USER MOD reduce.3.24.130724 H: found=0, std=0, add=289, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 289 hydrogens (18 hets) HEADER DNA 19-JUL-11 2LG3 TITLE STRUCTURE OF THE DUPLEX CONTAINING HNE DERIVED (6S,8R,11S) GAMMA-HO- TITLE 2 PDG WHEN PLACED OPPOSITE DT COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA (5'-D(*GP*CP*TP*AP*GP*CP*GP*AP*GP*TP*CP*C)-3'); COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA (5'-D(*GP*GP*AP*CP*TP*TP*GP*CP*TP*AP*GP*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 TRANS-4-HYDROXYNONENAL, GAMMA-HO-PDG, DNA EXPDTA SOLUTION NMR AUTHOR H.HUANG,H.WANG,A.KOZEKOVA,R.S.LLOYD,C.J.RIZZO,M.P.STONE REVDAT 1 01-AUG-12 2LG3 0 JRNL AUTH H.HUANG,H.WANG,A.KOZEKOVA,R.S.LLOYD,C.J.RIZZO,M.P.STONE JRNL TITL RING-CHAIN TAUTOMERIZATION OF TRANS-4-HYDROXYNONENAL DERIVED JRNL TITL 2 (6S,8R,11S) GAMMA-HYDROXY-1,N2-PROPANO-DEOXYGUANOSINE ADDUCT JRNL TITL 3 WHEN PLACED OPPOSITE 2'-DEOXYTHYMIDINE IN DUPLEX JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : AMBER 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 2LG3 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 01-AUG-11. REMARK 100 THE RCSB ID CODE IS RCSB102349. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 7.0 REMARK 210 IONIC STRENGTH : 100 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1 MM DNA (5'-D(*GP*CP*TP*AP*GP* REMARK 210 CP*GP*AP*GP*TP*CP*C)-3'), 1 MM DNA (5'-D(*GP*GP*AP*CP*TP*TP*GP* REMARK 210 CP*TP*AP*GP*C)-3'), 1 MM (2E,4R)-4-HYDROXYNON-2-ENAL, 100% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H NOESY 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 DC A 2 N3 - C2 - O2 ANGL. DEV. = -4.3 DEGREES REMARK 500 DA A 4 C4 - C5 - C6 ANGL. DEV. = -3.6 DEGREES REMARK 500 DA A 4 C5 - C6 - N1 ANGL. DEV. = 3.8 DEGREES REMARK 500 DA A 4 N1 - C6 - N6 ANGL. DEV. = -5.0 DEGREES REMARK 500 DG A 5 O4' - C1' - N9 ANGL. DEV. = 1.9 DEGREES REMARK 500 DC A 6 N3 - C2 - O2 ANGL. DEV. = -4.7 DEGREES REMARK 500 DG A 7 O4' - C1' - N9 ANGL. DEV. = 2.1 DEGREES REMARK 500 DG A 7 N3 - C2 - N2 ANGL. DEV. = -6.2 DEGREES REMARK 500 DA A 8 C4 - C5 - C6 ANGL. DEV. = -3.3 DEGREES REMARK 500 DA A 8 C5 - C6 - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA A 8 N1 - C6 - N6 ANGL. DEV. = -5.1 DEGREES REMARK 500 DC A 11 N3 - C2 - O2 ANGL. DEV. = -4.9 DEGREES REMARK 500 DC A 12 N3 - C2 - O2 ANGL. DEV. = -4.3 DEGREES REMARK 500 DA B 15 C4 - C5 - C6 ANGL. DEV. = -3.6 DEGREES REMARK 500 DA B 15 C5 - C6 - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA B 15 N1 - C6 - N6 ANGL. DEV. = -4.9 DEGREES REMARK 500 DC B 16 N3 - C2 - O2 ANGL. DEV. = -4.7 DEGREES REMARK 500 DT B 17 C6 - C5 - C7 ANGL. DEV. = -3.7 DEGREES REMARK 500 DT B 18 O4' - C4' - C3' ANGL. DEV. = 3.7 DEGREES REMARK 500 DT B 18 N3 - C2 - O2 ANGL. DEV. = -3.8 DEGREES REMARK 500 DT B 18 C6 - C5 - C7 ANGL. DEV. = -4.3 DEGREES REMARK 500 DG B 19 O4' - C4' - C3' ANGL. DEV. = 4.6 DEGREES REMARK 500 DG B 19 O4' - C1' - N9 ANGL. DEV. = 2.7 DEGREES REMARK 500 DC B 20 N3 - C2 - O2 ANGL. DEV. = -4.5 DEGREES REMARK 500 DT B 21 O4' - C1' - N1 ANGL. DEV. = 2.0 DEGREES REMARK 500 DT B 21 C6 - C5 - C7 ANGL. DEV. = -3.7 DEGREES REMARK 500 DA B 22 C4 - C5 - C6 ANGL. DEV. = -3.2 DEGREES REMARK 500 DA B 22 C5 - C6 - N1 ANGL. DEV. = 4.0 DEGREES REMARK 500 DA B 22 N1 - C6 - N6 ANGL. DEV. = -4.8 DEGREES REMARK 500 DG B 23 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES REMARK 500 DG B 23 N1 - C6 - O6 ANGL. DEV. = -3.7 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 0.07 SIDE CHAIN REMARK 500 DC A 6 0.07 SIDE CHAIN REMARK 500 DG B 13 0.07 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HND A 25 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 17791 RELATED DB: BMRB REMARK 900 RELATED ID: 2LG2 RELATED DB: PDB DBREF 2LG3 A 1 12 PDB 2LG3 2LG3 1 12 DBREF 2LG3 B 13 24 PDB 2LG3 2LG3 13 24 SEQRES 1 A 12 DG DC DT DA DG DC DG DA DG DT DC DC SEQRES 1 B 12 DG DG DA DC DT DT DG DC DT DA DG DC HET HND A 25 29 HETNAM HND (4S)-NONANE-1,4-DIOL FORMUL 3 HND C9 H20 O2 LINK N1 DG A 7 C1 HND A 25 1555 1555 1.48 LINK N2 DG A 7 C3 HND A 25 1555 1555 1.46 SITE *** AC1 5 DG A 7 DA A 8 DT B 17 DT B 18 SITE *** AC1 5 DG B 19 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 NoAdj-H: A 7 DG H1 : A 7 DG N1 : A 25 HND C1 :(H bumps) USER MOD NoAdj-H: A 7 DG H22 : A 7 DG N2 : A 25 HND C3 :(H bumps) USER MOD NoAdj-H: A 25 HND H3A : A 25 HND C3 : A 7 DG N2 :(H bumps) USER MOD NoAdj-H: A 25 HND H1A : A 25 HND C1 : A 7 DG N1 :(H bumps) USER MOD Single : A 1 DG O5' : rot -35:sc= 0.0334 USER MOD Single : A 3 DT C7 :methyl 150:sc= -0.0237 (180deg=-0.0237) USER MOD Single : A 10 DT C7 :methyl -30:sc= -0.0643 (180deg=-0.888) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : A 25 HND O10 : rot 180:sc= 0.0154 USER MOD Single : A 25 HND O11 : rot -99:sc= 1.13 USER MOD Single : B 13 DG O5' : rot -31:sc= 0.0768 USER MOD Single : B 17 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 18 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 21 DT C7 :methyl 150:sc=-0.00872 (180deg=-0.00872) USER MOD Single : B 24 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 7.662 -13.339 3.811 1.00 0.00 O ATOM 2 C5' DG A 1 8.026 -12.736 5.063 1.00 0.00 C ATOM 3 C4' DG A 1 8.688 -11.375 4.795 1.00 0.00 C ATOM 4 O4' DG A 1 7.771 -10.573 4.063 1.00 0.00 O ATOM 5 C3' DG A 1 9.029 -10.629 6.088 1.00 0.00 C ATOM 6 O3' DG A 1 10.218 -9.899 5.860 1.00 0.00 O ATOM 7 C2' DG A 1 7.793 -9.753 6.306 1.00 0.00 C ATOM 8 C1' DG A 1 7.302 -9.500 4.873 1.00 0.00 C ATOM 9 N9 DG A 1 5.825 -9.435 4.743 1.00 0.00 N ATOM 10 C8 DG A 1 4.867 -10.236 5.316 1.00 0.00 C ATOM 11 N7 DG A 1 3.660 -10.048 4.858 1.00 0.00 N ATOM 12 C5 DG A 1 3.814 -8.998 3.939 1.00 0.00 C ATOM 13 C6 DG A 1 2.882 -8.332 3.060 1.00 0.00 C ATOM 14 O6 DG A 1 1.688 -8.549 2.859 1.00 0.00 O ATOM 15 N1 DG A 1 3.464 -7.339 2.302 1.00 0.00 N ATOM 16 C2 DG A 1 4.775 -7.013 2.360 1.00 0.00 C ATOM 17 N2 DG A 1 5.192 -6.054 1.585 1.00 0.00 N ATOM 18 