USER MOD reduce.3.24.130724 H: found=0, std=0, add=272, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 272 hydrogens (11 hets) HEADER DNA 26-SEP-01 1K29 TITLE SOLUTION STRUCTURE OF A DNA DUPLEX CONTAINING M1G OPPOSITE TITLE 2 A 2 BASE PAIR DELETION COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*AP*TP*CP*GP*CP*(M1G)P*CP*GP*GP*CP*AP*TP*G)- COMPND 3 3'; COMPND 4 CHAIN: A; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: 5'-D(*CP*AP*TP*GP*CP*CP*GP*CP*GP*AP*T)-3'; COMPND 8 CHAIN: B; COMPND 9 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN THE SOURCE 4 SALMONELLA TYPHIMURIUM HIS3052 GENE; SOURCE 5 MOL_ID: 2; SOURCE 6 SYNTHETIC: YES; SOURCE 7 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN THE SOURCE 8 SALMONELLA TYPHIMURIUM HIS3052 GENE KEYWDS TWO BASE DELETION, DNA ADDUCT, MALONDIALDEHYDE EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR N.C.SCHNETZ-BOUTAUD,S.SALEH,L.J.MARNETT,M.P.STONE REVDAT 3 24-FEB-09 1K29 1 VERSN REVDAT 2 01-APR-03 1K29 1 JRNL REVDAT 1 16-JAN-02 1K29 0 JRNL AUTH N.C.SCHNETZ-BOUTAUD,S.SALEH,L.J.MARNETT,M.P.STONE JRNL TITL THE EXOCYCLIC 1,N2-DEOXYGUANOSINE PYRIMIDOPURINONE JRNL TITL 2 M1G IS A CHEMICALLY STABLE DNA ADDUCT WHEN PLACED JRNL TITL 3 OPPOSITE A TWO-BASE DELETION IN THE (CPG)3 JRNL TITL 4 FRAMESHIFT HOTSPOT OF THE SALMONELLA TYPHIMURIUM JRNL TITL 5 HISD3052 GENE. JRNL REF BIOCHEMISTRY V. 40 15638 2001 JRNL REFN ISSN 0006-2960 JRNL PMID 11747439 JRNL DOI 10.1021/BI011242U REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.85 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1K29 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 09-OCT-01. REMARK 100 THE RCSB ID CODE IS RCSB014469. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 293; 303; 278 REMARK 210 PH : 7; 7; 7 REMARK 210 IONIC STRENGTH : 0.1M NACL; 0.1M NACL; 0.1M REMARK 210 NACL REMARK 210 PRESSURE : AMBIENT; AMBIENT; AMBIENT REMARK 210 SAMPLE CONTENTS : 2MM DNA, 10MM PHOSPHATE REMARK 210 BUFFER, 0.1M NACL, 50 UM EDTA REMARK 210 , PH 7; 2MM DNA, 10MM REMARK 210 PHOSPHATE BUFFER, 0.1M NACL, REMARK 210 50 UM EDTA , PH 7 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NOESY, E-COSY, P-COSY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XWINNMR 2.6, FELIX 2000, REMARK 210 MARDIGRAS 3.0, X-PLOR 3.85 REMARK 210 METHOD USED : MATRIX RELAXATION, REMARK 210 SIMULATED ANNEALING, DISTANCE REMARK 210 RESTRAINTS, DIHEDRAL ANGLE REMARK 210 RESTRAINTS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 20 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : THE SUBMITTED STRUCTURE IS AN REMARK 210 AVERAGE OF 10 DIFFERENT REMARK 210 STRUCTURES THAT WERE BACK REMARK 210 CALCULATED AND THE DATA AGREED REMARK 210 WITH EXPERIMENTAL NOESY REMARK 210 SPECTRUM REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D HOMO- REMARK 210 AND HETERO- NUCLEAR TECHNIQUES REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 DC A 3 C4 DC A 3 C5 -0.055 REMARK 500 DC A 5 C4 DC A 5 C5 -0.059 REMARK 500 DC A 7 C4 DC A 7 C5 -0.057 REMARK 500 DC A 10 C4 DC A 10 C5 -0.056 REMARK 500 DC B 14 C4 DC B 14 C5 -0.054 REMARK 500 DC B 18 C4 DC B 18 C5 -0.054 REMARK 500 DC B 19 C4 DC B 19 C5 -0.054 REMARK 500 DC B 21 C4 DC B 21 C5 -0.055 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DA A 1 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES REMARK 500 DA A 1 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DT A 2 O4' - C1' - N1 ANGL. DEV. = 4.3 DEGREES REMARK 500 DT A 2 C4 - C5 - C6 ANGL. DEV. = 4.2 DEGREES REMARK 500 DT A 2 C6 - C5 - C7 ANGL. DEV. = -4.5 DEGREES REMARK 500 DC A 3 O4' - C1' - N1 ANGL. DEV. = 3.9 DEGREES REMARK 500 DG A 4 O4' - C1' - N9 ANGL. DEV. = 3.8 DEGREES REMARK 500 DG A 4 N7 - C8 - N9 ANGL. DEV. = 4.8 DEGREES REMARK 500 DG A 4 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 DC A 5 O4' - C1' - N1 ANGL. DEV. = 3.1 DEGREES REMARK 500 DC A 7 O4' - C1' - N1 ANGL. DEV. = 3.5 DEGREES REMARK 500 DG A 8 O4' - C1' - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DG A 8 N7 - C8 - N9 ANGL. DEV. = 4.4 DEGREES REMARK 500 DG A 8 C8 - N9 - C4 ANGL. DEV. = -2.8 DEGREES REMARK 500 DG A 9 O4' - C1' - N9 ANGL. DEV. = 3.5 DEGREES REMARK 500 DG A 9 N7 - C8 - N9 ANGL. DEV. = 4.5 DEGREES REMARK 500 DG A 9 C8 - N9 - C4 ANGL. DEV. = -2.6 DEGREES REMARK 500 DC A 10 O4' - C1' - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA A 11 O4' - C1' - N9 ANGL. DEV. = 3.1 DEGREES REMARK 500 DA A 11 N7 - C8 - N9 ANGL. DEV. = 3.8 DEGREES REMARK 500 DT A 12 O4' - C1' - N1 ANGL. DEV. = 2.7 DEGREES REMARK 500 DT A 12 C4 - C5 - C6 ANGL. DEV. = 3.9 DEGREES REMARK 500 DT A 12 C6 - C5 - C7 ANGL. DEV. = -5.1 DEGREES REMARK 500 DG A 13 O4' - C1' - N9 ANGL. DEV. = 3.0 DEGREES REMARK 500 DG A 13 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG A 13 C8 - N9 - C4 ANGL. DEV. = -2.8 DEGREES REMARK 500 DC B 14 O4' - C1' - N1 ANGL. DEV. = 3.1 DEGREES REMARK 500 DA B 15 O4' - C1' - N9 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA B 15 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DT B 16 O4' - C1' - N1 ANGL. DEV. = 2.6 DEGREES REMARK 500 DT B 16 C4 - C5 - C6 ANGL. DEV. = 4.0 DEGREES REMARK 500 DT B 16 C6 - C5 - C7 ANGL. DEV. = -5.2 DEGREES REMARK 500 DG B 17 O4' - C1' - N9 ANGL. DEV. = 3.9 DEGREES REMARK 500 DG B 17 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG B 17 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 DC B 18 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 DC B 19 O4' - C1' - N1 ANGL. DEV. = 4.9 DEGREES REMARK 500 DG B 20 O4' - C1' - N9 ANGL. DEV. = 4.1 DEGREES REMARK 500 DG B 20 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG B 20 C8 - N9 - C4 ANGL. DEV. = -3.0 DEGREES REMARK 500 DC B 21 O4' - C1' - N1 ANGL. DEV. = 3.7 DEGREES REMARK 500 DG B 22 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG B 22 C8 - N9 - C4 ANGL. DEV. = -2.6 DEGREES REMARK 500 DA B 23 O4' - C1' - N9 ANGL. DEV. = 3.2 DEGREES REMARK 500 DA B 23 N7 - C8 - N9 ANGL. DEV. = 3.9 DEGREES REMARK 500 DT B 24 O4' - C1' - N1 ANGL. DEV. = 3.7 DEGREES REMARK 500 DT B 