12 5.833 -2.750 30.947 1.00 0.00 O ATOM 358 C3' DT A 12 6.908 -3.276 32.971 1.00 0.00 C ATOM 359 O3' DT A 12 8.172 -3.113 33.595 1.00 0.00 O ATOM 360 C2' DT A 12 6.010 -2.064 33.203 1.00 0.00 C ATOM 361 C1' DT A 12 5.484 -1.689 31.812 1.00 0.00 C ATOM 362 N1 DT A 12 4.015 -1.493 31.827 1.00 0.00 N ATOM 363 C2 DT A 12 3.545 -0.188 31.998 1.00 0.00 C ATOM 364 O2 DT A 12 4.277 0.782 32.182 1.00 0.00 O ATOM 365 N3 DT A 12 2.185 -0.030 32.052 1.00 0.00 N ATOM 366 C4 DT A 12 1.254 -1.040 32.083 1.00 0.00 C ATOM 367 O4 DT A 12 0.078 -0.735 32.266 1.00 0.00 O ATOM 368 C5 DT A 12 1.808 -2.388 31.942 1.00 0.00 C ATOM 369 C7 DT A 12 0.890 -3.598 31.957 1.00 0.00 C ATOM 370 C6 DT A 12 3.150 -2.569 31.808 1.00 0.00 C ATOM 0 H5' DT A 12 7.028 -4.766 29.816 1.00 0.00 H new ATOM 0 H5'' DT A 12 8.182 -5.123 31.085 1.00 0.00 H new ATOM 0 H4' DT A 12 7.913 -2.825 31.114 1.00 0.00 H new ATOM 0 H3' DT A 12 6.514 -4.196 33.402 1.00 0.00 H new ATOM 0 H2' DT A 12 5.192 -2.303 33.883 1.00 0.00 H new ATOM 0 H2'' DT A 12 6.566 -1.240 33.650 1.00 0.00 H new ATOM 0 HO3' DT A 12 8.054 -3.073 34.567 1.00 0.00 H new ATOM 0 H1' DT A 12 5.921 -0.748 31.480 1.00 0.00 H new ATOM 0 H3 DT A 12 1.831 0.926 32.071 1.00 0.00 H new ATOM 0 H71 DT A 12 1.322 -4.390 31.346 1.00 0.00 H new ATOM 0 H72 DT A 12 0.772 -3.953 32.981 1.00 0.00 H new ATOM 0 H73 DT A 12 -0.084 -3.321 31.555 1.00 0.00 H new ATOM 0 H6 DT A 12 3.544 -3.567 31.685 1.00 0.00 H new TER 384 DT A 12 ATOM 385 O5' DA B 13 -2.427 9.471 29.882 1.00 0.00 O ATOM 386 C5' DA B 13 -1.548 10.232 30.711 1.00 0.00 C ATOM 387 C4' DA B 13 -0.078 9.768 30.699 1.00 0.00 C ATOM 388 O4' DA B 13 0.021 8.460 31.240 1.00 0.00 O ATOM 389 C3' DA B 13 0.582 9.769 29.319 1.00 0.00 C ATOM 390 O3' DA B 13 1.861 10.348 29.481 1.00 0.00 O ATOM 391 C2' DA B 13 0.653 8.291 28.958 1.00 0.00 C ATOM 392 C1' DA B 13 0.719 7.619 30.330 1.00 0.00 C ATOM 393 N9 DA B 13 0.057 6.298 30.340 1.00 0.00 N ATOM 394 C8 DA B 13 -1.254 6.010 30.047 1.00 0.00 C ATOM 395 N7 DA B 13 -1.582 4.756 30.205 1.00 0.00 N ATOM 396 C5 DA B 13 -0.377 4.172 30.637 1.00 0.00 C ATOM 397 C6 DA B 13 0.022 2.875 31.040 1.00 0.00 C ATOM 398 N6 DA B 13 -0.768 1.820 31.058 1.00 0.00 N ATOM 399 N1 DA B 13 1.258 2.640 31.477 1.00 0.00 N ATOM 400 C2 DA B 13 2.129 3.639 31.461 1.00 0.00 C ATOM 401 N3 DA B 13 1.905 4.906 31.132 1.00 0.00 N ATOM 402 C4 DA B 13 0.623 5.105 30.722 1.00 0.00 C ATOM 0 H5' DA B 13 -1.917 10.195 31.736 1.00 0.00 H new ATOM 0 H5'' DA B 13 -1.587 11.275 30.396 1.00 0.00 H new ATOM 0 H4' DA B 13 0.456 10.500 31.305 1.00 0.00 H new ATOM 0 H3' DA B 13 0.063 10.329 28.541 1.00 0.00 H new ATOM 0 H2' DA B 13 -0.220 7.969 28.390 1.00 0.00 H new ATOM 0 H2'' DA B 13 1.530 8.063 28.352 1.00 0.00 H new ATOM 0 HO5' DA B 13 -3.336 9.832 29.951 1.00 