N3 DG A 1 5.684 -7.630 3.104 1.00 0.00 N ATOM 19 C4 DG A 1 5.138 -8.609 3.885 1.00 0.00 C ATOM 0 H5' DG A 1 8.711 -13.386 5.608 1.00 0.00 H new ATOM 0 H5'' DG A 1 7.143 -12.607 5.689 1.00 0.00 H new ATOM 0 H4' DG A 1 9.614 -11.555 4.248 1.00 0.00 H new ATOM 0 H3' DG A 1 9.222 -11.242 6.968 1.00 0.00 H new ATOM 0 H2' DG A 1 7.039 -10.259 6.909 1.00 0.00 H new ATOM 0 H2'' DG A 1 8.041 -8.824 6.819 1.00 0.00 H new ATOM 0 HO5' DG A 1 7.375 -12.643 3.184 1.00 0.00 H new ATOM 0 H1' DG A 1 7.687 -8.528 4.565 1.00 0.00 H new ATOM 0 H8 DG A 1 5.095 -10.962 6.083 1.00 0.00 H new ATOM 0 H1 DG A 1 2.869 -6.818 1.658 1.00 0.00 H new ATOM 0 H21 DG A 1 6.174 -5.778 1.599 1.00 0.00 H new ATOM 0 H22 DG A 1 4.537 -5.579 0.964 1.00 0.00 H new ATOM 32 P DC A 2 10.953 -9.085 7.033 1.00 0.00 P ATOM 33 OP1 DC A 2 12.402 -9.110 6.741 1.00 0.00 O ATOM 34 OP2 DC A 2 10.440 -9.608 8.316 1.00 0.00 O ATOM 35 O5' DC A 2 10.364 -7.608 6.764 1.00 0.00 O ATOM 36 C5' DC A 2 10.829 -6.853 5.651 1.00 0.00 C ATOM 37 C4' DC A 2 10.002 -5.594 5.336 1.00 0.00 C ATOM 38 O4' DC A 2 8.655 -5.919 5.025 1.00 0.00 O ATOM 39 C3' DC A 2 10.004 -4.519 6.434 1.00 0.00 C ATOM 40 O3' DC A 2 10.755 -3.405 5.971 1.00 0.00 O ATOM 41 C2' DC A 2 8.517 -4.185 6.606 1.00 0.00 C ATOM 42 C1' DC A 2 7.852 -4.807 5.370 1.00 0.00 C ATOM 43 N1 DC A 2 6.467 -5.282 5.626 1.00 0.00 N ATOM 44 C2 DC A 2 5.408 -4.782 4.860 1.00 0.00 C ATOM 45 O2 DC A 2 5.583 -3.941 3.975 1.00 0.00 O ATOM 46 N3 DC A 2 4.147 -5.225 5.061 1.00 0.00 N ATOM 47 C4 DC A 2 3.934 -6.119 6.004 1.00 0.00 C ATOM 48 N4 DC A 2 2.713 -6.542 6.129 1.00 0.00 N ATOM 49 C5 DC A 2 4.967 -6.683 6.803 1.00 0.00 C ATOM 50 C6 DC A 2 6.231 -6.240 6.582 1.00 0.00 C ATOM 0 H5' DC A 2 10.836 -7.496 4.771 1.00 0.00 H new ATOM 0 H5'' DC A 2 11.861 -6.556 5.837 1.00 0.00 H new ATOM 0 H4' DC A 2 10.508 -5.165 4.471 1.00 0.00 H new ATOM 0 H3' DC A 2 10.454 -4.826 7.378 1.00 0.00 H new ATOM 0 H2' DC A 2 8.117 -4.606 7.529 1.00 0.00 H new ATOM 0 H2'' DC A 2 8.352 -3.108 6.649 1.00 0.00 H new ATOM 0 H1' DC A 2 7.778 -4.056 4.584 1.00 0.00 H new ATOM 0 H41 DC A 2 2.484 -7.235 6.842 1.00 0.00 H new ATOM 0 H42 DC A 2 1.983 -6.181 5.515 1.00 0.00 H new ATOM 0 H5 DC A 2 4.755 -7.431 7.553 1.00 0.00 H new ATOM 0 H6 DC A 2 7.052 -6.641 7.158 1.00 0.00 H new ATOM 62 P DT A 3 11.131 -2.156 6.921 1.00 0.00 P ATOM 63 OP1 DT A 3 12.361 -1.541 6.378 1.00 0.00 O ATOM 64 OP2 DT A 3 11.080 -2.608 8.324 1.00 0.00 O ATOM 65 O5' DT A 3 9.901 -1.159 6.657 1.00 0.00 O ATOM 66 C5' DT A 3 9.780 -0.502 5.407 1.00 0.00 C ATOM 67 C4' DT A 3 8.428 0.203 5.217 1.00 0.00 C ATOM 68 O4' DT A 3 7.354 -0.727 5.282 1.00 0.00 O ATOM 69 C3' DT A 3 8.147 1.347 6.206 1.00 0.00 C ATOM 70 O3' DT A 3 8.005 2.552 5.465 1.00 0.00 O ATOM 71 C2' DT A 3 6.833 0.917 6.866 1.00 0.00 C ATOM 72 C1' DT A 3 6.238 -0.063 5.846 1.00 0.00 C ATOM 73 N1 DT A 3 5.313 -1.061 6.452 1.00 0.00 N ATOM 74 C2 DT A 3 3.992 -1.123 5.983 1.00 0.00 C ATOM 75 O2 DT A 3 3.566 -0.424 5.069 1.00 0.00 O ATOM 76 N3 DT A 3 3.166 -2.053 6.575 1.00 0.00 N ATOM 77 C4 DT A 3 3.537 -2.932 7.568 1.00 0.00 C ATOM 78 O4 DT A 3 2.720 -3.750 7.979 1.00 0.00 O ATOM 79 C5 DT A 3 4.923 -2.813 8.017 1.00 0.00 C ATOM 80 C7 DT A 3 5.442 -3.710 9.128 1.00 0.00 C ATOM 81 C6 DT A 3 5.756 -1.901 7.452 1.00 0.00 C ATOM 0 H5' DT A 3 9.917 -1.230 4.607 1.00 0.00 H new ATOM 0 H5'' DT A 3 10.581 0.232 5.311 1.00 0.00 H new ATOM 0 H4' DT A 3 8.499 0.653 4.227 1.00 0.00 H new ATOM 0 H3' DT A 3 8.928 1.525 6.945 1.00 0.00 H new ATOM 0 H2' DT A 3 7.003 0.440 7.831 1.00 0.00 H new ATOM 0 H2'' DT A 3 6.173 1.766 7.042 1.00 0.00 H new ATOM 0 H1' DT A 3 5.636 0.479 5.116 1.00 0.00 H new ATOM 0 H3 DT A 3 2.200 -2.094 6.251 1.00 0.00 H new ATOM 0 H71 DT A 3 6.508 -3.887 8.985 1.00 0.00 H new ATOM 0 H72 DT A 3 5.280 -3.227 10.091 1.00 0.00 H new ATOM 0 H73 DT A 3 4.910 -4.661 9.106 1.00 0.00 H new ATOM 0 H6 DT A 3 6.779 -1.833 7.791 1.00 0.00 H new ATOM 94 P DA A 4 8.022 4.007 6.161 1.00 0.00 P ATOM 95 OP1 DA A 4 8.329 4.992 5.100 1.00 0.00 O ATOM 96 OP2 DA A 4 8.875 3.938 7.366 1.00 0.00 O ATOM 97 O5' DA A 4 6.491 4.202 6.614 1.00 0.00 O ATOM 98 C5' DA A 4 5.484 4.454 5.645 1.00 0.00 C ATOM 99 C4' DA A 4 4.053 4.418 6.210 1.00 0.00 C ATOM 100 O4' DA A 4 3.677 3.093 6.556 1.00 0.00 O ATOM 101 C3' DA A 4 3.800 5.327 7.430 1.00 0.00 C ATOM 102 O3' DA A 4 2.854 6.329 7.066 1.00 0.00 O ATOM 103 C2' DA A 4 3.259 4.337 8.472 1.00 0.00 C ATOM 104 C1' DA A 4 2.738 3.181 7.610 1.00 0.00 C ATOM 105 N9 DA A 4 2.676 1.888 8.327 1.00 0.00 N ATOM 106 C8 DA A 4 3.712 1.149 8.842 1.00 0.00 C ATOM 107 N7 DA A 4 3.360 0.008 9.374 1.00 0.00 N ATOM 108 C5 DA A 4 1.958 0.021 9.224 1.00 0.00 C ATOM 109 C6 DA A 4 0.898 -0.857 9.562 1.00 0.00 C ATOM 110 N6 DA A 4 1.044 -2.021 10.162 1.00 0.00 N ATOM 111 N1 DA A 4 -0.369 -0.563 9.270 1.00 0.00 N ATOM 112 C2 DA A 4 -0.614 0.581 8.645 1.00 0.00 C ATOM 113 N3 DA A 4 0.264 1.497 8.252 1.00 0.00 N ATOM 114 C4 DA A 4 1.540 1.157 8.583 1.00 0.00 C ATOM 0 H5' DA A 4 5.568 3.716 4.847 1.00 0.00 H new ATOM 0 H5'' DA A 4 5.662 5.431 5.195 1.00 0.00 H new ATOM 0 H4' DA A 4 3.442 4.808 5.396 1.00 0.00 H new ATOM 0 H3' DA A 4 4.669 5.868 7.805 1.00 0.00 H new ATOM 0 H2' DA A 4 4.038 4.009 9.160 1.00 0.00 H new ATOM 0 H2'' DA A 4 2.467 4.779 9.076 1.00 0.00 H new ATOM 0 H1' DA A 4 1.714 3.375 7.289 1.00 0.00 H new ATOM 0 H8 DA A 4 4.738 1.484 8.810 1.00 0.00 H new ATOM 0 H61 DA A 4 0.226 -2.594 10.370 1.00 0.00 H new ATOM 0 H62 DA A 4 1.975 -2.349 10.418 1.00 0.00 H new ATOM 0 H2 DA A 4 -1.651 0.793 8.430 1.00 0.00 H new ATOM 126 P DG A 5 2.465 7.568 8.027 1.00 0.00 P ATOM 127 OP1 DG A 5 2.055 8.697 7.162 1.00 0.00 O ATOM 128 OP2 DG A 5 3.549 7.763 9.014 1.00 0.00 O ATOM 129 O5' DG A 5 1.159 7.028 8.806 1.00 0.00 O ATOM 130 C5' DG A 5 -0.072 6.843 8.117 1.00 0.00 C ATOM 131 C4' DG A 5 -1.214 6.302 9.000 1.00 0.00 C ATOM 132 O4' DG A 5 -0.991 4.928 9.293 1.00 0.00 O ATOM 133 C3' DG A 5 -1.430 7.056 10.330 1.00 0.00 C ATOM 134 