USER MOD reduce.3.24.130724 H: found=0, std=0, add=202, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 201 hydrogens (0 hets) HEADER DNA 17-JAN-03 1NP5 TITLE (GAC)3 PARALLEL DUPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*GP*AP*CP*GP*AP*CP*GP*AP*C)-3'; COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THIS SEQUENCE IS FOUND IN TRIPLET REPEAT SOURCE 4 EXPANSION INVOLVING NEUROGENETIC DISEASES. KEYWDS DNA TRINUCLEOTIDE REPEAT, PARALLEL DUPLEX, HOMO-BASEPAIR KEYWDS 2 MISMATCH, NMR SOLUTION STRUCTURE EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR M.ZHENG,X.HAN,X.GAO REVDAT 2 24-FEB-09 1NP5 1 VERSN REVDAT 1 11-FEB-03 1NP5 0 JRNL AUTH M.ZHENG,X.HAN,X.GAO JRNL TITL STRAND POLARITY OF TRINUCLEOTIDE REPEAT SEQUENCES: JRNL TITL 2 NMR STUDIES OF PARALLEL/ANTI-PARARELL JRNL TITL 3 DUPLEX,{D(GAC)3}2 JRNL REF TO BE PUBLISHED JRNL REFN REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : MARDIGRAS 3.0 REMARK 3 AUTHORS : BORGIAS, B.A. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1NP5 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 21-JAN-03. REMARK 100 THE RCSB ID CODE IS RCSB018071. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 273 REMARK 210 PH : 4.7 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 2 MM 5'-D(GACGACGAC), 0.1 M REMARK 210 NACL, 10 MM SODIUM PHOSPHATE, REMARK 210 0.1 MM EDTA REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY, 2D TOCSY, DQF-COSY, REMARK 210 COSY-35, 1H-31P COSY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : AMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : UXNMR 940101, FELIX 95, X- REMARK 210 PLOR 3.01 REMARK 210 METHOD USED : DISTANCE GEOMETRY, RESTRAINT REMARK 210 MOLECULAR DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 10 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D REMARK 210 HOMONUCLEAR 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 ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DG A 1 O4' - C1' - N9 ANGL. DEV. = 2.7 DEGREES REMARK 500 DG A 1 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG A 1 C8 - N9 - C4 ANGL. DEV. = -3.0 DEGREES REMARK 500 DA A 2 O4' - C1' - N9 ANGL. DEV. = 4.3 DEGREES REMARK 500 DA A 2 N7 - C8 - N9 ANGL. DEV. = 4.1 DEGREES REMARK 500 DG A 4 O4' - C1' - N9 ANGL. DEV. = 2.3 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 DA A 5 O4' - C1' - N9 ANGL. DEV. = 3.2 DEGREES REMARK 500 DA A 5 N7 - C8 - N9 ANGL. DEV. = 3.9 DEGREES REMARK 500 DG A 7 O4' - C1' - N9 ANGL. DEV. = 2.5 DEGREES REMARK 500 DG A 7 N7 - C8 - N9 ANGL. DEV. = 4.8 DEGREES REMARK 500 DG A 7 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 DA A 8 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DC A 9 O4' - C1' - N1 ANGL. DEV. = 2.9 DEGREES REMARK 500 DG B 101 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES REMARK 500 DG B 101 N7 - C8 - N9 ANGL. DEV. = 4.7 DEGREES REMARK 500 DG B 101 C8 - N9 - C4 ANGL. DEV. = -3.0 DEGREES REMARK 500 DA B 102 O4' - C1' - N9 ANGL. DEV. = 4.3 DEGREES REMARK 500 DA B 102 N7 - C8 - N9 ANGL. DEV. = 4.1 DEGREES REMARK 500 DC B 103 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DG B 104 O4' - C1' - N9 ANGL. DEV. = 2.3 DEGREES REMARK 500 DG B 104 N7 - C8 - N9 ANGL. DEV. = 4.7 DEGREES REMARK 500 DG B 104 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 DA B 105 O4' - C1' - N9 ANGL. DEV. = 3.2 DEGREES REMARK 500 DA B 105 N7 - C8 - N9 ANGL. DEV. = 4.0 DEGREES REMARK 500 DG B 107 O4' - C1' - N9 ANGL. DEV. = 2.5 DEGREES REMARK 500 DG B 107 N7 - C8 - N9 ANGL. DEV. = 4.8 DEGREES REMARK 500 DG B 107 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 DA B 108 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DC B 109 O4' - C1' - N1 ANGL. DEV. = 3.0 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 DA A 2 0.07 SIDE_CHAIN REMARK 500 DA A 5 0.06 SIDE_CHAIN REMARK 500 DA B 102 0.07 SIDE_CHAIN REMARK 500 DA B 105 0.06 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL DBREF 1NP5 A 1 9 PDB 1NP5 1NP5 1 9 DBREF 1NP5 B 101 109 PDB 1NP5 1NP5 101 109 SEQRES 1 A 9 DG DA DC DG DA DC DG DA DC SEQRES 1 B 9 DG DA DC DG DA DC DG DA DC CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 9 DC O3' : rot 180:sc= 0 USER MOD Single : B 101 DG O5' : rot 180:sc= 0 USER MOD Single : B 109 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 13.460 -6.123 4.080 1.00 0.37 O