0.00 H new ATOM 0 H1' DA B 13 1.766 7.473 30.597 1.00 0.00 H new ATOM 0 H8 DA B 13 -1.956 6.760 29.713 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.405 0.916 31.362 1.00 0.00 H new ATOM 0 H62 DA B 13 -1.742 1.907 30.768 1.00 0.00 H new ATOM 0 H2 DA B 13 3.140 3.394 31.750 1.00 0.00 H new ATOM 415 P DC B 14 2.695 10.933 28.241 1.00 0.00 P ATOM 416 OP1 DC B 14 3.676 11.887 28.799 1.00 0.00 O ATOM 417 OP2 DC B 14 1.711 11.383 27.236 1.00 0.00 O ATOM 418 O5' DC B 14 3.447 9.603 27.723 1.00 0.00 O ATOM 419 C5' DC B 14 4.539 9.071 28.462 1.00 0.00 C ATOM 420 C4' DC B 14 4.938 7.633 28.095 1.00 0.00 C ATOM 421 O4' DC B 14 3.895 6.699 28.343 1.00 0.00 O ATOM 422 C3' DC B 14 5.440 7.404 26.663 1.00 0.00 C ATOM 423 O3' DC B 14 6.803 7.009 26.744 1.00 0.00 O ATOM 424 C2' DC B 14 4.562 6.253 26.166 1.00 0.00 C ATOM 425 C1' DC B 14 4.122 5.599 27.479 1.00 0.00 C ATOM 426 N1 DC B 14 2.898 4.751 27.401 1.00 0.00 N ATOM 427 C2 DC B 14 2.931 3.447 27.917 1.00 0.00 C ATOM 428 O2 DC B 14 3.968 2.927 28.324 1.00 0.00 O ATOM 429 N3 DC B 14 1.800 2.708 27.999 1.00 0.00 N ATOM 430 C4 DC B 14 0.685 3.208 27.521 1.00 0.00 C ATOM 431 N4 DC B 14 -0.364 2.445 27.621 1.00 0.00 N ATOM 432 C5 DC B 14 0.582 4.509 26.950 1.00 0.00 C ATOM 433 C6 DC B 14 1.719 5.253 26.906 1.00 0.00 C ATOM 0 H5' DC B 14 4.289 9.102 29.522 1.00 0.00 H new ATOM 0 H5'' DC B 14 5.404 9.719 28.319 1.00 0.00 H new ATOM 0 H4' DC B 14 5.787 7.468 28.758 1.00 0.00 H new ATOM 0 H3' DC B 14 5.383 8.272 26.007 1.00 0.00 H new ATOM 0 H2' DC B 14 3.713 6.610 25.583 1.00 0.00 H new ATOM 0 H2'' DC B 14 5.116 5.562 25.531 1.00 0.00 H new ATOM 0 H1' DC B 14 4.888 4.898 27.810 1.00 0.00 H new ATOM 0 H41 DC B 14 -1.265 2.769 27.270 1.00 0.00 H new ATOM 0 H42 DC B 14 -0.285 1.523 28.050 1.00 0.00 H new ATOM 0 H5 DC B 14 -0.356 4.887 26.570 1.00 0.00 H new ATOM 0 H6 DC B 14 1.695 6.245 26.479 1.00 0.00 H new ATOM 445 P DA B 15 7.761 6.927 25.450 1.00 0.00 P ATOM 446 OP1 DA B 15 9.132 7.247 25.905 1.00 0.00 O ATOM 447 OP2 DA B 15 7.136 7.717 24.370 1.00 0.00 O ATOM 448 O5' DA B 15 7.689 5.361 25.077 1.00 0.00 O ATOM 449 C5' DA B 15 8.387 4.403 25.861 1.00 0.00 C ATOM 450 C4' DA B 15 8.193 2.948 25.410 1.00 0.00 C ATOM 451 O4' DA B 15 6.868 2.507 25.673 1.00 0.00 O ATOM 452 C3' DA B 15 8.526 2.662 23.940 1.00 0.00 C ATOM 453 O3' DA B 15 9.524 1.647 23.923 1.00 0.00 O ATOM 454 C2' DA B 15 7.181 2.197 23.375 1.00 0.00 C ATOM 455 C1' DA B 15 6.455 1.665 24.611 1.00 0.00 C ATOM 456 N9 DA B 15 4.977 1.734 24.534 1.00 0.00 N ATOM 457 C8 DA B 15 4.192 2.848 24.367 1.00 0.00 C ATOM 458 N7 DA B 15 2.909 2.649 24.535 1.00 0.00 N ATOM 459 C5 DA B 15 2.850 1.266 24.782 1.00 0.00 C ATOM 460 C6 DA B 15 1.811 0.345 25.061 1.00 0.00 C ATOM 461 N6 DA B 15 0.534 0.657 25.153 1.00 0.00 N ATOM 462 