USER MOD reduce.3.24.130724 H: found=0, std=0, add=199, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 199 hydrogens (0 hets) HEADER RNA 30-AUG-99 1C4L TITLE SOLUTION STRUCTURE OF AN RNA DUPLEX INCLUDING A C-U BASE- TITLE 2 PAIR COMPND MOL_ID: 1; COMPND 2 MOLECULE: RNA (5'-R(*CP*GP*AP*CP*UP*CP*AP*GP*G)-3'); COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: RNA (5'-R(*CP*CP*UP*GP*CP*GP*UP*CP*G)-3'); COMPND 7 CHAIN: B; COMPND 8 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THIS OLIGONUCLEOTIDE WAS CHEMICALLY SOURCE 4 SYNTHESIZED (PHOSPHORAMIDITE METHOD).; SOURCE 5 MOL_ID: 2; SOURCE 6 SYNTHETIC: YES; SOURCE 7 OTHER_DETAILS: THIS OLIGONUCLEOTIDE WAS CHEMICALLY SOURCE 8 SYNTHESIZED (PHOSPHORAMIDITE METHOD). KEYWDS C-U BASE PAIR, RNA EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR Y.TANAKA,C.KOJIMA,T.YAMAZAKI,T.S.KODAMA,K.YASUNO, AUTHOR 2 S.MIYASHITA,A.M.ONO,A.S.ONO,M.KAINOSHO,Y.KYOGOKU REVDAT 3 24-FEB-09 1C4L 1 VERSN REVDAT 2 01-APR-03 1C4L 1 JRNL REVDAT 1 09-AUG-00 1C4L 0 JRNL AUTH Y.TANAKA,C.KOJIMA,T.YAMAZAKI,T.S.KODAMA,K.YASUNO, JRNL AUTH 2 S.MIYASHITA,A.ONO,A.ONO,M.KAINOSHO,Y.KYOGOKU JRNL TITL SOLUTION STRUCTURE OF AN RNA DUPLEX INCLUDING A JRNL TITL 2 C-U BASE PAIR. JRNL REF BIOCHEMISTRY V. 39 7074 2000 JRNL REFN ISSN 0006-2960 JRNL PMID 10852704 JRNL DOI 10.1021/BI000018M REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH Y.TANAKA,C.KOJIMA,T.YAMAZAKI,Y.KYOGOKU,S.MIYASHITA, REMARK 1 AUTH 2 A.S.ONO,M.KAINOSHO REMARK 1 TITL STRUCTURE MODEL AND PHYSICOCHEMICAL PROPERTIES OF REMARK 1 TITL 2 THE C-U MISMATCH PAIR IN THE DOUBLE STRANDED RNA REMARK 1 TITL 3 IN SOLUTION REMARK 1 REF NUCLEIC ACIDS SYMP.SER. V. 37 271 1997 REMARK 1 REFN ISSN 0261-3166 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851, X-PLOR 3.8.1 REMARK 3 AUTHORS : BRUNGER (X-PLOR), BRUNGER (X-PLOR) REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: DISTANCE CONSTRAINTS (NOE 433, REMARK 3 HYDROGEN BOND (BASE-PAIR) 54), DIHEDRAL ANGLE CONSTRAINTS 45 REMARK 4 REMARK 4 1C4L COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 30-AUG-99. REMARK 100 THE RCSB ID CODE IS RCSB001298. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 300; 278 REMARK 210 PH : 7.0; 7.0 REMARK 210 IONIC STRENGTH : 50MM(NACL); 50MM(NACL) REMARK 210 PRESSURE : 1 ATM; 1 ATM REMARK 210 SAMPLE CONTENTS : R[CGACUCAGG]_R[CCUG(15N4) REMARK 210 CGUCG] (AMINO-NITROGEN OF CYTIDINE IS POINT-LABELED (> 95%)); REMARK 210 R[CGACUCAGG]_R[CCUG(15N4)CGUCG] (AMINO-NITROGEN OF CYTIDINE IS REMARK 210 POINT-LABELED (> 95%)) REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D_1H_NOESY, 2D_PCOSY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ, 500 MHZ REMARK 210 SPECTROMETER MODEL : DRX, ARX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR 3.851, X-PLOR 3.8.1 REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 50 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : SUMMATION OF TOTAL ENERGY REMARK 210 (COVALENT GEOMETRY, NON-BOND REMARK 210 ENERGY, DISTANCE AND DIHEDRAL REMARK 210 ANGLE CONSTRAINTS) 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 G A 2 N7 - C8 - N9 ANGL. DEV. = 4.2 DEGREES REMARK 500 G A 2 C8 - N9 - C4 ANGL. DEV. = -2.7 DEGREES REMARK 500 A A 3 N7 - C8 - N9 ANGL. DEV. = 3.6 DEGREES REMARK 500 A A 7 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 A A 7 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 G A 8 N7 - C8 - N9 ANGL. DEV. = 4.4 DEGREES REMARK 500 G A 8 C8 - N9 - C4 ANGL. DEV. = -2.9 DEGREES REMARK 500 G A 9 N7 - C8 - N9 ANGL. DEV. = 4.4 DEGREES REMARK 500 G A 9 C8 - N9 - C4 ANGL. DEV. = -2.9 DEGREES REMARK 500 G B 13 N7 - C8 - N9 ANGL. DEV. = 4.3 DEGREES REMARK 500 G B 13 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES REMARK 500 G B 15 N7 - C8 - N9 ANGL. DEV. = 4.1 DEGREES REMARK 500 G B 15 C8 - N9 - C4 ANGL. DEV. = -2.7 DEGREES REMARK 500 G B 18 N7 - C8 - N9 ANGL. DEV. = 4.5 DEGREES REMARK 500 G B 18 C8 - N9 - C4 ANGL. DEV. = -2.8 DEGREES REMARK 500 REMARK 500 REMARK: NULL DBREF 1C4L A 1 9 PDB 1C4L 1C4L 1 9 DBREF 1C4L B 10 18 PDB 1C4L 1C4L 10 18 SEQRES 1 A 9 C G A C U C A G G SEQRES 1 B 9 C C U G C G U C G 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 C O2' : rot -134:sc= 1.12 USER MOD Single : A 1 C O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -160:sc= -3.32! USER MOD Single : A 3 A O2' : rot -140:sc= 1.24 USER MOD Single : A 4 C O2' : rot -19:sc= 0.271 USER MOD Single : A 5 U O2' : rot -12:sc= -2.64! USER MOD Single : A 6 C O2' : rot -121:sc= -0.049 USER MOD Single : A 7 A O2' : rot -119:sc= 1.21 USER MOD Single : A 8 G O2' : rot 180:sc= -2.54! USER MOD Single : A 9 G O2' : rot -10:sc= 0.37 USER MOD Single : A 9 G O3' : rot 180:sc= 0.302 USER MOD Single : B 10 C O2' : rot -122:sc= 0.745 USER MOD Single : B 10 C O5' : rot 180:sc= 0 USER MOD Single : B 11 C O2' : rot -170:sc= -0.964 USER MOD Single : B 12 U O2' : rot -92:sc= 1.27 USER MOD Single : B 13 G O2' : rot -97:sc= 0.848 USER MOD Single : B 14 C O2' : rot 0:sc= -1.57! USER MOD Single : B 15 G O2' : rot -6:sc= 0.387 USER MOD Single : B 16 U O2' : rot -63:sc= 0.561 USER MOD Single : B 17 C O2' : rot -122:sc= 1.23 USER MOD Single : B 18 G O2' : rot -11:sc= 0.301 USER MOD Single : B 18 G O3' : rot 180:sc= 0.256 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 1 -12.259 0.937 8.278 1.00 0.00 O ATOM 2 C5' C A 1 -11.261 1.099 9.289 1.00 0.00 C ATOM 3 C4' C A 1 -10.791 2.548 9.386 1.00 0.00 C ATOM 4 O4' C A 1 -9.784 2.707 10.397 1.00 0.00 O ATOM 5 C3' C A 1 -10.199 3.029 8.070 1.00 0.00 C ATOM 6 O3' C A 1 -11.167 3.783 7.329 1.00 0.00 O ATOM 7 C2' C A 1 -9.009 3.884 8.457 1.00 0.00 C ATOM 8 O2' C A 1 -9.286 5.275 8.265 1.00 0.00 O ATOM 9 C1' C A 1 -8.751 3.593 9.929 1.00 0.00 C ATOM 10 N1 C A 1 -7.409 3.005 10.137 1.00 0.00 N ATOM 11 C2 C A 1 -6.408 3.840 10.610 1.00 0.00 C ATOM 12 O2 C A 1 -6.643 5.022 10.836 1.00 0.00 O ATOM 13 N3 C A 1 -5.173 3.317 10.814 1.00 0.00 N ATOM 14 C4 C A 1 -4.927 2.029 10.564 1.00 0.00 C ATOM 15 N4 C A 1 -3.713 1.544 10.771 1.00 0.00 N ATOM 16 C5 C A 1 -5.947 1.160 10.077 1.00 0.00 C ATOM 17 C6 C A 1 -7.165 1.687 9.879 1.00 0.00 C ATOM 0 H5' C A 1 -10.411 0.454 9.069 1.00 0.00 H new ATOM 0 H5'' C A 1 -11.662 0.780 10.251 1.00 0.00 H new ATOM 0 H4' C A 1 -11.673 3.137 9.639 1.00 0.00 H new ATOM 0 H3' C A 1 -9.901 2.202 7.425 1.00 0.00 H new ATOM 0 H2' C A 1 -8.142 3.652 7.838 1.00 0.00 H new ATOM 0 HO2' C A 1 -8.528 5.700 7.813 1.00 0.00 H new ATOM 0 HO5' C A 1 -12.537 -0.002 8.240 1.00 0.00 H new ATOM 0 H1' C A 1 -8.773 4.523 10.496 1.00 0.00 H new ATOM 0 H41 C A 1 -3.518 0.561 10.582 1.00 0.00 H new ATOM 0 H42 C A 1 -2.973 2.153 11.119 1.00 0.00 H new ATOM 0 H5 C A 1 -5.747 0.118 9.875 1.00 0.00 H new ATOM 0 H6 C A 1 -7.963 1.060 9.510 1.00 0.00 H new ATOM 30 P G A 2 -10.985 4.045 5.749 1.00 0.00 P ATOM 31 OP1 G A 2 -12.317 4.343 5.177 1.00 0.00 O ATOM 32 OP2 G A 2 -10.171 2.946 5.183 1.00 0.00 O ATOM 33 O5' G A 2 -10.113 5.401 5.719 1.00 0.00 O ATOM 34 C5' G A 2 -8.875 5.462 5.005 1.00 0.00 C ATOM 35 C4' G A 2 -8.074 6.709 5.372 1.00 0.00 C ATOM 36 O4' G A 2 -7.533 6.624 6.704 1.00 0.00 O ATOM 37 C3' G A 2 -6.902 6.909 4.426 1.00 0.00 C ATOM 38 O3' G A 2 -7.238 7.795 3.352 1.00 0.00 O ATOM 39 C2' G A 2 -5.811 7.481 5.299 1.00 0.00 C ATOM 40 O2' G A 2 -5.833 8.912 5.285 1.00 0.00 O ATOM 41 C1' G A 2 -6.133 6.970 6.688 1.00 0.00 C ATOM 42 N9 G A 2 -5.307 5.794 7.006 1.00 0.00 N ATOM 43 C8 G A 2 -5.613 4.474 6.907 1.00 0.00 C ATOM 44 N7 G A 2 -4.696 3.625 7.244 1.00 0.00 N ATOM 45 C5 G A 2 -3.650 4.473 7.614 1.00 0.00 C ATOM 46 C6 G A 2 -2.352 4.151 8.083 1.00 0.00 C ATOM 47 O6 G A 2 -1.879 3.042 8.286 1.00 0.00 O ATOM 48 N1 G A 2 -1.593 5.284 8.338 1.00 0.00 N ATOM 49 C2 G A 2 -2.041 6.583 8.166 1.00 0.00 C ATOM 50 N2 G A 2 -1.186 7.561 8.457 1.00 0.00 N ATOM 51 N3 G A 2 -3.266 6.892 7.729 1.00 0.00 N ATOM 52 C4 G A 2 -4.013 5.795 7.472 1.00 0.00 C ATOM 0 H5' G A 2 -9.072 5.458 3.933 1.00 0.00 H new ATOM 0 H5'' G A 2 -8.284 4.572 5.223 1.00 0.00 H new ATOM 0 H4' G A 2 -8.772 7.543 5.303 1.00 0.00 H new ATOM 0 H3' G A 2 -6.598 5.981 3.942 1.00 0.00 H new ATOM 0 H2' G A 2 -4.820 7.185 4.956 1.00 0.00 H new ATOM 0 HO2' G A 2 -4.963 9.255 5.578 1.00 0.00 H new ATOM 0 H1' G A 2 -5.919 7.732 7.437 1.00 0.00 H new ATOM 0 H8 G A 2 -6.582 4.146 6.561 1.00 0.00 H new ATOM 0 H1 G A 2 -0.640 5.151 8.675 1.00 0.00 H new ATOM 0 H21 G A 2 -1.468 8.535 8.347 1.00 0.00 H new ATOM 0 H22 G A 2 -0.248 7.336 8.790 1.00 0.00 H new ATOM 64 P A A 3 -6.361 7.822 2.000 1.00 0.00 P ATOM 65 OP1 A A 3 -6.920 8.860 1.106 1.00 0.00 O ATOM 66 OP2 A A 3 -6.218 6.432 1.514 1.00 0.00 O ATOM 67 O5' A A 3 -4.920 8.322 2.521 1.00 0.00 O ATOM 68 C5' A A 3 -4.701 9.693 2.869 1.00 0.00 C ATOM 69 C4' A A 3 -3.235 9.964 3.192 1.00 0.00 C ATOM 70 O4' A A 3 -2.792 9.237 4.350 1.00 0.00 O ATOM 71 C3' A A 3 -2.344 9.553 2.035 1.00 0.00 C ATOM 72 O3' A A 3 -2.066 10.677 1.191 1.00 0.00 O ATOM 73 C2' A A 3 -1.088 9.015 2.682 1.00 0.00 C ATOM 74 O2' A A 3 -0.046 9.997 2.679 1.00 0.00 O ATOM 75 C1' A A 3 -1.492 8.666 4.105 1.00 0.00 C ATOM 76 N9 A A 3 -1.519 7.207 4.300 1.00 0.00 N ATOM 77 C8 A A 3 -2.514 6.316 4.058 1.00 0.00 C ATOM 78 N7 A A 3 -2.281 5.071 4.337 1.00 0.00 N ATOM 79 C5 A A 3 -0.974 5.138 4.823 1.00 0.00 C ATOM 80 C6 A A 3 -0.087 4.167 5.309 1.00 0.00 C ATOM 81 N6 A A 3 -0.386 2.871 5.398 1.00 0.00 N ATOM 82 N1 A A 3 1.122 4.586 5.704 1.00 0.00 N ATOM 83 C2 A A 3 1.456 5.868 5.634 1.00 0.00 C ATOM 84 N3 A A 3 0.707 6.867 5.197 1.00 0.00 N ATOM 85 C4 A A 3 -0.507 6.430 4.803 1.00 0.00 C ATOM 0 H5' A A 3 -5.318 9.953 3.729 1.00 0.00 H new ATOM 0 H5'' A A 3 -5.017 10.333 2.045 1.00 0.00 H new ATOM 0 H4' A A 3 -3.162 11.035 3.381 1.00 0.00 H new