24 C4 - C5 - C6 ANGL. DEV. = 3.8 DEGREES REMARK 500 DT B 24 C6 - C5 - C7 ANGL. DEV. = -4.9 DEGREES REMARK 500 REMARK 500 REMARK: NULL DBREF 1K29 A 1 13 PDB 1K29 1K29 1 13 DBREF 1K29 B 14 24 PDB 1K29 1K29 14 24 SEQRES 1 A 13 DA DT DC DG DC M1G DC DG DG DC DA DT DG SEQRES 1 B 11 DC DA DT DG DC DC DG DC DG DA DT MODRES 1K29 M1G A 6 DG HET M1G A 6 36 HETNAM M1G 3-(2-DEOXY-BETA-D-RIBOFURANOSYL)-PYRIDO[5,6-A]-PURINE- HETNAM 2 M1G 10-ONE-5'-MONOPHOSPHATE FORMUL 1 M1G C13 H14 N5 O7 P LINK O3' DC A 5 P M1G A 6 1555 1555 1.61 LINK O3' M1G A 6 P DC A 7 1555 1555 1.62 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 DA O5' : rot 180:sc= 0 USER MOD Single : A 2 DT C7 :methyl -30:sc= -0.0217 (180deg=-0.0488) USER MOD Single : A 12 DT C7 :methyl 150:sc= -1.94 (180deg=-1.94) USER MOD Single : A 13 DG O3' : rot 180:sc= 0 USER MOD Single : B 14 DC O5' : rot 180:sc= 0 USER MOD Single : B 16 DT C7 :methyl 150:sc= -0.0961 (180deg=-0.0961) USER MOD Single : B 24 DT C7 :methyl 150:sc= -0.284 (180deg=-0.284) USER MOD Single : B 24 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 7.225 -7.361 1.309 1.00 0.15 O ATOM 2 C5' DA A 1 8.172 -6.849 0.358 1.00 0.17 C ATOM 3 C4' DA A 1 8.397 -5.334 0.479 1.00 0.16 C ATOM 4 O4' DA A 1 7.182 -4.595 0.209 1.00 0.16 O ATOM 5 C3' DA A 1 8.878 -4.959 1.874 1.00 0.15 C ATOM 6 O3' DA A 1 10.087 -4.195 1.810 1.00 0.15 O ATOM 7 C2' DA A 1 7.778 -4.119 2.467 1.00 0.13 C ATOM 8 C1' DA A 1 6.879 -3.716 1.314 1.00 0.14 C ATOM 9 N9 DA A 1 5.460 -3.810 1.691 1.00 0.13 N ATOM 10 C8 DA A 1 4.757 -4.866 2.164 1.00 0.13 C ATOM 11 N7 DA A 1 3.504 -4.683 2.415 1.00 0.12 N ATOM 12 C5 DA A 1 3.342 -3.337 2.070 1.00 0.12 C ATOM 13 C6 DA A 1 2.240 -2.477 2.090 1.00 0.12 C ATOM 14 N6 DA A 1 1.024 -2.847 2.495 1.00 0.11 N ATOM 15 N1 DA A 1 2.437 -1.215 1.681 1.00 0.12 N ATOM 16 C2 DA A 1 3.640 -0.808 1.278 1.00 0.12 C ATOM 17 N3 DA A 1 4.750 -1.536 1.217 1.00 0.13 N ATOM 18 C4 DA A 1 4.530 -2.800 1.630 1.00 0.13 C ATOM 0 H5' DA A 1 7.825 -7.078 -0.649 1.00 0.17 H new ATOM 0 H5'' DA A 1 9.124 -7.362 0.492 1.00 0.17 H new ATOM 0 H4' DA A 1 9.156 -5.074 -0.259 1.00 0.16 H new ATOM 0 H3' DA A 1 9.090 -5.847 2.470 1.00 0.15 H new ATOM 0 H2' DA A 1 7.221 -4.681 3.216 1.00 0.13 H new ATOM 0 H2'' DA A 1 8.186 -3.241 2.967 1.00 0.13 H new ATOM 0 HO5' DA A 1 7.123 -8.327 1.182 1.00 0.15 H new ATOM 0 H1' DA A 1 7.058 -2.677 1.036 1.00 0.14 H new ATOM 0 H8 DA A 1 5.227 -5.825 2.325 1.00 0.13 H new ATOM 0 H61 DA A 1 0.257 -2.174 2.487 1.00 0.11 H new ATOM 0 H62 DA A 1 0.861 -3.803 2.812 1.00 0.11 H new ATOM 0 H2 DA A 1 3.722 0.223 0.968 1.00 0.12 H new ATOM 31 P DT A 2 10.857 -3.775 3.160 1.00 0.15 P ATOM 32 OP1 DT A 2 12.312 -3.776 2.886 1.00 0.16 O ATOM 33 OP2 DT A 2 10.316 -4.584 4.276 1.00 0.14 O ATOM 34 O5' DT A 2 10.385 -2.248 3.368 1.00 0.14 O ATOM 35 C5' DT A 2 10.592 -1.269 2.347 1.00 0.15 C ATOM 36 C4' DT A 2 9.856 0.033 2.660 1.00 0.13 C ATOM 37 O4' DT A 2 8.413 -0.121 2.552 1.00 0.12 O ATOM 38 C3' DT A 2 10.158 0.496 4.081 1.00 0.13 C ATOM 39 O3' DT A 2 10.520 1.885 4.093 1.00 0.13 O ATOM 40 C2' DT A 2 8.870 0.259 4.820 1.00 0.11 C ATOM 41 C1' DT A 2 7.808 0.396 3.757 1.00 0.11 C ATOM 42 N1 DT A 2 6.569 -0.315 4.120 1.00 0.10 N ATOM 43 C2 DT A 2 5.363 0.327 3.866 1.00 0.09 C ATOM 44 O2 DT A 2 5.311 1.443 3.360 1.00 0.09 O ATOM 45 N3 DT A 2 4.219 -0.363 4.225 1.00 0.08 N ATOM 46 C4 DT A 2 4.184 -1.616 4.803 1.00 0.08 C ATOM 47 O4 DT A 2 3.104 -2.146 5.076 1.00 0.08 O ATOM 48 C5 DT A 2 5.494 -2.193 5.020 1.00 0.09 C ATOM 49 C7 DT A 2 5.607 -3.576 5.643 1.00 0.14 C ATOM 50 C6 DT A 2 6.614 -1.555 4.688 1.00 0.10 C ATOM 0 H5' DT A 2 10.248 -1.662 1.390 1.00 0.15 H new ATOM 0 H5'' DT A 2 11.659 -1.069 2.244 1.00 0.15 H new ATOM 0 H4' DT A 2 10.204 0.764 1.930 1.00 0.13 H new ATOM 0 H3' DT A 2 10.997 -0.033 4.533 1.00 0.13 H new ATOM 0 H2' DT A 2 8.850 -0.729 5.279 1.00 0.11 H new ATOM 0 H2'' DT A 2 8.730 0.986 5.620 1.00 0.11 H new ATOM 0 H1' DT A 2 7.494 1.432 3.628 1.00 0.11 H new ATOM 0 H3 DT A 2 3.324 0.093 4.047 1.00 0.08 H new ATOM 0 H71 DT A 2 4.763 -3.744 6.312 1.00 0.14 H new ATOM 0 H72 DT A 2 5.602 -4.331 4.857 1.00 0.14 H new ATOM 0 H73 DT A 2 6.537 -3.646 6.207 1.00 0.14 H new ATOM 0 H6 DT A 2 7.570 -2.024 4.870 1.00 0.10 H new ATOM 63 P DC A 3 11.006 2.612 5.447 1.00 0.13 P ATOM 64 OP1 DC A 3 12.260 3.343 5.156 1.00 0.15 O ATOM 65 OP2 DC A 3 10.967 1.624 6.548 1.00 0.13 O ATOM 66 O5' DC A 3 9.840 3.695 5.700 1.00 0.12 O ATOM 67 C5' DC A 3 9.581 4.727 4.741 1.00 0.13 C ATOM 68 C4' DC A 3 8.258 5.431 5.022 1.00 0.11 C ATOM 69 O4' DC A 3 7.153 4.493 4.994 1.00 0.10 O ATOM 70 C3' DC A 3 8.265 6.081 6.402 1.00 0.11 C ATOM 71 O3' DC A 3 7.739 7.412 6.351 1.00 0.11 O ATOM 72 C2' DC A 3 7.367 5.205 7.221 1.00 0.10 C ATOM 73 C1' DC A 3 6.402 4.632 6.213 1.00 0.09 C ATOM 74 N1 DC A 3 5.830 3.351 6.665 1.00 0.08 N ATOM 75 C2 DC A 3 4.455 3.232 6.664 1.00 0.06 C ATOM 76 O2 DC A 3 3.750 4.168 6.295 1.00 0.06 O ATOM 77 N3 DC A 3 3.923 2.053 7.075 1.00 0.05 N ATOM 78 C4 DC A 3 4.711 1.041 7.471 1.00 0.06 C ATOM 79 N4 DC A 3 4.148 -0.099 7.874 1.00 0.05 N ATOM 80 C5 DC A 3 6.076 1.157 7.476 1.00 0.07 C ATOM 81 C6 DC A 3 6.621 2.324 7.068 1.00 0.08 C ATOM 0 H5' DC A 3 9.560 4.298 3.739 1.00 0.13 H new ATOM 0 H5'' DC A 3 10.393 5.454 4.759 1.00 0.13 H new ATOM 0 H4' DC A 3 8.136 6.187 4.246 1.00 0.11 H new ATOM 0 H3' DC A 3 9.272 6.165 6.810 1.00 0.11 H new ATOM 0 H2' DC A 3 7.928 4.420 7.728 1.00 0.10 H new ATOM 0 H2'' DC A 3 6.848 5.774 7.992 1.00 0.10 H new ATOM 0 H1' DC A 3 5.540 5.284 6.071 1.00 0.09 H new ATOM 0 H41 DC A 3 4.733 -0.877 8.178 1.00 0.05 H new ATOM 0 H42 DC A 3 3.132 -0.193 7.878 1.00 0.05 H new ATOM 0 H5 DC A 3 6.700 0.337 7.798 1.00 0.07 H new ATOM 0 H6 DC A 3 7.695 2.441 7.062 1.00 0.08 H new ATOM 93 P DG A 4 7.739 8.343 7.665 1.00 0.12 P ATOM 94 OP1 DG A 4 7.957 9.744 7.239 1.00 0.13 O ATOM 95 OP2 DG A 4 8.636 7.730 8.670 1.00 0.13 O ATOM 96 O5' DG A 4 6.221 8.206 8.193 1.00 0.10 O ATOM 97 C5' DG A 4 5.145 8.888 7.541 1.00 0.10 C ATOM 98 C4' DG A 4 3.873 8.864 8.389 1.00 0.09 C ATOM 