O3' DG A 5 -2.793 7.463 10.428 1.00 0.00 O ATOM 135 C2' DG A 5 -1.024 5.988 11.350 1.00 0.00 C ATOM 136 C1' DG A 5 -1.386 4.688 10.630 1.00 0.00 C ATOM 137 N9 DG A 5 -0.669 3.511 11.171 1.00 0.00 N ATOM 138 C8 DG A 5 0.682 3.335 11.323 1.00 0.00 C ATOM 139 N7 DG A 5 1.022 2.212 11.899 1.00 0.00 N ATOM 140 C5 DG A 5 -0.210 1.568 12.112 1.00 0.00 C ATOM 141 C6 DG A 5 -0.547 0.291 12.690 1.00 0.00 C ATOM 142 O6 DG A 5 0.193 -0.583 13.140 1.00 0.00 O ATOM 143 N1 DG A 5 -1.904 0.046 12.741 1.00 0.00 N ATOM 144 C2 DG A 5 -2.843 0.920 12.311 1.00 0.00 C ATOM 145 N2 DG A 5 -4.092 0.609 12.522 1.00 0.00 N ATOM 146 N3 DG A 5 -2.585 2.108 11.773 1.00 0.00 N ATOM 147 C4 DG A 5 -1.247 2.371 11.683 1.00 0.00 C ATOM 0 H5' DG A 5 0.089 6.154 7.287 1.00 0.00 H new ATOM 0 H5'' DG A 5 -0.381 7.795 7.686 1.00 0.00 H new ATOM 0 H4' DG A 5 -2.118 6.453 8.410 1.00 0.00 H new ATOM 0 H3' DG A 5 -0.865 7.979 10.460 1.00 0.00 H new ATOM 0 H2' DG A 5 0.038 6.038 11.588 1.00 0.00 H new ATOM 0 H2'' DG A 5 -1.567 6.097 12.289 1.00 0.00 H new ATOM 0 H1' DG A 5 -2.444 4.450 10.745 1.00 0.00 H new ATOM 0 H8 DG A 5 1.407 4.065 10.994 1.00 0.00 H new ATOM 0 H1 DG A 5 -2.217 -0.845 13.125 1.00 0.00 H new ATOM 0 H21 DG A 5 -4.833 1.239 12.215 1.00 0.00 H new ATOM 0 H22 DG A 5 -4.327 -0.264 12.994 1.00 0.00 H new ATOM 159 P DC A 6 -3.406 8.212 11.722 1.00 0.00 P ATOM 160 OP1 DC A 6 -4.396 9.211 11.259 1.00 0.00 O ATOM 161 OP2 DC A 6 -2.291 8.646 12.590 1.00 0.00 O ATOM 162 O5' DC A 6 -4.190 7.003 12.451 1.00 0.00 O ATOM 163 C5' DC A 6 -5.261 6.339 11.781 1.00 0.00 C ATOM 164 C4' DC A 6 -5.950 5.213 12.586 1.00 0.00 C ATOM 165 O4' DC A 6 -5.030 4.174 12.889 1.00 0.00 O ATOM 166 C3' DC A 6 -6.609 5.635 13.910 1.00 0.00 C ATOM 167 O3' DC A 6 -7.844 4.944 14.020 1.00 0.00 O ATOM 168 C2' DC A 6 -5.594 5.159 14.951 1.00 0.00 C ATOM 169 C1' DC A 6 -5.098 3.877 14.278 1.00 0.00 C ATOM 170 N1 DC A 6 -3.758 3.442 14.755 1.00 0.00 N ATOM 171 C2 DC A 6 -3.623 2.220 15.424 1.00 0.00 C ATOM 172 O2 DC A 6 -4.591 1.539 15.752 1.00 0.00 O ATOM 173 N3 DC A 6 -2.394 1.738 15.728 1.00 0.00 N ATOM 174 C4 DC A 6 -1.338 2.444 15.394 1.00 0.00 C ATOM 175 N4 DC A 6 -0.187 1.871 15.585 1.00 0.00 N ATOM 176 C5 DC A 6 -1.407 3.713 14.752 1.00 0.00 C ATOM 177 C6 DC A 6 -2.644 4.182 14.445 1.00 0.00 C ATOM 0 H5' DC A 6 -4.879 5.917 10.851 1.00 0.00 H new ATOM 0 H5'' DC A 6 -6.012 7.080 11.509 1.00 0.00 H new ATOM 0 H4' DC A 6 -6.749 4.887 11.920 1.00 0.00 H new ATOM 0 H3' DC A 6 -6.829 6.698 14.012 1.00 0.00 H new ATOM 0 H2' DC A 6 -4.793 5.881 15.112 1.00 0.00 H new ATOM 0 H2'' DC A 6 -6.052 4.969 15.922 1.00 0.00 H new ATOM 0 H1' DC A 6 -5.777 3.057 14.513 1.00 0.00 H new ATOM 0 H41 DC A 6 0.674 2.364 15.347 1.00 0.00 H new ATOM 0 H42 DC A 6 -0.145 0.929 15.973 1.00 0.00 H new ATOM 0 H5 DC A 6 -0.516 4.277 14.520 1.00 0.00 H new ATOM 0 H6 DC A 6 -2.752 5.139 13.956 1.00 0.00 H new ATOM 189 P DG A 7 -8.947 5.324 15.121 1.00 0.00 P ATOM 190 OP1 DG A 7 -10.260 4.842 14.634 1.00 0.00 O ATOM 191 OP2 DG A 7 -8.773 6.755 15.463 1.00 0.00 O ATOM 192 O5' DG A 7 -8.492 4.418 16.378 1.00 0.00 O ATOM 193 C5' DG A 7 -8.658 3.004 16.348 1.00 0.00 C ATOM 194 C4' DG A 7 -8.247 2.288 17.649 1.00 0.00 C ATOM 195 O4' DG A 7 -6.839 2.137 17.763 1.00 0.00 O ATOM 196 C3' DG A 7 -8.739 2.957 18.946 1.00 0.00 C ATOM 197 O3' DG A 7 -9.852 2.242 19.476 1.00 0.00 O ATOM 198 C2' DG A 7 -7.497 2.884 19.854 1.00 0.00 C ATOM 199 C1' DG A 7 -6.541 1.924 19.127 1.00 0.00 C ATOM 200 N9 DG A 7 -5.095 2.162 19.384 1.00 0.00 N ATOM 201 C8 DG A 7 -4.375 3.309 19.162 1.00 0.00 C ATOM 202 N7 DG A 7 -3.110 3.225 19.475 1.00 0.00 N ATOM 203 C5 DG A 7 -2.965 1.900 19.924 1.00 0.00 C ATOM 204 C6 DG A 7 -1.811 1.174 20.397 1.00 0.00 C ATOM 205 O6 DG A 7 -0.662 1.611 20.514 1.00 0.00 O ATOM 206 N1 DG A 7 -2.082 -0.153 20.767 1.00 0.00 N ATOM 207 C2 DG A 7 -3.349 -0.690 20.662 1.00 0.00 C ATOM 208 N2 DG A 7 -3.595 -1.918 21.077 1.00 0.00 N ATOM 209 N3 DG A 7 -4.438 -0.033 20.253 1.00 0.00 N ATOM 210 C4 DG A 7 -4.183 1.253 19.880 1.00 0.00 C ATOM 0 H5' DG A 7 -8.071 2.599 15.524 1.00 0.00 H new ATOM 0 H5'' DG A 7 -9.703 2.777 16.137 1.00 0.00 H new ATOM 0 H4' DG A 7 -8.741 1.321 17.554 1.00 0.00 H new ATOM 0 H3' DG A 7 -9.097 3.979 18.822 1.00 0.00 H new ATOM 0 H2' DG A 7 -7.046 3.867 19.988 1.00 0.00 H new ATOM 0 H2'' DG A 7 -7.753 2.513 20.846 1.00 0.00 H new ATOM 0 H1' DG A 7 -6.693 0.903 19.477 1.00 0.00 H new ATOM 0 H8 DG A 7 -4.819 4.208 18.761 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.535 -2.305 20.995 1.00 0.00 H new ATOM 220 P DA A 8 -10.760 2.818 20.685 1.00 0.00 P ATOM 221 OP1 DA A 8 -12.119 2.241 20.571 1.00 0.00 O ATOM 222 OP2 DA A 8 -10.588 4.284 20.770 1.00 0.00 O ATOM 223 O5' DA A 8 -10.047 2.162 21.967 1.00 0.00 O ATOM 224 C5' DA A 8 -10.148 0.767 22.217 1.00 0.00 C ATOM 225 C4' DA A 8 -9.428 0.334 23.508 1.00 0.00 C ATOM 226 O4' DA A 8 -8.020 0.340 23.302 1.00 0.00 O ATOM 227 C3' DA A 8 -9.755 1.230 24.719 1.00 0.00 C ATOM 228 O3' DA A 8 -10.056 0.429 25.859 1.00 0.00 O ATOM 229 C2' DA A 8 -8.451 2.014 24.882 1.00 0.00 C ATOM 230 C1' DA A 8 -7.410 0.999 24.392 1.00 0.00 C ATOM 231 N9 DA A 8 -6.132 1.605 23.946 1.00 0.00 N ATOM 232 C8 DA A 8 -5.934 2.744 23.200 1.00 0.00 C ATOM 233 N7 DA A 8 -4.680 3.060 23.012 1.00 0.00 N ATOM 234 C5 DA A 8 -3.996 2.035 23.689 1.00 0.00 C ATOM 235 C6 DA A 8 -2.635 1.732 23.939 1.00 0.00 C ATOM 236 N6 DA A 8 -1.610 2.442 23.515 1.00 0.00 N ATOM 237 N1 DA A 8 -2.282 0.653 24.639 1.00 0.00 N ATOM 238 C2 DA A 8 -3.245 -0.136 25.090 1.00 0.00 C ATOM 239 N3 DA A 8 -4.558 0.012 24.949 1.00 0.00 N ATOM 240 C4 DA A 8 -4.870 1.133 24.235 1.00 0.00 C ATOM 0 H5' DA A 8 -9.728 0.221 21.372 1.00 0.00 H new ATOM 0 H5'' DA A 8 -11.200 0.491 22.284 1.00 0.00 H new ATOM 0 H4' DA A 8 -9.787 -0.670 23.737 1.00 0.00 H new ATOM 0 H3' DA A 8 -10.626 1.874 24.596 1.00 0.00 H new ATOM 0 H2' DA A 8 -8.445 2.926 24.285 1.00 0.00 H new ATOM 0 H2'' DA A 8 -8.278 2.309 25.917 1.00 0.00 