ATOM 0 H3' A A 3 -2.811 8.806 1.393 1.00 0.00 H new ATOM 0 H2' A A 3 -0.696 8.152 2.144 1.00 0.00 H new ATOM 0 HO2' A A 3 0.809 9.566 2.471 1.00 0.00 H new ATOM 0 H1' A A 3 -0.765 9.071 4.809 1.00 0.00 H new ATOM 0 H8 A A 3 -3.463 6.631 3.649 1.00 0.00 H new ATOM 0 H61 A A 3 0.303 2.212 5.761 1.00 0.00 H new ATOM 0 H62 A A 3 -1.304 2.538 5.103 1.00 0.00 H new ATOM 0 H2 A A 3 2.449 6.124 5.971 1.00 0.00 H new ATOM 97 P C A 4 -2.026 10.533 -0.413 1.00 0.00 P ATOM 98 OP1 C A 4 -2.395 11.840 -1.001 1.00 0.00 O ATOM 99 OP2 C A 4 -2.777 9.316 -0.796 1.00 0.00 O ATOM 100 O5' C A 4 -0.461 10.280 -0.695 1.00 0.00 O ATOM 101 C5' C A 4 0.107 8.978 -0.532 1.00 0.00 C ATOM 102 C4' C A 4 1.540 9.051 -0.006 1.00 0.00 C ATOM 103 O4' C A 4 1.657 8.506 1.323 1.00 0.00 O ATOM 104 C3' C A 4 2.488 8.272 -0.900 1.00 0.00 C ATOM 105 O3' C A 4 3.131 9.137 -1.844 1.00 0.00 O ATOM 106 C2' C A 4 3.482 7.648 0.053 1.00 0.00 C ATOM 107 O2' C A 4 4.653 8.461 0.177 1.00 0.00 O ATOM 108 C1' C A 4 2.747 7.563 1.382 1.00 0.00 C ATOM 109 N1 C A 4 2.228 6.199 1.636 1.00 0.00 N ATOM 110 C2 C A 4 3.107 5.241 2.126 1.00 0.00 C ATOM 111 O2 C A 4 4.285 5.514 2.333 1.00 0.00 O ATOM 112 N3 C A 4 2.628 3.997 2.371 1.00 0.00 N ATOM 113 C4 C A 4 1.346 3.701 2.146 1.00 0.00 C ATOM 114 N4 C A 4 0.905 2.482 2.400 1.00 0.00 N ATOM 115 C5 C A 4 0.436 4.674 1.644 1.00 0.00 C ATOM 116 C6 C A 4 0.917 5.901 1.405 1.00 0.00 C ATOM 0 H5' C A 4 0.096 8.453 -1.487 1.00 0.00 H new ATOM 0 H5'' C A 4 -0.505 8.397 0.158 1.00 0.00 H new ATOM 0 H4' C A 4 1.801 10.109 0.006 1.00 0.00 H new ATOM 0 H3' C A 4 1.973 7.520 -1.498 1.00 0.00 H new ATOM 0 H2' C A 4 3.822 6.673 -0.295 1.00 0.00 H new ATOM 0 HO2' C A 4 4.704 9.079 -0.582 1.00 0.00 H new ATOM 0 H1' C A 4 3.431 7.795 2.198 1.00 0.00 H new ATOM 0 H41 C A 4 -0.073 2.248 2.231 1.00 0.00 H new ATOM 0 H42 C A 4 1.543 1.775 2.765 1.00 0.00 H new ATOM 0 H5 C A 4 -0.601 4.432 1.463 1.00 0.00 H new ATOM 0 H6 C A 4 0.257 6.666 1.024 1.00 0.00 H new ATOM 128 P U A 5 2.599 9.227 -3.361 1.00 0.00 P ATOM 129 OP1 U A 5 3.711 9.701 -4.216 1.00 0.00 O ATOM 130 OP2 U A 5 1.311 9.956 -3.358 1.00 0.00 O ATOM 131 O5' U A 5 2.300 7.680 -3.708 1.00 0.00 O ATOM 132 C5' U A 5 3.238 6.872 -4.428 1.00 0.00 C ATOM 133 C4' U A 5 4.643 6.936 -3.830 1.00 0.00 C ATOM 134 O4' U A 5 4.646 6.614 -2.428 1.00 0.00 O ATOM 135 C3' U A 5 5.578 5.959 -4.521 1.00 0.00 C ATOM 136 O3' U A 5 6.337 6.609 -5.547 1.00 0.00 O ATOM 137 C2' U A 5 6.475 5.439 -3.420 1.00 0.00 C ATOM 138 O2' U A 5 7.746 6.096 -3.438 1.00 0.00 O ATOM 139 C1' U A 5 5.746 5.736 -2.119 1.00 0.00 C ATOM 140 N1 U A 5 5.273 4.492 -1.470 1.00 0.00 N ATOM 141 C2 U A 5 6.221 3.555 -1.083 1.00 0.00 C ATOM 142 O2 U A 5 7.430 3.726 -1.231 1.00 0.00 O ATOM 143 N3 U A 5 5.727 2.401 -0.503 1.00 0.00 N ATOM 144 C4 U A 5 4.394 2.106 -0.280 1.00 0.00 C ATOM 145 O4 U A 5 4.072 1.045 0.234 1.00 0.00 O ATOM 146 C5 U A 5 3.479 3.135 -0.709 1.00 0.00 C ATOM 147 C6 U A 5 3.936 4.273 -1.276 1.00 0.00 C ATOM 0 H5' U A 5 3.273 7.200 -5.467 1.00 0.00 H new ATOM 0 H5'' U A 5 2.895 5.838 -4.432 1.00 0.00 H new ATOM 0 H4' U A 5 4.983 7.961 -3.975 1.00 0.00 H new ATOM 0 H3' U A 5 5.036 5.155 -5.019 1.00 0.00 H new ATOM 0 H2' U A 5 6.672 4.374 -3.543 1.00 0.00 H