99 O4' DG A 4 3.342 7.514 8.515 1.00 0.08 O ATOM 100 C3' DG A 4 4.160 9.368 9.798 1.00 0.10 C ATOM 101 O3' DG A 4 3.122 10.267 10.222 1.00 0.10 O ATOM 102 C2' DG A 4 4.180 8.116 10.630 1.00 0.09 C ATOM 103 C1' DG A 4 3.243 7.172 9.918 1.00 0.08 C ATOM 104 N9 DG A 4 3.610 5.770 10.173 1.00 0.07 N ATOM 105 C8 DG A 4 4.834 5.233 10.315 1.00 0.08 C ATOM 106 N7 DG A 4 4.915 3.961 10.529 1.00 0.07 N ATOM 107 C5 DG A 4 3.567 3.589 10.536 1.00 0.06 C ATOM 108 C6 DG A 4 2.975 2.310 10.724 1.00 0.05 C ATOM 109 O6 DG A 4 3.529 1.230 10.924 1.00 0.05 O ATOM 110 N1 DG A 4 1.592 2.376 10.658 1.00 0.05 N ATOM 111 C2 DG A 4 0.857 3.528 10.441 1.00 0.05 C ATOM 112 N2 DG A 4 -0.470 3.391 10.414 1.00 0.05 N ATOM 113 N3 DG A 4 1.406 4.734 10.262 1.00 0.06 N ATOM 114 C4 DG A 4 2.757 4.695 10.320 1.00 0.06 C ATOM 0 H5' DG A 4 4.949 8.422 6.575 1.00 0.10 H new ATOM 0 H5'' DG A 4 5.433 9.921 7.344 1.00 0.10 H new ATOM 0 H4' DG A 4 3.149 9.505 7.885 1.00 0.09 H new ATOM 0 H3' DG A 4 5.092 9.927 9.877 1.00 0.10 H new ATOM 0 H2' DG A 4 5.186 7.701 10.698 1.00 0.09 H new ATOM 0 H2'' DG A 4 3.847 8.312 11.649 1.00 0.09 H new ATOM 0 H1' DG A 4 2.217 7.271 10.272 1.00 0.08 H new ATOM 0 H8 DG A 4 5.722 5.845 10.252 1.00 0.08 H new ATOM 0 H1 DG A 4 1.075 1.505 10.779 1.00 0.05 H new ATOM 0 H21 DG A 4 -1.064 4.206 10.258 1.00 0.05 H new ATOM 0 H22 DG A 4 -0.891 2.472 10.550 1.00 0.05 H new ATOM 126 P DC A 5 2.805 10.530 11.782 1.00 0.11 P ATOM 127 OP1 DC A 5 2.375 11.940 11.930 1.00 0.12 O ATOM 128 OP2 DC A 5 3.933 10.016 12.589 1.00 0.12 O ATOM 129 O5' DC A 5 1.521 9.590 12.038 1.00 0.10 O ATOM 130 C5' DC A 5 0.464 9.540 11.076 1.00 0.09 C ATOM 131 C4' DC A 5 -0.677 8.626 11.521 1.00 0.09 C ATOM 132 O4' DC A 5 -0.246 7.242 11.646 1.00 0.08 O ATOM 133 C3' DC A 5 -1.222 9.049 12.878 1.00 0.10 C ATOM 134 O3' DC A 5 -2.650 9.118 12.867 1.00 0.09 O ATOM 135 C2' DC A 5 -0.749 7.979 13.826 1.00 0.10 C ATOM 136 C1' DC A 5 -0.615 6.747 12.955 1.00 0.08 C ATOM 137 N1 DC A 5 0.380 5.769 13.464 1.00 0.08 N ATOM 138 C2 DC A 5 -0.040 4.460 13.631 1.00 0.08 C ATOM 139 O2 DC A 5 -1.201 4.138 13.377 1.00 0.07 O ATOM 140 N3 DC A 5 0.872 3.552 14.071 1.00 0.08 N ATOM 141 C4 DC A 5 2.140 3.917 14.329 1.00 0.08 C ATOM 142 N4 DC A 5 3.008 3.002 14.762 1.00 0.08 N ATOM 143 C5 DC A 5 2.559 5.207 14.168 1.00 0.09 C ATOM 144 C6 DC A 5 1.667 6.124 13.735 1.00 0.09 C ATOM 0 H5' DC A 5 0.859 9.188 10.123 1.00 0.09 H new ATOM 0 H5'' DC A 5 0.078 10.546 10.910 1.00 0.09 H new ATOM 0 H4' DC A 5 -1.445 8.710 10.752 1.00 0.09 H new ATOM 0 H3' DC A 5 -0.877 10.043 13.163 1.00 0.10 H new ATOM 0 H2' DC A 5 0.202 8.247 14.287 1.00 0.10 H new ATOM 0 H2'' DC A 5 -1.462 7.820 14.635 1.00 0.10 H new ATOM 0 H1' DC A 5 -1.552 6.190 12.940 1.00 0.08 H new ATOM 0 H41 DC A 5 3.972 3.268 14.961 1.00 0.08 H new ATOM 0 H42 DC A 5 2.707 2.036 14.894 1.00 0.08 H new ATOM 0 H5 DC A 5 3.580 5.487 14.382 1.00 0.09 H new ATOM 0 H6 DC A 5 1.977 7.150 13.602 1.00 0.09 H new HETATM 156 P M1G A 6 -3.442 9.275 14.255 1.00 0.10 P HETATM 157 OP1 M1G A 6 -4.640 10.110 14.016 1.00 0.11 O HETATM 158 OP2 M1G A 6 -2.470 9.664 15.302 1.00 0.12 O HETATM 159 O5' M1G A 6 -3.923 7.767 14.550 1.00 0.10 O HETATM 160 C5' M1G A 6 -5.075 7.209 13.909 1.00 0.09 C HETATM 161 C4' M1G A 6 -6.068 6.728 14.962 1.00 0.10 C HETATM 162 O4' M1G A 6 -5.512 5.617 15.728 1.00 0.10 O HETATM 163 C3' M1G A 6 -6.296 7.848 15.943 1.00 0.12 C HETATM 164 O3' M1G A 6 -7.577 7.671 16.592 1.00 0.13 O HETATM 165 C2' M1G A 6 -5.135 7.665 16.878 1.00 0.12 C HETATM 166 C1' M1G A 6 -4.931 6.133 16.960 1.00 0.11 C HETATM 167 N9 M1G A 6 -3.465 5.774 17.079 1.00 0.11 N HETATM 168 C8 M1G A 6 -2.396 6.644 17.096 1.00 0.11 C HETATM 169 N7 M1G A 6 -1.228 6.157 17.248 1.00 0.11 N HETATM 170 C5 M1G A 6 -1.467 4.809 17.354 1.00 0.10 C HETATM 171 C6 M1G A 6 -0.535 3.811 17.529 1.00 0.09 C HETATM 172 O6 M1G A 6 0.667 4.006 17.629 1.00 0.10 O HETATM 173 N1 M1G A 6 -0.918 2.545 17.620 1.00 0.09 N HETATM 174 C2 M1G A 6 -2.231 2.192 17.537 1.00 0.09 C HETATM 175 N2 M1G A 6 -2.525 0.851 17.624 1.00 0.09 N HETATM 176 N3 M1G A 6 -3.221 3.182 17.344 1.00 0.09 N HETATM 177 C4 M1G A 6 -2.789 4.509 17.261 1.00 0.10 C HETATM 178 C6A M1G A 6 -1.493 -0.084 17.685 1.00 0.08 C HETATM 179 C7A M1G A 6 -0.191 0.308 17.609 1.00 0.08 C HETATM 180 C8A M1G A 6 0.083 1.625 17.689 1.00 0.09 C HETATM 0 H5'' M1G A 6 -5.544 7.956 13.268 1.00 0.09 H new HETATM 0 H2'' M1G A 6 -4.242 8.163 16.502 1.00 0.12 H new HETATM 0 H8A M1G A 6 1.114 1.956 17.810 1.00 0.09 H new HETATM 0 H8 M1G A 6 -2.545 7.718 16.983 1.00 0.11 H new HETATM 0 H7A M1G A 6 0.608 -0.424 17.487 1.00 0.08 H new HETATM 0 H6A M1G A 6 -1.731 -1.142 17.795 1.00 0.08 H new HETATM 0 H5' M1G A 6 -4.780 6.379 13.268 1.00 0.09 H new HETATM 0 H4' M1G A 6 -6.983 6.419 14.457 1.00 0.10 H new HETATM 0 H3' M1G A 6 -6.336 8.850 15.517 1.00 0.12 H new HETATM 0 H2' M1G A 6 -5.347 8.089 17.860 1.00 0.12 H new HETATM 0 H1' M1G A 6 -5.403 5.704 17.844 1.00 0.11 H new ATOM 192 P DC A 7 -7.880 8.133 18.113 1.00 0.14 P ATOM 193 OP1 DC A 7 -9.147 8.903 18.109 1.00 0.16 O ATOM 194 OP2 DC A 7 -6.656 8.736 18.685 1.00 0.14 O ATOM 195 O5' DC A 7 -8.158 6.724 18.860 1.00 0.14 O ATOM 196 C5' DC A 7 -9.328 5.961 18.536 1.00 0.14 C ATOM 197 C4' DC A 7 -9.565 4.785 19.492 1.00 0.13 C ATOM 198 O4' DC A 7 -8.573 3.727 19.336 1.00 0.13 O ATOM 199 C3' DC A 7 -9.526 5.225 20.951 1.00 0.13 C ATOM 200 O3' DC A 7 -10.699 4.778 21.645 1.00 0.13 O ATOM 201 C2' DC A 7 -8.281 4.578 21.501 1.00 0.12 C ATOM 202 C1' DC A 7 -8.102 3.338 20.649 1.00 0.12 C ATOM 203 N1 DC A 7 -6.694 2.850 20.611 1.00 0.11 N ATOM 204 C2 DC A 7 -6.468 1.502 20.830 1.00 0.11 C ATOM 205 O2 DC A 7 -7.406 0.743 21.062 1.00 0.11 O ATOM 206 N3 DC A 7 -5.180 1.058 20.777 1.00 0.10 N ATOM 207 C4 DC A 7 -4.168 1.905 20.521 1.00 0.10 C ATOM 208 N4 DC A 7 -2.919 1.436 20.477 1.00 0.10 N ATOM 209 C5 DC A 7 -4.391 3.237 20.304 1.00 0.11 C ATOM 210 C6 DC A 7 -5.659 3.687 20.355 1.00 0.11 C ATOM 0 H5' DC A 7 -9.236 5.581 17.518 1.00 0.14 H new ATOM 0 H5'' DC A 7 -10.198 6.617 18.554 1.00 