H new ATOM 0 H1' DA A 8 -7.138 0.339 25.216 1.00 0.00 H new ATOM 0 H8 DA A 8 -6.749 3.330 22.802 1.00 0.00 H new ATOM 0 H61 DA A 8 -0.659 2.151 23.742 1.00 0.00 H new ATOM 0 H62 DA A 8 -1.767 3.283 22.960 1.00 0.00 H new ATOM 0 H2 DA A 8 -2.924 -1.008 25.641 1.00 0.00 H new ATOM 252 P DG A 9 -10.901 1.004 27.108 1.00 0.00 P ATOM 253 OP1 DG A 9 -11.415 -0.144 27.885 1.00 0.00 O ATOM 254 OP2 DG A 9 -11.856 2.023 26.624 1.00 0.00 O ATOM 255 O5' DG A 9 -9.796 1.770 27.999 1.00 0.00 O ATOM 256 C5' DG A 9 -9.092 1.141 29.063 1.00 0.00 C ATOM 257 C4' DG A 9 -7.947 0.200 28.639 1.00 0.00 C ATOM 258 O4' DG A 9 -7.008 0.897 27.831 1.00 0.00 O ATOM 259 C3' DG A 9 -7.183 -0.247 29.902 1.00 0.00 C ATOM 260 O3' DG A 9 -7.435 -1.599 30.253 1.00 0.00 O ATOM 261 C2' DG A 9 -5.710 0.007 29.562 1.00 0.00 C ATOM 262 C1' DG A 9 -5.693 0.433 28.093 1.00 0.00 C ATOM 263 N9 DG A 9 -4.723 1.531 27.835 1.00 0.00 N ATOM 264 C8 DG A 9 -5.009 2.816 27.447 1.00 0.00 C ATOM 265 N7 DG A 9 -3.964 3.566 27.232 1.00 0.00 N ATOM 266 C5 DG A 9 -2.883 2.705 27.478 1.00 0.00 C ATOM 267 C6 DG A 9 -1.457 2.903 27.386 1.00 0.00 C ATOM 268 O6 DG A 9 -0.820 3.913 27.080 1.00 0.00 O ATOM 269 N1 DG A 9 -0.725 1.775 27.693 1.00 0.00 N ATOM 270 C2 DG A 9 -1.276 0.597 28.067 1.00 0.00 C ATOM 271 N2 DG A 9 -0.456 -0.379 28.345 1.00 0.00 N ATOM 272 N3 DG A 9 -2.582 0.371 28.199 1.00 0.00 N ATOM 273 C4 DG A 9 -3.343 1.462 27.872 1.00 0.00 C ATOM 0 H5' DG A 9 -9.804 0.571 29.660 1.00 0.00 H new ATOM 0 H5'' DG A 9 -8.681 1.915 29.711 1.00 0.00 H new ATOM 0 H4' DG A 9 -8.376 -0.641 28.094 1.00 0.00 H new ATOM 0 H3' DG A 9 -7.503 0.306 30.785 1.00 0.00 H new ATOM 0 H2' DG A 9 -5.289 0.784 30.200 1.00 0.00 H new ATOM 0 H2'' DG A 9 -5.112 -0.891 29.716 1.00 0.00 H new ATOM 0 H1' DG A 9 -5.391 -0.399 27.456 1.00 0.00 H new ATOM 0 H8 DG A 9 -6.020 3.178 27.329 1.00 0.00 H new ATOM 0 H1 DG A 9 0.292 1.832 27.635 1.00 0.00 H new ATOM 0 H21 DG A 9 -0.822 -1.287 28.632 1.00 0.00 H new ATOM 0 H22 DG A 9 0.551 -0.234 28.276 1.00 0.00 H new ATOM 285 P DT A 10 -7.341 -2.097 31.787 1.00 0.00 P ATOM 286 OP1 DT A 10 -7.913 -3.458 31.880 1.00 0.00 O ATOM 287 OP2 DT A 10 -7.860 -1.021 32.663 1.00 0.00 O ATOM 288 O5' DT A 10 -5.754 -2.199 32.030 1.00 0.00 O ATOM 289 C5' DT A 10 -4.987 -3.236 31.431 1.00 0.00 C ATOM 290 C4' DT A 10 -3.495 -3.157 31.805 1.00 0.00 C ATOM 291 O4' DT A 10 -2.909 -2.006 31.206 1.00 0.00 O ATOM 292 C3' DT A 10 -3.254 -3.093 33.324 1.00 0.00 C ATOM 293 O3' DT A 10 -2.238 -4.013 33.710 1.00 0.00 O ATOM 294 C2' DT A 10 -2.825 -1.642 33.507 1.00 0.00 C ATOM 295 C1' DT A 10 -2.127 -1.335 32.176 1.00 0.00 C ATOM 296 N1 DT A 10 -2.056 0.119 31.854 1.00 0.00 N ATOM 297 C2 DT A 10 -0.802 0.678 31.574 1.00 0.00 C ATOM 298 O2 DT A 10 0.258 0.079 31.704 1.00 0.00 O ATOM 299 N3 DT A 10 -0.784 1.998 31.190 1.00 0.00 N ATOM 300 C4 DT A 10 -1.871 2.831 31.121 1.00 0.00 C ATOM 301 O4 DT A 10 -1.708 3.996 30.768 1.00 0.00 O ATOM 302 C5 DT A 10 -3.140 2.220 31.512 1.00 0.00 C ATOM 303 C7 DT A 10 -4.401 3.071 31.540 1.00 0.00 C ATOM 304 C6 DT A 10 -3.198 0.901 31.843 1.00 0.00 C ATOM 0 H5' DT A 10 -5.090 -3.180 30.347 1.00 0.00 H new ATOM 0 H5'' DT A 10 -5.385 -4.203 31.740 1.00 0.00 H new ATOM 0 H4' DT A 10 -3.036 -4.073 31.434 1.00 0.00 H new ATOM 0 H3' DT A 10 -4.115 -3.364 33.935 1.00 0.00 H new ATOM 0 H2' DT A 10 -3.677 -0.985 33.680 1.00 0.00 H new ATOM 0 H2'' DT A 10 -2.152 -1.521 34.356 1.00 0.00 H new ATOM 0 H1' DT A 10 -1.087 -1.661 32.213 1.00 0.00 H new ATOM 0 H3 DT A 10 0.120 2.394 30.933 1.00 0.00 H new ATOM 0 H71 DT A 10 -4.138 4.103 31.773 1.00 0.00 H new ATOM 0 H72 DT A 10 -4.888 3.032 30.566 1.00 0.00 H new ATOM 0 H73 DT A 10 -5.081 2.689 32.301 1.00 0.00 H new ATOM 0 H6 DT A 10 -4.149 0.458 32.101 1.00 0.00 H new ATOM 317 P DC A 11 -1.836 -4.266 35.254 1.00 0.00 P ATOM 318 OP1 DC A 11 -1.504 -5.697 35.423 1.00 0.00 O ATOM 319 OP2 DC A 11 -2.859 -3.642 36.120 1.00 0.00 O ATOM 320 O5' DC A 11 -0.480 -3.407 35.409 1.00 0.00 O ATOM 321 C5' DC A 11 0.710 -3.799 34.732 1.00 0.00 C ATOM 322 C4' DC A 11 1.924 -2.897 35.039 1.00 0.00 C ATOM 323 O4' DC A 11 1.707 -1.632 34.426 1.00 0.00 O ATOM 324 C3' DC A 11 2.194 -2.679 36.544 1.00 0.00 C ATOM 325 O3' DC A 11 3.585 -2.801 36.851 1.00 0.00 O ATOM 326 C2' DC A 11 1.660 -1.258 36.737 1.00 0.00 C ATOM 327 C1' DC A 11 1.929 -0.606 35.369 1.00 0.00 C ATOM 328 N1 DC A 11 1.035 0.544 35.047 1.00 0.00 N ATOM 329 C2 DC A 11 1.589 1.764 34.635 1.00 0.00 C ATOM 330 O2 DC A 11 2.802 1.951 34.583 1.00 0.00 O ATOM 331 N3 DC A 11 0.790 2.824 34.362 1.00 0.00 N ATOM 332 C4 DC A 11 -0.509 2.679 34.453 1.00 0.00 C ATOM 333 N4 DC A 11 -1.220 3.731 34.177 1.00 0.00 N ATOM 334 C5 DC A 11 -1.139 1.480 34.888 1.00 0.00 C ATOM 335 C6 DC A 11 -0.328 0.427 35.167 1.00 0.00 C ATOM 0 H5' DC A 11 0.526 -3.792 33.658 1.00 0.00 H new ATOM 0 H5'' DC A 11 0.952 -4.826 35.007 1.00 0.00 H new ATOM 0 H4' DC A 11 2.801 -3.409 34.644 1.00 0.00 H new ATOM 0 H3' DC A 11 1.726 -3.410 37.204 1.00 0.00 H new ATOM 0 H2' DC A 11 0.599 -1.255 36.985 1.00 0.00 H new ATOM 0 H2'' DC A 11 2.177 -0.737 37.543 1.00 0.00 H new ATOM 0 H1' DC A 11 2.938 -0.194 35.364 1.00 0.00 H new ATOM 0 H41 DC A 11 -2.238 3.687 34.228 1.00 0.00 H new ATOM 0 H42 DC A 11 -0.760 4.601 33.909 1.00 0.00 H new ATOM 0 H5 DC A 11 -2.212 1.410 34.992 1.00 0.00 H new ATOM 0 H6 DC A 11 -0.759 -0.511 35.486 1.00 0.00 H new ATOM 347 P DC A 12 4.178 -2.615 38.346 1.00 0.00 P ATOM 348 OP1 DC A 12 5.331 -3.520 38.551 1.00 0.00 O ATOM 349 OP2 DC A 12 3.076 -2.598 39.330 1.00 0.00 O ATOM 350 O5' DC A 12 4.755 -1.120 38.265 1.00 0.00 O ATOM 351 C5' DC A 12 5.959 -0.840 37.566 1.00 0.00 C ATOM 352 C4' DC A 12 6.386 0.625 37.748 1.00 0.00 C ATOM 353 O4' DC A 12 5.635 1.488 36.913 1.00 0.00 O ATOM 354 C3' DC A 12 6.215 1.146 39.183 1.00 0.00 C ATOM 355 O3' DC A 12 7.365 0.860 40.002 1.00 0.00 O ATOM 356 C2' DC A 12 6.042 2.645 38.963 1.00 0.00 C ATOM 357 C1' DC A 12 5.451 2.744 37.545 1.00 0.00 C