new ATOM 0 HO2' U A 5 7.839 6.606 -4.269 1.00 0.00 H new ATOM 0 H1' U A 5 6.423 6.214 -1.411 1.00 0.00 H new ATOM 0 H3 U A 5 6.410 1.701 -0.212 1.00 0.00 H new ATOM 0 H5 U A 5 2.417 2.994 -0.576 1.00 0.00 H new ATOM 0 H6 U A 5 3.229 5.029 -1.584 1.00 0.00 H new ATOM 158 P C A 6 6.951 5.767 -6.775 1.00 0.00 P ATOM 159 OP1 C A 6 8.188 6.444 -7.227 1.00 0.00 O ATOM 160 OP2 C A 6 5.863 5.501 -7.743 1.00 0.00 O ATOM 161 O5' C A 6 7.359 4.370 -6.082 1.00 0.00 O ATOM 162 C5' C A 6 8.636 4.201 -5.458 1.00 0.00 C ATOM 163 C4' C A 6 8.927 2.737 -5.142 1.00 0.00 C ATOM 164 O4' C A 6 8.340 2.311 -3.899 1.00 0.00 O ATOM 165 C3' C A 6 8.369 1.822 -6.214 1.00 0.00 C ATOM 166 O3' C A 6 9.304 1.635 -7.282 1.00 0.00 O ATOM 167 C2' C A 6 8.082 0.536 -5.481 1.00 0.00 C ATOM 168 O2' C A 6 9.170 -0.386 -5.590 1.00 0.00 O ATOM 169 C1' C A 6 7.868 0.953 -4.036 1.00 0.00 C ATOM 170 N1 C A 6 6.434 0.824 -3.712 1.00 0.00 N ATOM 171 C2 C A 6 6.009 -0.358 -3.121 1.00 0.00 C ATOM 172 O2 C A 6 6.814 -1.233 -2.829 1.00 0.00 O ATOM 173 N3 C A 6 4.685 -0.521 -2.880 1.00 0.00 N ATOM 174 C4 C A 6 3.810 0.428 -3.204 1.00 0.00 C ATOM 175 N4 C A 6 2.515 0.264 -2.959 1.00 0.00 N ATOM 176 C5 C A 6 4.238 1.635 -3.807 1.00 0.00 C ATOM 177 C6 C A 6 5.545 1.805 -4.041 1.00 0.00 C ATOM 0 H5' C A 6 8.670 4.784 -4.538 1.00 0.00 H new ATOM 0 H5'' C A 6 9.414 4.592 -6.113 1.00 0.00 H new ATOM 0 H4' C A 6 10.013 2.670 -5.085 1.00 0.00 H new ATOM 0 H3' C A 6 7.479 2.229 -6.693 1.00 0.00 H new ATOM 0 H2' C A 6 7.216 0.020 -5.897 1.00 0.00 H new ATOM 0 HO2' C A 6 8.854 -1.217 -6.002 1.00 0.00 H new ATOM 0 H1' C A 6 8.419 0.321 -3.340 1.00 0.00 H new ATOM 0 H41 C A 6 1.852 0.997 -3.211 1.00 0.00 H new ATOM 0 H42 C A 6 2.184 -0.595 -2.519 1.00 0.00 H new ATOM 0 H5 C A 6 3.526 2.402 -4.073 1.00 0.00 H new ATOM 0 H6 C A 6 5.897 2.721 -4.492 1.00 0.00 H new ATOM 189 P A A 7 8.797 1.280 -8.770 1.00 0.00 P ATOM 190 OP1 A A 7 9.853 1.685 -9.726 1.00 0.00 O ATOM 191 OP2 A A 7 7.420 1.798 -8.930 1.00 0.00 O ATOM 192 O5' A A 7 8.731 -0.328 -8.741 1.00 0.00 O ATOM 193 C5' A A 7 9.894 -1.107 -8.442 1.00 0.00 C ATOM 194 C4' A A 7 9.551 -2.586 -8.289 1.00 0.00 C ATOM 195 O4' A A 7 8.747 -2.819 -7.120 1.00 0.00 O ATOM 196 C3' A A 7 8.777 -3.098 -9.493 1.00 0.00 C ATOM 197 O3' A A 7 9.642 -3.797 -10.396 1.00 0.00 O ATOM 198 C2' A A 7 7.717 -4.014 -8.921 1.00 0.00 C ATOM 199 O2' A A 7 8.081 -5.388 -9.082 1.00 0.00 O ATOM 200 C1' A A 7 7.621 -3.655 -7.445 1.00 0.00 C ATOM 201 N9 A A 7 6.358 -2.955 -7.148 1.00 0.00 N ATOM 202 C8 A A 7 6.059 -1.630 -7.206 1.00 0.00 C ATOM 203 N7 A A 7 4.859 -1.272 -6.877 1.00 0.00 N ATOM 204 C5 A A 7 4.284 -2.502 -6.560 1.00 0.00 C ATOM 205 C6 A A 7 3.004 -2.864 -6.126 1.00 0.00 C ATOM 206 N6 A A 7 2.023 -1.986 -5.921 1.00 0.00 N ATOM 207 N1 A A 7 2.777 -4.166 -5.909 1.00 0.00 N ATOM 208 C2 A A 7 3.734 -5.065 -6.101 1.00 0.00 C ATOM 209 N3 A A 7 4.974 -4.842 -6.509 1.00 0.00 N ATOM 210 C4 A A 7 5.185 -3.526 -6.722 1.00 0.00 C ATOM 0 H5' A A 7 10.352 -0.741 -7.523 1.00 0.00 H new ATOM 0 H5'' A A 7 10.630 -0.983 -9.236 1.00 0.00 H new ATOM 0 H4' A A 7 10.500 -3.115 -8.200 1.00 0.00 H new ATOM 0 H3' A A 7 8.335 -2.287 -10.072 1.00 0.00 H new ATOM 0 H2' A A 7 6.763 -3.886 -9.433 1.00 0.00 H new