HEADER DNA 30-JUL-04 1U6O TITLE MISPAIRING OF A SITE-SPECIFIC MAJOR GROOVE (2S,3S)-N6-(2,3, TITLE 2 4-TRIHYDROXYBUTYL)-2-DEOXYADENOSYL DNA ADDUCT OF BUTADIENE TITLE 3 DIOL EPOXIDE WITH DEOXYGUANOSINE: FORMATION OF A DA(ANTI) TITLE 4 DG(ANTI) PAIRING INTERACTION COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*CP*GP*GP*AP*CP*(2BU)P*AP*GP*AP*AP*G)-3'; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: 5'-D(*CP*TP*TP*CP*TP*GP*GP*TP*CP*CP*G)-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 BUTADIENE, MISMATCH, RAS61, DEOXYADENOSYL, DIOL EPOXIDE, DNA EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR T.A.SCHOLDBERG,L.N.NECHEV,W.K.MERRITT,T.M.HARRIS,C.M.HARRIS, AUTHOR 2 R.S.LLOYD,M.P.STONE REVDAT 3 24-FEB-09 1U6O 1 VERSN REVDAT 2 26-APR-05 1U6O 1 JRNL REVDAT 1 10-AUG-04 1U6O 0 JRNL AUTH T.A.SCHOLDBERG,L.V.NECHEV,W.K.MERRITT,T.M.HARRIS, JRNL AUTH 2 C.M.HARRIS,R.S.LLOYD,M.P.STONE JRNL TITL MISPAIRING OF A SITE SPECIFIC MAJOR GROOVE JRNL TITL 2 (2S,3S)-N6-(2,3,4-TRIHYDROXYBUTYL)-2'- JRNL TITL 3 DEOXYADENOSYL DNA ADDUCT OF BUTADIENE DIOL EPOXIDE JRNL TITL 4 WITH DEOXYGUANOSINE: FORMATION OF A JRNL TITL 5 DA(ANTI)DG(ANTI) PAIRING INTERACTION. JRNL REF CHEM.RES.TOXICOL. V. 18 145 2005 JRNL REFN ISSN 0893-228X JRNL PMID 15720118 JRNL DOI 10.1021/TX049772P REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : NULL REMARK 3 AUTHORS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1U6O COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 02-AUG-04. REMARK 100 THE RCSB ID CODE IS RCSB023312. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : NULL REMARK 210 PH : NULL REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ REMARK 210 SPECTROMETER MODEL : DMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : DISTANCE GEOMETRY SIMULATED REMARK 210 ANNEALING, MOLECULAR DYNAMICS, REMARK 210 MATRIX RELAXATION, TORSION REMARK 210 ANGLE DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 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 1 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DG A 2 O4' - C1' - N9 ANGL. DEV. = 2.5 DEGREES REMARK 500 DG A 2 N7 - C8 - N9 ANGL. DEV. = 4.9 DEGREES REMARK 500 DG A 2 C8 - N9 - C4 ANGL. DEV. = -2.6 DEGREES REMARK 500 DG A 3 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DG A 3 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DG A 3 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 DA A 4 N7 - C8 - N9 ANGL. DEV. = 4.1 DEGREES REMARK 500 DC A 5 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DA A 7 O4' - C1' - N9 ANGL. DEV. = 2.4 DEGREES REMARK 500 DA A 7 N7 - C8 - N9 ANGL. DEV. = 3.9 DEGREES REMARK 500 DG A 8 O4' - C1' - N9 ANGL. DEV. = 2.6 DEGREES REMARK 500 DG A 8 N7 - C8 - N9 ANGL. DEV. = 4.7 DEGREES REMARK 500 DG A 8 C8 - N9 - C4 ANGL. DEV. = -2.4 DEGREES REMARK 500 DA A 9 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DA A 10 O4' - C1' - N9 ANGL. DEV. = 1.9 DEGREES REMARK 500 DA A 10 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DG A 11 O4' - C1' - N9 ANGL. DEV. = 2.2 DEGREES REMARK 500 DG A 11 N7 - C8 - N9 ANGL. DEV. = 4.8 DEGREES REMARK 500 DG A 11 C8 - N9 - C4 ANGL. DEV. = -2.6 DEGREES REMARK 500 DC B 12 O4' - C1' - N1 ANGL. DEV. = 2.5 DEGREES REMARK 500 DT B 13 O4' - C1' - N1 ANGL. DEV. = 2.5 DEGREES REMARK 500 DT B 14 O4' - C1' - N1 ANGL. DEV. = 3.3 DEGREES REMARK 500 DC B 15 O4' - C1' - N1 ANGL. DEV. = 2.5 DEGREES REMARK 500 DT B 16 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DG B 17 O4' - C1' - N9 ANGL. DEV. = 2.2 DEGREES REMARK 500 DG B 17 N7 - C8 - N9 ANGL. DEV. = 4.7 DEGREES REMARK 500 DG B 17 C8 - N9 - C4 ANGL. DEV. = -2.6 DEGREES REMARK 500 DG B 18 O4' - C1' - N9 ANGL. DEV. = 3.2 DEGREES REMARK 500 DG B 18 N7 - C8 - N9 ANGL. DEV. = 4.5 DEGREES REMARK 500 DG B 18 C8 - N9 - C4 ANGL. DEV. = -2.6 DEGREES REMARK 500 DT B 19 O4' - C1' - N1 ANGL. DEV. = 1.9 DEGREES REMARK 500 DC B 20 O4' - C1' - N1 ANGL. DEV. = 3.2 DEGREES REMARK 500 DC B 21 O4' - C1' - N1 ANGL. DEV. = 2.7 DEGREES REMARK 500 DG B 22 O4' - C1' - N9 ANGL. DEV. = 2.0 DEGREES REMARK 500 DG B 22 N7 - C8 - N9 ANGL. DEV. = 4.8 DEGREES REMARK 500 DG B 22 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1U6N RELATED DB: PDB REMARK 999 REMARK 999 SEQUENCE REMARK 999 RESIDUE (A G 8 ) AND RESIDUE (A A 9 ) ARE NOT LINKED. REMARK 999 DISTANCE OF O3*-P BOND IS 3.46 DBREF 1U6O A 1 11 PDB 1U6O 1U6O 1 11 DBREF 1U6O B 12 22 PDB 1U6O 1U6O 12 22 SEQRES 1 A 11 DC DG DG DA DC 2BU DA DG DA DA DG SEQRES 1 B 11 DC DT DT DC DT DG DG DT DC DC DG MODRES 1U6O 2BU A 6 DA HET 2BU A 6 47 HETNAM 2BU (2S,3S)-N6-(2,3,4-TRIHYDROXYBUTYL)-2'-DEOXYADENOSINE HETNAM 2 2BU MONO PHOSPHORIC ACID FORMUL 1 2BU C14 H22 N5 O9 P LINK O3' DC A 5 P 2BU A 6 1555 1555 1.61 LINK O3' 2BU A 6 P DA A 7 1555 1555 1.63 LINK N1 DG B 17 N1 2BU A 6 1555 1555 1.90 LINK O6 DG B 17 N1 2BU A 6 1555 1555 2.00 LINK N1 DG B 17 C2 2BU A 6 1555 1555 1.77 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 ATOM 1 O5' DC A 1 -0.330 -7.585 -0.880 1.00 0.13 O ATOM 2 C5' DC A 1 0.957 -8.070 -1.261 1.00 0.08 C ATOM 3 C4' DC A 1 2.026 -7.526 -0.311 1.00 0.08 C ATOM 4 O4' DC A 1 2.142 -6.096 -0.416 1.00 0.10 O ATOM 5 C3' DC A 1 1.689 -7.868 1.130 1.00 0.07 C ATOM 6 O3' DC A 1 2.747 -8.651 1.720 1.00 0.10 O ATOM 7 C2' DC A 1 1.499 -6.547 1.843 1.00 0.08 C ATOM 8 C1' DC A 1 1.700 -5.474 0.805 1.00 0.09 C ATOM 9 N1 DC A 1 0.456 -4.720 0.575 1.00 0.14 N ATOM 10 C2 DC A 1 0.473 -3.351 0.801 1.00 0.18 C ATOM 11 O2 DC A 1 1.508 -2.793 1.157 1.00 0.26 O ATOM 12 N3 DC A 1 -0.678 -2.653 0.598 1.00 0.24 N ATOM 13 C4 DC A 1 -1.796 -3.270 0.190 1.00 0.20 C ATOM 14 N4 DC A 1 -2.906 -2.554 -0.002 1.00 0.24 N ATOM 15 C5 DC A 1 -1.813 -4.682 -0.045 1.00 0.17 C ATOM 16 C6 DC A 1 -0.668 -5.363 0.159 1.00 0.15 C ATOM 17 H5' DC A 1 1.173 -7.735 -2.271 1.00 0.11 H ATOM 18 H5'' DC A 1 0.960 -9.160 -1.230 1.00 0.10 H ATOM 19 H4' DC A 1 2.985 -7.977 -0.566 1.00 0.11 H ATOM 20 H3' DC A 1 0.748 -8.425 1.157 1.00 0.09 H ATOM 21 H2' DC A 1 0.499 -6.484 2.272 1.00 0.13 H ATOM 22 H2'' DC A 1 2.249 -6.423 2.612 1.00 0.12 H ATOM 23 H1' DC A 1 2.468 -4.800 1.177 1.00 0.12 H ATOM 24 H41 DC A 1 -2.899 -1.556 0.164 1.00 0.28 H ATOM 25 H42 DC A 1 -3.752 -3.008 -0.313 1.00 0.20 H ATOM 26 H5 DC A 1 -2.719 -5.188 -0.379 1.00 0.21 H ATOM 27 H6 DC A 1 -0.631 -6.446 -0.023 1.00 0.16 H ATOM 28 HO5' DC A 1 -0.972 -7.979 -1.477 1.00 0.15 H ATOM 29 P DG A 2 3.077 -8.604 3.304 1.00 0.07 P ATOM 30 OP1 DG A 2 4.199 -9.532 3.571 1.00 0.11 O ATOM 31 OP2 DG A 2 1.805 -8.751 4.048 1.00 0.10 O ATOM 32 O5' DG A 2 3.611 -7.093 3.511 1.00 0.08 O ATOM 33 C5' DG A 2 4.775 -6.627 2.816 1.00 0.05 C ATOM 34 C4' DG A 2 5.167 -5.206 3.230 1.00 0.04 C ATOM 35 O4' DG A 2 4.182 -4.243 2.787 1.00 0.05 O ATOM 36 C3' DG A 2 5.290 -5.095 4.742 1.00 0.03 C ATOM 37 O3' DG A 2 6.636 -4.774 5.124 1.00 0.04 O ATOM 38 C2' DG A 2 4.330 -4.009 5.173 1.00 0.04 C ATOM 39 C1' DG A 2 3.687 -3.471 3.905 1.00 0.04 C ATOM 40 N9 DG A 2 2.223 -3.579 4.008 1.00 0.04 N ATOM 41 C8 DG A 2 1.475 -4.681 4.194 1.00 0.04 C ATOM 42 N7 DG A 2 0.195 -4.540 4.262 1.00 0.04 N ATOM 43 C5 DG A 2 0.056 -3.159 4.105 1.00 0.05 C ATOM 44 C6 DG A 2 -1.119 -2.363 4.083 1.00 0.06 C ATOM 45 O6 DG A 2 -2.287 -2.724 4.203 1.00 0.06 O ATOM 46 N1 DG A 2 -0.822 -1.020 3.897 1.00 0.08 N ATOM 47 C2 DG A 2 0.449 -0.499 3.751 1.00 0.09 C ATOM 48 N2 DG A 2 0.528 0.822 3.588 1.00 0.11 N ATOM 49 N3 DG A 2 1.562 -1.241 3.770 1.00 0.07 N ATOM 50 C4 DG A 2 1.296 -2.557 3.948 1.00 0.05 C ATOM 51 H5' DG A 2 4.577 -6.641 1.746 1.00 0.07 H ATOM 52 H5'' DG A 2 5.607 -7.300 3.032 1.00 0.07 H ATOM 53 H4' DG A 2 6.130 -4.964 2.777 1.00 0.05 H ATOM 54 H3' DG A 2 4.992 -6.040 5.201 1.00 0.04 H ATOM 55 H2' DG A 2 3.563 -4.429 5.827 1.00 0.05 H ATOM 56 H2'' DG A 2 4.867 -3.216 5.682 1.00 0.05 H ATOM 57 H1' DG A 2 3.958 -2.421 3.777 1.00 0.05 H ATOM 58 H8 DG A 2 1.947 -5.656 4.289 1.00 0.05 H ATOM 59 H1 DG A 2 -1.612 -0.392 3.863 1.00 0.10 H ATOM 60 H21 DG A 2 -0.314 1.381 3.570 1.00 0.13 H ATOM 61 H22 DG A 2 1.429 1.265 3.481 1.00 0.12 H ATOM 62 P DG A 3 7.046 -4.590 6.677 1.00 0.03 P ATOM 63 OP1 DG A 3 8.451 -5.025 6.839 1.00 0.04 O ATOM 64 OP2 DG A 3 5.988 -5.197 7.517 1.00 0.04 O ATOM 65 O5' DG A 3 6.986 -2.990 6.872 1.00 0.04 O ATOM 66 C5' DG A 3 7.740 -2.133 6.011 1.00 0.03 C ATOM 67 C4' DG A 3 7.668 -0.670 6.432 1.00 0.03 C ATOM 68 O4' DG A 3 6.336 -0.184 6.229 1.00 0.03 O ATOM 69 C3' DG A 3 7.994 -0.472 7.904 1.00 0.03 C ATOM 70 O3' DG A 3 8.668 0.784 8.093 1.00 0.04 O ATOM 71 C2' DG A 3 6.664 -0.489 8.585 1.00 0.03 C ATOM 72 C1' DG A 3 5.675 -0.067 7.502 1.00 0.03 C ATOM 73 N9 DG A 3 4.464 -0.902 7.538 1.00 0.03 N ATOM 74 C8 DG A 3 4.345 -2.240 7.699 1.00 0.03 C ATOM 75 N7 DG A 3 3.156 -2.741 7.691 1.00 0.03 N ATOM 76 C5 DG A 3 2.370 -1.601 7.497 1.00 0.03 C ATOM 77 C6 DG A 3 0.959 -1.471 7.416 1.00 0.02 C ATOM 78 O6 DG A 3 0.107 -2.354 7.481 1.00 0.03 O ATOM 79 N1 DG A 3 0.579 -0.145 7.246 1.00 0.02 N ATOM 80 C2 DG A 3 1.443 0.927 7.161 1.00 0.02 C ATOM 81 N2 DG A 3 0.886 2.127 7.003 1.00 0.03 N ATOM 82 N3 DG A 3 2.771 0.813 7.236 1.00 0.03 N ATOM 83 C4 DG A 3 3.166 -0.469 7.404 1.00 0.03 C ATOM 84 H5' DG A 3 7.337 -2.209 5.007 1.00 0.04 H ATOM 85 H5'' DG A 3 8.774 -2.460 6.006 1.00 0.04 H ATOM 86 H4' DG A 3 8.355 -0.083 5.824 1.00 0.04 H ATOM 87 H3' DG A 3 8.602 -1.280 8.287 1.00 0.04 H ATOM 88 H2' DG A 3 6.434 -1.497 8.933 1.00 0.03 H ATOM 89 H2'' DG A 3 6.665 0.204 9.410 1.00 0.03 H ATOM 90 H1' DG A 3 5.399 0.965 7.652 1.00 0.03 H ATOM 91 H8 DG A 3 5.229 -2.873 7.812 1.00 0.03 H ATOM 92 H1 DG A 3 -0.415 0.025 7.187 1.00 0.02 H ATOM 93 H21 DG A 3 -0.118 2.215 6.947 1.00 0.03 H ATOM 94 H22 DG A 3 1.469 2.950 6.939 1.00 0.03 H ATOM 95 P DA A 4 8.882 1.434 9.556 1.00 0.04 P ATOM 96 OP1 DA A 4 10.084 2.296 9.507 1.00 0.04 O ATOM 97 OP2 DA A 4 8.792 0.356 10.568 1.00 0.04 O ATOM 98 O5' DA A 4 7.588 2.386 9.719 1.00 0.03 O ATOM 99 C5' DA A 4 7.135 3.199 8.625 1.00 0.03 C ATOM 100 C4' DA A 4 6.508 4.525 9.096 1.00 0.02 C ATOM 101 O4' DA A 4 5.075 4.466 9.032 1.00 0.01 O ATOM 102 C3' DA A 4 6.874 4.833 10.543 1.00 0.02 C ATOM 103 O3' DA A 4 7.186 6.227 10.730 1.00 0.02 O ATOM 104 C2' DA A 4 5.667 4.431 11.357 1.00 0.02 C ATOM 105 C1' DA A 4 4.557 4.168 10.340 1.00 0.01 C ATOM 106 N9 DA A 4 4.134 2.770 10.395 1.00 0.01 N ATOM 107 C8 DA A 4 4.901 1.689 10.528 1.00 0.02 C ATOM 108 N7 DA A 4 4.322 0.534 10.544 1.00 0.02 N ATOM 109 C5 DA A 4 2.979 0.900 10.397 1.00 0.02 C ATOM 110 C6 DA A 4 1.796 0.161 10.329 1.00 0.02 C ATOM 111 N6 DA A 4 1.766 -1.170 10.400 1.00 0.02 N ATOM 112 N1 DA A 4 0.645 0.844 10.182 1.00 0.02 N ATOM 113 C2 DA A 4 0.658 2.176 10.104 1.00 0.01 C ATOM 114 N3 DA A 4 1.720 2.975 10.157 1.00 0.01 N ATOM 115 C4 DA A 4 2.856 2.266 10.306 1.00 0.01 C ATOM 116 H5' DA A 4 6.385 2.631 8.062 1.00 0.03 H ATOM 117 H5'' DA A 4 7.980 3.418 7.972 1.00 0.03 H ATOM 118 