ATOM 358 N1 DC A 12 4.002 3.086 37.575 1.00 0.00 N ATOM 359 C2 DC A 12 3.631 4.428 37.432 1.00 0.00 C ATOM 360 O2 DC A 12 4.471 5.323 37.350 1.00 0.00 O ATOM 361 N3 DC A 12 2.329 4.791 37.437 1.00 0.00 N ATOM 362 C4 DC A 12 1.418 3.852 37.546 1.00 0.00 C ATOM 363 N4 DC A 12 0.186 4.251 37.442 1.00 0.00 N ATOM 364 C5 DC A 12 1.723 2.476 37.752 1.00 0.00 C ATOM 365 C6 DC A 12 3.036 2.126 37.759 1.00 0.00 C ATOM 0 H5' DC A 12 5.823 -1.052 36.505 1.00 0.00 H new ATOM 0 H5'' DC A 12 6.751 -1.498 37.924 1.00 0.00 H new ATOM 0 H4' DC A 12 7.444 0.631 37.488 1.00 0.00 H new ATOM 0 H3' DC A 12 5.385 0.682 39.715 1.00 0.00 H new ATOM 0 H2' DC A 12 5.375 3.084 39.705 1.00 0.00 H new ATOM 0 H2'' DC A 12 6.993 3.172 39.037 1.00 0.00 H new ATOM 0 HO3' DC A 12 7.218 1.209 40.906 1.00 0.00 H new ATOM 0 H1' DC A 12 5.958 3.539 36.998 1.00 0.00 H new ATOM 0 H41 DC A 12 -0.576 3.577 37.516 1.00 0.00 H new ATOM 0 H42 DC A 12 -0.019 5.238 37.286 1.00 0.00 H new ATOM 0 H5 DC A 12 0.944 1.742 37.896 1.00 0.00 H new ATOM 0 H6 DC A 12 3.320 1.095 37.909 1.00 0.00 H new TER 378 DC A 12 ATOM 379 O5' DG B 13 -0.433 15.718 35.228 1.00 0.00 O ATOM 380 C5' DG B 13 0.311 15.431 34.033 1.00 0.00 C ATOM 381 C4' DG B 13 1.549 14.592 34.393 1.00 0.00 C ATOM 382 O4' DG B 13 1.143 13.479 35.177 1.00 0.00 O ATOM 383 C3' DG B 13 2.262 14.057 33.144 1.00 0.00 C ATOM 384 O3' DG B 13 3.623 14.435 33.223 1.00 0.00 O ATOM 385 C2' DG B 13 2.071 12.541 33.234 1.00 0.00 C ATOM 386 C1' DG B 13 1.842 12.326 34.729 1.00 0.00 C ATOM 387 N9 DG B 13 1.041 11.116 35.025 1.00 0.00 N ATOM 388 C8 DG B 13 -0.325 10.985 35.031 1.00 0.00 C ATOM 389 N7 DG B 13 -0.759 9.854 35.514 1.00 0.00 N ATOM 390 C5 DG B 13 0.420 9.139 35.780 1.00 0.00 C ATOM 391 C6 DG B 13 0.650 7.837 36.356 1.00 0.00 C ATOM 392 O6 DG B 13 -0.153 7.026 36.819 1.00 0.00 O ATOM 393 N1 DG B 13 1.988 7.505 36.435 1.00 0.00 N ATOM 394 C2 DG B 13 2.995 8.337 36.083 1.00 0.00 C ATOM 395 N2 DG B 13 4.211 7.886 36.187 1.00 0.00 N ATOM 396 N3 DG B 13 2.838 9.578 35.638 1.00 0.00 N ATOM 397 C4 DG B 13 1.523 9.911 35.476 1.00 0.00 C ATOM 0 H5' DG B 13 0.615 16.359 33.549 1.00 0.00 H new ATOM 0 H5'' DG B 13 -0.315 14.891 33.323 1.00 0.00 H new ATOM 0 H4' DG B 13 2.237 15.237 34.939 1.00 0.00 H new ATOM 0 H3' DG B 13 1.882 14.439 32.197 1.00 0.00 H new ATOM 0 H2' DG B 13 1.222 12.203 32.640 1.00 0.00 H new ATOM 0 H2'' DG B 13 2.946 11.999 32.875 1.00 0.00 H new ATOM 0 HO5' DG B 13 -0.322 14.983 35.867 1.00 0.00 H new ATOM 0 H1' DG B 13 2.798 12.180 35.231 1.00 0.00 H new ATOM 0 H8 DG B 13 -0.987 11.756 34.665 1.00 0.00 H new ATOM 0 H1 DG B 13 2.232 6.576 36.780 1.00 0.00 H new ATOM 0 H21 DG B 13 4.999 8.481 35.932 1.00 0.00 H new ATOM 0 H22 DG B 13 4.376 6.937 36.524 1.00 0.00 H new ATOM 410 P DG B 14 4.565 14.465 31.918 1.00 0.00 P ATOM 411 OP1 DG B 14 5.676 15.394 32.207 1.00 0.00 O ATOM 412 OP2 DG B 14 3.690 14.697 30.749 1.00 0.00 O ATOM 413 O5' DG B 14 5.130 12.958 31.875 1.00 0.00 O ATOM 414 C5' DG B 14 6.127 12.539 32.798 1.00 0.00 C ATOM 415 C4' DG B 14 6.503 11.046 32.706 1.00 0.00 C ATOM 416 O4' DG B 14 5.443 10.222 33.182 1.00 0.00 O ATOM 417 C3' DG B 14 6.901 10.557 31.302 1.00 0.00 C ATOM 418 O3' DG B 14 8.109 9.814 31.426 1.00 0.00 O ATOM 419 C2' DG B 14 5.703 9.688 30.918 1.00 0.00 C ATOM 420 C1' DG B 14 5.285 9.135 32.282 1.00 0.00 C ATOM 421 N9 DG B 14 3.888 8.647 32.318 1.00 0.00 N ATOM 422 C8 DG B 14 2.742 9.301 31.941 1.00 0.00 C ATOM 423 N7 DG B 14 1.638 8.648 32.184 1.00 0.00 N ATOM 424 C5 DG B 14 2.093 7.432 32.721 1.00 0.00 C ATOM 425 C6 DG B 14 1.395 6.269 33.211 1.00 0.00 C ATOM 426 O6 DG B 14 0.187 6.066 33.327 1.00 0.00 O ATOM 427 N1 DG B 14 2.236 5.258 33.631 1.00 0.00 N ATOM 428 C2 DG B 14 3.586 5.346 33.624 1.00 0.00 C ATOM 429 N2 DG B 14 4.264 4.291 33.974 1.00 0.00 N ATOM 430 N3 DG B 14 4.274 6.416 33.245 1.00 0.00 N ATOM 431 C4 DG B 14 3.472 7.424 32.786 1.00 0.00 C ATOM 0 H5' DG B 14 5.779 12.750 33.809 1.00 0.00 H new ATOM 0 H5'' DG B 14 7.025 13.136 32.639 1.00 0.00 H new ATOM 0 H4' DG B 14 7.389 10.959 33.336 1.00 0.00 H new ATOM 0 H3' DG B 14 7.094 11.328 30.556 1.00 0.00 H new ATOM 0 H2' DG B 14 4.908 10.268 30.448 1.00 0.00 H new ATOM 0 H2'' DG B 14 5.976 8.897 30.220 1.00 0.00 H new ATOM 0 H1' DG B 14 5.894 8.267 32.536 1.00 0.00 H new ATOM 0 H8 DG B 14 2.753 10.278 31.480 1.00 0.00 H new ATOM 0 H1 DG B 14 1.814 4.392 33.967 1.00 0.00 H new ATOM 0 H21 DG B 14 5.284 4.319 33.981 1.00 0.00 H new ATOM 0 H22 DG B 14 3.776 3.436 34.241 1.00 0.00 H new ATOM 443 P DA B 15 8.891 9.185 30.164 1.00 0.00 P ATOM 444 OP1 DA B 15 10.339 9.356 30.411 1.00 0.00 O ATOM 445 OP2 DA B 15 8.284 9.703 28.920 1.00 0.00 O ATOM 446 O5' DA B 15 8.526 7.621 30.312 1.00 0.00 O ATOM 447 C5' DA B 15 9.047 6.868 31.402 1.00 0.00 C ATOM 448 C4' DA B 15 8.692 5.368 31.390 1.00 0.00 C ATOM 449 O4' DA B 15 7.296 5.185 31.601 1.00 0.00 O ATOM 450 C3' DA B 15 9.089 4.628 30.105 1.00 0.00 C ATOM 451 O3' DA B 15 9.594 3.348 30.465 1.00 0.00 O ATOM 452 C2' DA B 15 7.757 4.563 29.364 1.00 0.00 C ATOM 453 C1' DA B 15 6.767 4.422 30.527 1.00 0.00 C ATOM 454 N9 DA B 15 5.414 4.920 30.200 1.00 0.00 N ATOM 455 C8 DA B 15 5.051 6.112 29.623 1.00 0.00 C ATOM 456 N7 DA B 15 3.761 6.265 29.451 1.00 0.00 N ATOM 457 C5 DA B 15 3.239 5.069 29.985 1.00 0.00 C ATOM 458 C6 DA B 15 1.941 4.534 30.181 1.00 0.00 C ATOM 459 N6 DA B 15 0.816 5.149 29.877 1.00 0.00 N ATOM 460 N1 DA B 15 1.763 3.335 30.736 1.00 0.00 N ATOM 461 C2 DA B 15 2.836 2.648 31.101 1.00 0.00 C ATOM 462 N3 DA B 15 4.106 3.018 30.999 1.00 0.00 N ATOM 463 C4 DA B 15 4.238 4.249 30.432 1.00 0.00 C ATOM 0 H5' DA B 15 8.682 7.304 32.332 1.00 0.00 H new ATOM 0 H5'' DA B 15 10.132 6.969 31.407 1.00 0.00 H new ATOM 0 H4' DA B 15 9.278 4.936 32.201 1.00 0.00 H new ATOM 0 H3' DA B 15 9.868 5.090 29.499 1.00 0.00 H new ATOM 0 H2' DA B 15 7.572 5.461 28.774 1.00 0.00 H new ATOM 0 H2'' DA B 15 7.709 3.716 28.680 1.00 0.00 H new ATOM 0 H1' DA B 15 6.655 3.366 30.771 