N1 DA B 15 2.065 -0.942 25.268 1.00 0.00 N ATOM 463 C2 DA B 15 3.324 -1.349 25.190 1.00 0.00 C ATOM 464 N3 DA B 15 4.407 -0.607 24.977 1.00 0.00 N ATOM 465 C4 DA B 15 4.096 0.702 24.760 1.00 0.00 C ATOM 0 H5' DA B 15 8.063 4.495 26.898 1.00 0.00 H new ATOM 0 H5'' DA B 15 9.451 4.639 25.837 1.00 0.00 H new ATOM 0 H4' DA B 15 8.920 2.392 26.002 1.00 0.00 H new ATOM 0 H3' DA B 15 8.922 3.496 23.360 1.00 0.00 H new ATOM 0 H2' DA B 15 6.635 3.016 22.907 1.00 0.00 H new ATOM 0 H2'' DA B 15 7.307 1.424 22.617 1.00 0.00 H new ATOM 0 H1' DA B 15 6.702 0.610 24.729 1.00 0.00 H new ATOM 0 H8 DA B 15 4.602 3.815 24.116 1.00 0.00 H new ATOM 0 H61 DA B 15 -0.154 -0.067 25.358 1.00 0.00 H new ATOM 0 H62 DA B 15 0.234 1.623 25.020 1.00 0.00 H new ATOM 0 H2 DA B 15 3.490 -2.409 25.314 1.00 0.00 H new ATOM 477 P DA B 16 10.344 1.249 22.593 1.00 0.00 P ATOM 478 OP1 DA B 16 11.627 0.647 23.027 1.00 0.00 O ATOM 479 OP2 DA B 16 10.352 2.411 21.683 1.00 0.00 O ATOM 480 O5' DA B 16 9.419 0.089 21.973 1.00 0.00 O ATOM 481 C5' DA B 16 9.385 -1.194 22.580 1.00 0.00 C ATOM 482 C4' DA B 16 8.296 -2.117 22.020 1.00 0.00 C ATOM 483 O4' DA B 16 7.004 -1.613 22.314 1.00 0.00 O ATOM 484 C3' DA B 16 8.370 -2.398 20.512 1.00 0.00 C ATOM 485 O3' DA B 16 8.741 -3.760 20.332 1.00 0.00 O ATOM 486 C2' DA B 16 6.943 -2.107 20.036 1.00 0.00 C ATOM 487 C1' DA B 16 6.124 -2.112 21.328 1.00 0.00 C ATOM 488 N9 DA B 16 4.926 -1.248 21.284 1.00 0.00 N ATOM 489 C8 DA B 16 4.861 0.111 21.094 1.00 0.00 C ATOM 490 N7 DA B 16 3.663 0.621 21.212 1.00 0.00 N ATOM 491 C5 DA B 16 2.874 -0.513 21.484 1.00 0.00 C ATOM 492 C6 DA B 16 1.501 -0.742 21.739 1.00 0.00 C ATOM 493 N6 DA B 16 0.582 0.202 21.772 1.00 0.00 N ATOM 494 N1 DA B 16 1.031 -1.966 21.987 1.00 0.00 N ATOM 495 C2 DA B 16 1.895 -2.974 21.980 1.00 0.00 C ATOM 496 N3 DA B 16 3.205 -2.919 21.760 1.00 0.00 N ATOM 497 C4 DA B 16 3.633 -1.650 21.518 1.00 0.00 C ATOM 0 H5' DA B 16 9.230 -1.074 23.652 1.00 0.00 H new ATOM 0 H5'' DA B 16 10.356 -1.673 22.450 1.00 0.00 H new ATOM 0 H4' DA B 16 8.484 -3.066 22.522 1.00 0.00 H new ATOM 0 H3' DA B 16 9.099 -1.805 19.959 1.00 0.00 H new ATOM 0 H2' DA B 16 6.879 -1.146 19.525 1.00 0.00 H new ATOM 0 H2'' DA B 16 6.592 -2.865 19.336 1.00 0.00 H new ATOM 0 H1' DA B 16 5.752 -3.119 21.517 1.00 0.00 H new ATOM 0 H8 DA B 16 5.730 0.710 20.865 1.00 0.00 H new ATOM 0 H61 DA B 16 -0.391 -0.039 21.963 1.00 0.00 H new ATOM 0 H62 DA B 16 0.843 1.174 21.607 1.00 0.00 H new ATOM 0 H2 DA B 16 1.486 -3.954 22.176 1.00 0.00 H new ATOM 509 P DA B 17 9.065 -4.402 18.885 1.00 0.00 P ATOM 510 OP1 DA B 17 10.030 -5.506 19.091 1.00 0.00 O ATOM 511 OP2 DA B 17 9.380 -3.311 17.940 1.00 0.00 O ATOM 512 O5' DA B 17 7.646 -5.039 18.480 1.00 0.00 O ATOM 513 C5' DA B 17 7.114 -6.123 19.226 1.00 0.00 C