H4' DA A 4 6.860 5.332 8.454 1.00 0.02 H ATOM 119 H3' DA A 4 7.735 4.227 10.850 1.00 0.03 H ATOM 120 H2' DA A 4 5.881 3.525 11.927 1.00 0.02 H ATOM 121 H2'' DA A 4 5.383 5.234 12.024 1.00 0.02 H ATOM 122 H1' DA A 4 3.713 4.802 10.558 1.00 0.01 H ATOM 123 H8 DA A 4 5.976 1.801 10.604 1.00 0.02 H ATOM 124 H61 DA A 4 2.626 -1.687 10.506 1.00 0.03 H ATOM 125 H62 DA A 4 0.885 -1.659 10.348 1.00 0.02 H ATOM 126 H2 DA A 4 -0.310 2.665 9.984 1.00 0.01 H ATOM 127 P DC A 5 6.192 7.438 10.307 1.00 0.02 P ATOM 128 OP1 DC A 5 5.883 7.303 8.866 1.00 0.02 O ATOM 129 OP2 DC A 5 6.775 8.699 10.814 1.00 0.03 O ATOM 130 O5' DC A 5 4.843 7.153 11.143 1.00 0.02 O ATOM 131 C5' DC A 5 3.568 7.560 10.623 1.00 0.03 C ATOM 132 C4' DC A 5 2.421 7.197 11.564 1.00 0.04 C ATOM 133 O4' DC A 5 2.155 5.781 11.551 1.00 0.04 O ATOM 134 C3' DC A 5 2.749 7.590 13.000 1.00 0.03 C ATOM 135 O3' DC A 5 1.917 8.670 13.438 1.00 0.04 O ATOM 136 C2' DC A 5 2.521 6.342 13.834 1.00 0.03 C ATOM 137 C1' DC A 5 1.839 5.358 12.887 1.00 0.04 C ATOM 138 N1 DC A 5 2.272 3.953 13.125 1.00 0.04 N ATOM 139 C2 DC A 5 1.295 2.967 13.075 1.00 0.04 C ATOM 140 O2 DC A 5 0.124 3.262 12.837 1.00 0.05 O ATOM 141 N3 DC A 5 1.669 1.676 13.279 1.00 0.05 N ATOM 142 C4 DC A 5 2.944 1.356 13.524 1.00 0.04 C ATOM 143 N4 DC A 5 3.276 0.080 13.703 1.00 0.05 N ATOM 144 C5 DC A 5 3.954 2.358 13.581 1.00 0.04 C ATOM 145 C6 DC A 5 3.581 3.632 13.374 1.00 0.03 C ATOM 146 H5' DC A 5 3.401 7.087 9.656 1.00 0.04 H ATOM 147 H5'' DC A 5 3.578 8.643 10.489 1.00 0.04 H ATOM 148 H4' DC A 5 1.522 7.728 11.250 1.00 0.04 H ATOM 149 H3' DC A 5 3.799 7.885 13.067 1.00 0.03 H ATOM 150 H2' DC A 5 3.476 5.941 14.172 1.00 0.03 H ATOM 151 H2'' DC A 5 1.878 6.562 14.684 1.00 0.04 H ATOM 152 H1' DC A 5 0.757 5.427 13.032 1.00 0.04 H ATOM 153 H41 DC A 5 2.567 -0.637 13.665 1.00 0.06 H ATOM 154 H42 DC A 5 4.239 -0.169 13.877 1.00 0.05 H ATOM 155 H5 DC A 5 4.995 2.101 13.783 1.00 0.04 H ATOM 156 H6 DC A 5 4.333 4.407 13.382 1.00 0.03 H HETATM 157 P 2BU A 6 2.124 9.338 14.891 1.00 0.03 P HETATM 158 OP1 2BU A 6 1.828 10.785 14.785 1.00 0.05 O HETATM 159 OP2 2BU A 6 3.428 8.891 15.434 1.00 0.04 O HETATM 160 O5' 2BU A 6 0.958 8.644 15.754 1.00 0.02 O HETATM 161 C5' 2BU A 6 -0.409 8.780 15.356 1.00 0.02 C HETATM 162 C4' 2BU A 6 -1.329 7.884 16.183 1.00 0.02 C HETATM 163 O4' 2BU A 6 -0.973 6.491 16.029 1.00 0.02 O HETATM 164 C1' 2BU A 6 -0.728 5.904 17.320 1.00 0.01 C HETATM 165 N9 2BU A 6 0.473 5.038 17.254 1.00 0.01 N HETATM 166 C4 2BU A 6 0.540 3.655 17.158 1.00 0.02 C HETATM 167 N3 2BU A 6 -0.492 2.791 17.003 1.00 0.02 N HETATM 168 C2 2BU A 6 -0.064 1.537 16.870 1.00 0.02 C HETATM 169 N1 2BU A 6 1.202 1.113 16.899 1.00 0.02 N HETATM 170 C6 2BU A 6 2.213 1.986 17.045 1.00 0.02 C HETATM 171 N6 2BU A 6 3.461 1.510 17.232 1.00 0.02 N HETATM 172 CB1 2BU A 6 4.619 2.279 16.687 1.00 0.02 C HETATM 173 CB2 2BU A 6 5.913 1.737 17.413 1.00 0.03 C HETATM 174 OH2 2BU A 6 5.796 0.695 17.598 1.00 0.03 O HETATM 175 CB3 2BU A 6 6.914 0.669 16.763 1.00 0.04 C HETATM 176 OH3 2BU A 6 6.492 0.061 15.925 1.00 0.04 O HETATM 177 CB4 2BU A 6 8.220 1.392 16.343 1.00 0.04 C HETATM 178 OH4 2BU A 6 9.309 0.450 16.320 1.00 0.04 O HETATM 179 C5 2BU A 6 1.880 3.335 17.179 1.00 0.02 C HETATM 180 N7 2BU A 6 2.673 4.492 17.279 1.00 0.02 N HETATM 181 C8 2BU A 6 1.773 5.413 17.310 1.00 0.02 C HETATM 182 C2' 2BU A 6 -0.563 7.029 18.319 1.00 0.02 C HETATM 183 C3' 2BU A 6 -1.215 8.225 17.664 1.00 0.02 C HETATM 184 O3' 2BU A 6 -2.502 8.508 18.260 1.00 0.02 O HETATM 185 H5' 2BU A 6 -0.503 8.515 14.303 1.00 0.03 H HETATM 186 H5'' 2BU A 6 -0.715 9.818 15.489 1.00 0.03 H HETATM 187 H4' 2BU A 6 -2.358 8.033 15.847 1.00 0.02 H HETATM 188 H1' 2BU A 6 -1.590 5.319 17.613 1.00 0.01 H HETATM 189 H2 2BU A 6 -0.836 0.768 16.701 1.00 0.02 H HETATM 190 H6 2BU A 6 3.591 0.518 17.111 1.00 0.03 H HETATM 191 HB12 2BU A 6 4.460 3.339 16.914 1.00 0.02 H HETATM 192 HB11 2BU A 6 4.715 2.100 15.596 1.00 0.03 H HETATM 193 HB2 2BU A 6 6.471 2.571 17.802 1.00 0.03 H HETATM 194 HO2 2BU A 6 6.166 0.501 18.452 1.00 0.03 H HETATM 195 HB3 2BU A 6 7.134 -0.039 17.518 1.00 0.04 H HETATM 196 HO3 2BU A 6 6.221 -0.808 16.289 1.00 0.04 H HETATM 197 HB41 2BU A 6 8.398 2.134 17.040 1.00 0.04 H HETATM 198 HB42 2BU A 6 8.090 1.803 15.353 1.00 0.03 H HETATM 199 HO4 2BU A 6 8.962 -0.442 16.475 1.00 0.04 H HETATM 200 H8 2BU A 6 2.047 6.462 17.394 1.00 0.02 H HETATM 201 H2' 2BU A 6 0.487 7.222 18.489 1.00 0.02 H HETATM 202 H2'' 2BU A 6 -1.060 6.793 19.262 1.00 0.02 H HETATM 203 H3' 2BU A 6 -0.565 9.093 17.782 1.00 0.02 H ATOM 204 P DA A 7 -3.873 7.725 17.877 1.00 0.01 P ATOM 205 OP1 DA A 7 -4.145 7.944 16.438 1.00 0.01 O ATOM 206 OP2 DA A 7 -4.901 8.092 18.876 1.00 0.02 O ATOM 207 O5' DA A 7 -3.513 6.167 18.090 1.00 0.02 O ATOM 208 C5' DA A 7 -4.065 5.163 17.219 1.00 0.01 C ATOM 209 C4' DA A 7 -4.958 4.189 17.975 1.00 0.01 C ATOM 210 O4' DA A 7 -4.201 3.037 18.355 1.00 0.01 O ATOM 211 C3' DA A 7 -5.492 4.818 19.249 1.00 0.01 C ATOM 212 O3' DA A 7 -6.855 4.416 19.485 1.00 0.01 O ATOM 213 C2' DA A 7 -4.557 4.344 20.334 1.00 0.01 C ATOM 214 C1' DA A 7 -3.870 3.121 19.751 1.00 0.01 C ATOM 215 N9 DA A 7 -2.413 3.209 19.935 1.00 0.01 N ATOM 216 C8 DA A 7 -1.617 4.297 19.913 1.00 0.01 C ATOM 217 N7 DA A 7 -0.351 4.118 20.086 1.00 0.01 N ATOM 218 C5 DA A 7 -0.287 2.732 20.247 1.00 0.01 C ATOM 219 C6 DA A 7 0.774 1.854 20.474 1.00 0.01 C ATOM 220 N6 DA A 7 2.043 2.251 