ATOM 0 HO2' A A 7 7.409 -5.842 -9.632 1.00 0.00 H new ATOM 0 H1' A A 7 7.634 -4.564 -6.843 1.00 0.00 H new ATOM 0 H8 A A 7 6.795 -0.903 -7.515 1.00 0.00 H new ATOM 0 H61 A A 7 1.109 -2.308 -5.604 1.00 0.00 H new ATOM 0 H62 A A 7 2.187 -0.992 -6.081 1.00 0.00 H new ATOM 0 H2 A A 7 3.472 -6.094 -5.902 1.00 0.00 H new ATOM 222 P G A 8 9.276 -3.927 -11.960 1.00 0.00 P ATOM 223 OP1 G A 8 10.540 -4.064 -12.717 1.00 0.00 O ATOM 224 OP2 G A 8 8.323 -2.848 -12.309 1.00 0.00 O ATOM 225 O5' G A 8 8.502 -5.338 -12.018 1.00 0.00 O ATOM 226 C5' G A 8 7.145 -5.423 -12.462 1.00 0.00 C ATOM 227 C4' G A 8 6.425 -6.602 -11.814 1.00 0.00 C ATOM 228 O4' G A 8 6.003 -6.285 -10.477 1.00 0.00 O ATOM 229 C3' G A 8 5.191 -7.013 -12.602 1.00 0.00 C ATOM 230 O3' G A 8 5.478 -8.130 -13.451 1.00 0.00 O ATOM 231 C2' G A 8 4.163 -7.363 -11.552 1.00 0.00 C ATOM 232 O2' G A 8 4.089 -8.777 -11.344 1.00 0.00 O ATOM 233 C1' G A 8 4.627 -6.662 -10.288 1.00 0.00 C ATOM 234 N9 G A 8 3.801 -5.470 -10.011 1.00 0.00 N ATOM 235 C8 G A 8 4.107 -4.151 -10.155 1.00 0.00 C ATOM 236 N7 G A 8 3.199 -3.289 -9.836 1.00 0.00 N ATOM 237 C5 G A 8 2.159 -4.120 -9.428 1.00 0.00 C ATOM 238 C6 G A 8 0.873 -3.773 -8.953 1.00 0.00 C ATOM 239 O6 G A 8 0.399 -2.654 -8.807 1.00 0.00 O ATOM 240 N1 G A 8 0.120 -4.892 -8.643 1.00 0.00 N ATOM 241 C2 G A 8 0.548 -6.194 -8.777 1.00 0.00 C ATOM 242 N2 G A 8 -0.330 -7.135 -8.439 1.00 0.00 N ATOM 243 N3 G A 8 1.761 -6.534 -9.225 1.00 0.00 N ATOM 244 C4 G A 8 2.512 -5.450 -9.530 1.00 0.00 C ATOM 0 H5' G A 8 7.121 -5.530 -13.546 1.00 0.00 H new ATOM 0 H5'' G A 8 6.622 -4.497 -12.221 1.00 0.00 H new ATOM 0 H4' G A 8 7.143 -7.422 -11.800 1.00 0.00 H new ATOM 0 H3' G A 8 4.838 -6.222 -13.264 1.00 0.00 H new ATOM 0 H2' G A 8 3.164 -7.048 -11.854 1.00 0.00 H new ATOM 0 HO2' G A 8 3.416 -8.972 -10.659 1.00 0.00 H new ATOM 0 H1' G A 8 4.527 -7.331 -9.433 1.00 0.00 H new ATOM 0 H8 G A 8 5.073 -3.837 -10.522 1.00 0.00 H new ATOM 0 H1 G A 8 -0.824 -4.741 -8.288 1.00 0.00 H new ATOM 0 H21 G A 8 -0.076 -8.120 -8.515 1.00 0.00 H new ATOM 0 H22 G A 8 -1.257 -6.871 -8.104 1.00 0.00 H new ATOM 256 P G A 9 4.734 -8.298 -14.869 1.00 0.00 P ATOM 257 OP1 G A 9 5.387 -9.403 -15.606 1.00 0.00 O ATOM 258 OP2 G A 9 4.617 -6.962 -15.496 1.00 0.00 O ATOM 259 O5' G A 9 3.261 -8.779 -14.433 1.00 0.00 O ATOM 260 C5' G A 9 3.068 -10.038 -13.782 1.00 0.00 C ATOM 261 C4' G A 9 1.590 -10.328 -13.538 1.00 0.00 C ATOM 262 O4' G A 9 1.092 -9.590 -12.409 1.00 0.00 O ATOM 263 C3' G A 9 0.750 -9.940 -14.744 1.00 0.00 C ATOM 264 O3' G A 9 0.476 -11.079 -15.566 1.00 0.00 O ATOM 265 C2' G A 9 -0.528 -9.361 -14.160 1.00 0.00 C ATOM 266 O2' G A 9 -1.574 -10.338 -14.174 1.00 0.00 O ATOM 267 C1' G A 9 -0.177 -8.988 -12.727 1.00 0.00 C ATOM 268 N9 G A 9 -0.120 -7.521 -12.590 1.00 0.00 N ATOM 269 C8 G A 9 0.903 -6.659 -12.840 1.00 0.00 C ATOM 270 N7 G A 9 0.681 -5.398 -12.653 1.00 0.00 N ATOM 271 C5 G A 9 -0.646 -5.410 -12.226 1.00 0.00 C ATOM 272 C6 G A 9 -1.483 -4.327 -11.856 1.00 0.00 C ATOM 273 O6 G A 9 -1.212 -3.133 -11.831 1.00 0.00 O ATOM 274 N1 G A 9 -2.747 -4.759 -11.489 1.00 0.00 N ATOM 275 C2 G A 9 -3.160 -6.074 -11.477 1.00 0.00 C ATOM 276 N2 G A 9 -4.413 -6.297 -11.096 1.00 0.00 N ATOM 277 N3 G A 9 -2.379 -7.100 -11.822 1.00 0.00 N ATOM 278 C4 G A 9 -1.141 -6.697 -12.184 1.00 0.00 C ATOM 0 H5' G A 9 3.601 -10.041 -12.831 1.00 0.00 H new ATOM 0 H5'' G A 9 3.499 -10.832 -14.392 1.00 0.00 H new ATOM 0 H4' G A 9 1.512 -11.399 -13.350 1.00 0.00 H new ATOM 0 H3' G A 9 1.262 -9.225 -15.388 1.00 0.00 H new ATOM 0 H2' G A 9 -0.885 -8.505 -14.733 1.00 0.00 H new ATOM 0 HO2' G A 9 -1.292 -11.111 -14.706 1.00 0.00 H new ATOM 0 HO3' G A 9 -0.067 -10.805 -16.334 1.00 0.00 H new ATOM 0 H1' G A 9 -0.936 -9.353 -12.035 1.00 0.00 H new ATOM 0 H8 G A 9 1.864 -7.014 -13.182 1.00 0.00 H new ATOM 0 H1 G A 9 -3.424 -4.050 -11.206 1.00 0.00 H new ATOM 0 H21 G A 9 -4.775 -7.250 -11.067 1.00 0.00 H new ATOM 0 H22 G A 9 -5.013 -5.515 -10.832 1.00 0.00 H new TER 291 G A 9 ATOM 292 O5' C B 10 -11.364 0.394 -7.469 1.00 0.00 O ATOM 293 C5' C B 10 -10.477 0.220 -8.577 1.00 0.00 C ATOM 294 C4' C B 10 -10.126 -1.251 -8.789 1.00 0.00 C ATOM 295 O4' C B 10 -9.241 -1.425 -9.906 1.00 0.00 O ATOM 296 C3' C B 10 -9.438 -1.837 -7.565 1.00 0.00 C ATOM 297 O3' C B 10 -10.374 -2.582 -6.775 1.00 0.00 O ATOM 298 C2' C B 10 -8.341 -2.730 -8.110 1.00 0.00 C ATOM 299 O2' C B 10 -8.638 -4.113 -7.897 1.00 0.00 O ATOM 300 C1' C B 10 -8.261 -2.431 -9.599 1.00 0.00 C ATOM 301 N1 C B 10 -6.900 -2.003 -9.994 1.00 0.00 N ATOM 302 C2 C B 10 -6.023 -2.985 -10.427 1.00 0.00 C ATOM 303 O2 C B 10 -6.376 -4.158 -10.464 1.00 0.00 O ATOM 304 N3 C B 10 -4.774 -2.616 -10.803 1.00 0.00 N ATOM 305 C4 C B 10 -4.398 -1.335 -10.758 1.00 0.00 C ATOM 306 N4 C B 10 -3.173 -1.003 -11.133 1.00 0.00 N ATOM 307 C5 C B 10 -5.290 -0.316 -10.313 1.00 0.00 C ATOM 308 C6 C B 10 -6.523 -0.692 -9.943 1.00 0.00 C ATOM 0 H5' C B 10 -9.565 0.792 -8.407 1.00 0.00 H new ATOM 0 H5'' C B 10 -10.939 0.618 -9.480 1.00 0.00 H new ATOM 0 H4' C B 10 -11.069 -1.765 -8.975 1.00 0.00 H new ATOM 0 H3' C B 10 -9.031 -1.065 -6.911 1.00 0.00 H new ATOM 0 H2' C B 10 -7.396 -2.535 -7.604 1.00 0.00 H new ATOM 0 HO2' C B 10 -7.916 -4.527 -7.380 1.00 0.00 H new ATOM 0 HO5' C B 10 -11.568 1.346 -7.359 1.00 0.00 H new ATOM 0 H1' C B 10 -8.472 -3.336 -10.169 1.00 0.00 H new ATOM 0 H41 C B 10 -2.877 -0.027 -11.102 1.00 0.00 H new ATOM 0 H42 C B 10 -2.525 -1.723 -11.453 1.00 0.00 H new ATOM 0 H5 C B 10 -4.985 0.719 -10.275 1.00 0.00 H new ATOM 0 H6 C B 10 -7.227 0.052 -9.600 1.00 0.00 H new ATOM 321 P C B 11 -10.037 -3.000 -5.256 1.00 0.00 P ATOM 322 OP1 C B 11 -11.316 -3.159 -4.529 1.00 0.00 O ATOM 323 OP2 C B 11 -9.003 -2.076 -4.735 1.00 0.00 O ATOM 324 O5' C B 11 -9.375 -4.459 -5.433 1.00 0.00 O ATOM 325 C5' C B 11 -8.257 -4.857 -4.635 1.00 0.00 C ATOM 326 C4' C B 11 -7.559 -6.092 -5.200 1.00 0.00 C ATOM 327 O4' C B 11 -7.074 -5.875 -6.539 1.00 0.00 O ATOM 328 C3' C B 11 -6.364 -6.476 -4.346 1.00 0.00 C ATOM 329 O3' C B 11 -6.711 -7.486 -3.392 1.00 0.00 O ATOM 330 C2' C B 11 -5.332 -6.969 -5.331 1.00 0.00 C ATOM 331 O2' C B 11 -5.363 -8.394 -5.448 1.00 0.00 O ATOM 332 C1' C B 11 -5.704 -6.318 -6.649 1.00 0.00 C ATOM 333 N1 C B 11 -4.809 -5.176 -6.947 1.00 0.00 N ATOM 334 C2 C B 11 -3.558 -5.438 -7.495 1.00 0.00 C ATOM 335 O2 C B 11 -3.200 -6.588 -7.725 1.00 0.00 O ATOM 336 N3 C B 11 -2.743 -4.386 -7.765 1.00 0.00 N ATOM 337 C4 C B 11 -3.135 -3.134 -7.509 1.00 