ATOM 2 C5' DG A 1 14.377 -5.262 4.759 1.00 0.32 C ATOM 3 C4' DG A 1 14.276 -3.818 4.267 1.00 0.23 C ATOM 4 O4' DG A 1 14.641 -3.696 2.870 1.00 0.24 O ATOM 5 C3' DG A 1 12.852 -3.287 4.412 1.00 0.20 C ATOM 6 O3' DG A 1 12.831 -2.081 5.189 1.00 0.19 O ATOM 7 C2' DG A 1 12.369 -3.044 3.005 1.00 0.18 C ATOM 8 C1' DG A 1 13.619 -2.949 2.171 1.00 0.17 C ATOM 9 N9 DG A 1 13.437 -3.460 0.790 1.00 0.18 N ATOM 10 C8 DG A 1 13.139 -4.711 0.350 1.00 0.22 C ATOM 11 N7 DG A 1 13.122 -4.911 -0.924 1.00 0.23 N ATOM 12 C5 DG A 1 13.440 -3.644 -1.417 1.00 0.20 C ATOM 13 C6 DG A 1 13.579 -3.198 -2.759 1.00 0.23 C ATOM 14 O6 DG A 1 13.453 -3.844 -3.795 1.00 0.26 O ATOM 15 N1 DG A 1 13.902 -1.851 -2.817 1.00 0.24 N ATOM 16 C2 DG A 1 14.074 -1.031 -1.725 1.00 0.24 C ATOM 17 N2 DG A 1 14.369 0.236 -1.982 1.00 0.29 N ATOM 18 N3 DG A 1 13.949 -1.439 -0.460 1.00 0.20 N ATOM 19 C4 DG A 1 13.632 -2.749 -0.375 1.00 0.18 C ATOM 0 H5' DG A 1 15.394 -5.626 4.611 1.00 0.32 H new ATOM 0 H5'' DG A 1 14.180 -5.295 5.831 1.00 0.32 H new ATOM 0 H4' DG A 1 14.967 -3.242 4.882 1.00 0.23 H new ATOM 0 H3' DG A 1 12.208 -3.992 4.937 1.00 0.20 H new ATOM 0 H2' DG A 1 11.728 -3.856 2.663 1.00 0.18 H new ATOM 0 H2'' DG A 1 11.783 -2.127 2.942 1.00 0.18 H new ATOM 0 HO5' DG A 1 13.556 -7.037 4.421 1.00 0.37 H new ATOM 0 H1' DG A 1 13.898 -1.902 2.050 1.00 0.17 H new ATOM 0 H8 DG A 1 12.924 -5.510 1.044 1.00 0.22 H new ATOM 0 H1 DG A 1 14.021 -1.435 -3.741 1.00 0.24 H new ATOM 0 H21 DG A 1 14.508 0.893 -1.214 1.00 0.29 H new ATOM 0 H22 DG A 1 14.457 0.554 -2.947 1.00 0.29 H new ATOM 32 P DA A 2 14.008 -0.968 5.118 1.00 0.18 P ATOM 33 OP1 DA A 2 14.341 -0.709 3.700 1.00 0.21 O ATOM 34 OP2 DA A 2 15.072 -1.349 6.073 1.00 0.23 O ATOM 35 O5' DA A 2 13.247 0.318 5.692 1.00 0.21 O ATOM 36 C5' DA A 2 11.827 0.271 5.783 1.00 0.18 C ATOM 37 C4' DA A 2 11.195 1.656 5.699 1.00 0.17 C ATOM 38 O4' DA A 2 11.705 2.399 4.569 1.00 0.16 O ATOM 39 C3' DA A 2 9.682 1.549 5.532 1.00 0.16 C ATOM 40 O3' DA A 2 8.985 2.148 6.616 1.00 0.19 O ATOM 41 C2' DA A 2 9.357 2.307 4.296 1.00 0.15 C ATOM 42 C1' DA A 2 10.602 2.895 3.776 1.00 0.15 C ATOM 43 N9 DA A 2 10.661 2.452 2.407 1.00 0.14 N ATOM 44 C8 DA A 2 10.661 1.190 1.967 1.00 0.15 C ATOM 45 N7 DA A 2 10.455 0.990 0.720 1.00 0.16 N ATOM 46 C5 DA A 2 10.283 2.291 0.259 1.00 0.15 C ATOM 47 C6 DA A 2 10.007 2.825 -0.999 1.00 0.16 C ATOM 48 N6 DA A 2 9.800 2.081 -2.078 1.00 0.19 N ATOM 49 N1 DA A 2 9.900 4.154 -1.085 1.00 0.17 N ATOM 50 C2 DA A 2 10.051 4.905 0.005 1.00 0.17 C ATOM 51 N3 DA A 2 10.310 4.508 1.232 1.00 0.16 N ATOM 52 C4 DA A 2 10.415 3.184 1.289 1.00 0.14 C ATOM 0 H5' DA A 2 11.541 -0.200 6.723 1.00 0.18 H new ATOM 0 H5'' DA A 2 11.434 -0.354 4.981 1.00 0.18 H new ATOM 0 H4' DA A 2 11.444 2.171 6.627 1.00 0.17 H new ATOM 0 H3' DA A 2 9.387 0.501 5.490 1.00 0.16 H new ATOM 0 H2' DA A 2 8.909 1.648 3.553 1.00 0.15 H new ATOM 0 H2'' DA A 2 8.628 3.089 4.510 1.00 0.15 H new ATOM 0 H1' DA A 2 10.646 3.983 3.827 1.00 0.15 H new ATOM 0 H8 DA A 2 10.830 0.365 2.643 1.00 0.15 H new ATOM 0 H61 DA A 2 9.602 2.526 -2.974 1.00 0.19 H new ATOM 0 H62 DA A 2 9.839 1.064 -2.011 1.00 0.19 H new ATOM 0 H2 DA A 2 9.948 5.971 -0.136 1.00 0.17 H new ATOM 64 P DC A 3 9.216 3.699 6.995 1.00 0.21 P ATOM 65 OP1 DC A 3 10.631 3.866 7.399 1.00 0.25 O ATOM 66 OP2 DC A 3 8.150 4.094 7.945 1.00 0.27 O ATOM 67 O5' DC A 3 9.003 4.564 5.624 1.00 0.17 O ATOM 68 C5' DC A 3 7.803 5.338 5.452 1.00 0.16 C ATOM 69 C4' DC A 3 7.268 5.509 4.031 1.00 0.15 C ATOM 70 O4' DC A 3 7.686 4.467 3.135 1.00 0.13 O ATOM 71 C3' DC A 3 5.747 5.580 4.027 1.00 0.15 C ATOM 72 O3' DC A 3 5.275 6.743 3.315 1.00 0.17 O ATOM 73 C2' DC A 3 5.336 4.311 3.354 1.00 0.14 C ATOM 74 C1' DC A 3 6.525 3.892 2.520 1.00 0.12 C ATOM 75 N1 DC A 3 6.639 2.454 2.496 1.00 0.12 N ATOM 76 C2 DC A 3 6.917 1.827 1.290 1.00 0.13 C ATOM 77 O2 DC A 3 7.043 2.487 0.258 1.00 0.15 O ATOM 78 N3 DC A 3 7.039 0.476 1.289 1.00 0.15 N ATOM 79 C4 DC A 3 6.892 -0.217 2.421 1.00 0.16 C ATOM 80 N4 DC A 3 7.025 -1.541 2.389 1.00 0.18 N ATOM 81 C5 DC A 3 6.601 0.449 3.661 1.00 0.15 C ATOM 82 C6 DC A 3 6.487 1.779 3.644 1.00 0.14 C ATOM 0 H5' DC A 3 7.982 6.331 5.865 1.00 0.16 H new ATOM 0 H5'' DC A 3 7.018 4.879 6.053 1.00 0.16 H new ATOM 0 H4' DC A 3 7.692 6.446 3.671 1.00 0.15 H new ATOM 0 H3' DC A 3 5.325 5.676 5.028 1.00 0.15 H