20.565 1.00 0.02 N ATOM 221 N1 DA A 7 0.478 0.548 20.585 1.00 0.01 N ATOM 222 C2 DA A 7 -0.782 0.125 20.480 1.00 0.01 C ATOM 223 N3 DA A 7 -1.861 0.867 20.265 1.00 0.01 N ATOM 224 C4 DA A 7 -1.541 2.172 20.158 1.00 0.01 C ATOM 225 H5' DA A 7 -3.255 4.596 16.768 1.00 0.01 H ATOM 226 H5'' DA A 7 -4.648 5.645 16.437 1.00 0.01 H ATOM 227 H4' DA A 7 -5.788 3.883 17.341 1.00 0.01 H ATOM 228 H3' DA A 7 -5.431 5.898 19.173 1.00 0.01 H ATOM 229 H2' DA A 7 -3.818 5.117 20.556 1.00 0.02 H ATOM 230 H2'' DA A 7 -5.106 4.076 21.235 1.00 0.02 H ATOM 231 H1' DA A 7 -4.242 2.247 20.248 1.00 0.01 H ATOM 232 H8 DA A 7 -2.037 5.289 19.759 1.00 0.01 H ATOM 233 H61 DA A 7 2.275 3.227 20.460 1.00 0.02 H ATOM 234 H62 DA A 7 2.774 1.572 20.732 1.00 0.02 H ATOM 235 H2 DA A 7 -0.945 -0.947 20.580 1.00 0.01 H ATOM 236 P DG A 8 -7.489 4.379 20.969 1.00 0.02 P ATOM 237 OP1 DG A 8 -8.963 4.421 20.846 1.00 0.02 O ATOM 238 OP2 DG A 8 -6.791 5.383 21.805 1.00 0.02 O ATOM 239 O5' DG A 8 -7.063 2.912 21.481 1.00 0.02 O ATOM 240 C5' DG A 8 -7.724 1.750 20.969 1.00 0.02 C ATOM 241 C4' DG A 8 -7.385 0.494 21.771 1.00 0.02 C ATOM 242 O4' DG A 8 -6.031 0.061 21.541 1.00 0.01 O ATOM 243 C3' DG A 8 -7.521 0.739 23.259 1.00 0.02 C ATOM 244 O3' DG A 8 -8.822 0.375 23.734 1.00 0.02 O ATOM 245 C2' DG A 8 -6.448 -0.116 23.891 1.00 0.02 C ATOM 246 C1' DG A 8 -5.417 -0.300 22.801 1.00 0.01 C ATOM 247 N9 DG A 8 -4.231 0.529 23.062 1.00 0.01 N ATOM 248 C8 DG A 8 -4.151 1.868 23.184 1.00 0.01 C ATOM 249 N7 DG A 8 -2.987 2.385 23.404 1.00 0.01 N ATOM 250 C5 DG A 8 -2.174 1.246 23.436 1.00 0.01 C ATOM 251 C6 DG A 8 -0.782 1.126 23.697 1.00 0.01 C ATOM 252 O6 DG A 8 0.037 2.020 23.895 1.00 0.01 O ATOM 253 N1 DG A 8 -0.377 -0.202 23.705 1.00 0.01 N ATOM 254 C2 DG A 8 -1.202 -1.288 23.488 1.00 0.01 C ATOM 255 N2 DG A 8 -0.623 -2.489 23.534 1.00 0.01 N ATOM 256 N3 DG A 8 -2.513 -1.185 23.241 1.00 0.01 N ATOM 257 C4 DG A 8 -2.932 0.102 23.228 1.00 0.01 C ATOM 258 H5' DG A 8 -7.429 1.599 19.930 1.00 0.01 H ATOM 259 H5'' DG A 8 -8.801 1.914 21.010 1.00 0.02 H ATOM 260 H4' DG A 8 -8.063 -0.307 21.480 1.00 0.02 H ATOM 261 H3' DG A 8 -7.317 1.794 23.466 1.00 0.02 H ATOM 262 H2' DG A 8 -6.005 0.367 24.768 1.00 0.02 H ATOM 263 H2'' DG A 8 -6.855 -1.083 24.159 1.00 0.02 H ATOM 264 H1' DG A 8 -5.133 -1.341 22.778 1.00 0.01 H ATOM 265 H8 DG A 8 -5.045 2.486 23.107 1.00 0.01 H ATOM 266 H1 DG A 8 0.603 -0.365 23.886 1.00 0.01 H ATOM 267 H21 DG A 8 0.366 -2.568 23.721 1.00 0.01 H ATOM 268 H22 DG A 8 -1.176 -3.320 23.379 1.00 0.01 H ATOM 269 P DA A 9 -8.101 -2.441 25.608 1.00 0.01 P ATOM 270 OP1 DA A 9 -7.947 -1.320 26.562 1.00 0.01 O ATOM 271 OP2 DA A 9 -8.846 -3.653 26.022 1.00 0.01 O ATOM 272 O5' DA A 9 -6.631 -2.909 25.147 1.00 0.01 O ATOM 273 C5' DA A 9 -6.456 -3.886 24.110 1.00 0.01 C ATOM 274 C4' DA A 9 -5.540 -5.011 24.584 1.00 0.01 C ATOM 275 O4' DA A 9 -4.165 -4.590 24.608 1.00 0.01 O ATOM 276 C3' DA A 9 -5.898 -5.359 26.009 1.00 0.01 C ATOM 277 O3' DA A 9 -5.615 -6.735 26.290 1.00 0.01 O ATOM 278 C2' DA A 9 -5.033 -4.447 26.837 1.00 0.01 C ATOM 279 C1' DA A 9 -3.828 -4.167 25.951 1.00 0.01 C ATOM 280 N9 DA A 9 -3.503 -2.739 25.962 1.00 0.01 N ATOM 281 C8 DA A 9 -4.296 -1.679 25.694 1.00 0.01 C ATOM 282 N7 DA A 9 -3.760 -0.506 25.748 1.00 0.01 N ATOM 283 C5 DA A 9 -2.440 -0.821 26.097 1.00 0.01 C ATOM 284 C6 DA A 9 -1.307 -0.038 26.323 1.00 0.01 C ATOM 285 N6 DA A 9 -1.309 1.290 26.220 1.00 0.01 N ATOM 286 N1 DA A 9 -0.168 -0.677 26.649 1.00 0.01 N ATOM 287 C2 DA A 9 -0.142 -2.007 26.746 1.00 0.01 C ATOM 288 N3 DA A 9 -1.153 -2.842 26.552 1.00 0.01 N ATOM 289 C4 DA A 9 -2.281 -2.179 26.227 1.00 0.01 C ATOM 290 H5' DA A 9 -6.017 -3.409 23.236 1.00 0.01 H ATOM 291 H5'' DA A 9 -7.424 -4.297 23.847 1.00 0.01 H ATOM 292 H4' DA A 9 -5.656 -5.885 23.937 1.00 0.01 H ATOM 293 H3' DA A 9 -6.952 -5.137 26.188 1.00 0.01 H ATOM 294 H2' DA A 9 -5.566 -3.517 27.048 1.00 0.01 H ATOM 295 H2'' DA A 9 -4.729 -4.930 27.758 1.00 0.01 H ATOM 296 H1' DA A 9 -2.973 -4.734 26.321 1.00 0.01 H ATOM 297 H8 DA A 9 -5.352 -1.819 25.440 1.00 0.01 H ATOM 298 H61 DA A 9 -2.158 1.773 25.962 1.00 0.01 H ATOM 299 H62 DA A 9 -0.463 1.812 26.394 1.00 0.01 H ATOM 300 H2 DA A 9 0.814 -2.456 27.017 1.00 0.01 H ATOM 301 P DA A 10 -5.866 -7.364 27.753 1.00 0.01 P ATOM 302 OP1 DA A 10 -6.797 -8.506 27.622 1.00 0.02 O ATOM 303 OP2 DA A 10 -6.188 -6.260 28.687 1.00 0.01 O ATOM 304 O5' DA A 10 -4.415 -7.933 28.163 1.00 0.01 O ATOM 305 C5' DA A 10 -3.204 -7.225 27.850 1.00 0.01 C ATOM 306 C4' DA A 10 -2.126 -7.537 28.888 1.00 0.01 C ATOM 307 O4' DA A 10 -1.156 -6.470 28.983 1.00 0.01 O ATOM 308 C3' DA A 10 -2.762 -7.697 30.257 1.00 0.01 C ATOM 309 O3' DA A 10 -2.265 -8.881 30.901 1.00 0.01 O ATOM 310 C2' DA A 10 -2.415 -6.442 31.034 1.00 0.01 C ATOM 311 C1' DA A 10 -1.331 -5.745 30.225 1.00 0.01 C ATOM 312 N9 DA A 10 -1.704 -4.343 29.950 1.00 0.01 N ATOM 313 C8 DA A 10 -2.899 -3.821 29.568 1.00 0.01 C ATOM 314 N7 DA A 10 -2.962 -2.545 29.394 1.00 0.01 N ATOM 315 C5 DA A 10 -1.653 -2.155 29.690 1.00 0.01 C ATOM 316 C6 DA A 10 -1.019 -0.910 29.700 1.00 0.01 C ATOM 317 N6 DA A 10 -1.647 0.222 29.389 1.00 0.01 N ATOM 318 N1 DA A 10 0.284 -0.879 30.037 1.00 0.01 N ATOM 319 C2 DA A 10 0.926 -2.010 30.345 1.00 0.01 C ATOM 320 N3 DA A 10 0.422 -3.240 30.368 1.00 0.01 N ATOM 321 C4 DA A 10 -0.882 -3.242 30.026 1.00 0.01 C ATOM 322 H5' DA A 10 -3.406 -6.158 27.854 1.00 0.01 H ATOM 323 H5'' DA A 