ATOM 514 C4' DA B 17 5.669 -6.465 18.845 1.00 0.00 C ATOM 515 O4' DA B 17 4.801 -5.387 19.162 1.00 0.00 O ATOM 516 C3' DA B 17 5.465 -6.841 17.371 1.00 0.00 C ATOM 517 O3' DA B 17 4.962 -8.174 17.329 1.00 0.00 O ATOM 518 C2' DA B 17 4.457 -5.790 16.896 1.00 0.00 C ATOM 519 C1' DA B 17 3.775 -5.344 18.191 1.00 0.00 C ATOM 520 N9 DA B 17 3.231 -3.968 18.131 1.00 0.00 N ATOM 521 C8 DA B 17 3.904 -2.799 17.870 1.00 0.00 C ATOM 522 N7 DA B 17 3.166 -1.720 17.916 1.00 0.00 N ATOM 523 C5 DA B 17 1.899 -2.230 18.256 1.00 0.00 C ATOM 524 C6 DA B 17 0.622 -1.663 18.490 1.00 0.00 C ATOM 525 N6 DA B 17 0.356 -0.375 18.405 1.00 0.00 N ATOM 526 N1 DA B 17 -0.427 -2.421 18.812 1.00 0.00 N ATOM 527 C2 DA B 17 -0.243 -3.734 18.882 1.00 0.00 C ATOM 528 N3 DA B 17 0.881 -4.412 18.674 1.00 0.00 N ATOM 529 C4 DA B 17 1.928 -3.593 18.378 1.00 0.00 C ATOM 0 H5' DA B 17 7.155 -5.880 20.288 1.00 0.00 H new ATOM 0 H5'' DA B 17 7.741 -7.002 19.075 1.00 0.00 H new ATOM 0 H4' DA B 17 5.431 -7.352 19.432 1.00 0.00 H new ATOM 0 H3' DA B 17 6.355 -6.837 16.742 1.00 0.00 H new ATOM 0 H2' DA B 17 4.950 -4.958 16.394 1.00 0.00 H new ATOM 0 H2'' DA B 17 3.742 -6.210 16.189 1.00 0.00 H new ATOM 0 H1' DA B 17 2.922 -5.988 18.403 1.00 0.00 H new ATOM 0 H8 DA B 17 4.960 -2.773 17.644 1.00 0.00 H new ATOM 0 H61 DA B 17 -0.589 -0.036 18.587 1.00 0.00 H new ATOM 0 H62 DA B 17 1.095 0.283 18.157 1.00 0.00 H new ATOM 0 H2 DA B 17 -1.112 -4.322 19.139 1.00 0.00 H new ATOM 541 P DC B 18 4.765 -9.002 15.962 1.00 0.00 P ATOM 542 OP1 DC B 18 4.781 -10.444 16.296 1.00 0.00 O ATOM 543 OP2 DC B 18 5.715 -8.481 14.956 1.00 0.00 O ATOM 544 O5' DC B 18 3.261 -8.589 15.547 1.00 0.00 O ATOM 545 C5' DC B 18 2.165 -8.970 16.372 1.00 0.00 C ATOM 546 C4' DC B 18 0.826 -8.315 16.001 1.00 0.00 C ATOM 547 O4' DC B 18 0.867 -6.910 16.194 1.00 0.00 O ATOM 548 C3' DC B 18 0.325 -8.573 14.573 1.00 0.00 C ATOM 549 O3' DC B 18 -0.837 -9.394 14.638 1.00 0.00 O ATOM 550 C2' DC B 18 0.005 -7.163 14.064 1.00 0.00 C ATOM 551 C1' DC B 18 -0.117 -6.344 15.351 1.00 0.00 C ATOM 552 N1 DC B 18 0.139 -4.886 15.186 1.00 0.00 N ATOM 553 C2 DC B 18 -0.909 -3.970 15.359 1.00 0.00 C ATOM 554 O2 DC B 18 -2.065 -4.336 15.559 1.00 0.00 O ATOM 555 N3 DC B 18 -0.678 -2.637 15.302 1.00 0.00 N ATOM 556 C4 DC B 18 0.538 -2.224 15.030 1.00 0.00 C ATOM 557 N4 DC B 18 0.727 -0.938 15.000 1.00 0.00 N ATOM 558 C5 DC B 18 1.641 -3.096 14.806 1.00 0.00 C ATOM 559 C6 DC B 18 1.399 -4.431 14.892 1.00 0.00 C ATOM 0 H5' DC B 18 2.402 -8.720 17.406 1.00 0.00 H new ATOM 0 H5'' DC B 18 2.050 -10.053 16.324 1.00 0.00 H new ATOM 0 H4' DC B 18 0.123 -8.800 16.678 1.00 0.00 H new ATOM 0 H3' DC B 18 1.031 -9.090 13.923 1.00 0.00 H new ATOM 0 H2' DC B 18 0.794 -6.780 13.417 1.00 0.00 H new ATOM 0 H2'' DC B 18 -0.919 -7.144 