0.14 H new ATOM 0 H4' DC A 7 -10.553 4.406 19.231 1.00 0.13 H new ATOM 0 H3' DC A 7 -9.508 6.309 21.065 1.00 0.13 H new ATOM 0 H2' DC A 7 -7.420 5.242 21.425 1.00 0.12 H new ATOM 0 H2'' DC A 7 -8.396 4.324 22.555 1.00 0.12 H new ATOM 0 H1' DC A 7 -8.658 2.495 21.059 1.00 0.12 H new ATOM 0 H41 DC A 7 -2.143 2.069 20.284 1.00 0.10 H new ATOM 0 H42 DC A 7 -2.741 0.445 20.637 1.00 0.10 H new ATOM 0 H5 DC A 7 -3.572 3.910 20.097 1.00 0.11 H new ATOM 0 H6 DC A 7 -5.855 4.736 20.189 1.00 0.11 H new ATOM 222 P DG A 8 -10.882 5.042 23.223 1.00 0.12 P ATOM 223 OP1 DG A 8 -12.321 5.267 23.490 1.00 0.12 O ATOM 224 OP2 DG A 8 -9.887 6.051 23.646 1.00 0.12 O ATOM 225 O5' DG A 8 -10.469 3.623 23.861 1.00 0.11 O ATOM 226 C5' DG A 8 -11.225 2.448 23.560 1.00 0.11 C ATOM 227 C4' DG A 8 -10.744 1.246 24.367 1.00 0.10 C ATOM 228 O4' DG A 8 -9.396 0.858 23.985 1.00 0.11 O ATOM 229 C3' DG A 8 -10.717 1.570 25.855 1.00 0.09 C ATOM 230 O3' DG A 8 -11.289 0.489 26.610 1.00 0.09 O ATOM 231 C2' DG A 8 -9.254 1.743 26.164 1.00 0.08 C ATOM 232 C1' DG A 8 -8.557 0.852 25.160 1.00 0.09 C ATOM 233 N9 DG A 8 -7.175 1.292 24.858 1.00 0.09 N ATOM 234 C8 DG A 8 -6.578 2.505 25.006 1.00 0.09 C ATOM 235 N7 DG A 8 -5.334 2.605 24.666 1.00 0.09 N ATOM 236 C5 DG A 8 -5.049 1.305 24.235 1.00 0.10 C ATOM 237 C6 DG A 8 -3.838 0.755 23.732 1.00 0.10 C ATOM 238 O6 DG A 8 -2.756 1.316 23.561 1.00 0.10 O ATOM 239 N1 DG A 8 -3.983 -0.592 23.416 1.00 0.10 N ATOM 240 C2 DG A 8 -5.145 -1.323 23.563 1.00 0.10 C ATOM 241 N2 DG A 8 -5.087 -2.606 23.205 1.00 0.11 N ATOM 242 N3 DG A 8 -6.285 -0.813 24.035 1.00 0.10 N ATOM 243 C4 DG A 8 -6.170 0.497 24.350 1.00 0.10 C ATOM 0 H5' DG A 8 -11.146 2.227 22.496 1.00 0.11 H new ATOM 0 H5'' DG A 8 -12.279 2.629 23.770 1.00 0.11 H new ATOM 0 H4' DG A 8 -11.441 0.434 24.162 1.00 0.10 H new ATOM 0 H3' DG A 8 -11.297 2.456 26.112 1.00 0.09 H new ATOM 0 H2' DG A 8 -8.944 2.783 26.057 1.00 0.08 H new ATOM 0 H2'' DG A 8 -9.025 1.446 27.187 1.00 0.08 H new ATOM 0 H1' DG A 8 -8.434 -0.154 25.560 1.00 0.09 H new ATOM 0 H8 DG A 8 -7.123 3.354 25.393 1.00 0.09 H new ATOM 0 H1 DG A 8 -3.166 -1.078 23.046 1.00 0.10 H new ATOM 0 H21 DG A 8 -5.914 -3.197 23.291 1.00 0.11 H new ATOM 0 H22 DG A 8 -4.216 -2.996 22.845 1.00 0.11 H new ATOM 255 P DG A 9 -11.286 0.485 28.222 1.00 0.08 P ATOM 256 OP1 DG A 9 -12.672 0.244 28.684 1.00 0.08 O ATOM 257 OP2 DG A 9 -10.550 1.679 28.694 1.00 0.06 O ATOM 258 O5' DG A 9 -10.408 -0.822 28.571 1.00 0.09 O ATOM 259 C5' DG A 9 -10.847 -2.123 28.164 1.00 0.12 C ATOM 260 C4' DG A 9 -9.802 -3.196 28.468 1.00 0.13 C ATOM 261 O4' DG A 9 -8.540 -2.890 27.822 1.00 0.13 O ATOM 262 C3' DG A 9 -9.531 -3.286 29.965 1.00 0.13 C ATOM 263 O3' DG A 9 -9.436 -4.654 30.382 1.00 0.16 O ATOM 264 C2' DG A 9 -8.209 -2.597 30.139 1.00 0.11 C ATOM 265 C1' DG A 9 -7.501 -2.814 28.823 1.00 0.12 C ATOM 266 N9 DG A 9 -6.544 -1.733 28.535 1.00 0.10 N ATOM 267 C8 DG A 9 -6.672 -0.394 28.691 1.00 0.08 C ATOM 268 N7 DG A 9 -5.667 0.345 28.358 1.00 0.08 N ATOM 269 C5 DG A 9 -4.743 -0.610 27.924 1.00 0.10 C ATOM 270 C6 DG A 9 -3.424 -0.441 27.424 1.00 0.11 C ATOM 271 O6 DG A 9 -2.797 0.603 27.262 1.00 0.10 O ATOM 272 N1 DG A 9 -2.842 -1.660 27.102 1.00 0.12 N ATOM 273 C2 DG A 9 -3.447 -2.892 27.240 1.00 0.14 C ATOM 274 N2 DG A 9 -2.722 -3.949 26.875 1.00 0.16 N ATOM 275 N3 DG A 9 -4.686 -3.060 27.708 1.00 0.13 N ATOM 276 C4 DG A 9 -5.274 -1.885 28.030 1.00 0.11 C ATOM 0 H5' DG A 9 -11.061 -2.116 27.095 1.00 0.12 H new ATOM 0 H5'' DG A 9 -11.779 -2.368 28.674 1.00 0.12 H new ATOM 0 H4' DG A 9 -10.204 -4.138 28.095 1.00 0.13 H new ATOM 0 H3' DG A 9 -10.326 -2.835 30.559 1.00 0.13 H new ATOM 0 H2' DG A 9 -8.338 -1.536 30.351 1.00 0.11 H new ATOM 0 H2'' DG A 9 -7.645 -3.022 30.969 1.00 0.11 H new ATOM 0 H1' DG A 9 -6.906 -3.727 28.842 1.00 0.12 H new ATOM 0 H8 DG A 9 -7.581 0.040 29.080 1.00 0.08 H new ATOM 0 H1 DG A 9 -1.891 -1.643 26.734 1.00 0.12 H new ATOM 0 H21 DG A 9 -3.114 -4.888 26.953 1.00 0.16 H new ATOM 0 H22 DG A 9 -1.776 -3.819 26.517 1.00 0.16 H new ATOM 288 P DC A 10 -9.020 -5.031 31.892 1.00 0.17 P ATOM 289 OP1 DC A 10 -9.750 -6.261 32.278 1.00 0.19 O ATOM 290 OP2 DC A 10 -9.135 -3.814 32.726 1.00 0.15 O ATOM 291 O5' DC A 10 -7.456 -5.400 31.745 1.00 0.17 O ATOM 292 C5' DC A 10 -7.040 -6.598 31.084 1.00 0.18 C ATOM 293 C4' DC A 10 -5.544 -6.852 31.270 1.00 0.18 C ATOM 294 O4' DC A 10 -4.748 -5.884 30.542 1.00 0.16 O ATOM 295 C3' DC A 10 -5.163 -6.757 32.743 1.00 0.17 C ATOM 296 O3' DC A 10 -4.626 -7.999 33.212 1.00 0.19 O ATOM 297 C2' DC A 10 -4.120 -5.669 32.818 1.00 0.15 C ATOM 298 C1' DC A 10 -3.682 -5.409 31.390 1.00 0.14 C ATOM 299 N1 DC A 10 -3.393 -3.977 31.163 1.00 0.12 N ATOM 300 C2 DC A 10 -2.174 -3.645 30.600 1.00 0.11 C ATOM 301 O2 DC A 10 -1.362 -4.517 30.297 1.00 0.13 O ATOM 302 N3 DC A 10 -1.909 -2.328 30.402 1.00 0.09 N ATOM 303 C4 DC A 10 -2.801 -1.385 30.736 1.00 0.08 C ATOM 304 N4 DC A 10 -2.500 -0.104 30.509 1.00 0.06 N ATOM 305 C5 DC A 10 -4.009 -1.707 31.293 1.00 0.09 C ATOM 306 C6 DC A 10 -4.290 -3.013 31.502 1.00 0.11 C ATOM 0 H5' DC A 10 -7.268 -6.526 30.021 1.00 0.18 H new ATOM 0 H5'' DC A 10 -7.605 -7.445 31.474 1.00 0.18 H new ATOM 0 H4' DC A 10 -5.344 -7.853 30.888 1.00 0.18 H new ATOM 0 H3' DC A 10 -6.028 -6.536 33.368 1.00 0.17 H new ATOM 0 H2' DC A 10 -4.530 -4.766 33.271 1.00 0.15 H new ATOM 0 H2'' DC A 10 -3.276 -5.979 33.434 1.00 0.15 H new ATOM 0 H1' DC A 10 -2.752 -5.932 31.166 1.00 0.14 H new ATOM 0 H41 DC A 10 -3.166 0.628 30.756 1.00 0.06 H new ATOM 0 H42 DC A 10 -1.604 0.143 30.088 1.00 0.06 H new ATOM 0 H5 DC A 10 -4.719 -0.938 31.559 1.00 0.09 H new ATOM 0 H6 DC A 10 -5.236 -3.293 31.942 1.00 0.11 H new ATOM 318 P DA A 11 -4.259 -8.197 34.767 1.00 0.19 P ATOM 319 OP1 DA A 11 -4.534 -9.605 35.132 1.00 0.22 O ATOM 320 OP2 DA A 11 -4.886 -7.100 35.538 1.00 0.18 O ATOM 321 O5' DA A 11 -2.664 -7.977 34.785 1.00 0.18 O ATOM 322 C5' DA A 11 -1.806 -8.755 33.946 1.00 0.18 C ATOM 323 C4' DA A 11 -0.355 -8.295 34.063 1.00 0.16 C ATOM 324 O4' DA A 11 -0.203 -6.939 33.577 1.00 