10 -2.851 -7.516 26.861 1.00 0.01 H ATOM 324 H4' DA A 10 -1.616 -8.462 28.614 1.00 0.01 H ATOM 325 H3' DA A 10 -3.848 -7.770 30.141 1.00 0.01 H ATOM 326 H2' DA A 10 -3.290 -5.796 31.126 1.00 0.01 H ATOM 327 H2'' DA A 10 -2.036 -6.701 32.019 1.00 0.01 H ATOM 328 H1' DA A 10 -0.399 -5.760 30.802 1.00 0.01 H ATOM 329 H8 DA A 10 -3.769 -4.458 29.408 1.00 0.01 H ATOM 330 H61 DA A 10 -2.622 0.202 29.128 1.00 0.01 H ATOM 331 H62 DA A 10 -1.148 1.100 29.412 1.00 0.01 H ATOM 332 H2 DA A 10 1.982 -1.917 30.601 1.00 0.01 H ATOM 333 P DG A 11 -2.409 -9.099 32.491 1.00 0.01 P ATOM 334 OP1 DG A 11 -2.169 -10.528 32.789 1.00 0.01 O ATOM 335 OP2 DG A 11 -3.662 -8.451 32.943 1.00 0.01 O ATOM 336 O5' DG A 11 -1.166 -8.246 33.060 1.00 0.01 O ATOM 337 C5' DG A 11 0.176 -8.721 32.897 1.00 0.01 C ATOM 338 C4' DG A 11 1.166 -7.922 33.742 1.00 0.01 C ATOM 339 O4' DG A 11 1.340 -6.590 33.224 1.00 0.01 O ATOM 340 C3' DG A 11 0.682 -7.809 35.177 1.00 0.01 C ATOM 341 O3' DG A 11 1.470 -8.624 36.052 1.00 0.01 O ATOM 342 C2' DG A 11 0.789 -6.350 35.550 1.00 0.01 C ATOM 343 C1' DG A 11 1.178 -5.618 34.279 1.00 0.01 C ATOM 344 N9 DG A 11 0.147 -4.630 33.915 1.00 0.01 N ATOM 345 C8 DG A 11 -1.161 -4.827 33.650 1.00 0.01 C ATOM 346 N7 DG A 11 -1.881 -3.794 33.366 1.00 0.01 N ATOM 347 C5 DG A 11 -0.941 -2.763 33.446 1.00 0.01 C ATOM 348 C6 DG A 11 -1.112 -1.362 33.285 1.00 0.01 C ATOM 349 O6 DG A 11 -2.137 -0.745 32.997 1.00 0.01 O ATOM 350 N1 DG A 11 0.077 -0.676 33.503 1.00 0.01 N ATOM 351 C2 DG A 11 1.284 -1.260 33.833 1.00 0.01 C ATOM 352 N2 DG A 11 2.318 -0.433 33.994 1.00 0.01 N ATOM 353 N3 DG A 11 1.453 -2.577 33.989 1.00 0.01 N ATOM 354 C4 DG A 11 0.308 -3.267 33.783 1.00 0.01 C ATOM 355 H5' DG A 11 0.459 -8.643 31.847 1.00 0.01 H ATOM 356 H5'' DG A 11 0.217 -9.768 33.199 1.00 0.01 H ATOM 357 H4' DG A 11 2.127 -8.431 33.735 1.00 0.01 H ATOM 358 H3' DG A 11 -0.364 -8.115 35.229 1.00 0.01 H ATOM 359 HO3' DG A 11 1.346 -9.550 35.828 1.00 0.01 H ATOM 360 H2' DG A 11 -0.166 -5.981 35.912 1.00 0.01 H ATOM 361 H2'' DG A 11 1.555 -6.211 36.306 1.00 0.01 H ATOM 362 H1' DG A 11 2.119 -5.105 34.449 1.00 0.01 H ATOM 363 H8 DG A 11 -1.586 -5.828 33.672 1.00 0.01 H ATOM 364 H1 DG A 11 0.030 0.329 33.415 1.00 0.01 H ATOM 365 H21 DG A 11 2.192 0.562 33.880 1.00 0.01 H ATOM 366 H22 DG A 11 3.228 -0.803 34.231 1.00 0.01 H TER 367 DG A 11 ATOM 368 O5' DC B 12 0.034 7.465 35.225 1.00 0.02 O ATOM 369 C5' DC B 12 1.259 7.765 35.900 1.00 0.02 C ATOM 370 C4' DC B 12 2.419 7.066 35.195 1.00 0.02 C ATOM 371 O4' DC B 12 2.273 5.635 35.264 1.00 0.02 O ATOM 372 C3' DC B 12 2.480 7.472 33.731 1.00 0.02 C ATOM 373 O3' DC B 12 3.754 8.072 33.420 1.00 0.02 O ATOM 374 C2' DC B 12 2.245 6.217 32.936 1.00 0.02 C ATOM 375 C1' DC B 12 2.195 5.077 33.939 1.00 0.02 C ATOM 376 N1 DC B 12 0.943 4.332 33.761 1.00 0.01 N ATOM 377 C2 DC B 12 0.985 2.947 33.805 1.00 0.01 C ATOM 378 O2 DC B 12 2.049 2.361 34.004 1.00 0.01 O ATOM 379 N3 DC B 12 -0.178 2.265 33.615 1.00 0.01 N ATOM 380 C4 DC B 12 -1.330 2.916 33.395 1.00 0.01 C ATOM 381 N4 DC B 12 -2.450 2.214 33.207 1.00 0.01 N ATOM 382 C5 DC B 12 -1.370 4.350 33.353 1.00 0.01 C ATOM 383 C6 DC B 12 -0.210 5.010 33.540 1.00 0.02 C ATOM 384 H5' DC B 12 1.195 7.406 36.921 1.00 0.02 H ATOM 385 H5'' DC B 12 1.426 8.845 35.902 1.00 0.02 H ATOM 386 H4' DC B 12 3.353 7.350 35.681 1.00 0.02 H ATOM 387 H3' DC B 12 1.670 8.173 33.518 1.00 0.02 H ATOM 388 H2' DC B 12 1.295 6.293 32.409 1.00 0.02 H ATOM 389 H2'' DC B 12 3.044 6.062 32.234 1.00 0.02 H ATOM 390 H1' DC B 12 3.037 4.407 33.775 1.00 0.01 H ATOM 391 H41 DC B 12 -2.424 1.204 33.236 1.00 0.01 H ATOM 392 H42 DC B 12 -3.323 2.692 33.036 1.00 0.01 H ATOM 393 H5 DC B 12 -2.304 4.885 33.177 1.00 0.02 H ATOM 394 H6 DC B 12 -0.174 6.110 33.493 1.00 0.02 H ATOM 395 HO5' DC B 12 -0.249 6.597 35.522 1.00 0.02 H ATOM 396 P DT B 13 4.343 8.131 31.910 1.00 0.02 P ATOM 397 OP1 DT B 13 5.514 9.035 31.907 1.00 0.02 O ATOM 398 OP2 DT B 13 3.216 8.385 30.984 1.00 0.02 O ATOM 399 O5' DT B 13 4.867 6.620 31.662 1.00 0.02 O ATOM 400 C5' DT B 13 5.421 5.860 32.744 1.00 0.02 C ATOM 401 C4' DT B 13 6.149 4.599 32.293 1.00 0.02 C ATOM 402 O4' DT B 13 5.246 3.480 32.322 1.00 0.02 O ATOM 403 C3' DT B 13 6.681 4.729 30.878 1.00 0.02 C ATOM 404 O3' DT B 13 7.995 4.145 30.786 1.00 0.02 O ATOM 405 C2' DT B 13 5.676 3.994 30.024 1.00 0.02 C ATOM 406 C1' DT B 13 4.980 3.032 30.983 1.00 0.01 C ATOM 407 N1 DT B 13 3.526 2.979 30.726 1.00 0.01 N ATOM 408 C2 DT B 13 2.936 1.732 30.578 1.00 0.01 C ATOM 409 O2 DT B 13 3.570 0.684 30.687 1.00 0.01 O ATOM 410 N3 DT B 13 1.581 1.732 30.309 1.00 0.01 N ATOM 411 C4 DT B 13 0.778 2.850 30.174 1.00 0.01 C ATOM 412 O4 DT B 13 -0.419 2.733 29.930 1.00 0.01 O ATOM 413 C5 DT B 13 1.477 4.103 30.347 1.00 0.01 C ATOM 414 C7 DT B 13 0.708 5.414 30.197 1.00 0.02 C ATOM 415 C6 DT B 13 2.801 4.129 30.617 1.00 0.01 C ATOM 416 H5' DT B 13 4.603 5.550 33.382 1.00 0.02 H ATOM 417 H5'' DT B 13 6.108 6.490 33.313 1.00 0.02 H ATOM 418 H4' DT B 13 6.977 4.400 32.971 1.00 0.02 H ATOM 419 H3' DT B 13 6.715 5.783 30.590 1.00 0.02 H ATOM 420 H2' DT B 13 4.958 4.702 29.612 1.00 0.02 H ATOM 421 H2'' DT B 13 6.167 3.448 29.226 1.00 0.02 H ATOM 422 H1' DT B 13 5.400 2.041 30.855 1.00 0.01 H ATOM 423 H3 DT B 13 1.136 0.831 30.201 1.00 0.01 H ATOM 424 H71 DT B 13 1.407 6.250 30.200 1.00 0.02 H ATOM 425 H72 DT B 13 0.008 5.522 31.025 1.00 0.02 H ATOM 426 H73 DT B 13 0.157 