13.486 1.00 0.00 H new ATOM 0 H1' DC B 18 -1.137 -6.391 15.734 1.00 0.00 H new ATOM 0 H41 DC B 18 1.653 -0.563 14.794 1.00 0.00 H new ATOM 0 H42 DC B 18 -0.051 -0.304 15.183 1.00 0.00 H new ATOM 0 H5 DC B 18 2.625 -2.714 14.578 1.00 0.00 H new ATOM 0 H6 DC B 18 2.201 -5.135 14.728 1.00 0.00 H new ATOM 571 P DA B 19 -1.481 -10.096 13.339 1.00 0.00 P ATOM 572 OP1 DA B 19 -2.252 -11.270 13.801 1.00 0.00 O ATOM 573 OP2 DA B 19 -0.418 -10.282 12.330 1.00 0.00 O ATOM 574 O5' DA B 19 -2.525 -8.991 12.796 1.00 0.00 O ATOM 575 C5' DA B 19 -3.786 -8.810 13.432 1.00 0.00 C ATOM 576 C4' DA B 19 -4.664 -7.724 12.787 1.00 0.00 C ATOM 577 O4' DA B 19 -4.161 -6.431 13.086 1.00 0.00 O ATOM 578 C3' DA B 19 -4.847 -7.839 11.264 1.00 0.00 C ATOM 579 O3' DA B 19 -6.220 -8.093 10.968 1.00 0.00 O ATOM 580 C2' DA B 19 -4.371 -6.468 10.767 1.00 0.00 C ATOM 581 C1' DA B 19 -4.453 -5.571 12.004 1.00 0.00 C ATOM 582 N9 DA B 19 -3.458 -4.471 12.017 1.00 0.00 N ATOM 583 C8 DA B 19 -2.092 -4.587 12.063 1.00 0.00 C ATOM 584 N7 DA B 19 -1.448 -3.453 12.121 1.00 0.00 N ATOM 585 C5 DA B 19 -2.488 -2.507 12.128 1.00 0.00 C ATOM 586 C6 DA B 19 -2.555 -1.094 12.200 1.00 0.00 C ATOM 587 N6 DA B 19 -1.503 -0.306 12.306 1.00 0.00 N ATOM 588 N1 DA B 19 -3.722 -0.449 12.178 1.00 0.00 N ATOM 589 C2 DA B 19 -4.827 -1.180 12.096 1.00 0.00 C ATOM 590 N3 DA B 19 -4.932 -2.505 12.029 1.00 0.00 N ATOM 591 C4 DA B 19 -3.714 -3.117 12.056 1.00 0.00 C ATOM 0 H5' DA B 19 -3.620 -8.554 14.478 1.00 0.00 H new ATOM 0 H5'' DA B 19 -4.327 -9.756 13.418 1.00 0.00 H new ATOM 0 H4' DA B 19 -5.649 -7.883 13.227 1.00 0.00 H new ATOM 0 H3' DA B 19 -4.298 -8.654 10.791 1.00 0.00 H new ATOM 0 H2' DA B 19 -3.354 -6.517 10.377 1.00 0.00 H new ATOM 0 H2'' DA B 19 -5.004 -6.095 9.962 1.00 0.00 H new ATOM 0 H1' DA B 19 -5.432 -5.094 12.039 1.00 0.00 H new ATOM 0 H8 DA B 19 -1.588 -5.542 12.052 1.00 0.00 H new ATOM 0 H61 DA B 19 -1.626 0.705 12.353 1.00 0.00 H new ATOM 0 H62 DA B 19 -0.566 -0.708 12.341 1.00 0.00 H new ATOM 0 H2 DA B 19 -5.757 -0.631 12.082 1.00 0.00 H new ATOM 603 P DT B 20 -6.732 -8.545 9.503 1.00 0.00 P ATOM 604 OP1 DT B 20 -8.037 -9.228 9.656 1.00 0.00 O ATOM 605 OP2 DT B 20 -5.628 -9.231 8.801 1.00 0.00 O ATOM 606 O5' DT B 20 -6.992 -7.134 8.772 1.00 0.00 O ATOM 607 C5' DT B 20 -8.084 -6.317 9.167 1.00 0.00 C ATOM 608 C4' DT B 20 -8.050 -4.918 8.542 1.00 0.00 C ATOM 609 O4' DT B 20 -6.925 -4.191 9.013 1.00 0.00 O ATOM 610 C3' DT B 20 -8.040 -4.884 7.003 1.00 0.00 C ATOM 611 O3' DT B 20 -9.246 -4.266 6.555 1.00 0.00 O ATOM 612 C2' DT B 20 -6.784 -4.057 6.707 1.00 0.00 C ATOM 613 C1' DT B 20 -6.565 -3.273 8.003 1.00 0.00 C ATOM 614 N1 DT B 20 -5.171 -2.791 8.225 1.00 0.00 N ATOM 615 C2 DT B 20 -4.974 -1.419 8.447 1.00 0.00 C ATOM 616 O2 DT B 20 -5.876 -0.589 8.418 