1.00 0.00 H new ATOM 0 H8 DA B 15 5.771 6.863 29.334 1.00 0.00 H new ATOM 0 H61 DA B 15 -0.079 4.691 30.051 1.00 0.00 H new ATOM 0 H62 DA B 15 0.840 6.083 29.467 1.00 0.00 H new ATOM 0 H2 DA B 15 2.656 1.674 31.531 1.00 0.00 H new ATOM 475 P DC B 16 10.184 2.308 29.381 1.00 0.00 P ATOM 476 OP1 DC B 16 11.195 1.482 30.077 1.00 0.00 O ATOM 477 OP2 DC B 16 10.566 3.074 28.175 1.00 0.00 O ATOM 478 O5' DC B 16 8.890 1.403 29.047 1.00 0.00 O ATOM 479 C5' DC B 16 8.364 0.503 30.018 1.00 0.00 C ATOM 480 C4' DC B 16 7.083 -0.243 29.590 1.00 0.00 C ATOM 481 O4' DC B 16 5.991 0.653 29.447 1.00 0.00 O ATOM 482 C3' DC B 16 7.195 -1.062 28.293 1.00 0.00 C ATOM 483 O3' DC B 16 6.955 -2.433 28.587 1.00 0.00 O ATOM 484 C2' DC B 16 6.090 -0.466 27.413 1.00 0.00 C ATOM 485 C1' DC B 16 5.131 0.152 28.439 1.00 0.00 C ATOM 486 N1 DC B 16 4.319 1.274 27.890 1.00 0.00 N ATOM 487 C2 DC B 16 2.928 1.149 27.767 1.00 0.00 C ATOM 488 O2 DC B 16 2.337 0.103 28.017 1.00 0.00 O ATOM 489 N3 DC B 16 2.181 2.196 27.344 1.00 0.00 N ATOM 490 C4 DC B 16 2.782 3.322 27.041 1.00 0.00 C ATOM 491 N4 DC B 16 1.997 4.297 26.691 1.00 0.00 N ATOM 492 C5 DC B 16 4.189 3.512 27.123 1.00 0.00 C ATOM 493 C6 DC B 16 4.930 2.458 27.557 1.00 0.00 C ATOM 0 H5' DC B 16 8.154 1.060 30.931 1.00 0.00 H new ATOM 0 H5'' DC B 16 9.130 -0.233 30.262 1.00 0.00 H new ATOM 0 H4' DC B 16 6.920 -0.952 30.402 1.00 0.00 H new ATOM 0 H3' DC B 16 8.171 -1.019 27.810 1.00 0.00 H new ATOM 0 H2' DC B 16 6.482 0.282 26.724 1.00 0.00 H new ATOM 0 H2'' DC B 16 5.599 -1.229 26.809 1.00 0.00 H new ATOM 0 H1' DC B 16 4.408 -0.589 28.781 1.00 0.00 H new ATOM 0 H41 DC B 16 2.391 5.204 26.441 1.00 0.00 H new ATOM 0 H42 DC B 16 0.987 4.155 26.666 1.00 0.00 H new ATOM 0 H5 DC B 16 4.648 4.451 26.853 1.00 0.00 H new ATOM 0 H6 DC B 16 6.003 2.552 27.640 1.00 0.00 H new ATOM 505 P DT B 17 7.229 -3.608 27.517 1.00 0.00 P ATOM 506 OP1 DT B 17 7.696 -4.794 28.268 1.00 0.00 O ATOM 507 OP2 DT B 17 8.063 -3.060 26.428 1.00 0.00 O ATOM 508 O5' DT B 17 5.765 -3.924 26.908 1.00 0.00 O ATOM 509 C5' DT B 17 4.827 -4.718 27.628 1.00 0.00 C ATOM 510 C4' DT B 17 3.500 -4.948 26.873 1.00 0.00 C ATOM 511 O4' DT B 17 2.785 -3.720 26.833 1.00 0.00 O ATOM 512 C3' DT B 17 3.658 -5.478 25.430 1.00 0.00 C ATOM 513 O3' DT B 17 2.867 -6.638 25.183 1.00 0.00 O ATOM 514 C2' DT B 17 3.143 -4.307 24.597 1.00 0.00 C ATOM 515 C1' DT B 17 2.191 -3.589 25.561 1.00 0.00 C ATOM 516 N1 DT B 17 1.980 -2.146 25.246 1.00 0.00 N ATOM 517 C2 DT B 17 0.662 -1.673 25.193 1.00 0.00 C ATOM 518 O2 DT B 17 -0.324 -2.365 25.426 1.00 0.00 O ATOM 519 N3 DT B 17 0.487 -0.365 24.810 1.00 0.00 N ATOM 520 C4 DT B 17 1.484 0.512 24.454 1.00 0.00 C ATOM 521 O4 DT B 17 1.167 1.631 24.061 1.00 0.00 O ATOM 522 C5 DT B 17 2.843 -0.022 24.575 1.00 0.00 C ATOM 523 C7 DT B 17 4.043 0.854 24.256 1.00 0.00 C ATOM 524 C6 DT B 17 3.046 -1.306 24.978 1.00 0.00 C ATOM 0 H5' DT B 17 4.613 -4.236 28.582 1.00 0.00 H new ATOM 0 H5'' DT B 17 5.279 -5.684 27.853 1.00 0.00 H new ATOM 0 H4' DT B 17 2.968 -5.725 27.422 1.00 0.00 H new ATOM 0 H3' DT B 17 4.681 -5.783 25.209 1.00 0.00 H new ATOM 0 H2' DT B 17 3.954 -3.656 24.272 1.00 0.00 H new ATOM 0 H2'' DT B 17 2.627 -4.647 23.699 1.00 0.00 H new ATOM 0 H1' DT B 17 1.199 -4.036 25.492 1.00 0.00 H new ATOM 0 H3 DT B 17 -0.470 -0.013 24.788 1.00 0.00 H new ATOM 0 H71 DT B 17 4.893 0.543 24.864 1.00 0.00 H new ATOM 0 H72 DT B 17 4.296 0.754 23.200 1.00 0.00 H new ATOM 0 H73 DT B 17 3.802 1.894 24.475 1.00 0.00 H new ATOM 0 H6 DT B 17 4.055 -1.675 25.090 1.00 0.00 H new ATOM 537 P DT B 18 3.331 -7.780 24.126 1.00 0.00 P ATOM 538 OP1 DT B 18 2.483 -8.969 24.358 1.00 0.00 O ATOM 539 OP2 DT B 18 4.800 -7.911 24.198 1.00 0.00 O ATOM 540 O5' DT B 18 2.963 -7.157 22.683 1.00 0.00 O ATOM 541 C5' DT B 18 1.634 -7.261 22.191 1.00 0.00 C ATOM 542 C4' DT B 18 1.355 -6.453 20.912 1.00 0.00 C ATOM 543 O4' DT B 18 1.553 -5.081 21.218 1.00 0.00 O ATOM 544 C3' DT B 18 2.243 -6.853 19.718 1.00 0.00 C ATOM 545 O3' DT B 18 1.542 -7.279 18.555 1.00 0.00 O ATOM 546 C2' DT B 18 2.941 -5.546 19.336 1.00 0.00 C ATOM 547 C1' DT B 18 2.264 -4.447 20.177 1.00 0.00 C ATOM 548 N1 DT B 18 3.257 -3.513 20.783 1.00 0.00 N ATOM 549 C2 DT B 18 3.131 -2.143 20.523 1.00 0.00 C ATOM 550 O2 DT B 18 2.211 -1.634 19.896 1.00 0.00 O ATOM 551 N3 DT B 18 4.128 -1.328 20.999 1.00 0.00 N ATOM 552 C4 DT B 18 5.253 -1.737 21.673 1.00 0.00 C ATOM 553 O4 DT B 18 6.084 -0.882 21.960 1.00 0.00 O ATOM 554 C5 DT B 18 5.312 -3.174 21.958 1.00 0.00 C ATOM 555 C7 DT B 18 6.466 -3.774 22.750 1.00 0.00 C ATOM 556 C6 DT B 18 4.316 -3.997 21.533 1.00 0.00 C ATOM 0 H5' DT B 18 0.946 -6.931 22.970 1.00 0.00 H new ATOM 0 H5'' DT B 18 1.415 -8.311 21.996 1.00 0.00 H new ATOM 0 H4' DT B 18 0.331 -6.660 20.601 1.00 0.00 H new ATOM 0 H3' DT B 18 2.873 -7.690 20.018 1.00 0.00 H new ATOM 0 H2' DT B 18 4.009 -5.597 19.547 1.00 0.00 H new ATOM 0 H2'' DT B 18 2.836 -5.343 18.270 1.00 0.00 H new ATOM 0 H1' DT B 18 1.611 -3.864 19.527 1.00 0.00 H new ATOM 0 H3 DT B 18 4.024 -0.326 20.837 1.00 0.00 H new ATOM 0 H71 DT B 18 6.115 -4.649 23.298 1.00 0.00 H new ATOM 0 H72 DT B 18 7.262 -4.069 22.066 1.00 0.00 H new ATOM 0 H73 DT B 18 6.848 -3.034 23.454 1.00 0.00 H new ATOM 0 H6 DT B 18 4.352 -5.047 21.785 1.00 0.00 H new ATOM 569 P DG B 19 0.818 -8.711 18.405 1.00 0.00 P ATOM 570 OP1 DG B 19 1.116 -9.525 19.600 1.00 0.00 O ATOM 571 OP2 DG B 19 1.126 -9.240 17.061 1.00 0.00 O ATOM 572 O5' DG B 19 -0.734 -8.279 18.442 1.00 0.00 O ATOM 573 C5' DG B 19 -1.580 -8.634 19.528 1.00 0.00 C ATOM 574 C4' DG B 19 -2.888 -7.822 19.561 1.00 0.00 C ATOM 575 O4' DG B 19 -2.568 -6.463 19.832 1.00 0.00 O ATOM 576 C3' DG B 19 -3.718 -7.935 18.267 1.00 0.00 C ATOM 577 O3' DG B 19 -5.047 -8.396 18.519 1.00 0.00 O ATOM 578 C2' DG B 19 -3.707 -6.500 17.740 1.00 0.00 C ATOM 579 C1' DG B 19 -3.161 -5.616 18.865 1.00 0.00 C ATOM 580 N9 DG B 19 -2.169 -4.662 18.313 1.00 0.00 N ATOM 581 C8 DG B 19 -0.839 -4.873 18.051 1.00 