5.405 29.257 1.00 0.02 H ATOM 427 H6 DT B 13 3.303 5.085 30.778 1.00 0.02 H ATOM 428 P DT B 14 8.612 3.628 29.385 1.00 0.02 P ATOM 429 OP1 DT B 14 10.069 3.440 29.563 1.00 0.02 O ATOM 430 OP2 DT B 14 8.109 4.503 28.301 1.00 0.02 O ATOM 431 O5' DT B 14 7.930 2.174 29.216 1.00 0.02 O ATOM 432 C5' DT B 14 8.197 1.132 30.164 1.00 0.02 C ATOM 433 C4' DT B 14 7.513 -0.185 29.788 1.00 0.02 C ATOM 434 O4' DT B 14 6.076 -0.032 29.738 1.00 0.01 O ATOM 435 C3' DT B 14 7.970 -0.677 28.416 1.00 0.02 C ATOM 436 O3' DT B 14 8.443 -2.031 28.492 1.00 0.02 O ATOM 437 C2' DT B 14 6.764 -0.575 27.521 1.00 0.02 C ATOM 438 C1' DT B 14 5.582 -0.522 28.473 1.00 0.01 C ATOM 439 N1 DT B 14 4.494 0.331 27.945 1.00 0.01 N ATOM 440 C2 DT B 14 3.268 -0.274 27.723 1.00 0.01 C ATOM 441 O2 DT B 14 3.073 -1.468 27.942 1.00 0.01 O ATOM 442 N3 DT B 14 2.269 0.542 27.236 1.00 0.01 N ATOM 443 C4 DT B 14 2.379 1.889 26.953 1.00 0.01 C ATOM 444 O4 DT B 14 1.412 2.517 26.528 1.00 0.01 O ATOM 445 C5 DT B 14 3.691 2.438 27.211 1.00 0.01 C ATOM 446 C7 DT B 14 3.953 3.915 26.930 1.00 0.01 C ATOM 447 C6 DT B 14 4.688 1.663 27.690 1.00 0.01 C ATOM 448 H5' DT B 14 7.839 1.447 31.145 1.00 0.02 H ATOM 449 H5'' DT B 14 9.274 0.970 30.217 1.00 0.02 H ATOM 450 H4' DT B 14 7.766 -0.937 30.538 1.00 0.02 H ATOM 451 H3' DT B 14 8.755 -0.023 28.033 1.00 0.02 H ATOM 452 H2' DT B 14 6.828 0.337 26.935 1.00 0.02 H ATOM 453 H2'' DT B 14 6.689 -1.443 26.868 1.00 0.02 H ATOM 454 H1' DT B 14 5.197 -1.536 28.606 1.00 0.01 H ATOM 455 H3 DT B 14 1.372 0.111 27.065 1.00 0.01 H ATOM 456 H71 DT B 14 4.826 4.014 26.286 1.00 0.01 H ATOM 457 H72 DT B 14 4.133 4.437 27.868 1.00 0.01 H ATOM 458 H73 DT B 14 3.085 4.350 26.435 1.00 0.01 H ATOM 459 H6 DT B 14 5.666 2.104 27.877 1.00 0.01 H ATOM 460 P DC B 15 8.780 -2.875 27.158 1.00 0.02 P ATOM 461 OP1 DC B 15 9.545 -4.080 27.553 1.00 0.02 O ATOM 462 OP2 DC B 15 9.340 -1.947 26.150 1.00 0.02 O ATOM 463 O5' DC B 15 7.322 -3.347 26.646 1.00 0.02 O ATOM 464 C5' DC B 15 6.660 -4.478 27.231 1.00 0.02 C ATOM 465 C4' DC B 15 5.756 -5.178 26.225 1.00 0.01 C ATOM 466 O4' DC B 15 4.553 -4.416 25.990 1.00 0.01 O ATOM 467 C3' DC B 15 6.474 -5.339 24.892 1.00 0.01 C ATOM 468 O3' DC B 15 6.334 -6.690 24.410 1.00 0.01 O ATOM 469 C2' DC B 15 5.830 -4.325 23.977 1.00 0.01 C ATOM 470 C1' DC B 15 4.463 -4.069 24.594 1.00 0.01 C ATOM 471 N1 DC B 15 4.020 -2.659 24.428 1.00 0.01 N ATOM 472 C2 DC B 15 2.724 -2.442 23.965 1.00 0.01 C ATOM 473 O2 DC B 15 1.988 -3.390 23.697 1.00 0.01 O ATOM 474 N3 DC B 15 2.295 -1.158 23.823 1.00 0.01 N ATOM 475 C4 DC B 15 3.094 -0.127 24.122 1.00 0.01 C ATOM 476 N4 DC B 15 2.638 1.117 23.976 1.00 0.01 N ATOM 477 C5 DC B 15 4.425 -0.342 24.597 1.00 0.01 C ATOM 478 C6 DC B 15 4.845 -1.615 24.735 1.00 0.01 C ATOM 479 H5' DC B 15 6.059 -4.147 28.077 1.00 0.01 H ATOM 480 H5'' DC B 15 7.406 -5.186 27.578 1.00 0.02 H ATOM 481 H4' DC B 15 5.489 -6.164 26.613 1.00 0.01 H ATOM 482 H3' DC B 15 7.531 -5.093 25.011 1.00 0.02 H ATOM 483 H2' DC B 15 6.424 -3.414 23.975 1.00 0.01 H ATOM 484 H2'' DC B 15 5.730 -4.714 22.967 1.00 0.01 H ATOM 485 H1' DC B 15 3.743 -4.724 24.111 1.00 0.01 H ATOM 486 H41 DC B 15 1.697 1.275 23.643 1.00 0.01 H ATOM 487 H42 DC B 15 3.232 1.902 24.201 1.00 0.01 H ATOM 488 H5 DC B 15 5.079 0.496 24.839 1.00 0.01 H ATOM 489 H6 DC B 15 5.849 -1.811 25.100 1.00 0.01 H ATOM 490 P DT B 16 6.391 -7.059 22.839 1.00 0.02 P ATOM 491 OP1 DT B 16 6.709 -8.499 22.711 1.00 0.02 O ATOM 492 OP2 DT B 16 7.232 -6.054 22.148 1.00 0.02 O ATOM 493 O5' DT B 16 4.862 -6.837 22.385 1.00 0.01 O ATOM 494 C5' DT B 16 3.809 -7.584 23.006 1.00 0.01 C ATOM 495 C4' DT B 16 2.463 -7.343 22.328 1.00 0.01 C ATOM 496 O4' DT B 16 2.070 -5.959 22.435 1.00 0.01 O ATOM 497 C3' DT B 16 2.528 -7.691 20.848 1.00 0.01 C ATOM 498 O3' DT B 16 1.419 -8.534 20.489 1.00 0.01 O ATOM 499 C2' DT B 16 2.479 -6.364 20.124 1.00 0.01 C ATOM 500 C1' DT B 16 1.848 -5.416 21.118 1.00 0.01 C ATOM 501 N1 DT B 16 2.423 -4.064 20.992 1.00 0.01 N ATOM 502 C2 DT B 16 1.572 -3.039 20.620 1.00 0.01 C ATOM 503 O2 DT B 16 0.375 -3.221 20.404 1.00 0.01 O ATOM 504 N3 DT B 16 2.146 -1.793 20.499 1.00 0.01 N ATOM 505 C4 DT B 16 3.473 -1.479 20.712 1.00 0.01 C ATOM 506 O4 DT B 16 3.869 -0.322 20.582 1.00 0.01 O ATOM 507 C5 DT B 16 4.289 -2.608 21.097 1.00 0.01 C ATOM 508 C7 DT B 16 5.779 -2.400 21.354 1.00 0.01 C ATOM 509 C6 DT B 16 3.752 -3.840 21.227 1.00 0.01 C ATOM 510 H5' DT B 16 3.736 -7.291 24.054 1.00 0.01 H ATOM 511 H5'' DT B 16 4.048 -8.646 22.950 1.00 0.01 H ATOM 512 H4' DT B 16 1.706 -7.964 22.807 1.00 0.01 H ATOM 513 H3' DT B 16 3.471 -8.197 20.627 1.00 0.01 H ATOM 514 H2' DT B 16 3.486 -6.030 19.887 1.00 0.01 H ATOM 515 H2'' DT B 16 1.876 -6.431 19.220 1.00 0.01 H ATOM 516 H1' DT B 16 0.781 -5.370 20.921 1.00 0.01 H ATOM 517 H3 DT B 16 1.534 -1.035 20.237 1.00 0.01 H ATOM 518 H71 DT B 16 6.341 -3.239 20.943 1.00 0.02 H ATOM 519 H72 DT B 16 5.957 -2.334 22.425 1.00 0.01 H ATOM 520 H73 DT B 16 6.105 -1.476 20.876 1.00 0.02 H ATOM 521 H6 DT B 16 4.383 -4.675 21.534 1.00 0.01 H ATOM 522 P DG B 17 0.981 -8.748 18.952 1.00 0.01 P ATOM 523 OP1 DG B 17 0.281 -10.049 18.848 1.00 0.01 O ATOM 524 OP2 DG B 17 2.151 -8.473 18.087 1.00 0.01 O ATOM 525 O5' DG B 17 -0.101 -7.573 18.724 1.00 0.01 O ATOM 526 C5' DG B 17 -1.436 -7.687 19.242 1.00 0.01 C ATOM 527 C4' DG B 17 -2.446 -6.997 18.325 1.00 0.02 C ATOM 528 O4' DG B 17 -2.383 -5.564 18.463 1.00 0.02 