1.00 0.00 O ATOM 617 N3 DT B 20 -3.687 -1.008 8.700 1.00 0.00 N ATOM 618 C4 DT B 20 -2.574 -1.810 8.727 1.00 0.00 C ATOM 619 O4 DT B 20 -1.486 -1.295 8.973 1.00 0.00 O ATOM 620 C5 DT B 20 -2.836 -3.227 8.463 1.00 0.00 C ATOM 621 C7 DT B 20 -1.687 -4.220 8.440 1.00 0.00 C ATOM 622 C6 DT B 20 -4.103 -3.668 8.237 1.00 0.00 C ATOM 0 H5' DT B 20 -8.084 -6.223 10.253 1.00 0.00 H new ATOM 0 H5'' DT B 20 -9.016 -6.809 8.890 1.00 0.00 H new ATOM 0 H4' DT B 20 -8.988 -4.461 8.856 1.00 0.00 H new ATOM 0 H3' DT B 20 -8.007 -5.851 6.502 1.00 0.00 H new ATOM 0 H2' DT B 20 -5.930 -4.692 6.472 1.00 0.00 H new ATOM 0 H2'' DT B 20 -6.931 -3.393 5.855 1.00 0.00 H new ATOM 0 H1' DT B 20 -7.152 -2.355 7.984 1.00 0.00 H new ATOM 0 H3 DT B 20 -3.546 -0.015 8.885 1.00 0.00 H new ATOM 0 H71 DT B 20 -2.045 -5.198 8.760 1.00 0.00 H new ATOM 0 H72 DT B 20 -1.289 -4.293 7.428 1.00 0.00 H new ATOM 0 H73 DT B 20 -0.901 -3.882 9.115 1.00 0.00 H new ATOM 0 H6 DT B 20 -4.277 -4.720 8.064 1.00 0.00 H new ATOM 635 P DG B 21 -9.678 -4.170 4.999 1.00 0.00 P ATOM 636 OP1 DG B 21 -11.147 -3.986 4.942 1.00 0.00 O ATOM 637 OP2 DG B 21 -9.052 -5.285 4.258 1.00 0.00 O ATOM 638 O5' DG B 21 -8.976 -2.796 4.539 1.00 0.00 O ATOM 639 C5' DG B 21 -9.361 -1.553 5.115 1.00 0.00 C ATOM 640 C4' DG B 21 -8.406 -0.402 4.766 1.00 0.00 C ATOM 641 O4' DG B 21 -7.134 -0.621 5.361 1.00 0.00 O ATOM 642 C3' DG B 21 -8.187 -0.163 3.264 1.00 0.00 C ATOM 643 O3' DG B 21 -8.681 1.121 2.900 1.00 0.00 O ATOM 644 C2' DG B 21 -6.667 -0.260 3.127 1.00 0.00 C ATOM 645 C1' DG B 21 -6.163 -0.001 4.545 1.00 0.00 C ATOM 646 N9 DG B 21 -4.830 -0.590 4.806 1.00 0.00 N ATOM 647 C8 DG B 21 -4.466 -1.911 4.754 1.00 0.00 C ATOM 648 N7 DG B 21 -3.204 -2.137 5.004 1.00 0.00 N ATOM 649 C5 DG B 21 -2.690 -0.857 5.276 1.00 0.00 C ATOM 650 C6 DG B 21 -1.367 -0.402 5.626 1.00 0.00 C ATOM 651 O6 DG B 21 -0.332 -1.048 5.790 1.00 0.00 O ATOM 652 N1 DG B 21 -1.273 0.966 5.759 1.00 0.00 N ATOM 653 C2 DG B 21 -2.308 1.814 5.571 1.00 0.00 C ATOM 654 N2 DG B 21 -2.066 3.089 5.675 1.00 0.00 N ATOM 655 N3 DG B 21 -3.541 1.449 5.232 1.00 0.00 N ATOM 656 C4 DG B 21 -3.678 0.095 5.121 1.00 0.00 C ATOM 0 H5' DG B 21 -9.408 -1.661 6.199 1.00 0.00 H new ATOM 0 H5'' DG B 21 -10.365 -1.299 4.776 1.00 0.00 H new ATOM 0 H4' DG B 21 -8.900 0.486 5.160 1.00 0.00 H new ATOM 0 H3' DG B 21 -8.706 -0.867 2.613 1.00 0.00 H new ATOM 0 H2' DG B 21 -6.359 -1.241 2.764 1.00 0.00 H new ATOM 0 H2'' DG B 21 -6.280 0.476 2.423 1.00 0.00 H new ATOM 0 H1' DG B 21 -6.038 1.066 4.730 1.00 0.00 H new ATOM 0 H8 DG B 21 -5.166 -2.701 4.525 1.00 0.00 H new ATOM 0 H1 DG B 21 -0.368 1.362 6.015 1.00 0.00 H new ATOM 0 H21 DG B 21 -2.819 3.764 5.541 1.00 0.00 H new ATOM 0 H22 DG B 21 -1.123 3.413 5.891 1.00 0.00 H new ATOM 668 P DC B 22 -8.717 