new ATOM 0 H2' DC A 3 5.080 3.544 4.085 1.00 0.14 H new ATOM 0 H2'' DC A 3 4.455 4.465 2.731 1.00 0.14 H new ATOM 0 H1' DC A 3 6.416 4.232 1.490 1.00 0.12 H new ATOM 0 H41 DC A 3 6.916 -2.085 3.245 1.00 0.18 H new ATOM 0 H42 DC A 3 7.236 -2.011 1.509 1.00 0.18 H new ATOM 0 H5 DC A 3 6.478 -0.109 4.578 1.00 0.15 H new ATOM 0 H6 DC A 3 6.272 2.313 4.558 1.00 0.14 H new ATOM 94 P DG A 4 5.497 6.925 1.724 1.00 0.17 P ATOM 95 OP1 DG A 4 6.940 6.782 1.430 1.00 0.21 O ATOM 96 OP2 DG A 4 4.776 8.144 1.294 1.00 0.24 O ATOM 97 O5' DG A 4 4.726 5.647 1.120 1.00 0.16 O ATOM 98 C5' DG A 4 4.599 5.459 -0.292 1.00 0.14 C ATOM 99 C4' DG A 4 3.244 4.875 -0.653 1.00 0.11 C ATOM 100 O4' DG A 4 3.114 3.555 -0.102 1.00 0.12 O ATOM 101 C3' DG A 4 2.130 5.736 -0.090 1.00 0.12 C ATOM 102 O3' DG A 4 1.186 6.081 -1.094 1.00 0.15 O ATOM 103 C2' DG A 4 1.517 4.927 1.010 1.00 0.12 C ATOM 104 C1' DG A 4 2.011 3.505 0.813 1.00 0.11 C ATOM 105 N9 DG A 4 2.423 2.901 2.088 1.00 0.10 N ATOM 106 C8 DG A 4 2.397 3.424 3.328 1.00 0.12 C ATOM 107 N7 DG A 4 2.793 2.679 4.306 1.00 0.14 N ATOM 108 C5 DG A 4 3.138 1.501 3.636 1.00 0.12 C ATOM 109 C6 DG A 4 3.653 0.276 4.142 1.00 0.15 C ATOM 110 O6 DG A 4 3.920 -0.021 5.302 1.00 0.19 O ATOM 111 N1 DG A 4 3.862 -0.642 3.127 1.00 0.15 N ATOM 112 C2 DG A 4 3.613 -0.418 1.792 1.00 0.15 C ATOM 113 N2 DG A 4 3.901 -1.408 0.968 1.00 0.19 N ATOM 114 N3 DG A 4 3.128 0.722 1.308 1.00 0.12 N ATOM 115 C4 DG A 4 2.914 1.634 2.276 1.00 0.10 C ATOM 0 H5' DG A 4 5.389 4.796 -0.645 1.00 0.14 H new ATOM 0 H5'' DG A 4 4.733 6.413 -0.801 1.00 0.14 H new ATOM 0 H4' DG A 4 3.171 4.839 -1.740 1.00 0.11 H new ATOM 0 H3' DG A 4 2.503 6.688 0.287 1.00 0.12 H new ATOM 0 H2' DG A 4 1.812 5.310 1.987 1.00 0.12 H new ATOM 0 H2'' DG A 4 0.429 4.971 0.966 1.00 0.12 H new ATOM 0 H1' DG A 4 1.209 2.884 0.415 1.00 0.11 H new ATOM 0 H8 DG A 4 2.056 4.434 3.500 1.00 0.12 H new ATOM 0 H1 DG A 4 4.230 -1.557 3.389 1.00 0.15 H new ATOM 0 H21 DG A 4 3.738 -1.302 -0.033 1.00 0.19 H new ATOM 0 H22 DG A 4 4.286 -2.279 1.333 1.00 0.19 H new ATOM 127 P DA A 5 1.607 7.091 -2.278 1.00 0.16 P ATOM 128 OP1 DA A 5 3.076 7.274 -2.254 1.00 0.20 O ATOM 129 OP2 DA A 5 0.711 8.266 -2.226 1.00 0.22 O ATOM 130 O5' DA A 5 1.227 6.226 -3.565 1.00 0.15 O ATOM 131 C5' DA A 5 -0.042 5.592 -3.597 1.00 0.13 C ATOM 132 C4' DA A 5 -0.091 4.467 -4.635 1.00 0.12 C ATOM 133 O4' DA A 5 0.927 3.453 -4.437 1.00 0.13 O ATOM 134 C3' DA A 5 -1.411 3.729 -4.632 1.00 0.12 C ATOM 135 O3' DA A 5 -2.408 4.404 -5.390 1.00 0.16 O ATOM 136 C2' DA A 5 -1.045 2.421 -5.242 1.00 0.12 C ATOM 137 C1' DA A 5 0.354 2.157 -4.785 1.00 0.12 C ATOM 138 N9 DA A 5 0.285 1.279 -3.631 1.00 0.11 N ATOM 139 C8 DA A 5 0.229 1.621 -2.342 1.00 0.12 C ATOM 140 N7 DA A 5 -0.035 0.691 -1.484 1.00 0.12 N ATOM 141 C5 DA A 5 -0.172 -0.424 -2.322 1.00 0.10 C ATOM 142 C6 DA A 5 -0.467 -1.770 -2.080 1.00 0.11 C ATOM 143 N6 DA A 5 -0.723 -2.253 -0.868 1.00 0.13 N ATOM 144 N1 DA A 5 -0.520 -2.594 -3.141 1.00 0.11 N ATOM 145 C2 DA A 5 -0.301 -2.125 -4.371 1.00 0.12 C ATOM 146 N3 DA A 5 -0.019 -0.873 -4.713 1.00 0.12 N ATOM 147 C4 DA A 5 0.030 -0.070 -3.632 1.00 0.10 C ATOM 0 H5' DA A 5 -0.811 6.330 -3.825 1.00 0.13 H new ATOM 0 H5'' DA A 5 -0.271 5.187 -2.611 1.00 0.13 H new ATOM 0 H4' DA A 5 0.070 4.990 -5.578 1.00 0.12 H new ATOM 0 H3' DA A 5 -1.851 3.641 -3.638 1.00 0.12 H new ATOM 0 H2' DA A 5 -1.722 1.631 -4.917 1.00 0.12 H new ATOM 0 H2'' DA A 5 -1.103 2.463 -6.330 1.00 0.12 H new ATOM 0 H1' DA A 5 0.970 1.677 -5.545 1.00 0.12 H new ATOM 0 H8 DA A 5 0.398 2.640 -2.027 1.00 0.12 H new ATOM 0 H61 DA A 5 -0.932 -3.244 -0.748 1.00 0.13 H new ATOM 0 H62 DA A 5 -0.710 -1.633 -0.059 1.00 0.13 H new ATOM 0 H2 DA A 5 -0.359 -2.842 -5.177 1.00 0.12 H new ATOM 159 P DC A 6 -2.303 4.456 -6.987 1.00 0.19 P ATOM 160 OP1 DC A 6 -1.016 5.089 -7.353 1.00 0.22 O ATOM 161 OP2 DC A 6 -3.570 5.012 -7.516 1.00 0.26 O ATOM 162 O5' DC A 6 -2.228 2.894 -7.407 1.00 0.17 O ATOM 163 C5' DC A 6 -3.427 2.125 -7.473 1.00 0.16 C ATOM 164 C4' DC A 6 -3.352 0.684 -6.958 1.00 0.15 C ATOM 165 O4' DC A 6 -2.795 0.562 -5.637 1.00 0.14 O ATOM 166 C3' DC A 6 -4.760 0.126 -6.928 1.00 0.16 C ATOM 167 O3' DC A 6 -4.829 -1.119 -7.653 1.00 0.18 O ATOM 168 C2' DC A 6 -5.083 -0.013 -5.464 1.00 0.14 C ATOM 169 C1' DC A 6 -3.756 -0.050 -4.754 1.00 0.14 C ATOM 170 N1 DC A 6 -3.790 0.701 -3.498 1.00 0.14 N ATOM 171 C2 DC A 6 -3.673 0.008 -2.305 1.00 0.18 C ATOM 172 O2 DC A 6 -3.609 -1.218 -2.303 1.00 0.22 O ATOM 173 N3 DC A 6 -3.626 0.726 -1.150 1.00 0.20 N ATOM 174 C4 DC A 6 -3.691 2.062 -1.170 1.00 0.17 C ATOM 175 N4 DC A 6 -3.633 2.733 -0.022 1.00 0.20 N ATOM 176 C5 DC A 6 -3.816 2.773 -2.407 1.00 0.13 C ATOM 177 C6 DC A 6 -3.864 2.051 -3.535 1.00 0.12 C ATOM 0 H5' DC A 6 -3.757 2.098 -8.512 1.00 0.16 H new ATOM 0 H5'' DC A 6 -4.198 2.648 -6.907 1.00 0.16 H new ATOM 0 H4' DC A 6 -2.691 0.139 -7.631 1.00 0.15 H new ATOM 0 H3' DC A 6 -5.490 0.768 -7.420 1.00 0.16 H new ATOM 0 H2' DC A 6 -5.690 0.823 -5.116 1.00 0.14 H new ATOM 0 H2'' DC A 6 -5.654 -0.922 -5.274 1.00 0.14 H new ATOM 0 H1' DC A 6 -3.501 -1.082 -4.512 1.00 0.14 H new ATOM 0 H41 DC A 6 -3.681 3.752 -0.024 1.00 0.20 H new ATOM 0 H42 DC A 6 -3.540 2.228 0.860 1.00 0.20 H new ATOM 0 H5 DC A 6 -3.870 3.851 -2.430 1.00 0.13 H new ATOM 0 H6 DC A 6 -3.963 2.554 -4.486 1.00 0.12 H new ATOM 189 P DG A 7 -4.720 -2.548 -6.921 1.00 0.17 P ATOM 190 OP1 DG A 7 -3.496 -2.561 -6.090 1.00 0.19 O ATOM 191 OP2 DG A 7 -4.938 -3.607 -7.933 1.00 0.22 O ATOM 192 O5' DG A 7 -5.998 -2.505 -5.950 1.00 0.16 O ATOM 193 C5' DG A 7 -6.086 -3.367 -4.820 1.00 0.14 C ATOM 194 C4' DG A 7 -7.457 -3.292 -4.172 1.00 0.13 C ATOM 195 O4' DG A 7 -7.508 -2.211 -3.218 1.00 0.14 O ATOM 196 C3' DG A 7 -8.523 -3.050 -5.233 1.00 0.14 C ATOM 197 O3' DG A 7 -9.452 -4.129 -5.352 1.00 0.21 O ATOM 198 C2' DG A 7 -9.211 -1.777 -4.845 1.00 0.15 C ATOM 199 C1' DG A 7 -8.569 -1.296 -3.549 1.00 0.13 C ATOM 200 N9 DG A 7 -8.051 0.069 -3.707 1.00 0.13 N ATOM 201 C8 DG A 7 -7.911 0.792 -4.832 1.00 0.14 C ATOM 202 N7 DG A 7 -7.456 1.995 -4.725 1.00 0.15 N ATOM 203 C5 DG A 7 -7.258 2.096 -3.344 1.00 0.13 C ATOM 204 C6 DG A 7 -6.767 3.181 -2.570 1.00 0.14 C ATOM 205 O6 DG A 7 -6.404 4.288 -2.952 1.00 0.18 O ATOM 206 N1 DG A 7 -6.724 2.866 -1.222 1.00 0.14 N ATOM 207 C2 DG A 7 -7.105 1.660 -0.677 1.00 0.13 C ATOM 208 N2 DG A 7 -6.985 1.548 0.640 1.00 0.17 N ATOM 209 N3 DG A 7 -7.569 0.634 -1.393 1.00 0.13 N ATOM 210 C4 DG A 7 -7.619 0.917 -2.713 1.00 0.12 C ATOM 0 H5' DG A 7 -5.322 -3.094 -4.092 1.00 0.14 H new ATOM 0 H5'' DG A 7 -5.882 -4.393 -5.126 1.00 0.14 H new ATOM 0 H4' DG A 7 -7.642 -4.238 -3.663 1.00 0.13 H new ATOM 0 H3' DG A 7 -8.061 -2.977 -6.217 1.00 0.14 H new ATOM 0 H2' DG A 7 -9.104 -1.027 -5.629 1.00 0.15 H new ATOM 0 H2'' DG A 7 -10.279 -1.943 -4.707 1.00 0.15 H new ATOM 0 H1' DG A 7 -9.306 -1.272 -2.746 1.00 0.13 H new ATOM 0 H8 DG A 7 -8.171 0.379 -5.795 1.00 0.14 H new ATOM 0 H1 DG A 7 -6.383 3.584 -0.582 1.00 0.14 H new ATOM 0 H21 DG A 7 -7.251 0.679 1.104 1.00 0.17 H new ATOM 0 H22 DG A 7 -6.627 2.330 1.188 1.00 0.17 H new ATOM 222 P DA A 8 -10.264 -4.676 -4.089 1.00 0.27 P ATOM 223 OP1 DA A 8 -11.372 -5.523 -4.586 1.00 0.39 O ATOM 224 OP2 DA A 8 -10.556 -3.544 -3.179 1.00 0.35 O ATOM 225 O5' DA A 8 -9.178 -5.627 -3.387 1.00 0.21 O ATOM 226 C5' DA A 8 -9.637 -6.717 -2.608 1.00 0.20 C ATOM 227 C4' DA A 8 -9.058 -6.726 -1.220 1.00 0.20 C ATOM 228 O4' DA A 8 -8.586 -5.443 -0.843 1.00 0.20 O ATOM 229 C3' DA A 8 -10.097 -7.170 -0.221 1.00 0.20 C ATOM 230 O3' DA A 8 -10.049 -8.586 0.044 1.00 0.23 O ATOM 231 C2' DA A 8 -9.806 -6.342 0.986 1.00 0.20 C ATOM 232 C1' DA A 8 -8.910 -5.217 0.525 1.00 0.20 C ATOM 233 N9 DA A 8 -9.551 -3.924 0.649 1.00 0.16 N ATOM 234 C8 DA A 8 -9.844 -3.066 -0.333 1.00 0.15 C ATOM 235 N7 DA A 8 -10.377 -1.936 0.000 1.00 0.14 N ATOM 236 C5 DA A 8 -10.448 -2.070 1.397 1.00 0.14 C ATOM 237 C6 DA A 8 -10.917 -1.232 2.414 1.00 0.16 C ATOM 238 N6 DA A 8 -11.409 -0.018 2.188 1.00 0.17 N ATOM 239 N1 DA A 8 -10.842 -1.689 3.678 1.00 0.18 N ATOM 240 C2 DA A 8 -10.335 -2.897 3.930 1.00 0.20 C ATOM 241 N3 DA A 8 -9.858 -3.765 3.047 1.00 0.20 N ATOM 242 C4 DA A 8 -9.947 -3.286 1.793 1.00 0.17 C ATOM 0 H5' DA A 8 -9.380 -7.650 -3.110 1.00 0.20 H new ATOM 0 H5'' DA A 8 -10.724 -6.679 -2.543 1.00 0.20 H new ATOM 0 H4' DA A 8 -8.220 -7.423 -1.226 1.00 0.20 H new ATOM 0 H3' DA A 8 -11.113 -7.022 -0.587 1.00 0.20 H new ATOM 0 H2' DA A 8 -10.726 -5.952 1.421 1.00 0.20 H new ATOM 0 H2'' DA A 8 -9.317 -6.937 1.757 1.00 0.20 H new ATOM 0 H1' DA A 8 -8.019 -5.205 1.153 1.00 0.20 H new ATOM 0 H8 DA A 8 -9.643 -3.308 -1.366 1.00 0.15 H new ATOM 0 H61 DA A 8 -11.738 0.552 2.967 1.00 