O ATOM 529 C3' DG B 17 -2.146 -7.345 16.875 1.00 0.02 C ATOM 530 O3' DG B 17 -3.193 -8.125 16.260 1.00 0.03 O ATOM 531 C2' DG B 17 -1.934 -6.039 16.147 1.00 0.02 C ATOM 532 C1' DG B 17 -2.113 -4.944 17.188 1.00 0.02 C ATOM 533 N9 DG B 17 -0.896 -4.123 17.263 1.00 0.02 N ATOM 534 C8 DG B 17 0.388 -4.515 17.421 1.00 0.02 C ATOM 535 N7 DG B 17 1.296 -3.599 17.465 1.00 0.02 N ATOM 536 C5 DG B 17 0.532 -2.436 17.316 1.00 0.02 C ATOM 537 C6 DG B 17 0.944 -1.079 17.264 1.00 0.02 C ATOM 538 O6 DG B 17 2.080 -0.627 17.357 1.00 0.02 O ATOM 539 N1 DG B 17 -0.134 -0.222 17.084 1.00 0.02 N ATOM 540 C2 DG B 17 -1.452 -0.618 16.968 1.00 0.02 C ATOM 541 N2 DG B 17 -2.349 0.355 16.808 1.00 0.03 N ATOM 542 N3 DG B 17 -1.850 -1.895 17.015 1.00 0.02 N ATOM 543 C4 DG B 17 -0.814 -2.748 17.191 1.00 0.02 C ATOM 544 H5' DG B 17 -1.478 -7.229 20.231 1.00 0.01 H ATOM 545 H5'' DG B 17 -1.696 -8.742 19.326 1.00 0.02 H ATOM 546 H4' DG B 17 -3.450 -7.337 18.579 1.00 0.02 H ATOM 547 H3' DG B 17 -1.215 -7.917 16.844 1.00 0.02 H ATOM 548 H2' DG B 17 -0.920 -5.990 15.735 1.00 0.02 H ATOM 549 H2'' DG B 17 -2.669 -5.933 15.356 1.00 0.03 H ATOM 550 H1' DG B 17 -2.954 -4.312 16.907 1.00 0.02 H ATOM 551 H8 DG B 17 0.643 -5.573 17.497 1.00 0.02 H ATOM 552 H1 DG B 17 0.087 0.763 17.038 1.00 0.02 H ATOM 553 H21 DG B 17 -2.048 1.318 16.773 1.00 0.03 H ATOM 554 H22 DG B 17 -3.329 0.128 16.722 1.00 0.03 H ATOM 555 P DG B 18 -4.771 -7.756 16.331 1.00 0.03 P ATOM 556 OP1 DG B 18 -5.148 -7.597 17.754 1.00 0.04 O ATOM 557 OP2 DG B 18 -5.499 -8.730 15.489 1.00 0.04 O ATOM 558 O5' DG B 18 -4.881 -6.315 15.615 1.00 0.02 O ATOM 559 C5' DG B 18 -5.836 -5.351 16.082 1.00 0.04 C ATOM 560 C4' DG B 18 -5.912 -4.128 15.171 1.00 0.04 C ATOM 561 O4' DG B 18 -4.680 -3.381 15.203 1.00 0.04 O ATOM 562 C3' DG B 18 -6.175 -4.533 13.720 1.00 0.04 C ATOM 563 O3' DG B 18 -7.425 -3.975 13.264 1.00 0.07 O ATOM 564 C2' DG B 18 -4.993 -3.995 12.930 1.00 0.03 C ATOM 565 C1' DG B 18 -4.332 -2.999 13.865 1.00 0.04 C ATOM 566 N9 DG B 18 -2.870 -2.966 13.674 1.00 0.08 N ATOM 567 C8 DG B 18 -1.971 -3.980 13.634 1.00 0.12 C ATOM 568 N7 DG B 18 -0.731 -3.672 13.454 1.00 0.15 N ATOM 569 C5 DG B 18 -0.796 -2.280 13.359 1.00 0.15 C ATOM 570 C6 DG B 18 0.235 -1.337 13.115 1.00 0.18 C ATOM 571 O6 DG B 18 1.437 -1.542 12.972 1.00 0.21 O ATOM 572 N1 DG B 18 -0.263 -0.044 13.043 1.00 0.18 N ATOM 573 C2 DG B 18 -1.590 0.308 13.188 1.00 0.16 C ATOM 574 N2 DG B 18 -1.874 1.605 13.080 1.00 0.19 N ATOM 575 N3 DG B 18 -2.566 -0.573 13.417 1.00 0.12 N ATOM 576 C4 DG B 18 -2.103 -1.841 13.492 1.00 0.11 C ATOM 577 H5' DG B 18 -5.564 -5.031 17.087 1.00 0.06 H ATOM 578 H5'' DG B 18 -6.819 -5.823 16.115 1.00 0.06 H ATOM 579 H4' DG B 18 -6.724 -3.484 15.509 1.00 0.07 H ATOM 580 H3' DG B 18 -6.208 -5.626 13.647 1.00 0.06 H ATOM 581 H2' DG B 18 -4.296 -4.800 12.688 1.00 0.06 H ATOM 582 H2'' DG B 18 -5.324 -3.498 12.021 1.00 0.04 H ATOM 583 H1' DG B 18 -4.736 -2.007 13.665 1.00 0.06 H ATOM 584 H8 DG B 18 -2.284 -5.018 13.738 1.00 0.12 H ATOM 585 H1 DG B 18 0.418 0.682 12.878 1.00 0.20 H ATOM 586 H21 DG B 18 -1.136 2.272 12.906 1.00 0.21 H ATOM 587 H22 DG B 18 -2.830 1.921 13.170 1.00 0.19 H ATOM 588 P DT B 19 -7.732 -3.687 11.700 1.00 0.08 P ATOM 589 OP1 DT B 19 -9.197 -3.565 11.531 1.00 0.12 O ATOM 590 OP2 DT B 19 -6.976 -4.665 10.884 1.00 0.09 O ATOM 591 O5' DT B 19 -7.077 -2.228 11.478 1.00 0.05 O ATOM 592 C5' DT B 19 -7.268 -1.204 12.464 1.00 0.05 C ATOM 593 C4' DT B 19 -7.115 0.211 11.900 1.00 0.04 C ATOM 594 O4' DT B 19 -5.733 0.610 11.885 1.00 0.04 O ATOM 595 C3' DT B 19 -7.625 0.302 10.473 1.00 0.03 C ATOM 596 O3' DT B 19 -8.317 1.542 10.273 1.00 0.03 O ATOM 597 C2' DT B 19 -6.400 0.221 9.622 1.00 0.02 C ATOM 598 C1' DT B 19 -5.277 0.718 10.524 1.00 0.02 C ATOM 599 N1 DT B 19 -4.049 -0.070 10.336 1.00 0.02 N ATOM 600 C2 DT B 19 -2.871 0.619 10.100 1.00 0.02 C ATOM 601 O2 DT B 19 -2.825 1.846 10.034 1.00 0.02 O ATOM 602 N3 DT B 19 -1.742 -0.156 9.936 1.00 0.02 N ATOM 603 C4 DT B 19 -1.689 -1.537 9.980 1.00 0.02 C ATOM 604 O4 DT B 19 -0.623 -2.124 9.819 1.00 0.02 O ATOM 605 C5 DT B 19 -2.966 -2.170 10.230 1.00 0.02 C ATOM 606 C7 DT B 19 -3.050 -3.692 10.281 1.00 0.03 C ATOM 607 C6 DT B 19 -4.084 -1.434 10.401 1.00 0.02 C ATOM 608 H5' DT B 19 -6.527 -1.345 13.245 1.00 0.06 H ATOM 609 H5'' DT B 19 -8.265 -1.310 12.892 1.00 0.08 H ATOM 610 H4' DT B 19 -7.675 0.905 12.525 1.00 0.05 H ATOM 611 H3' DT B 19 -8.272 -0.541 10.248 1.00 0.04 H ATOM 612 H2' DT B 19 -6.237 -0.817 9.343 1.00 0.02 H ATOM 613 H2'' DT B 19 -6.497 0.846 8.739 1.00 0.02 H ATOM 614 H1' DT B 19 -5.071 1.764 10.292 1.00 0.03 H ATOM 615 H3 DT B 19 -0.872 0.331 9.779 1.00 0.02 H ATOM 616 H71 DT B 19 -2.157 -4.120 9.826 1.00 0.04 H ATOM 617 H72 DT B 19 -3.932 -4.027 9.736 1.00 0.09 H ATOM 618 H73 DT B 19 -3.118 -4.016 11.317 1.00 0.08 H ATOM 619 H6 DT B 19 -5.035 -1.931 10.618 1.00 0.03 H ATOM 620 P DC B 20 -8.932 1.959 8.842 1.00 0.03 P ATOM 621 OP1 DC B 20 -10.384 2.185 8.999 1.00 0.04 O ATOM 622 OP2 DC B 20 -8.445 0.998 7.824 1.00 0.03 O ATOM 623 O5' DC B 20 -8.226 3.376 8.541 1.00 0.02 O ATOM 624 C5' DC B 20 -6.883 3.661 8.962 1.00 0.02 C ATOM 625 C4' DC B 20 -6.187 4.531 7.924 1.00 0.02 C ATOM 626 O4' DC B 20 -4.755 4.366 7.983 1.00 0.02 O ATOM 627 C3' DC B 20 -6.638 4.109 6.538 1.00 0.02 C ATOM 628 O3' DC B 20 -7.499 5.089 5.943 1.00 0.03 O ATOM 629 C2' DC B 20 -5.396 3.894 5.734 1.00 0.02 C ATOM 630 C1' DC