0.14 O ATOM 325 C3' DA A 11 0.091 -8.324 35.517 1.00 0.15 C ATOM 326 O3' DA A 11 1.329 -9.032 35.654 1.00 0.15 O ATOM 327 C2' DA A 11 0.247 -6.886 35.915 1.00 0.13 C ATOM 328 C1' DA A 11 0.326 -6.096 34.624 1.00 0.12 C ATOM 329 N9 DA A 11 -0.426 -4.833 34.729 1.00 0.11 N ATOM 330 C8 DA A 11 -1.659 -4.609 35.229 1.00 0.12 C ATOM 331 N7 DA A 11 -2.109 -3.397 35.193 1.00 0.11 N ATOM 332 C5 DA A 11 -1.042 -2.719 34.593 1.00 0.08 C ATOM 333 C6 DA A 11 -0.844 -1.376 34.245 1.00 0.06 C ATOM 334 N6 DA A 11 -1.743 -0.417 34.490 1.00 0.07 N ATOM 335 N1 DA A 11 0.324 -1.057 33.660 1.00 0.03 N ATOM 336 C2 DA A 11 1.254 -1.994 33.448 1.00 0.04 C ATOM 337 N3 DA A 11 1.171 -3.288 33.740 1.00 0.06 N ATOM 338 C4 DA A 11 -0.011 -3.587 34.311 1.00 0.08 C ATOM 0 H5' DA A 11 -2.134 -8.673 32.910 1.00 0.18 H new ATOM 0 H5'' DA A 11 -1.880 -9.807 34.221 1.00 0.18 H new ATOM 0 H4' DA A 11 0.253 -8.973 33.464 1.00 0.16 H new ATOM 0 H3' DA A 11 -0.629 -8.840 36.152 1.00 0.15 H new ATOM 0 H2' DA A 11 -0.596 -6.556 36.522 1.00 0.13 H new ATOM 0 H2'' DA A 11 1.146 -6.743 36.514 1.00 0.13 H new ATOM 0 H1' DA A 11 1.357 -5.821 34.404 1.00 0.12 H new ATOM 0 H8 DA A 11 -2.249 -5.413 35.644 1.00 0.12 H new ATOM 0 H61 DA A 11 -1.549 0.546 34.216 1.00 0.07 H new ATOM 0 H62 DA A 11 -2.623 -0.649 34.951 1.00 0.07 H new ATOM 0 H2 DA A 11 2.174 -1.663 32.989 1.00 0.04 H new ATOM 350 P DT A 12 1.976 -9.282 37.108 1.00 0.15 P ATOM 351 OP1 DT A 12 2.988 -10.356 36.985 1.00 0.16 O ATOM 352 OP2 DT A 12 0.875 -9.415 38.088 1.00 0.17 O ATOM 353 O5' DT A 12 2.742 -7.896 37.395 1.00 0.12 O ATOM 354 C5' DT A 12 4.023 -7.641 36.813 1.00 0.11 C ATOM 355 C4' DT A 12 4.570 -6.279 37.226 1.00 0.08 C ATOM 356 O4' DT A 12 3.829 -5.204 36.624 1.00 0.07 O ATOM 357 C3' DT A 12 4.500 -6.091 38.730 1.00 0.09 C ATOM 358 O3' DT A 12 5.759 -6.408 39.339 1.00 0.10 O ATOM 359 C2' DT A 12 4.140 -4.624 38.919 1.00 0.09 C ATOM 360 C1' DT A 12 3.813 -4.085 37.529 1.00 0.07 C ATOM 361 N1 DT A 12 2.505 -3.402 37.503 1.00 0.08 N ATOM 362 C2 DT A 12 2.475 -2.086 37.080 1.00 0.07 C ATOM 363 O2 DT A 12 3.487 -1.490 36.730 1.00 0.05 O ATOM 364 N3 DT A 12 1.230 -1.482 37.061 1.00 0.08 N ATOM 365 C4 DT A 12 0.032 -2.074 37.417 1.00 0.10 C ATOM 366 O4 DT A 12 -1.017 -1.441 37.363 1.00 0.11 O ATOM 367 C5 DT A 12 0.179 -3.443 37.858 1.00 0.11 C ATOM 368 C7 DT A 12 -1.022 -4.227 38.323 1.00 0.20 C ATOM 369 C6 DT A 12 1.367 -4.050 37.887 1.00 0.10 C ATOM 0 H5' DT A 12 3.945 -7.687 35.727 1.00 0.11 H new ATOM 0 H5'' DT A 12 4.722 -8.421 37.116 1.00 0.11 H new ATOM 0 H4' DT A 12 5.606 -6.255 36.887 1.00 0.08 H new ATOM 0 H3' DT A 12 3.769 -6.749 39.200 1.00 0.09 H new ATOM 0 H2' DT A 12 3.287 -4.515 39.589 1.00 0.09 H new ATOM 0 H2'' DT A 12 4.969 -4.074 39.365 1.00 0.09 H new ATOM 0 H1' DT A 12 4.551 -3.339 37.234 1.00 0.07 H new ATOM 0 H3 DT A 12 1.193 -0.509 36.756 1.00 0.08 H new ATOM 0 H71 DT A 12 -0.871 -5.285 38.108 1.00 0.20 H new ATOM 0 H72 DT A 12 -1.153 -4.089 39.396 1.00 0.20 H new ATOM 0 H73 DT A 12 -1.911 -3.874 37.801 1.00 0.20 H new ATOM 0 H6 DT A 12 1.429 -5.075 38.221 1.00 0.10 H new ATOM 382 P DG A 13 5.928 -6.410 40.941 1.00 0.12 P ATOM 383 OP1 DG A 13 6.888 -7.478 41.302 1.00 0.13 O ATOM 384 OP2 DG A 13 4.579 -6.397 41.550 1.00 0.14 O ATOM 385 O5' DG A 13 6.627 -4.988 41.225 1.00 0.12 O ATOM 386 C5' DG A 13 7.940 -4.712 40.731 1.00 0.12 C ATOM 387 C4' DG A 13 8.284 -3.229 40.859 1.00 0.13 C ATOM 388 O4' DG A 13 7.321 -2.437 40.132 1.00 0.12 O ATOM 389 C3' DG A 13 8.233 -2.807 42.330 1.00 0.16 C ATOM 390 O3' DG A 13 9.464 -2.218 42.792 1.00 0.18 O ATOM 391 C2' DG A 13 7.120 -1.805 42.431 1.00 0.17 C ATOM 392 C1' DG A 13 6.642 -1.524 41.018 1.00 0.14 C ATOM 393 N9 DG A 13 5.177 -1.669 40.919 1.00 0.14 N ATOM 394 C8 DG A 13 4.366 -2.655 41.378 1.00 0.14 C ATOM 395 N7 DG A 13 3.098 -2.538 41.163 1.00 0.14 N ATOM 396 C5 DG A 13 3.038 -1.323 40.473 1.00 0.14 C ATOM 397 C6 DG A 13 1.914 -0.629 39.950 1.00 0.14 C ATOM 398 O6 DG A 13 0.728 -0.952 39.991 1.00 0.15 O ATOM 399 N1 DG A 13 2.293 0.555 39.330 1.00 0.13 N ATOM 400 C2 DG A 13 3.590 1.019 39.221 1.00 0.13 C ATOM 401 N2 DG A 13 3.754 2.180 38.589 1.00 0.14 N ATOM 402 N3 DG A 13 4.650 0.371 39.711 1.00 0.13 N ATOM 403 C4 DG A 13 4.307 -0.786 40.320 1.00 0.13 C ATOM 0 H5' DG A 13 8.008 -5.014 39.686 1.00 0.12 H new ATOM 0 H5'' DG A 13 8.670 -5.305 41.282 1.00 0.12 H new ATOM 0 H4' DG A 13 9.284 -3.071 40.456 1.00 0.13 H new ATOM 0 H3' DG A 13 8.073 -3.684 42.957 1.00 0.16 H new ATOM 0 H2' DG A 13 6.306 -2.194 43.043 1.00 0.17 H new ATOM 0 H2'' DG A 13 7.468 -0.889 42.909 1.00 0.17 H new ATOM 0 HO3' DG A 13 9.373 -1.967 43.735 1.00 0.18 H new ATOM 0 H1' DG A 13 6.874 -0.496 40.738 1.00 0.14 H new ATOM 0 H8 DG A 13 4.767 -3.508 41.905 1.00 0.14 H new ATOM 0 H1 DG A 13 1.554 1.128 38.922 1.00 0.13 H new ATOM 0 H21 DG A 13 4.689 2.573 38.478 1.00 0.14 H new ATOM 0 H22 DG A 13 2.945 2.676 38.216 1.00 0.14 H new TER 416 DG A 13 ATOM 417 O5' DC B 14 -2.627 7.995 41.610 1.00 0.28 O ATOM 418 C5' DC B 14 -1.435 8.680 42.043 1.00 0.30 C ATOM 419 C4' DC B 14 -0.164 8.311 41.250 1.00 0.27 C ATOM 420 O4' DC B 14 0.208 6.922 41.423 1.00 0.26 O ATOM 421 C3' DC B 14 -0.344 8.568 39.760 1.00 0.25 C ATOM 422 O3' DC B 14 0.640 9.490 39.273 1.00 0.26 O ATOM 423 C2' DC B 14 -0.164 7.227 39.097 1.00 0.22 C ATOM 424 C1' DC B 14 0.477 6.328 40.134 1.00 0.22 C ATOM 425 N1 DC B 14 -0.048 4.953 40.056 1.00 0.21 N ATOM 426 C2 DC B 14 0.844 3.948 39.744 1.00 0.18 C ATOM 427 O2 DC B 14 2.028 4.210 39.541 1.00 0.18 O ATOM 428 N3 DC B 14 0.366 2.680 39.669 1.00 0.17 N ATOM 429 C4 DC B 14 -0.931 2.416 39.891 1.00 0.18 C ATOM 430 N4 DC B 14 -1.359 1.156 39.808 1.00 0.18 N ATOM 431 C5 DC B 14 -1.821 3.411 40.202 1.00 0.20 C ATOM 432 C6 DC B 14 -1.361 4.679 40.281 1.00 0.21 C ATOM 0 H5' DC B 14 -1.267 8.460 43.097 1.00 0.30 H new ATOM 0 H5'' DC B 14 -1.599 9.755 41.963 1.00 0.30 H new ATOM 0 H4' DC B 14 0.627 8.947 41.648 1.00 0.27 H new ATOM 0 H3' DC B 14 -1.319 9.007 39.550 1.00 0.25 H new ATOM 0 H2' DC B 14 -1.122 6.823 38.769 1.00 0.22 H new ATOM 