0.17 H new ATOM 0 H62 DA A 8 -11.458 0.343 1.235 1.00 0.17 H new ATOM 0 H2 DA A 8 -10.310 -3.202 4.966 1.00 0.20 H new ATOM 254 P DC A 9 -9.695 -9.200 1.503 1.00 0.25 P ATOM 255 OP1 DC A 9 -8.383 -8.664 1.926 1.00 0.27 O ATOM 256 OP2 DC A 9 -9.892 -10.667 1.434 1.00 0.29 O ATOM 257 O5' DC A 9 -10.837 -8.609 2.499 1.00 0.25 O ATOM 258 C5' DC A 9 -12.045 -7.981 2.029 1.00 0.22 C ATOM 259 C4' DC A 9 -12.438 -6.740 2.848 1.00 0.21 C ATOM 260 O4' DC A 9 -11.862 -5.513 2.344 1.00 0.19 O ATOM 261 C3' DC A 9 -13.945 -6.543 2.831 1.00 0.22 C ATOM 262 O3' DC A 9 -14.583 -7.231 3.913 1.00 0.27 O ATOM 263 C2' DC A 9 -14.137 -5.058 2.933 1.00 0.21 C ATOM 264 C1' DC A 9 -12.842 -4.439 2.445 1.00 0.19 C ATOM 265 N1 DC A 9 -13.054 -3.786 1.137 1.00 0.17 N ATOM 266 C2 DC A 9 -13.483 -2.463 1.125 1.00 0.18 C ATOM 267 O2 DC A 9 -13.665 -1.856 2.181 1.00 0.20 O ATOM 268 N3 DC A 9 -13.698 -1.869 -0.080 1.00 0.18 N ATOM 269 C4 DC A 9 -13.504 -2.540 -1.222 1.00 0.18 C ATOM 270 N4 DC A 9 -13.728 -1.926 -2.383 1.00 0.21 N ATOM 271 C5 DC A 9 -13.062 -3.902 -1.208 1.00 0.17 C ATOM 272 C6 DC A 9 -12.852 -4.476 -0.017 1.00 0.17 C ATOM 0 H5' DC A 9 -12.860 -8.704 2.062 1.00 0.22 H new ATOM 0 H5'' DC A 9 -11.916 -7.694 0.985 1.00 0.22 H new ATOM 0 H4' DC A 9 -12.058 -6.932 3.851 1.00 0.21 H new ATOM 0 H3' DC A 9 -14.397 -6.953 1.928 1.00 0.22 H new ATOM 0 H2' DC A 9 -14.980 -4.730 2.325 1.00 0.21 H new ATOM 0 H2'' DC A 9 -14.350 -4.761 3.960 1.00 0.21 H new ATOM 0 HO3' DC A 9 -15.550 -7.081 3.871 1.00 0.27 H new ATOM 0 H1' DC A 9 -12.488 -3.673 3.135 1.00 0.19 H new ATOM 0 H41 DC A 9 -13.584 -2.426 -3.260 1.00 0.21 H new ATOM 0 H42 DC A 9 -14.043 -0.956 -2.394 1.00 0.21 H new ATOM 0 H5 DC A 9 -12.904 -4.447 -2.127 1.00 0.17 H new ATOM 0 H6 DC A 9 -12.517 -5.502 0.028 1.00 0.17 H new TER 284 DC A 9 ATOM 285 O5' DG B 101 13.064 6.715 -4.522 1.00 0.38 O ATOM 286 C5' DG B 101 14.008 5.900 -5.219 1.00 0.32 C ATOM 287 C4' DG B 101 13.987 4.453 -4.726 1.00 0.23 C ATOM 288 O4' DG B 101 14.385 4.349 -3.337 1.00 0.24 O ATOM 289 C3' DG B 101 12.588 3.853 -4.843 1.00 0.20 C ATOM 290 O3' DG B 101 12.610 2.647 -5.621 1.00 0.19 O ATOM 291 C2' DG B 101 12.145 3.587 -3.428 1.00 0.17 C ATOM 292 C1' DG B 101 13.414 3.554 -2.618 1.00 0.17 C ATOM 293 N9 DG B 101 13.234 4.056 -1.234 1.00 0.18 N ATOM 294 C8 DG B 101 12.885 5.291 -0.787 1.00 0.22 C ATOM 295 N7 DG B 101 12.883 5.491 0.487 1.00 0.23 N ATOM 296 C5 DG B 101 13.272 4.241 0.973 1.00 0.20 C ATOM 297 C6 DG B 101 13.457 3.803 2.312 1.00 0.23 C ATOM 298 O6 DG B 101 13.321 4.443 3.350 1.00 0.26 O ATOM 299 N1 DG B 101 13.847 2.474 2.362 1.00 0.24 N ATOM 300 C2 DG B 101 14.037 1.662 1.267 1.00 0.23 C ATOM 301 N2 DG B 101 14.399 0.411 1.518 1.00 0.29 N ATOM 302 N3 DG B 101 13.868 2.063 0.005 1.00 0.20 N ATOM 303 C4 DG B 101 13.486 3.356 -0.073 1.00 0.18 C ATOM 0 H5' DG B 101 15.009 6.313 -5.090 1.00 0.32 H new ATOM 0 H5'' DG B 101 13.789 5.923 -6.286 1.00 0.32 H new ATOM 0 H4' DG B 101 14.693 3.911 -5.355 1.00 0.23 H new ATOM 0 H3' DG B 101 11.900 4.526 -5.354 1.00 0.20 H new ATOM 0 H2' DG B 101 11.471 4.367 -3.073 1.00 0.17 H new ATOM 0 H2'' DG B 101 11.606 2.642 -3.355 1.00 0.17 H new ATOM 0 HO5' DG B 101 13.109 7.632 -4.864 1.00 0.38 H new ATOM 0 H1' DG B 101 13.746 2.522 -2.502 1.00 0.17 H new ATOM 0 H8 DG B 101 12.618 6.079 -1.476 1.00 0.22 H new ATOM 0 H1 DG B 101 14.006 2.065 3.283 1.00 0.24 H new ATOM 0 H21 DG B 101 14.555 -0.239 0.748 1.00 0.29 H new ATOM 0 H22 DG B 101 14.521 0.099 2.481 1.00 0.29 H new ATOM 316 P DA B 102 13.842 1.593 -5.573 1.00 0.17 P ATOM 317 OP1 DA B 102 14.214 1.351 -4.162 1.00 0.21 O ATOM 318 OP2 DA B 102 14.867 2.025 -6.549 1.00 0.21 O ATOM 319 O5' DA B 102 13.133 0.271 -6.133 1.00 0.20 O ATOM 320 C5' DA B 102 11.712 0.248 -6.197 1.00 0.18 C ATOM 321 C4' DA B 102 11.150 -1.165 -6.101 1.00 0.16 C ATOM 322 O4' DA B 102 11.716 -1.882 -4.981 1.00 0.16 O ATOM 323 C3' DA B 102 9.638 -1.134 -5.910 1.00 0.16 C ATOM 324 O3' DA B 102 8.961 -1.770 -6.992 1.00 0.19 O ATOM 325 C2' DA B 102 9.372 -1.905 -4.665 1.00 0.14 C ATOM 326 C1' DA B 102 10.654 -2.431 -4.168 1.00 0.15 C ATOM 327 N9 DA B 102 10.718 -1.985 -2.799 1.00 0.14 N ATOM 328 C8 DA B 102 10.666 -0.724 -2.359 1.00 0.14 C ATOM 329 N7 DA B 102 10.475 -0.534 -1.108 1.00 0.15 N ATOM 330 C5 DA B 102 10.375 -1.842 -0.644 1.00 0.14 C ATOM 331 C6 DA B 102 