1.633 1.370 1.00 0.00 P ATOM 669 OP1 DC B 22 -9.866 2.557 1.224 1.00 0.00 O ATOM 670 OP2 DC B 22 -8.606 0.457 0.480 1.00 0.00 O ATOM 671 O5' DC B 22 -7.348 2.480 1.256 1.00 0.00 O ATOM 672 C5' DC B 22 -7.187 3.709 1.958 1.00 0.00 C ATOM 673 C4' DC B 22 -5.790 4.334 1.802 1.00 0.00 C ATOM 674 O4' DC B 22 -4.808 3.512 2.418 1.00 0.00 O ATOM 675 C3' DC B 22 -5.361 4.611 0.353 1.00 0.00 C ATOM 676 O3' DC B 22 -5.275 6.018 0.129 1.00 0.00 O ATOM 677 C2' DC B 22 -4.002 3.914 0.259 1.00 0.00 C ATOM 678 C1' DC B 22 -3.591 3.631 1.707 1.00 0.00 C ATOM 679 N1 DC B 22 -2.814 2.365 1.849 1.00 0.00 N ATOM 680 C2 DC B 22 -1.455 2.403 2.189 1.00 0.00 C ATOM 681 O2 DC B 22 -0.844 3.462 2.315 1.00 0.00 O ATOM 682 N3 DC B 22 -0.755 1.253 2.368 1.00 0.00 N ATOM 683 C4 DC B 22 -1.385 0.111 2.227 1.00 0.00 C ATOM 684 N4 DC B 22 -0.685 -0.960 2.467 1.00 0.00 N ATOM 685 C5 DC B 22 -2.754 -0.002 1.860 1.00 0.00 C ATOM 686 C6 DC B 22 -3.439 1.157 1.675 1.00 0.00 C ATOM 0 H5' DC B 22 -7.383 3.540 3.017 1.00 0.00 H new ATOM 0 H5'' DC B 22 -7.934 4.419 1.604 1.00 0.00 H new ATOM 0 H4' DC B 22 -5.865 5.304 2.294 1.00 0.00 H new ATOM 0 H3' DC B 22 -6.058 4.247 -0.402 1.00 0.00 H new ATOM 0 H2' DC B 22 -4.072 2.991 -0.317 1.00 0.00 H new ATOM 0 H2'' DC B 22 -3.269 4.547 -0.241 1.00 0.00 H new ATOM 0 H1' DC B 22 -2.944 4.427 2.077 1.00 0.00 H new ATOM 0 H41 DC B 22 -1.114 -1.881 2.376 1.00 0.00 H new ATOM 0 H42 DC B 22 0.293 -0.878 2.746 1.00 0.00 H new ATOM 0 H5 DC B 22 -3.228 -0.964 1.734 1.00 0.00 H new ATOM 0 H6 DC B 22 -4.480 1.126 1.390 1.00 0.00 H new ATOM 698 P DA B 23 -5.067 6.653 -1.343 1.00 0.00 P ATOM 699 OP1 DA B 23 -5.587 8.039 -1.333 1.00 0.00 O ATOM 700 OP2 DA B 23 -5.561 5.693 -2.351 1.00 0.00 O ATOM 701 O5' DA B 23 -3.465 6.728 -1.481 1.00 0.00 O ATOM 702 C5' DA B 23 -2.714 7.666 -0.723 1.00 0.00 C ATOM 703 C4' DA B 23 -1.201 7.464 -0.880 1.00 0.00 C ATOM 704 O4' DA B 23 -0.825 6.232 -0.280 1.00 0.00 O ATOM 705 C3' DA B 23 -0.698 7.477 -2.333 1.00 0.00 C ATOM 706 O3' DA B 23 0.177 8.584 -2.551 1.00 0.00 O ATOM 707 C2' DA B 23 0.021 6.132 -2.445 1.00 0.00 C ATOM 708 C1' DA B 23 0.255 5.686 -1.003 1.00 0.00 C ATOM 709 N9 DA B 23 0.274 4.212 -0.851 1.00 0.00 N ATOM 710 C8 DA B 23 -0.735 3.319 -1.119 1.00 0.00 C ATOM 711 N7 DA B 23 -0.422 2.064 -0.921 1.00 0.00 N ATOM 712 C5 DA B 23 0.897 2.151 -0.433 1.00 0.00 C ATOM 713 C6 DA B 23 1.866 1.219 0.015 1.00 0.00 C ATOM 714 N6 DA B 23 1.650 -0.071 0.174 1.00 0.00 N ATOM 715 N1 DA B 23 3.111 1.598 0.314 1.00 0.00 N ATOM 716 C2 DA B 23 3.392 2.892 0.248 1.00 0.00 C ATOM 717 N3 DA B 23 2.592 3.887 -0.118 1.00 0.00 N ATOM 718 C4 DA B 23 1.340 3.448 -0.432 1.00 0.00 C ATOM 0 H5' DA B 23 -2.983 7.577 0.330 1.00 0.00 H new ATOM 0 H5'' DA B 23 -2.978 8.676 -1.035 1.00 0.00 H new ATOM 0 