0 H2'' DC B 14 0.466 7.311 38.212 1.00 0.22 H new ATOM 0 HO5' DC B 14 -3.386 8.280 42.160 1.00 0.28 H new ATOM 0 H1' DC B 14 1.550 6.248 39.962 1.00 0.22 H new ATOM 0 H41 DC B 14 -2.342 0.939 39.974 1.00 0.18 H new ATOM 0 H42 DC B 14 -0.704 0.409 39.578 1.00 0.18 H new ATOM 0 H5 DC B 14 -2.863 3.187 40.379 1.00 0.20 H new ATOM 0 H6 DC B 14 -2.041 5.481 40.525 1.00 0.21 H new ATOM 445 P DA B 15 0.585 10.016 37.749 1.00 0.25 P ATOM 446 OP1 DA B 15 1.066 11.416 37.725 1.00 0.27 O ATOM 447 OP2 DA B 15 -0.745 9.685 37.193 1.00 0.23 O ATOM 448 O5' DA B 15 1.685 9.096 37.009 1.00 0.22 O ATOM 449 C5' DA B 15 3.056 9.116 37.415 1.00 0.23 C ATOM 450 C4' DA B 15 3.864 8.025 36.712 1.00 0.20 C ATOM 451 O4' DA B 15 3.385 6.703 37.073 1.00 0.18 O ATOM 452 C3' DA B 15 3.733 8.148 35.199 1.00 0.19 C ATOM 453 O3' DA B 15 4.995 7.888 34.576 1.00 0.19 O ATOM 454 C2' DA B 15 2.760 7.064 34.827 1.00 0.16 C ATOM 455 C1' DA B 15 2.992 6.003 35.874 1.00 0.15 C ATOM 456 N9 DA B 15 1.814 5.151 36.097 1.00 0.13 N ATOM 457 C8 DA B 15 0.534 5.481 36.371 1.00 0.14 C ATOM 458 N7 DA B 15 -0.307 4.514 36.545 1.00 0.13 N ATOM 459 C5 DA B 15 0.513 3.394 36.364 1.00 0.11 C ATOM 460 C6 DA B 15 0.267 2.018 36.413 1.00 0.09 C ATOM 461 N6 DA B 15 -0.937 1.499 36.656 1.00 0.10 N ATOM 462 N1 DA B 15 1.307 1.198 36.189 1.00 0.07 N ATOM 463 C2 DA B 15 2.522 1.690 35.920 1.00 0.07 C ATOM 464 N3 DA B 15 2.861 2.973 35.852 1.00 0.10 N ATOM 465 C4 DA B 15 1.803 3.776 36.090 1.00 0.11 C ATOM 0 H5' DA B 15 3.119 8.979 38.494 1.00 0.23 H new ATOM 0 H5'' DA B 15 3.488 10.091 37.192 1.00 0.23 H new ATOM 0 H4' DA B 15 4.900 8.153 37.024 1.00 0.20 H new ATOM 0 H3' DA B 15 3.409 9.141 34.886 1.00 0.19 H new ATOM 0 H2' DA B 15 1.732 7.425 34.844 1.00 0.16 H new ATOM 0 H2'' DA B 15 2.948 6.684 33.823 1.00 0.16 H new ATOM 0 H1' DA B 15 3.767 5.311 35.546 1.00 0.15 H new ATOM 0 H8 DA B 15 0.224 6.513 36.442 1.00 0.14 H new ATOM 0 H61 DA B 15 -1.061 0.487 36.680 1.00 0.10 H new ATOM 0 H62 DA B 15 -1.734 2.114 36.817 1.00 0.10 H new ATOM 0 H2 DA B 15 3.307 0.971 35.740 1.00 0.07 H new ATOM 477 P DT B 16 5.122 7.804 32.976 1.00 0.19 P ATOM 478 OP1 DT B 16 6.448 8.339 32.589 1.00 0.21 O ATOM 479 OP2 DT B 16 3.894 8.374 32.378 1.00 0.18 O ATOM 480 O5' DT B 16 5.124 6.212 32.717 1.00 0.16 O ATOM 481 C5' DT B 16 6.255 5.392 33.032 1.00 0.16 C ATOM 482 C4' DT B 16 6.194 4.076 32.262 1.00 0.13 C ATOM 483 O4' DT B 16 5.114 3.226 32.734 1.00 0.10 O ATOM 484 C3' DT B 16 5.943 4.359 30.791 1.00 0.14 C ATOM 485 O3' DT B 16 6.813 3.553 29.980 1.00 0.15 O ATOM 486 C2' DT B 16 4.498 3.983 30.599 1.00 0.12 C ATOM 487 C1' DT B 16 4.263 2.885 31.619 1.00 0.09 C ATOM 488 N1 DT B 16 2.851 2.773 32.047 1.00 0.07 N ATOM 489 C2 DT B 16 2.329 1.506 32.275 1.00 0.05 C ATOM 490 O2 DT B 16 2.981 0.482 32.089 1.00 0.05 O ATOM 491 N3 DT B 16 1.024 1.465 32.747 1.00 0.04 N ATOM 492 C4 DT B 16 0.207 2.552 32.988 1.00 0.05 C ATOM 493 O4 DT B 16 -0.947 2.389 33.386 1.00 0.06 O ATOM 494 C5 DT B 16 0.852 3.818 32.707 1.00 0.07 C ATOM 495 C7 DT B 16 0.112 5.127 32.944 1.00 0.09 C ATOM 496 C6 DT B 16 2.109 3.888 32.260 1.00 0.08 C ATOM 0 H5' DT B 16 6.279 5.192 34.103 1.00 0.16 H new ATOM 0 H5'' DT B 16 7.175 5.922 32.786 1.00 0.16 H new ATOM 0 H4' DT B 16 7.146 3.568 32.414 1.00 0.13 H new ATOM 0 H3' DT B 16 6.139 5.392 30.504 1.00 0.14 H new ATOM 0 H2' DT B 16 3.839 4.834 30.770 1.00 0.12 H new ATOM 0 H2'' DT B 16 4.309 3.632 29.585 1.00 0.12 H new ATOM 0 H1' DT B 16 4.494 1.910 31.190 1.00 0.09 H new ATOM 0 H3 DT B 16 0.631 0.543 32.934 1.00 0.04 H new ATOM 0 H71 DT B 16 0.828 5.908 33.200 1.00 0.09 H new ATOM 0 H72 DT B 16 -0.426 5.410 32.039 1.00 0.09 H new ATOM 0 H73 DT B 16 -0.597 5.001 33.763 1.00 0.09 H new ATOM 0 H6 DT B 16 2.545 4.856 32.063 1.00 0.08 H new ATOM 509 P DG B 17 6.867 3.714 28.379 1.00 0.17 P ATOM 510 OP1 DG B 17 8.125 4.411 28.027 1.00 0.19 O ATOM 511 OP2 DG B 17 5.570 4.258 27.919 1.00 0.16 O ATOM 512 O5' DG B 17 6.980 2.186 27.874 1.00 0.16 O ATOM 513 C5' DG B 17 8.074 1.350 28.277 1.00 0.16 C ATOM 514 C4' DG B 17 7.746 -0.127 28.058 1.00 0.16 C ATOM 515 O4' DG B 17 6.576 -0.497 28.827 1.00 0.13 O ATOM 516 C3' DG B 17 7.414 -0.376 26.593 1.00 0.18 C ATOM 517 O3' DG B 17 7.822 -1.680 26.171 1.00 0.18 O ATOM 518 C2' DG B 17 5.923 -0.323 26.552 1.00 0.17 C ATOM 519 C1' DG B 17 5.489 -0.794 27.923 1.00 0.14 C ATOM 520 N9 DG B 17 4.237 -0.147 28.329 1.00 0.12 N ATOM 521 C8 DG B 17 3.904 1.164 28.343 1.00 0.12 C ATOM 522 N7 DG B 17 2.719 1.475 28.731 1.00 0.10 N ATOM 523 C5 DG B 17 2.178 0.221 29.016 1.00 0.09 C ATOM 524 C6 DG B 17 0.893 -0.112 29.487 1.00 0.08 C ATOM 525 O6 DG B 17 -0.027 0.648 29.754 1.00 0.07 O ATOM 526 N1 DG B 17 0.744 -1.485 29.644 1.00 0.09 N ATOM 527 C2 DG B 17 1.718 -2.426 29.380 1.00 0.10 C ATOM 528 N2 DG B 17 1.382 -3.700 29.592 1.00 0.12 N ATOM 529 N3 DG B 17 2.940 -2.116 28.932 1.00 0.11 N ATOM 530 C4 DG B 17 3.101 -0.780 28.773 1.00 0.11 C ATOM 0 H5' DG B 17 8.300 1.524 29.329 1.00 0.16 H new ATOM 0 H5'' DG B 17 8.967 1.616 27.711 1.00 0.16 H new ATOM 0 H4' DG B 17 8.613 -0.712 28.366 1.00 0.16 H new ATOM 0 H3' DG B 17 7.915 0.345 25.947 1.00 0.18 H new ATOM 0 H2' DG B 17 5.567 0.687 26.348 1.00 0.17 H new ATOM 0 H2'' DG B 17 5.524 -0.966 25.767 1.00 0.17 H new ATOM 0 H1' DG B 17 5.282 -1.864 27.927 1.00 0.14 H new ATOM 0 H8 DG B 17 4.610 1.923 28.039 1.00 0.12 H new ATOM 0 H1 DG B 17 -0.157 -1.824 29.981 1.00 0.09 H new ATOM 0 H21 DG B 17 2.059 -4.442 29.415 1.00 0.12 H new ATOM 0 H22 DG B 17 0.448 -3.931 29.931 1.00 0.12 H new ATOM 542 P DC B 18 7.605 -2.128 24.639 1.00 0.19 P ATOM 543 OP1 DC B 18 8.726 -3.016 24.255 1.00 0.20 O ATOM 544 OP2 DC B 18 7.314 -0.920 23.835 1.00 0.19 O ATOM 545 O5' DC B 18 6.259 -3.021 24.718 1.00 0.18 O ATOM 546 C5' DC B 18 6.191 -4.208 25.513 1.00 0.19 C ATOM 547 C4' DC B 18 4.828 -4.899 25.387 1.00 0.19 C ATOM 548 O4' DC B 18 3.769 -4.163 26.043 1.00 0.18 O ATOM 549 C3' DC B 18 4.436 -5.075 23.926 1.00 0.18 C ATOM 550 O3' DC B 18 4.031 -6.411 23.636 1.00 0.18 O ATOM 551 C2' DC B 18 3.240 -4.154 23.756 