10.150 -2.388 0.618 1.00 0.16 C ATOM 332 N6 DA B 102 9.928 -1.654 1.702 1.00 0.19 N ATOM 333 N1 DA B 102 10.109 -3.721 0.706 1.00 0.17 N ATOM 334 C2 DA B 102 10.275 -4.464 -0.388 1.00 0.17 C ATOM 335 N3 DA B 102 10.491 -4.055 -1.618 1.00 0.16 N ATOM 336 C4 DA B 102 10.530 -2.728 -1.677 1.00 0.14 C ATOM 0 H5' DA B 102 11.386 0.703 -7.132 1.00 0.18 H new ATOM 0 H5'' DA B 102 11.305 0.854 -5.388 1.00 0.18 H new ATOM 0 H4' DA B 102 11.408 -1.668 -7.033 1.00 0.16 H new ATOM 0 H3' DA B 102 9.284 -0.104 -5.860 1.00 0.16 H new ATOM 0 H2' DA B 102 8.906 -1.266 -3.914 1.00 0.14 H new ATOM 0 H2'' DA B 102 8.678 -2.721 -4.864 1.00 0.14 H new ATOM 0 H1' DA B 102 10.749 -3.516 -4.220 1.00 0.15 H new ATOM 0 H8 DA B 102 10.782 0.108 -3.038 1.00 0.14 H new ATOM 0 H61 DA B 102 9.769 -2.108 2.602 1.00 0.19 H new ATOM 0 H62 DA B 102 9.916 -0.636 1.635 1.00 0.19 H new ATOM 0 H2 DA B 102 10.226 -5.534 -0.246 1.00 0.17 H new ATOM 348 P DC B 103 9.257 -3.318 -7.362 1.00 0.21 P ATOM 349 OP1 DC B 103 10.672 -3.424 -7.778 1.00 0.25 O ATOM 350 OP2 DC B 103 8.191 -3.762 -8.291 1.00 0.27 O ATOM 351 O5' DC B 103 9.066 -4.123 -5.953 1.00 0.17 O ATOM 352 C5' DC B 103 7.925 -4.978 -5.790 1.00 0.16 C ATOM 353 C4' DC B 103 7.453 -5.219 -4.357 1.00 0.15 C ATOM 354 O4' DC B 103 7.834 -4.155 -3.463 1.00 0.13 O ATOM 355 C3' DC B 103 5.934 -5.357 -4.322 1.00 0.15 C ATOM 356 O3' DC B 103 5.530 -6.538 -3.602 1.00 0.17 O ATOM 357 C2' DC B 103 5.475 -4.105 -3.642 1.00 0.14 C ATOM 358 C1' DC B 103 6.657 -3.628 -2.832 1.00 0.13 C ATOM 359 N1 DC B 103 6.702 -2.184 -2.810 1.00 0.12 N ATOM 360 C2 DC B 103 6.972 -1.543 -1.609 1.00 0.13 C ATOM 361 O2 DC B 103 7.149 -2.195 -0.580 1.00 0.15 O ATOM 362 N3 DC B 103 7.027 -0.188 -1.611 1.00 0.15 N ATOM 363 C4 DC B 103 6.824 0.496 -2.739 1.00 0.15 C ATOM 364 N4 DC B 103 6.893 1.826 -2.709 1.00 0.18 N ATOM 365 C5 DC B 103 6.543 -0.183 -3.973 1.00 0.15 C ATOM 366 C6 DC B 103 6.494 -1.518 -3.955 1.00 0.13 C ATOM 0 H5' DC B 103 8.155 -5.944 -6.240 1.00 0.16 H new ATOM 0 H5'' DC B 103 7.096 -4.552 -6.355 1.00 0.16 H new ATOM 0 H4' DC B 103 7.934 -6.137 -4.021 1.00 0.15 H new ATOM 0 H3' DC B 103 5.498 -5.471 -5.315 1.00 0.15 H new ATOM 0 H2' DC B 103 5.169 -3.353 -4.369 1.00 0.14 H new ATOM 0 H2'' DC B 103 4.614 -4.299 -3.003 1.00 0.14 H new ATOM 0 H1' DC B 103 6.584 -3.968 -1.799 1.00 0.13 H new ATOM 0 H41 DC B 103 6.740 2.364 -3.562 1.00 0.18 H new ATOM 0 H42 DC B 103 7.098 2.306 -1.833 1.00 0.18 H new ATOM 0 H5 DC B 103 6.377 0.368 -4.887 1.00 0.15 H new ATOM 0 H6 DC B 103 6.286 -2.062 -4.865 1.00 0.13 H new ATOM 378 P DG B 104 5.792 -6.705 -2.017 1.00 0.17 P ATOM 379 OP1 DG B 104 7.232 -6.491 -1.752 1.00 0.20 O ATOM 380 OP2 DG B 104 5.140 -7.957 -1.573 1.00 0.23 O ATOM 381 O5' DG B 104 4.972 -5.465 -1.398 1.00 0.16 O ATOM 382 C5' DG B 104 4.863 -5.282 0.016 1.00 0.15 C ATOM 383 C4' DG B 104 3.489 -4.764 0.404 1.00 0.12 C ATOM 384 O4' DG B 104 3.285 -3.453 -0.144 1.00 0.12 O ATOM 385 C3' DG B 104 2.408 -5.679 -0.138 1.00 0.12 C ATOM 386 O3' DG B 104 1.502 -6.070 0.883 1.00 0.15 O ATOM 387 C2' DG B 104 1.735 -4.901 -1.225 1.00 0.13 C ATOM 388 C1' DG B 104 2.163 -3.457 -1.037 1.00 0.11 C ATOM 389 N9 DG B 104 2.520 -2.834 -2.320 1.00 0.10 N ATOM 390 C8 DG B 104 2.495 -3.359 -3.560 1.00 0.12 C ATOM 391 N7 DG B 104 2.836 -2.596 -4.545 1.00 0.13 N ATOM 392 C5 DG B 104 3.136 -1.402 -3.881 1.00 0.12 C ATOM 393 C6 DG B 104 3.580 -0.154 -4.397 1.00 0.14 C ATOM 394 O6 DG B 104 3.810 0.156 -5.562 1.00 0.18 O ATOM 395 N1 DG B 104 3.764 0.774 -3.385 1.00 0.15 N ATOM 396 C2 DG B 104 3.552 0.538 -2.046 1.00 0.14 C ATOM 397 N2 DG B 104 3.807 1.542 -1.227 1.00 0.18 N ATOM 398 N3 DG B 104 3.133 -0.624 -1.553 1.00 0.12 N ATOM 399 C4 DG B 104 2.945 -1.545 -2.517 1.00 0.10 C ATOM 0 H5' DG B 104 5.626 -4.581 0.353 1.00 0.15 H new ATOM 0 H5'' DG B 104 5.053 -6.228 0.522 1.00 0.15 H new ATOM 0 H4' DG B 104 3.435 -4.730 1.492 1.00 0.12 H new ATOM 0 H3' DG B 104 2.820 -6.612 -0.523 1.00 0.12 H new ATOM 0 H2' DG B 104 2.029 -5.270 -2.208 1.00 0.13 H new ATOM 0 H2'' DG B 104 0.651 -4.998 -1.160 1.00 0.13 H new ATOM 0 H1' DG B 104 1.339 -2.875 -0.623 1.00 0.11 H new ATOM 0 H8 DG B 104 2.199 -4.385 -3.725 1.00 0.12 H new ATOM 0 H1 DG B 104 4.082 1.705 -3.654 1.00 0.15 H new ATOM 0 H21 DG B 104 3.669 1.429 -0.223 1.00 0.18 H new ATOM 0 H22 DG B 104 4.142 2.431 -1.599 