B 20 -4.279 3.828 6.730 1.00 0.02 C ATOM 631 N1 DC B 20 -3.810 2.432 6.881 1.00 0.02 N ATOM 632 C2 DC B 20 -2.441 2.193 6.838 1.00 0.02 C ATOM 633 O2 DC B 20 -1.649 3.125 6.707 1.00 0.02 O ATOM 634 N3 DC B 20 -2.010 0.906 6.942 1.00 0.02 N ATOM 635 C4 DC B 20 -2.878 -0.104 7.083 1.00 0.02 C ATOM 636 N4 DC B 20 -2.420 -1.353 7.184 1.00 0.02 N ATOM 637 C5 DC B 20 -4.285 0.138 7.130 1.00 0.01 C ATOM 638 C6 DC B 20 -4.703 1.412 7.026 1.00 0.01 C ATOM 639 H5' DC B 20 -6.333 2.730 9.065 1.00 0.02 H ATOM 640 H5'' DC B 20 -6.895 4.179 9.921 1.00 0.02 H ATOM 641 H4' DC B 20 -6.440 5.579 8.091 1.00 0.02 H ATOM 642 H3' DC B 20 -7.156 3.162 6.613 1.00 0.02 H ATOM 643 H2' DC B 20 -5.446 2.958 5.204 1.00 0.02 H ATOM 644 H2'' DC B 20 -5.244 4.721 5.041 1.00 0.03 H ATOM 645 H1' DC B 20 -3.481 4.427 6.357 1.00 0.02 H ATOM 646 H41 DC B 20 -1.426 -1.531 7.151 1.00 0.02 H ATOM 647 H42 DC B 20 -3.067 -2.121 7.295 1.00 0.02 H ATOM 648 H5 DC B 20 -4.995 -0.681 7.250 1.00 0.02 H ATOM 649 H6 DC B 20 -5.768 1.636 7.045 1.00 0.02 H ATOM 650 P DC B 21 -8.004 4.939 4.416 1.00 0.03 P ATOM 651 OP1 DC B 21 -9.184 5.811 4.227 1.00 0.06 O ATOM 652 OP2 DC B 21 -8.093 3.496 4.093 1.00 0.05 O ATOM 653 O5' DC B 21 -6.773 5.565 3.590 1.00 0.05 O ATOM 654 C5' DC B 21 -6.215 6.821 3.987 1.00 0.05 C ATOM 655 C4' DC B 21 -4.768 6.974 3.527 1.00 0.04 C ATOM 656 O4' DC B 21 -3.988 5.831 3.938 1.00 0.06 O ATOM 657 C3' DC B 21 -4.673 7.073 2.012 1.00 0.04 C ATOM 658 O3' DC B 21 -3.716 8.082 1.649 1.00 0.08 O ATOM 659 C2' DC B 21 -4.228 5.702 1.560 1.00 0.05 C ATOM 660 C1' DC B 21 -3.514 5.119 2.776 1.00 0.05 C ATOM 661 N1 DC B 21 -3.757 3.661 2.911 1.00 0.04 N ATOM 662 C2 DC B 21 -2.645 2.831 3.026 1.00 0.06 C ATOM 663 O2 DC B 21 -1.509 3.304 3.032 1.00 0.07 O ATOM 664 N3 DC B 21 -2.849 1.490 3.144 1.00 0.06 N ATOM 665 C4 DC B 21 -4.087 0.978 3.149 1.00 0.04 C ATOM 666 N4 DC B 21 -4.249 -0.340 3.273 1.00 0.05 N ATOM 667 C5 DC B 21 -5.234 1.823 3.031 1.00 0.03 C ATOM 668 C6 DC B 21 -5.026 3.153 2.917 1.00 0.03 C ATOM 669 H5' DC B 21 -6.243 6.883 5.072 1.00 0.07 H ATOM 670 H5'' DC B 21 -6.814 7.629 3.567 1.00 0.07 H ATOM 671 H4' DC B 21 -4.342 7.872 3.973 1.00 0.05 H ATOM 672 H3' DC B 21 -5.652 7.316 1.587 1.00 0.06 H ATOM 673 H2' DC B 21 -5.094 5.094 1.300 1.00 0.06 H ATOM 674 H2'' DC B 21 -3.549 5.775 0.713 1.00 0.07 H ATOM 675 H1' DC B 21 -2.443 5.292 2.672 1.00 0.07 H ATOM 676 H41 DC B 21 -3.443 -0.943 3.356 1.00 0.07 H ATOM 677 H42 DC B 21 -5.178 -0.735 3.286 1.00 0.06 H ATOM 678 H5 DC B 21 -6.243 1.403 3.033 1.00 0.05 H ATOM 679 H6 DC B 21 -5.879 3.832 2.862 1.00 0.04 H ATOM 680 P DG B 22 -3.317 8.375 0.112 1.00 0.08 P ATOM 681 OP1 DG B 22 -3.537 9.814 -0.155 1.00 0.14 O ATOM 682 OP2 DG B 22 -3.964 7.359 -0.749 1.00 0.11 O ATOM 683 O5' DG B 22 -1.728 8.097 0.112 1.00 0.12 O ATOM 684 C5' DG B 22 -0.857 8.862 0.955 1.00 0.10 C ATOM 685 C4' DG B 22 0.597 8.388 0.874 1.00 0.12 C ATOM 686 O4' DG B 22 0.792 7.181 1.641 1.00 0.19 O ATOM 687 C3' DG B 22 0.997 8.094 -0.565 1.00 0.12 C ATOM 688 O3' DG B 22 1.862 9.110 -1.083 1.00 0.19 O ATOM 689 C2' DG B 22 1.690 6.754 -0.530 1.00 0.16 C ATOM 690 C1' DG B 22 1.251 6.119 0.779 1.00 0.16 C ATOM 691 N9 DG B 22 0.173 5.150 0.547 1.00 0.23 N ATOM 692 C8 DG B 22 -1.148 5.377 0.426 1.00 0.16 C ATOM 693 N7 DG B 22 -1.918 4.362 0.222 1.00 0.27 N ATOM 694 C5 DG B 22 -0.998 3.310 0.204 1.00 0.24 C ATOM 695 C6 DG B 22 -1.217 1.914 0.064 1.00 0.28 C ATOM 696 O6 DG B 22 -2.280 1.322 -0.113 1.00 0.38 O ATOM 697 N1 DG B 22 -0.027 1.202 0.155 1.00 0.28 N ATOM 698 C2 DG B 22 1.221 1.759 0.353 1.00 0.30 C ATOM 699 N2 DG B 22 2.246 0.909 0.407 1.00 0.24 N ATOM 700 N3 DG B 22 1.435 3.071 0.486 1.00 0.21 N ATOM 701 C4 DG B 22 0.290 3.786 0.402 1.00 0.27 C ATOM 702 H5' DG B 22 -1.199 8.766 1.984 1.00 0.15 H ATOM 703 H5'' DG B 22 -0.906 9.910 0.658 1.00 0.13 H ATOM 704 H4' DG B 22 1.251 9.170 1.272 1.00 0.18 H ATOM 705 H3' DG B 22 0.099 8.017 -1.184 1.00 0.16 H ATOM 706 HO3' DG B 22 1.388 9.944 -1.128 1.00 0.26 H ATOM 707 H2' DG B 22 1.398 6.138 -1.382 1.00 0.28 H ATOM 708 H2'' DG B 22 2.756 6.898 -0.522 1.00 0.22 H ATOM 709 H1' DG B 22 2.098 5.614 1.242 1.00 0.17 H ATOM 710 H8 DG B 22 -1.544 6.389 0.502 1.00 0.22 H ATOM 711 H1 DG B 22 -0.105 0.199 0.066 1.00 0.36 H ATOM 712 H21 DG B 22 2.085 -0.083 0.307 1.00 0.32 H ATOM 713 H22 DG B 22 3.184 1.256 0.546 1.00 0.33 H TER 714 DG B 22 CONECT 135 157 CONECT 157 135 158 159 160 CONECT 158 157 CONECT 159 157 CONECT 160 157 161 CONECT 161 160 162 185 186 CONECT 162 161 163 183 187 CONECT 163 162 164 CONECT 164 163 165 182 188 CONECT 165 164 166 181 CONECT 166 165 167 179 CONECT 167 166 168 CONECT 168 167 169 189 539 CONECT 169 168 170 538 539 CONECT 170 169 171 179 CONECT 171 170 172 190 CONECT 172 171 173 191 192 CONECT 173 172 174 175 193 CONECT 174 173 194 CONECT 175 173 176 177 195 CONECT 176 175 196 CONECT 177 175 178 197 198 CONECT 178 177 199 CONECT 179 166 170 180 CONECT 180 179 181 CONECT 181 165 180 200 CONECT 182 164 183 201 202 CONECT 183 162 182 184 203 CONECT 184 183 204 CONECT 185 161 CONECT 186 161 CONECT 187 162 CONECT 188 164 CONECT 189 168 CONECT 190 171 CONECT 191 172 CONECT 192 172 CONECT 193 173 CONECT 194 174 CONECT 195 175 CONECT 196 176 CONECT 197 177 CONECT 198 177 CONECT 199 178 CONECT 200 181 CONECT 201 182 CONECT 202 182 CONECT 203 183 CONECT 204 184 CONECT 538 169 CONECT 539 168 169 MASTER 110 0 1 0 0 0 0 6 712 2 51 2 END