1.00 0.16 C ATOM 552 C1' DC B 18 2.644 -4.082 25.148 1.00 0.17 C ATOM 553 N1 DC B 18 1.857 -2.853 25.404 1.00 0.16 N ATOM 554 C2 DC B 18 0.539 -3.004 25.795 1.00 0.15 C ATOM 555 O2 DC B 18 0.042 -4.123 25.897 1.00 0.15 O ATOM 556 N3 DC B 18 -0.175 -1.879 26.065 1.00 0.15 N ATOM 557 C4 DC B 18 0.383 -0.663 25.957 1.00 0.15 C ATOM 558 N4 DC B 18 -0.355 0.417 26.234 1.00 0.14 N ATOM 559 C5 DC B 18 1.689 -0.509 25.570 1.00 0.15 C ATOM 560 C6 DC B 18 2.413 -1.619 25.296 1.00 0.16 C ATOM 0 H5' DC B 18 6.377 -3.957 26.557 1.00 0.19 H new ATOM 0 H5'' DC B 18 6.978 -4.897 25.206 1.00 0.19 H new ATOM 0 H4' DC B 18 4.943 -5.868 25.874 1.00 0.19 H new ATOM 0 H3' DC B 18 5.273 -4.854 23.264 1.00 0.18 H new ATOM 0 H2' DC B 18 3.540 -3.170 23.397 1.00 0.16 H new ATOM 0 H2'' DC B 18 2.527 -4.552 23.035 1.00 0.16 H new ATOM 0 H1' DC B 18 1.927 -4.891 25.286 1.00 0.17 H new ATOM 0 H41 DC B 18 0.054 1.348 26.157 1.00 0.14 H new ATOM 0 H42 DC B 18 -1.327 0.310 26.523 1.00 0.14 H new ATOM 0 H5 DC B 18 2.129 0.474 25.486 1.00 0.15 H new ATOM 0 H6 DC B 18 3.444 -1.522 24.988 1.00 0.16 H new ATOM 572 P DC B 19 3.709 -6.789 22.114 1.00 0.17 P ATOM 573 OP1 DC B 19 4.115 -8.196 21.894 1.00 0.18 O ATOM 574 OP2 DC B 19 4.255 -5.723 21.244 1.00 0.16 O ATOM 575 O5' DC B 19 2.110 -6.713 22.056 1.00 0.16 O ATOM 576 C5' DC B 19 1.233 -7.743 22.505 1.00 0.17 C ATOM 577 C4' DC B 19 -0.105 -7.507 21.829 1.00 0.16 C ATOM 578 O4' DC B 19 -0.695 -6.274 22.323 1.00 0.15 O ATOM 579 C3' DC B 19 0.188 -7.328 20.340 1.00 0.15 C ATOM 580 O3' DC B 19 -0.810 -7.870 19.467 1.00 0.15 O ATOM 581 C2' DC B 19 0.173 -5.836 20.177 1.00 0.14 C ATOM 582 C1' DC B 19 -0.797 -5.349 21.228 1.00 0.14 C ATOM 583 N1 DC B 19 -0.572 -3.932 21.632 1.00 0.13 N ATOM 584 C2 DC B 19 -1.673 -3.263 22.128 1.00 0.13 C ATOM 585 O2 DC B 19 -2.751 -3.842 22.235 1.00 0.14 O ATOM 586 N3 DC B 19 -1.526 -1.961 22.481 1.00 0.13 N ATOM 587 C4 DC B 19 -0.346 -1.338 22.356 1.00 0.12 C ATOM 588 N4 DC B 19 -0.250 -0.058 22.725 1.00 0.12 N ATOM 589 C5 DC B 19 0.758 -1.986 21.866 1.00 0.13 C ATOM 590 C6 DC B 19 0.635 -3.289 21.504 1.00 0.13 C ATOM 0 H5' DC B 19 1.128 -7.715 23.590 1.00 0.17 H new ATOM 0 H5'' DC B 19 1.628 -8.726 22.248 1.00 0.17 H new ATOM 0 H4' DC B 19 -0.787 -8.335 22.022 1.00 0.16 H new ATOM 0 H3' DC B 19 1.113 -7.841 20.076 1.00 0.15 H new ATOM 0 H2' DC B 19 1.166 -5.411 20.326 1.00 0.14 H new ATOM 0 H2'' DC B 19 -0.150 -5.550 19.176 1.00 0.14 H new ATOM 0 H1' DC B 19 -1.812 -5.331 20.832 1.00 0.14 H new ATOM 0 H41 DC B 19 0.640 0.433 22.637 1.00 0.12 H new ATOM 0 H42 DC B 19 -1.067 0.429 23.095 1.00 0.12 H new ATOM 0 H5 DC B 19 1.703 -1.472 21.770 1.00 0.13 H new ATOM 0 H6 DC B 19 1.490 -3.822 21.114 1.00 0.13 H new ATOM 602 P DG B 20 -0.526 -7.844 17.871 1.00 0.14 P ATOM 603 OP1 DG B 20 -1.131 -9.062 17.286 1.00 0.15 O ATOM 604 OP2 DG B 20 0.916 -7.582 17.670 1.00 0.14 O ATOM 605 O5' DG B 20 -1.344 -6.570 17.304 1.00 0.13 O ATOM 606 C5' DG B 20 -2.708 -6.323 17.632 1.00 0.13 C ATOM 607 C4' DG B 20 -3.365 -5.389 16.605 1.00 0.12 C ATOM 608 O4' DG B 20 -2.763 -4.052 16.600 1.00 0.11 O ATOM 609 C3' DG B 20 -3.196 -5.949 15.197 1.00 0.11 C ATOM 610 O3' DG B 20 -4.428 -5.843 14.468 1.00 0.11 O ATOM 611 C2' DG B 20 -2.126 -5.085 14.574 1.00 0.10 C ATOM 612 C1' DG B 20 -2.268 -3.748 15.262 1.00 0.09 C ATOM 613 N9 DG B 20 -0.990 -2.987 15.289 1.00 0.09 N ATOM 614 C8 DG B 20 0.262 -3.383 15.636 1.00 0.09 C ATOM 615 N7 DG B 20 1.206 -2.507 15.579 1.00 0.08 N ATOM 616 C5 DG B 20 0.523 -1.375 15.138 1.00 0.08 C ATOM 617 C6 DG B 20 1.014 -0.071 14.878 1.00 0.08 C ATOM 618 O6 DG B 20 2.166 0.338 14.985 1.00 0.08 O ATOM 619 N1 DG B 20 0.003 0.783 14.451 1.00 0.07 N ATOM 620 C2 DG B 20 -1.323 0.428 14.288 1.00 0.08 C ATOM 621 N2 DG B 20 -2.153 1.391 13.868 1.00 0.07 N ATOM 622 N3 DG B 20 -1.794 -0.804 14.534 1.00 0.08 N ATOM 623 C4 DG B 20 -0.823 -1.653 14.955 1.00 0.08 C ATOM 0 H5' DG B 20 -2.771 -5.878 18.625 1.00 0.13 H new ATOM 0 H5'' DG B 20 -3.252 -7.267 17.670 1.00 0.13 H new ATOM 0 H4' DG B 20 -4.415 -5.319 16.890 1.00 0.12 H new ATOM 0 H3' DG B 20 -2.925 -7.005 15.194 1.00 0.11 H new ATOM 0 H2' DG B 20 -1.134 -5.508 14.731 1.00 0.10 H new ATOM 0 H2'' DG B 20 -2.267 -4.994 13.497 1.00 0.10 H new ATOM 0 H1' DG B 20 -2.956 -3.096 14.724 1.00 0.09 H new ATOM 0 H8 DG B 20 0.460 -4.397 15.949 1.00 0.09 H new ATOM 0 H1 DG B 20 0.260 1.748 14.242 1.00 0.07 H new ATOM 0 H21 DG B 20 -3.143 1.187 13.730 1.00 0.07 H new ATOM 0 H22 DG B 20 -1.795 2.329 13.686 1.00 0.07 H new ATOM 635 P DC B 21 -4.470 -5.992 12.864 1.00 0.11 P ATOM 636 OP1 DC B 21 -5.750 -6.641 12.496 1.00 0.12 O ATOM 637 OP2 DC B 21 -3.190 -6.580 12.411 1.00 0.10 O ATOM 638 O5' DC B 21 -4.530 -4.457 12.373 1.00 0.10 O ATOM 639 C5' DC B 21 -5.421 -3.532 13.001 1.00 0.10 C ATOM 640 C4' DC B 21 -5.356 -2.146 12.363 1.00 0.09 C ATOM 641 O4' DC B 21 -4.062 -1.513 12.573 1.00 0.08 O ATOM 642 C3' DC B 21 -5.580 -2.225 10.858 1.00 0.09 C ATOM 643 O3' DC B 21 -6.540 -1.243 10.438 1.00 0.09 O ATOM 644 C2' DC B 21 -4.221 -1.953 10.269 1.00 0.08 C ATOM 645 C1' DC B 21 -3.538 -1.081 11.297 1.00 0.07 C ATOM 646 N1 DC B 21 -2.060 -1.186 11.238 1.00 0.06 N ATOM 647 C2 DC B 21 -1.345 -0.017 11.068 1.00 0.05 C ATOM 648 O2 DC B 21 -1.926 1.060 10.967 1.00 0.05 O ATOM 649 N3 DC B 21 0.010 -0.101 11.022 1.00 0.04 N ATOM 650 C4 DC B 21 0.633 -1.283 11.137 1.00 0.04 C ATOM 651 N4 DC B 21 1.967 -1.318 11.083 1.00 0.04 N ATOM 652 C5 DC B 21 -0.069 -2.448 11.304 1.00 0.05 C ATOM 653 C6 DC B 21 -1.421 -2.382 11.353 1.00 0.06 C ATOM 0 H5' DC B 21 -5.175 -3.455 14.060 1.00 0.10 H new ATOM 0 H5'' DC B 21 -6.441 -3.912 12.938 1.00 0.10 H new ATOM 0 H4' DC B 21 -6.140 -1.558 12.840 1.00 0.09 H new ATOM 0 H3' DC B 21 -5.980 -3.187 10.539 1.00 0.09 H new ATOM 0 H2' DC B 21 -3.668 -2.877 10.100 1.00 0.08 H new ATOM 0 H2'' DC B 21 -4.298 -1.448 9.306 1.00 0.08 H new ATOM 0 H1' DC B 21 -3.741 -0.026 11.116 1.00 0.07 H new ATOM 0 H41 DC B 21 2.458 -2.208 11.169 1.00 0.04 H new ATOM 0 H42 DC B 21 2.495 -0.455 10.956 1.00 0.04 H new ATOM 0 H5 DC B 21 