0.00 C ATOM 582 N7 DG B 19 -0.227 -3.853 17.508 1.00 0.00 N ATOM 583 C5 DG B 19 -1.244 -2.892 17.380 1.00 0.00 C ATOM 584 C6 DG B 19 -1.242 -1.544 16.865 1.00 0.00 C ATOM 585 O6 DG B 19 -0.307 -0.865 16.440 1.00 0.00 O ATOM 586 N1 DG B 19 -2.491 -0.960 16.848 1.00 0.00 N ATOM 587 C2 DG B 19 -3.619 -1.580 17.261 1.00 0.00 C ATOM 588 N2 DG B 19 -4.742 -0.944 17.092 1.00 0.00 N ATOM 589 N3 DG B 19 -3.672 -2.800 17.788 1.00 0.00 N ATOM 590 C4 DG B 19 -2.445 -3.404 17.828 1.00 0.00 C ATOM 0 H5' DG B 19 -1.042 -8.485 20.464 1.00 0.00 H new ATOM 0 H5'' DG B 19 -1.819 -9.695 19.463 1.00 0.00 H new ATOM 0 H4' DG B 19 -3.517 -8.239 20.348 1.00 0.00 H new ATOM 0 H3' DG B 19 -3.314 -8.660 17.561 1.00 0.00 H new ATOM 0 H2' DG B 19 -3.083 -6.421 16.850 1.00 0.00 H new ATOM 0 H2'' DG B 19 -4.711 -6.186 17.455 1.00 0.00 H new ATOM 0 H1' DG B 19 -3.959 -5.035 19.327 1.00 0.00 H new ATOM 0 H8 DG B 19 -0.339 -5.804 18.275 1.00 0.00 H new ATOM 0 H1 DG B 19 -2.568 -0.003 16.503 1.00 0.00 H new ATOM 0 H21 DG B 19 -5.620 -1.371 17.388 1.00 0.00 H new ATOM 0 H22 DG B 19 -4.744 -0.018 16.664 1.00 0.00 H new ATOM 602 P DC B 20 -5.959 -9.103 17.376 1.00 0.00 P ATOM 603 OP1 DC B 20 -7.229 -9.528 18.010 1.00 0.00 O ATOM 604 OP2 DC B 20 -5.130 -10.117 16.689 1.00 0.00 O ATOM 605 O5' DC B 20 -6.280 -7.910 16.327 1.00 0.00 O ATOM 606 C5' DC B 20 -7.267 -6.921 16.610 1.00 0.00 C ATOM 607 C4' DC B 20 -7.324 -5.745 15.606 1.00 0.00 C ATOM 608 O4' DC B 20 -6.131 -4.971 15.628 1.00 0.00 O ATOM 609 C3' DC B 20 -7.617 -6.137 14.145 1.00 0.00 C ATOM 610 O3' DC B 20 -8.856 -5.553 13.749 1.00 0.00 O ATOM 611 C2' DC B 20 -6.414 -5.551 13.393 1.00 0.00 C ATOM 612 C1' DC B 20 -5.897 -4.451 14.331 1.00 0.00 C ATOM 613 N1 DC B 20 -4.440 -4.169 14.176 1.00 0.00 N ATOM 614 C2 DC B 20 -4.006 -2.904 13.751 1.00 0.00 C ATOM 615 O2 DC B 20 -4.793 -2.021 13.421 1.00 0.00 O ATOM 616 N3 DC B 20 -2.683 -2.622 13.673 1.00 0.00 N ATOM 617 C4 DC B 20 -1.814 -3.548 14.012 1.00 0.00 C ATOM 618 N4 DC B 20 -0.562 -3.204 13.973 1.00 0.00 N ATOM 619 C5 DC B 20 -2.189 -4.857 14.428 1.00 0.00 C ATOM 620 C6 DC B 20 -3.515 -5.131 14.494 1.00 0.00 C ATOM 0 H5' DC B 20 -7.081 -6.519 17.606 1.00 0.00 H new ATOM 0 H5'' DC B 20 -8.244 -7.403 16.638 1.00 0.00 H new ATOM 0 H4' DC B 20 -8.175 -5.162 15.958 1.00 0.00 H new ATOM 0 H3' DC B 20 -7.724 -7.206 13.960 1.00 0.00 H new ATOM 0 H2' DC B 20 -5.652 -6.308 13.205 1.00 0.00 H new ATOM 0 H2'' DC B 20 -6.706 -5.146 12.424 1.00 0.00 H new ATOM 0 H1' DC B 20 -6.398 -3.506 14.119 1.00 0.00 H new ATOM 0 H41 DC B 20 0.160 -3.879 14.225 1.00 0.00 H new ATOM 0 H42 DC B 20 -0.301 -2.259 13.690 1.00 0.00 H new ATOM 0 H5 DC B 20 -1.448 -5.601 14.681 1.00 0.00 H new ATOM 0 H6 DC B 20 -3.845 -6.113 14.799 1.00 0.00 H new ATOM 632 P DT B 21 -9.591 -5.901 12.354 1.00 0.00 P ATOM 633 OP1 DT B 21 -11.040 -5.643 12.526 1.00 0.00 O ATOM 634 OP2 DT B 21 -9.140 -7.240 11.916 1.00 0.00 O ATOM 635 O5' DT B 21 -8.975 -4.789 11.355 1.00 0.00 O ATOM 636 C5' DT B 21 -9.331 -3.413 11.479 1.00 0.00 C ATOM 637 C4' DT B 21 -8.471 -2.458 10.624 1.00 0.00 C ATOM 638 O4' DT B 21 -7.120 -2.495 11.055 1.00 0.00 O ATOM 639 C3' DT B 21 -8.486 -2.716 9.105 1.00 0.00 C ATOM 640 O3' DT B 21 -9.276 -1.739 8.432 1.00 0.00 O ATOM 641 C2' DT B 21 -7.002 -2.604 8.723 1.00 0.00 C ATOM 642 C1' DT B 21 -6.307 -2.069 9.980 1.00 0.00 C ATOM 643 N1 DT B 21 -4.931 -2.610 10.128 1.00 0.00 N ATOM 644 C2 DT B 21 -3.845 -1.761 9.884 1.00 0.00 C ATOM 645 O2 DT B 21 -3.959 -0.595 9.525 1.00 0.00 O ATOM 646 N3 DT B 21 -2.592 -2.306 10.020 1.00 0.00 N ATOM 647 C4 DT B 21 -2.315 -3.627 10.280 1.00 0.00 C ATOM 648 O4 DT B 21 -1.142 -4.000 10.280 1.00 0.00 O ATOM 649 C5 DT B 21 -3.490 -4.470 10.506 1.00 0.00 C ATOM 650 C7 DT B 21 -3.328 -5.947 10.818 1.00 0.00 C ATOM 651 C6 DT B 21 -4.741 -3.943 10.426 1.00 0.00 C ATOM 0 H5' DT B 21 -9.247 -3.120 12.526 1.00 0.00 H new ATOM 0 H5'' DT B 21 -10.377 -3.293 11.197 1.00 0.00 H new ATOM 0 H4' DT B 21 -8.934 -1.483 10.778 1.00 0.00 H new ATOM 0 H3' DT B 21 -8.923 -3.676 8.830 1.00 0.00 H new ATOM 0 H2' DT B 21 -6.596 -3.572 8.430 1.00 0.00 H new ATOM 0 H2'' DT B 21 -6.862 -1.930 7.878 1.00 0.00 H new ATOM 0 H1' DT B 21 -6.197 -0.985 9.937 1.00 0.00 H new ATOM 0 H3 DT B 21 -1.797 -1.675 9.919 1.00 0.00 H new ATOM 0 H71 DT B 21 -4.154 -6.279 11.447 1.00 0.00 H new ATOM 0 H72 DT B 21 -3.327 -6.517 9.889 1.00 0.00 H new ATOM 0 H73 DT B 21 -2.386 -6.107 11.343 1.00 0.00 H new ATOM 0 H6 DT B 21 -5.598 -4.577 10.598 1.00 0.00 H new ATOM 664 P DA B 22 -9.701 -1.886 6.878 1.00 0.00 P ATOM 665 OP1 DA B 22 -10.832 -0.965 6.622 1.00 0.00 O ATOM 666 OP2 DA B 22 -9.849 -3.323 6.563 1.00 0.00 O ATOM 667 O5' DA B 22 -8.414 -1.330 6.079 1.00 0.00 O ATOM 668 C5' DA B 22 -8.075 0.051 6.116 1.00 0.00 C ATOM 669 C4' DA B 22 -6.766 0.385 5.372 1.00 0.00 C ATOM 670 O4' DA B 22 -5.637 -0.105 6.083 1.00 0.00 O ATOM 671 C3' DA B 22 -6.696 -0.153 3.929 1.00 0.00 C ATOM 672 O3' DA B 22 -6.517 0.931 3.022 1.00 0.00 O ATOM 673 C2' DA B 22 -5.482 -1.090 3.983 1.00 0.00 C ATOM 674 C1' DA B 22 -4.661 -0.526 5.149 1.00 0.00 C ATOM 675 N9 DA B 22 -3.785 -1.536 5.789 1.00 0.00 N ATOM 676 C8 DA B 22 -4.168 -2.656 6.484 1.00 0.00 C ATOM 677 N7 DA B 22 -3.182 -3.365 6.970 1.00 0.00 N ATOM 678 C5 DA B 22 -2.050 -2.642 6.549 1.00 0.00 C ATOM 679 C6 DA B 22 -0.651 -2.795 6.704 1.00 0.00 C ATOM 680 N6 DA B 22 -0.081 -3.728 7.440 1.00 0.00 N ATOM 681 N1 DA B 22 0.216 -1.952 6.133 1.00 0.00 N ATOM 682 C2 DA B 22 -0.289 -0.921 5.466 1.00 0.00 C ATOM 683 N3 DA B 22 -1.566 -0.628 5.250 1.00 0.00 N ATOM 684 C4 DA B 22 -2.407 -1.537 5.823 1.00 0.00 C ATOM 0 H5' DA B 22 -7.983 0.366 7.155 1.00 0.00 H new ATOM 0 H5'' DA B 22 -8.889 0.628 5.678 1.00 0.00 H new ATOM 0 H4' DA B 22 -6.755 1.474 5.316 1.00 0.00 H new ATOM 0 H3' DA B 22 -7.593 -0.667 3.584 1.00 0.00 H new ATOM 0 H2' DA B 22 -5.778 -2.124 4.161 1.00 0.00 H new ATOM 0 H2'' DA B 22 -4.920 -1.076 3.049 1.00 0.00 H new ATOM 0 H1' DA B 22 -3.995 