1.00 0.18 H new ATOM 411 P DA B 105 1.994 -7.057 2.058 1.00 0.17 P ATOM 412 OP1 DA B 105 3.469 -7.169 2.006 1.00 0.21 O ATOM 413 OP2 DA B 105 1.156 -8.275 2.023 1.00 0.23 O ATOM 414 O5' DA B 105 1.598 -6.211 3.353 1.00 0.15 O ATOM 415 C5' DA B 105 0.300 -5.640 3.410 1.00 0.13 C ATOM 416 C4' DA B 105 0.217 -4.518 4.449 1.00 0.13 C ATOM 417 O4' DA B 105 1.180 -3.455 4.232 1.00 0.13 O ATOM 418 C3' DA B 105 -1.137 -3.848 4.474 1.00 0.13 C ATOM 419 O3' DA B 105 -2.083 -4.578 5.256 1.00 0.16 O ATOM 420 C2' DA B 105 -0.824 -2.521 5.075 1.00 0.12 C ATOM 421 C1' DA B 105 0.551 -2.190 4.592 1.00 0.11 C ATOM 422 N9 DA B 105 0.417 -1.316 3.440 1.00 0.11 N ATOM 423 C8 DA B 105 0.353 -1.660 2.152 1.00 0.12 C ATOM 424 N7 DA B 105 0.027 -0.745 1.300 1.00 0.12 N ATOM 425 C5 DA B 105 -0.148 0.363 2.141 1.00 0.10 C ATOM 426 C6 DA B 105 -0.512 1.693 1.905 1.00 0.10 C ATOM 427 N6 DA B 105 -0.815 2.162 0.699 1.00 0.13 N ATOM 428 N1 DA B 105 -0.585 2.513 2.967 1.00 0.11 N ATOM 429 C2 DA B 105 -0.319 2.056 4.193 1.00 0.11 C ATOM 430 N3 DA B 105 0.030 0.819 4.529 1.00 0.11 N ATOM 431 C4 DA B 105 0.097 0.020 3.447 1.00 0.10 C ATOM 0 H5' DA B 105 -0.427 -6.415 3.653 1.00 0.13 H new ATOM 0 H5'' DA B 105 0.032 -5.247 2.429 1.00 0.13 H new ATOM 0 H4' DA B 105 0.423 -5.031 5.388 1.00 0.13 H new ATOM 0 H3' DA B 105 -1.604 -3.781 3.491 1.00 0.13 H new ATOM 0 H2' DA B 105 -1.545 -1.766 4.761 1.00 0.12 H new ATOM 0 H2'' DA B 105 -0.860 -2.563 6.164 1.00 0.12 H new ATOM 0 H1' DA B 105 1.158 -1.681 5.341 1.00 0.11 H new ATOM 0 H8 DA B 105 0.567 -2.669 1.833 1.00 0.12 H new ATOM 0 H61 DA B 105 -1.074 3.142 0.583 1.00 0.13 H new ATOM 0 H62 DA B 105 -0.788 1.542 -0.111 1.00 0.13 H new ATOM 0 H2 DA B 105 -0.396 2.770 5.000 1.00 0.11 H new ATOM 443 P DC B 106 -1.947 -4.613 6.855 1.00 0.19 P ATOM 444 OP1 DC B 106 -0.622 -5.179 7.196 1.00 0.22 O ATOM 445 OP2 DC B 106 -3.177 -5.223 7.408 1.00 0.26 O ATOM 446 O5' DC B 106 -1.940 -3.037 7.222 1.00 0.17 O ATOM 447 C5' DC B 106 -3.178 -2.344 7.335 1.00 0.16 C ATOM 448 C4' DC B 106 -3.180 -0.893 6.846 1.00 0.14 C ATOM 449 O4' DC B 106 -2.653 -0.740 5.512 1.00 0.14 O ATOM 450 C3' DC B 106 -4.613 -0.406 6.839 1.00 0.16 C ATOM 451 O3' DC B 106 -4.730 0.834 7.564 1.00 0.18 O ATOM 452 C2' DC B 106 -4.971 -0.286 5.380 1.00 0.14 C ATOM 453 C1' DC B 106 -3.661 -0.183 4.644 1.00 0.13 C ATOM 454 N1 DC B 106 -3.682 -0.937 3.388 1.00 0.14 N ATOM 455 C2 DC B 106 -3.623 -0.240 2.192 1.00 0.18 C ATOM 456 O2 DC B 106 -3.619 0.988 2.190 1.00 0.22 O ATOM 457 N3 DC B 106 -3.564 -0.955 1.036 1.00 0.20 N ATOM 458 C4 DC B 106 -3.563 -2.293 1.057 1.00 0.17 C ATOM 459 N4 DC B 106 -3.495 -2.960 -0.093 1.00 0.20 N ATOM 460 C5 DC B 106 -3.629 -3.009 2.295 1.00 0.14 C ATOM 461 C6 DC B 106 -3.690 -2.289 3.425 1.00 0.12 C ATOM 0 H5' DC B 106 -3.484 -2.355 8.381 1.00 0.16 H new ATOM 0 H5'' DC B 106 -3.934 -2.896 6.776 1.00 0.16 H new ATOM 0 H4' DC B 106 -2.541 -0.320 7.518 1.00 0.14 H new ATOM 0 H3' DC B 106 -5.301 -1.084 7.344 1.00 0.16 H new ATOM 0 H2' DC B 106 -5.541 -1.152 5.045 1.00 0.14 H new ATOM 0 H2'' DC B 106 -5.591 0.592 5.200 1.00 0.14 H new ATOM 0 H1' DC B 106 -3.462 0.859 4.393 1.00 0.13 H new ATOM 0 H41 DC B 106 -3.493 -3.980 -0.092 1.00 0.20 H new ATOM 0 H42 DC B 106 -3.445 -2.451 -0.975 1.00 0.20 H new ATOM 0 H5 DC B 106 -3.630 -4.089 2.318 1.00 0.14 H new ATOM 0 H6 DC B 106 -3.746 -2.796 4.377 1.00 0.12 H new ATOM 473 P DG B 107 -4.704 2.265 6.829 1.00 0.16 P ATOM 474 OP1 DG B 107 -3.497 2.336 5.974 1.00 0.19 O ATOM 475 OP2 DG B 107 -4.954 3.313 7.844 1.00 0.23 O ATOM 476 O5' DG B 107 -5.996 2.160 5.883 1.00 0.15 O ATOM 477 C5' DG B 107 -6.148 3.015 4.755 1.00 0.14 C ATOM 478 C4' DG B 107 -7.526 2.873 4.133 1.00 0.13 C ATOM 479 O4' DG B 107 -7.543 1.791 3.180 1.00 0.15 O ATOM 480 C3' DG B 107 -8.559 2.580 5.215 1.00 0.14 C ATOM 481 O3' DG B 107 -9.536 3.612 5.353 1.00 0.21 O ATOM 482 C2' DG B 107 -9.191 1.274 4.840 1.00 0.15 C ATOM 483 C1' DG B 107 -8.552 0.826 3.532 1.00 0.13 C ATOM 484 N9 DG B 107 -7.964 -0.513 3.678 1.00 0.13 N ATOM 485 C8 DG B 107 -7.768 -1.228 4.800 1.00 0.14 C ATOM 486 N7 DG B 107 -7.257 -2.407 4.684 1.00 0.15 N ATOM 487 C5 DG B 107 -7.081 -2.500 3.300 1.00 0.13 C ATOM 488 C6 DG B 107 -6.553 -3.559 2.516 1.00 0.14 C ATOM 489 O6 DG B 107 -6.129 -4.648 2.890 1.00 0.18 O ATOM 490 N1 DG B 107 -6.553 -3.243 1.167 1.00 