0.443 -3.395 11.394 1.00 0.05 H new ATOM 0 H6 DC B 21 -1.997 -3.286 11.484 1.00 0.06 H new ATOM 665 P DG B 22 -7.059 -1.179 8.914 1.00 0.10 P ATOM 666 OP1 DG B 22 -8.526 -0.974 8.933 1.00 0.11 O ATOM 667 OP2 DG B 22 -6.486 -2.328 8.178 1.00 0.10 O ATOM 668 O5' DG B 22 -6.371 0.169 8.360 1.00 0.09 O ATOM 669 C5' DG B 22 -6.905 1.457 8.687 1.00 0.09 C ATOM 670 C4' DG B 22 -6.192 2.565 7.915 1.00 0.08 C ATOM 671 O4' DG B 22 -4.772 2.541 8.197 1.00 0.07 O ATOM 672 C3' DG B 22 -6.353 2.361 6.415 1.00 0.09 C ATOM 673 O3' DG B 22 -6.588 3.607 5.752 1.00 0.10 O ATOM 674 C2' DG B 22 -5.035 1.784 5.978 1.00 0.08 C ATOM 675 C1' DG B 22 -4.040 2.344 6.966 1.00 0.07 C ATOM 676 N9 DG B 22 -2.913 1.424 7.191 1.00 0.06 N ATOM 677 C8 DG B 22 -2.924 0.122 7.562 1.00 0.06 C ATOM 678 N7 DG B 22 -1.786 -0.464 7.726 1.00 0.05 N ATOM 679 C5 DG B 22 -0.890 0.566 7.429 1.00 0.04 C ATOM 680 C6 DG B 22 0.529 0.564 7.426 1.00 0.04 C ATOM 681 O6 DG B 22 1.292 -0.365 7.683 1.00 0.04 O ATOM 682 N1 DG B 22 1.039 1.808 7.071 1.00 0.04 N ATOM 683 C2 DG B 22 0.280 2.918 6.753 1.00 0.04 C ATOM 684 N2 DG B 22 0.952 4.025 6.439 1.00 0.05 N ATOM 685 N3 DG B 22 -1.055 2.927 6.756 1.00 0.04 N ATOM 686 C4 DG B 22 -1.574 1.727 7.100 1.00 0.05 C ATOM 0 H5' DG B 22 -6.804 1.634 9.758 1.00 0.09 H new ATOM 0 H5'' DG B 22 -7.971 1.480 8.459 1.00 0.09 H new ATOM 0 H4' DG B 22 -6.633 3.513 8.223 1.00 0.08 H new ATOM 0 H3' DG B 22 -7.200 1.718 6.175 1.00 0.09 H new ATOM 0 H2' DG B 22 -5.050 0.694 6.002 1.00 0.08 H new ATOM 0 H2'' DG B 22 -4.791 2.077 4.957 1.00 0.08 H new ATOM 0 H1' DG B 22 -3.609 3.271 6.588 1.00 0.07 H new ATOM 0 H8 DG B 22 -3.853 -0.408 7.715 1.00 0.06 H new ATOM 0 H1 DG B 22 2.054 1.909 7.043 1.00 0.04 H new ATOM 0 H21 DG B 22 0.446 4.877 6.195 1.00 0.05 H new ATOM 0 H22 DG B 22 1.972 4.021 6.443 1.00 0.05 H new ATOM 698 P DA B 23 -6.911 3.645 4.178 1.00 0.11 P ATOM 699 OP1 DA B 23 -7.857 4.756 3.925 1.00 0.12 O ATOM 700 OP2 DA B 23 -7.248 2.273 3.737 1.00 0.11 O ATOM 701 O5' DA B 23 -5.484 4.043 3.544 1.00 0.10 O ATOM 702 C5' DA B 23 -5.001 5.389 3.573 1.00 0.10 C ATOM 703 C4' DA B 23 -3.835 5.568 2.605 1.00 0.10 C ATOM 704 O4' DA B 23 -2.661 4.840 3.062 1.00 0.09 O ATOM 705 C3' DA B 23 -4.210 5.013 1.238 1.00 0.12 C ATOM 706 O3' DA B 23 -3.806 5.900 0.186 1.00 0.13 O ATOM 707 C2' DA B 23 -3.478 3.700 1.168 1.00 0.11 C ATOM 708 C1' DA B 23 -2.262 3.889 2.047 1.00 0.10 C ATOM 709 N9 DA B 23 -1.840 2.605 2.643 1.00 0.09 N ATOM 710 C8 DA B 23 -2.601 1.568 3.059 1.00 0.09 C ATOM 711 N7 DA B 23 -1.996 0.538 3.548 1.00 0.08 N ATOM 712 C5 DA B 23 -0.656 0.924 3.450 1.00 0.08 C ATOM 713 C6 DA B 23 0.539 0.284 3.797 1.00 0.07 C ATOM 714 N6 DA B 23 0.577 -0.934 4.338 1.00 0.07 N ATOM 715 N1 DA B 23 1.687 0.946 3.567 1.00 0.08 N ATOM 716 C2 DA B 23 1.662 2.168 3.025 1.00 0.08 C ATOM 717 N3 DA B 23 0.587 2.866 2.658 1.00 0.08 N ATOM 718 C4 DA B 23 -0.549 2.182 2.900 1.00 0.08 C ATOM 0 H5' DA B 23 -4.683 5.644 4.584 1.00 0.10 H new ATOM 0 H5'' DA B 23 -5.806 6.075 3.310 1.00 0.10 H new ATOM 0 H4' DA B 23 -3.614 6.634 2.550 1.00 0.10 H new ATOM 0 H3' DA B 23 -5.286 4.896 1.113 1.00 0.12 H new ATOM 0 H2' DA B 23 -4.101 2.880 1.525 1.00 0.11 H new ATOM 0 H2'' DA B 23 -3.192 3.460 0.144 1.00 0.11 H new ATOM 0 H1' DA B 23 -1.404 4.253 1.481 1.00 0.10 H new ATOM 0 H8 DA B 23 -3.678 1.600 2.985 1.00 0.09 H new ATOM 0 H61 DA B 23 1.473 -1.359 4.574 1.00 0.07 H new ATOM 0 H62 DA B 23 -0.290 -1.440 4.516 1.00 0.07 H new ATOM 0 H2 DA B 23 2.619 2.642 2.867 1.00 0.08 H new ATOM 730 P DT B 24 -4.199 5.590 -1.347 1.00 0.15 P ATOM 731 OP1 DT B 24 -4.455 6.879 -2.028 1.00 0.16 O ATOM 732 OP2 DT B 24 -5.239 4.536 -1.354 1.00 0.17 O ATOM 733 O5' DT B 24 -2.844 4.960 -1.951 1.00 0.15 O ATOM 734 C5' DT B 24 -1.765 5.809 -2.355 1.00 0.15 C ATOM 735 C4' DT B 24 -0.510 5.004 -2.705 1.00 0.15 C ATOM 736 O4' DT B 24 -0.033 4.277 -1.553 1.00 0.14 O ATOM 737 C3' DT B 24 -0.766 3.967 -3.807 1.00 0.17 C ATOM 738 O3' DT B 24 -0.238 4.309 -5.086 1.00 0.18 O ATOM 739 C2' DT B 24 -0.018 2.769 -3.391 1.00 0.17 C ATOM 740 C1' DT B 24 0.454 2.989 -1.977 1.00 0.15 C ATOM 741 N1 DT B 24 -0.024 1.905 -1.107 1.00 0.14 N ATOM 742 C2 DT B 24 0.929 1.176 -0.434 1.00 0.14 C ATOM 743 O2 DT B 24 2.129 1.407 -0.546 1.00 0.14 O ATOM 744 N3 DT B 24 0.454 0.167 0.382 1.00 0.13 N ATOM 745 C4 DT B 24 -0.873 -0.174 0.578 1.00 0.13 C ATOM 746 O4 DT B 24 -1.180 -1.094 1.324 1.00 0.13 O ATOM 747 C5 DT B 24 -1.789 0.645 -0.175 1.00 0.14 C ATOM 748 C7 DT B 24 -3.291 0.401 -0.083 1.00 0.14 C ATOM 749 C6 DT B 24 -1.360 1.633 -0.974 1.00 0.14 C ATOM 0 H5' DT B 24 -1.535 6.511 -1.554 1.00 0.15 H new ATOM 0 H5'' DT B 24 -2.071 6.400 -3.218 1.00 0.15 H new ATOM 0 H4' DT B 24 0.222 5.734 -3.050 1.00 0.15 H new ATOM 0 H3' DT B 24 -1.846 3.862 -3.914 1.00 0.17 H new ATOM 0 H2' DT B 24 -0.651 1.884 -3.449 1.00 0.17 H new ATOM 0 H2'' DT B 24 0.830 2.598 -4.055 1.00 0.17 H new ATOM 0 HO3' DT B 24 -0.444 3.596 -5.726 1.00 0.18 H new ATOM 0 H1' DT B 24 1.542 2.977 -1.919 1.00 0.15 H new ATOM 0 H3 DT B 24 1.149 -0.380 0.890 1.00 0.13 H new ATOM 0 H71 DT B 24 -3.822 1.340 -0.237 1.00 0.14 H new ATOM 0 H72 DT B 24 -3.591 -0.315 -0.848 1.00 0.14 H new ATOM 0 H73 DT B 24 -3.535 0.003 0.902 1.00 0.14 H new ATOM 0 H6 DT B 24 -2.079 2.224 -1.521 1.00 0.14 H new TER 763 DT B 24 CONECT 134 156 CONECT 156 134 157 158 159 CONECT 157 156 CONECT 158 156 CONECT 159 156 160 CONECT 160 159 161 181 182 CONECT 161 160 162 163 183 CONECT 162 161 166 CONECT 163 161 164 165 184 CONECT 164 163 192 CONECT 165 163 166 185 186 CONECT 166 162 165 167 187 CONECT 167 166 168 177 CONECT 168 167 169 188 CONECT 169 168 170 CONECT 170 169 171 177 CONECT 171 170 172 173 CONECT 172 171 CONECT 173 171 174 180 CONECT 174 173 175 176 CONECT 175 174 178 CONECT 176 174 177 CONECT 177 167 170 176 CONECT 178 175 179 189 CONECT 179 178 180 190 CONECT 180 173 179 191 CONECT 181 160 CONECT 182 160 CONECT 183 161 CONECT 184 163 CONECT 185 165 CONECT 186 165 CONECT 187 166 CONECT 188 168 CONECT 189 178 CONECT 190 179 CONECT 191 180 CONECT 192 164 END