0.263 4.801 1.00 0.00 H new ATOM 0 H8 DA B 22 -5.204 -2.931 6.619 1.00 0.00 H new ATOM 0 H61 DA B 22 0.936 -3.777 7.504 1.00 0.00 H new ATOM 0 H62 DA B 22 -0.657 -4.401 7.945 1.00 0.00 H new ATOM 0 H2 DA B 22 0.430 -0.233 5.046 1.00 0.00 H new ATOM 696 P DG B 23 -6.624 0.756 1.419 1.00 0.00 P ATOM 697 OP1 DG B 23 -7.012 2.060 0.834 1.00 0.00 O ATOM 698 OP2 DG B 23 -7.420 -0.451 1.113 1.00 0.00 O ATOM 699 O5' DG B 23 -5.100 0.461 1.007 1.00 0.00 O ATOM 700 C5' DG B 23 -4.125 1.490 1.070 1.00 0.00 C ATOM 701 C4' DG B 23 -2.715 0.973 0.749 1.00 0.00 C ATOM 702 O4' DG B 23 -2.265 0.120 1.791 1.00 0.00 O ATOM 703 C3' DG B 23 -2.600 0.203 -0.582 1.00 0.00 C ATOM 704 O3' DG B 23 -1.890 0.964 -1.560 1.00 0.00 O ATOM 705 C2' DG B 23 -1.834 -1.059 -0.159 1.00 0.00 C ATOM 706 C1' DG B 23 -1.306 -0.755 1.248 1.00 0.00 C ATOM 707 N9 DG B 23 -1.159 -1.972 2.083 1.00 0.00 N ATOM 708 C8 DG B 23 -2.141 -2.827 2.520 1.00 0.00 C ATOM 709 N7 DG B 23 -1.698 -3.879 3.158 1.00 0.00 N ATOM 710 C5 DG B 23 -0.311 -3.673 3.206 1.00 0.00 C ATOM 711 C6 DG B 23 0.760 -4.460 3.768 1.00 0.00 C ATOM 712 O6 DG B 23 0.724 -5.538 4.359 1.00 0.00 O ATOM 713 N1 DG B 23 2.010 -3.929 3.547 1.00 0.00 N ATOM 714 C2 DG B 23 2.233 -2.787 2.862 1.00 0.00 C ATOM 715 N2 DG B 23 3.476 -2.413 2.743 1.00 0.00 N ATOM 716 N3 DG B 23 1.291 -2.043 2.287 1.00 0.00 N ATOM 717 C4 DG B 23 0.028 -2.525 2.517 1.00 0.00 C ATOM 0 H5' DG B 23 -4.130 1.932 2.066 1.00 0.00 H new ATOM 0 H5'' DG B 23 -4.389 2.281 0.368 1.00 0.00 H new ATOM 0 H4' DG B 23 -2.098 1.867 0.656 1.00 0.00 H new ATOM 0 H3' DG B 23 -3.558 -0.016 -1.054 1.00 0.00 H new ATOM 0 H2' DG B 23 -2.486 -1.933 -0.155 1.00 0.00 H new ATOM 0 H2'' DG B 23 -1.017 -1.274 -0.848 1.00 0.00 H new ATOM 0 H1' DG B 23 -0.305 -0.326 1.214 1.00 0.00 H new ATOM 0 H8 DG B 23 -3.192 -2.646 2.351 1.00 0.00 H new ATOM 0 H1 DG B 23 2.816 -4.428 3.923 1.00 0.00 H new ATOM 0 H21 DG B 23 3.705 -1.558 2.236 1.00 0.00 H new ATOM 0 H22 DG B 23 4.220 -2.975 3.157 1.00 0.00 H new ATOM 729 P DC B 24 -1.831 0.535 -3.117 1.00 0.00 P ATOM 730 OP1 DC B 24 -1.418 1.695 -3.938 1.00 0.00 O ATOM 731 OP2 DC B 24 -3.029 -0.242 -3.485 1.00 0.00 O ATOM 732 O5' DC B 24 -0.609 -0.494 -3.139 1.00 0.00 O ATOM 733 C5' DC B 24 0.722 -0.039 -3.023 1.00 0.00 C ATOM 734 C4' DC B 24 1.681 -1.231 -2.946 1.00 0.00 C ATOM 735 O4' DC B 24 1.630 -1.845 -1.675 1.00 0.00 O ATOM 736 C3' DC B 24 1.358 -2.362 -3.934 1.00 0.00 C ATOM 737 O3' DC B 24 1.885 -2.105 -5.247 1.00 0.00 O ATOM 738 C2' DC B 24 2.046 -3.557 -3.282 1.00 0.00 C ATOM 739 C1' DC B 24 2.158 -3.151 -1.800 1.00 0.00 C ATOM 740 N1 DC B 24 1.431 -4.081 -0.900 1.00 0.00 N ATOM 741 C2 DC B 24 2.173 -5.050 -0.220 1.00 0.00 C ATOM 742 O2 DC B 24 3.388 -5.158 -0.389 1.00 0.00 O ATOM 743 N3 DC B 24 1.568 -5.928 0.605 1.00 0.00 N ATOM 744 C4 DC B 24 0.267 -5.841 0.776 1.00 0.00 C ATOM 745 N4 DC B 24 -0.246 -6.664 1.636 1.00 0.00 N ATOM 746 C5 DC B 24 -0.553 -4.910 0.078 1.00 0.00 C ATOM 747 C6 DC B 24 0.066 -4.042 -0.761 1.00 0.00 C ATOM 0 H5' DC B 24 0.827 0.580 -2.132 1.00 0.00 H new ATOM 0 H5'' DC B 24 0.976 0.588 -3.878 1.00 0.00 H new ATOM 0 H4' DC B 24 2.653 -0.794 -3.176 1.00 0.00 H new ATOM 0 H3' DC B 24 0.289 -2.499 -4.098 1.00 0.00 H new ATOM 0 H2' DC B 24 1.463 -4.470 -3.404 1.00 0.00 H new ATOM 0 H2'' DC B 24 3.026 -3.743 -3.721 1.00 0.00 H new ATOM 0 HO3' DC B 24 1.658 -2.850 -5.842 1.00 0.00 H new ATOM 0 H1' DC B 24 3.205 -3.188 -1.501 1.00 0.00 H new ATOM 0 H41 DC B 24 -1.250 -6.651 1.818 1.00 0.00 H new ATOM 0 H42 DC B 24 0.354 -7.324 2.131 1.00 0.00 H new ATOM 0 H5 DC B 24 -1.625 -4.895 0.211 1.00 0.00 H new ATOM 0 H6 DC B 24 -0.514 -3.322 -1.319 1.00 0.00 H new TER 760 DC B 24 HETATM 761 C1 HND A 25 -0.971 -1.027 21.218 1.00 0.00 C HETATM 762 C2 HND A 25 -1.451 -2.033 22.264 1.00 0.00 C HETATM 763 C3 HND A 25 -2.674 -2.822 21.764 1.00 0.00 C HETATM 764 C4 HND A 25 -3.459 -3.498 22.926 1.00 0.00 C HETATM 765 C5 HND A 25 -2.684 -4.511 23.802 1.00 0.00 C HETATM 766 C6 HND A 25 -2.325 -5.861 23.154 1.00 0.00 C HETATM 767 C7 HND A 25 -1.635 -6.755 24.205 1.00 0.00 C HETATM 768 C8 HND A 25 -1.366 -8.186 23.689 1.00 0.00 C HETATM 769 C9 HND A 25 -2.611 -9.090 23.716 1.00 0.00 C HETATM 770 O10 HND A 25 -4.664 -4.113 22.415 1.00 0.00 O HETATM 771 O11 HND A 25 -0.511 -1.756 20.094 1.00 0.00 O HETATM 0 HO11 HND A 25 0.466 -1.829 20.129 1.00 0.00 H new HETATM 0 HO10 HND A 25 -5.152 -4.538 23.151 1.00 0.00 H new HETATM 0 H9B HND A 25 -2.977 -9.175 24.739 1.00 0.00 H new HETATM 0 H9A HND A 25 -3.389 -8.657 23.087 1.00 0.00 H new HETATM 0 H9 HND A 25 -2.350 -10.080 23.341 1.00 0.00 H new HETATM 0 H8A HND A 25 -0.988 -8.131 22.668 1.00 0.00 H new HETATM 0 H8 HND A 25 -0.582 -8.641 24.295 1.00 0.00 H new HETATM 0 H7A HND A 25 -0.691 -6.297 24.502 1.00 0.00 H new HETATM 0 H7 HND A 25 -2.259 -6.807 25.097 1.00 0.00 H new HETATM 0 H6A HND A 25 -3.224 -6.349 22.777 1.00 0.00 H new HETATM 0 H6 HND A 25 -1.665 -5.705 22.301 1.00 0.00 H new HETATM 0 H5A HND A 25 -1.760 -4.037 24.132 1.00 0.00 H new HETATM 0 H5 HND A 25 -3.276 -4.710 24.695 1.00 0.00 H new HETATM 0 H4 HND A 25 -3.678 -2.675 23.606 1.00 0.00 H new HETATM 0 H3 HND A 25 -2.347 -3.585 21.058 1.00 0.00 H new HETATM 0 H2A HND A 25 -0.643 -2.724 22.504 1.00 0.00 H new HETATM 0 H2 HND A 25 -1.706 -1.509 23.185 1.00 0.00 H new HETATM 0 H1 HND A 25 -0.172 -0.406 21.624 1.00 0.00 H new CONECT 206 761 CONECT 208 763 CONECT 761 206 762 771 787 CONECT 762 761 763 772 789 CONECT 763 208 762 764 773 CONECT 764 763 765 770 774 CONECT 765 764 766 775 776 CONECT 766 765 767 778 779 CONECT 767 766 768 780 781 CONECT 768 767 769 782 783 CONECT 769 768 784 785 786 CONECT 770 764 777 CONECT 771 761 788 CONECT 772 762 CONECT 773 763 CONECT 774 764 CONECT 775 765 CONECT 776 765 CONECT 777 770 CONECT 778 766 CONECT 779 766 CONECT 780 767 CONECT 781 767 CONECT 782 768 CONECT 783 768 CONECT 784 769 CONECT 785 769 CONECT 786 769 CONECT 787 761 CONECT 788 771 CONECT 789 762 END