H4' DA B 23 -0.738 8.318 -0.386 1.00 0.00 H new ATOM 0 H3' DA B 23 -1.483 7.594 -3.080 1.00 0.00 H new ATOM 0 H2' DA B 23 -0.583 5.406 -2.989 1.00 0.00 H new ATOM 0 H2'' DA B 23 0.963 6.232 -2.985 1.00 0.00 H new ATOM 0 H1' DA B 23 1.229 6.025 -0.650 1.00 0.00 H new ATOM 0 H8 DA B 23 -1.710 3.628 -1.466 1.00 0.00 H new ATOM 0 H61 DA B 23 2.402 -0.677 0.501 1.00 0.00 H new ATOM 0 H62 DA B 23 0.731 -0.463 -0.030 1.00 0.00 H new ATOM 0 H2 DA B 23 4.397 3.172 0.527 1.00 0.00 H new ATOM 730 P DC B 24 0.723 8.991 -4.017 1.00 0.00 P ATOM 731 OP1 DC B 24 1.190 10.395 -3.997 1.00 0.00 O ATOM 732 OP2 DC B 24 -0.229 8.542 -5.051 1.00 0.00 O ATOM 733 O5' DC B 24 2.029 8.082 -4.165 1.00 0.00 O ATOM 734 C5' DC B 24 3.136 8.265 -3.300 1.00 0.00 C ATOM 735 C4' DC B 24 4.219 7.228 -3.596 1.00 0.00 C ATOM 736 O4' DC B 24 3.789 5.962 -3.125 1.00 0.00 O ATOM 737 C3' DC B 24 4.520 7.094 -5.104 1.00 0.00 C ATOM 738 O3' DC B 24 5.913 7.130 -5.388 1.00 0.00 O ATOM 739 C2' DC B 24 3.965 5.711 -5.428 1.00 0.00 C ATOM 740 C1' DC B 24 4.143 4.998 -4.087 1.00 0.00 C ATOM 741 N1 DC B 24 3.323 3.767 -3.916 1.00 0.00 N ATOM 742 C2 DC B 24 3.969 2.583 -3.550 1.00 0.00 C ATOM 743 O2 DC B 24 5.192 2.528 -3.428 1.00 0.00 O ATOM 744 N3 DC B 24 3.268 1.448 -3.356 1.00 0.00 N ATOM 745 C4 DC B 24 1.961 1.479 -3.471 1.00 0.00 C ATOM 746 N4 DC B 24 1.350 0.359 -3.228 1.00 0.00 N ATOM 747 C5 DC B 24 1.242 2.640 -3.871 1.00 0.00 C ATOM 748 C6 DC B 24 1.959 3.773 -4.088 1.00 0.00 C ATOM 0 H5' DC B 24 2.814 8.178 -2.262 1.00 0.00 H new ATOM 0 H5'' DC B 24 3.541 9.269 -3.424 1.00 0.00 H new ATOM 0 H4' DC B 24 5.127 7.563 -3.095 1.00 0.00 H new ATOM 0 H3' DC B 24 4.088 7.910 -5.684 1.00 0.00 H new ATOM 0 H2' DC B 24 2.921 5.749 -5.738 1.00 0.00 H new ATOM 0 H2'' DC B 24 4.519 5.223 -6.230 1.00 0.00 H new ATOM 0 HO3' DC B 24 6.052 7.040 -6.354 1.00 0.00 H new ATOM 0 H1' DC B 24 5.167 4.636 -4.000 1.00 0.00 H new ATOM 0 H41 DC B 24 0.334 0.307 -3.297 1.00 0.00 H new ATOM 0 H42 DC B 24 1.886 -0.469 -2.968 1.00 0.00 H new ATOM 0 H5 DC B 24 0.170 2.621 -3.997 1.00 0.00 H new ATOM 0 H6 DC B 24 1.458 4.679 -4.396 1.00 0.00 H new TER 761 DC B 24 CONECT 105 127 CONECT 127 105 140 146 156 CONECT 128 129 133 CONECT 129 128 130 147 CONECT 130 129 131 CONECT 131 130 132 137 CONECT 132 131 133 135 CONECT 133 128 132 134 CONECT 134 133 148 149 CONECT 135 132 136 CONECT 136 135 137 145 CONECT 137 131 136 138 CONECT 138 137 139 144 150 CONECT 139 138 141 151 152 CONECT 140 127 CONECT 141 139 142 143 153 CONECT 142 141 157 CONECT 143 141 144 145 154 CONECT 144 138 143 CONECT 145 136 143 146 155 CONECT 146 127 145 CONECT 147 129 CONECT 148 134 CONECT 149 134 CONECT 150 138 CONECT 151 139 CONECT 152 139 CONECT 153 141 CONECT 154 143 CONECT 155 145 CONECT 156 127 CONECT 157 142 END