0.14 N ATOM 491 C2 DG B 107 -7.001 -2.058 0.630 1.00 0.14 C ATOM 492 N2 DG B 107 -6.913 -1.941 -0.689 1.00 0.17 N ATOM 493 N3 DG B 107 -7.501 -1.055 1.356 1.00 0.13 N ATOM 494 C4 DG B 107 -7.512 -1.339 2.676 1.00 0.12 C ATOM 0 H5' DG B 107 -5.386 2.779 4.012 1.00 0.14 H new ATOM 0 H5'' DG B 107 -5.989 4.050 5.057 1.00 0.14 H new ATOM 0 H4' DG B 107 -7.766 3.809 3.628 1.00 0.13 H new ATOM 0 H3' DG B 107 -8.075 2.531 6.190 1.00 0.14 H new ATOM 0 H2' DG B 107 -9.031 0.531 5.621 1.00 0.15 H new ATOM 0 H2'' DG B 107 -10.269 1.387 4.723 1.00 0.15 H new ATOM 0 H1' DG B 107 -9.304 0.767 2.745 1.00 0.13 H new ATOM 0 H8 DG B 107 -8.030 -0.828 5.768 1.00 0.14 H new ATOM 0 H1 DG B 107 -6.192 -3.945 0.521 1.00 0.14 H new ATOM 0 H21 DG B 107 -7.229 -1.086 -1.147 1.00 0.17 H new ATOM 0 H22 DG B 107 -6.530 -2.706 -1.244 1.00 0.17 H new ATOM 506 P DA B 108 -10.399 4.119 4.106 1.00 0.27 P ATOM 507 OP1 DA B 108 -11.537 4.911 4.624 1.00 0.39 O ATOM 508 OP2 DA B 108 -10.652 2.973 3.201 1.00 0.35 O ATOM 509 O5' DA B 108 -9.374 5.122 3.383 1.00 0.21 O ATOM 510 C5' DA B 108 -9.900 6.188 2.614 1.00 0.20 C ATOM 511 C4' DA B 108 -9.349 6.225 1.215 1.00 0.20 C ATOM 512 O4' DA B 108 -8.823 4.965 0.828 1.00 0.20 O ATOM 513 C3' DA B 108 -10.427 6.617 0.237 1.00 0.19 C ATOM 514 O3' DA B 108 -10.454 8.037 -0.028 1.00 0.22 O ATOM 515 C2' DA B 108 -10.120 5.804 -0.976 1.00 0.20 C ATOM 516 C1' DA B 108 -9.162 4.723 -0.533 1.00 0.20 C ATOM 517 N9 DA B 108 -9.742 3.400 -0.645 1.00 0.17 N ATOM 518 C8 DA B 108 -9.974 2.530 0.342 1.00 0.15 C ATOM 519 N7 DA B 108 -10.457 1.375 0.018 1.00 0.14 N ATOM 520 C5 DA B 108 -10.562 1.504 -1.377 1.00 0.15 C ATOM 521 C6 DA B 108 -11.009 0.644 -2.385 1.00 0.16 C ATOM 522 N6 DA B 108 -11.437 -0.592 -2.150 1.00 0.17 N ATOM 523 N1 DA B 108 -10.982 1.103 -3.650 1.00 0.19 N ATOM 524 C2 DA B 108 -10.538 2.335 -3.911 1.00 0.21 C ATOM 525 N3 DA B 108 -10.088 3.226 -3.038 1.00 0.20 N ATOM 526 C4 DA B 108 -10.128 2.743 -1.782 1.00 0.17 C ATOM 0 H5' DA B 108 -9.679 7.132 3.112 1.00 0.20 H new ATOM 0 H5'' DA B 108 -10.985 6.097 2.570 1.00 0.20 H new ATOM 0 H4' DA B 108 -8.546 6.962 1.205 1.00 0.20 H new ATOM 0 H3' DA B 108 -11.427 6.420 0.622 1.00 0.19 H new ATOM 0 H2' DA B 108 -11.029 5.370 -1.393 1.00 0.20 H new ATOM 0 H2'' DA B 108 -9.675 6.422 -1.756 1.00 0.20 H new ATOM 0 H1' DA B 108 -8.284 4.753 -1.179 1.00 0.20 H new ATOM 0 H8 DA B 108 -9.766 2.782 1.371 1.00 0.15 H new ATOM 0 H61 DA B 108 -11.753 -1.178 -2.923 1.00 0.17 H new ATOM 0 H62 DA B 108 -11.450 -0.955 -1.197 1.00 0.17 H new ATOM 0 H2 DA B 108 -10.546 2.639 -4.947 1.00 0.21 H new ATOM 538 P DC B 109 -10.163 8.669 -1.494 1.00 0.24 P ATOM 539 OP1 DC B 109 -8.828 8.206 -1.934 1.00 0.27 O ATOM 540 OP2 DC B 109 -10.446 10.120 -1.430 1.00 0.30 O ATOM 541 O5' DC B 109 -11.265 7.973 -2.466 1.00 0.25 O ATOM 542 C5' DC B 109 -12.448 7.322 -1.968 1.00 0.22 C ATOM 543 C4' DC B 109 -12.812 6.074 -2.790 1.00 0.21 C ATOM 544 O4' DC B 109 -12.164 4.875 -2.301 1.00 0.19 O ATOM 545 C3' DC B 109 -14.304 5.803 -2.740 1.00 0.22 C ATOM 546 O3' DC B 109 -14.996 6.457 -3.808 1.00 0.26 O ATOM 547 C2' DC B 109 -14.423 4.309 -2.839 1.00 0.21 C ATOM 548 C1' DC B 109 -13.090 3.754 -2.378 1.00 0.19 C ATOM 549 N1 DC B 109 -13.243 3.092 -1.065 1.00 0.17 N ATOM 550 C2 DC B 109 -13.607 1.749 -1.046 1.00 0.18 C ATOM 551 O2 DC B 109 -13.780 1.133 -2.098 1.00 0.21 O ATOM 552 N3 DC B 109 -13.769 1.146 0.163 1.00 0.19 N ATOM 553 C4 DC B 109 -13.585 1.826 1.301 1.00 0.17 C ATOM 554 N4 DC B 109 -13.757 1.202 2.466 1.00 0.21 N ATOM 555 C5 DC B 109 -13.211 3.208 1.280 1.00 0.17 C ATOM 556 C6 DC B 109 -13.052 3.791 0.085 1.00 0.16 C ATOM 0 H5' DC B 109 -13.282 8.023 -1.986 1.00 0.22 H new ATOM 0 H5'' DC B 109 -12.294 7.038 -0.927 1.00 0.22 H new ATOM 0 H4' DC B 109 -12.477 6.293 -3.804 1.00 0.21 H new ATOM 0 H3' DC B 109 -14.758 6.190 -1.828 1.00 0.22 H new ATOM 0 H2' DC B 109 -15.237 3.940 -2.215 1.00 0.21 H new ATOM 0 H2'' DC B 109 -14.641 4.002 -3.862 1.00 0.21 H new ATOM 0 HO3' DC B 109 -15.954 6.260 -3.746 1.00 0.26 H new ATOM 0 H1' DC B 109 -12.712 3.004 -3.072 1.00 0.19 H new ATOM 0 H41 DC B 109 -13.620 1.708 3.341 1.00 0.21 H new ATOM 0 H42 DC B 109 -14.026 0.218 2.483 1.00 0.21 H new ATOM 0 H5 DC B 109 -13.062 3.761 2.196 1.00 0.17 H new ATOM 0 H6 DC B 109 -12.768 4.832 0.034 1.00 0.16 H new TER 569 DC B 109 END