0.00 C ATOM 338 N4 C B 11 -2.323 -2.125 -7.781 1.00 0.00 N ATOM 339 C5 C B 11 -4.413 -2.856 -6.947 1.00 0.00 C ATOM 340 C6 C B 11 -5.211 -3.900 -6.684 1.00 0.00 C ATOM 0 H5' C B 11 -8.593 -5.064 -3.619 1.00 0.00 H new ATOM 0 H5'' C B 11 -7.544 -4.034 -4.574 1.00 0.00 H new ATOM 0 H4' C B 11 -8.307 -6.885 -5.203 1.00 0.00 H new ATOM 0 H3' C B 11 -5.992 -5.638 -3.756 1.00 0.00 H new ATOM 0 H2' C B 11 -4.321 -6.713 -5.014 1.00 0.00 H new ATOM 0 HO2' C B 11 -4.588 -8.697 -5.965 1.00 0.00 H new ATOM 0 H1' C B 11 -5.595 -7.030 -7.467 1.00 0.00 H new ATOM 0 H41 C B 11 -2.617 -1.168 -7.588 1.00 0.00 H new ATOM 0 H42 C B 11 -1.403 -2.305 -8.184 1.00 0.00 H new ATOM 0 H5 C B 11 -4.727 -1.844 -6.741 1.00 0.00 H new ATOM 0 H6 C B 11 -6.188 -3.728 -6.257 1.00 0.00 H new ATOM 352 P U B 12 -5.974 -7.552 -1.960 1.00 0.00 P ATOM 353 OP1 U B 12 -6.705 -8.516 -1.108 1.00 0.00 O ATOM 354 OP2 U B 12 -5.755 -6.167 -1.485 1.00 0.00 O ATOM 355 O5' U B 12 -4.542 -8.189 -2.332 1.00 0.00 O ATOM 356 C5' U B 12 -4.446 -9.517 -2.857 1.00 0.00 C ATOM 357 C4' U B 12 -3.080 -9.777 -3.486 1.00 0.00 C ATOM 358 O4' U B 12 -2.751 -8.787 -4.472 1.00 0.00 O ATOM 359 C3' U B 12 -1.981 -9.768 -2.435 1.00 0.00 C ATOM 360 O3' U B 12 -1.569 -11.111 -2.160 1.00 0.00 O ATOM 361 C2' U B 12 -0.849 -8.951 -3.021 1.00 0.00 C ATOM 362 O2' U B 12 0.316 -9.755 -3.237 1.00 0.00 O ATOM 363 C1' U B 12 -1.372 -8.402 -4.336 1.00 0.00 C ATOM 364 N1 U B 12 -1.219 -6.935 -4.445 1.00 0.00 N ATOM 365 C2 U B 12 -0.057 -6.464 -5.026 1.00 0.00 C ATOM 366 O2 U B 12 0.848 -7.209 -5.396 1.00 0.00 O ATOM 367 N3 U B 12 0.042 -5.094 -5.153 1.00 0.00 N ATOM 368 C4 U B 12 -0.892 -4.161 -4.751 1.00 0.00 C ATOM 369 O4 U B 12 -0.678 -2.962 -4.909 1.00 0.00 O ATOM 370 C5 U B 12 -2.072 -4.737 -4.151 1.00 0.00 C ATOM 371 C6 U B 12 -2.198 -6.078 -4.021 1.00 0.00 C ATOM 0 H5' U B 12 -5.226 -9.671 -3.603 1.00 0.00 H new ATOM 0 H5'' U B 12 -4.622 -10.238 -2.059 1.00 0.00 H new ATOM 0 H4' U B 12 -3.144 -10.758 -3.958 1.00 0.00 H new ATOM 0 H3' U B 12 -2.314 -9.337 -1.491 1.00 0.00 H new ATOM 0 H2' U B 12 -0.549 -8.154 -2.341 1.00 0.00 H new ATOM 0 HO2' U B 12 0.894 -9.713 -2.447 1.00 0.00 H new ATOM 0 H1' U B 12 -0.778 -8.823 -5.147 1.00 0.00 H new ATOM 0 H3 U B 12 0.891 -4.734 -5.588 1.00 0.00 H new ATOM 0 H5 U B 12 -2.863 -4.090 -3.802 1.00 0.00 H new ATOM 0 H6 U B 12 -3.093 -6.482 -3.572 1.00 0.00 H new ATOM 382 P G B 13 -1.012 -11.509 -0.707 1.00 0.00 P ATOM 383 OP1 G B 13 0.017 -12.560 -0.875 1.00 0.00 O ATOM 384 OP2 G B 13 -2.168 -11.739 0.188 1.00 0.00 O ATOM 385 O5' G B 13 -0.286 -10.147 -0.256 1.00 0.00 O ATOM 386 C5' G B 13 0.782 -10.165 0.688 1.00 0.00 C ATOM 387 C4' G B 13 2.136 -9.918 0.027 1.00 0.00 C ATOM 388 O4' G B 13 2.029 -9.238 -1.236 1.00 0.00 O ATOM 389 C3' G B 13 3.002 -9.053 0.917 1.00 0.00 C ATOM 390 O3' G B 13 3.824 -9.860 1.767 1.00 0.00 O ATOM 391 C2' G B 13 3.830 -8.226 -0.033 1.00 0.00 C ATOM 392 O2' G B 13 5.112 -8.823 -0.259 1.00 0.00 O ATOM 393 C1' G B 13 3.019 -8.192 -1.312 1.00 0.00 C ATOM 394 N9 G B 13 2.373 -6.883 -1.476 1.00 0.00 N ATOM 395 C8 G B 13 1.090 -6.540 -1.226 1.00 0.00 C ATOM 396 N7 G B 13 0.748 -5.308 -1.441 1.00 0.00 N ATOM 397 C5 G B 13 1.953 -4.758 -1.891 1.00 0.00 C ATOM 398 C6 G B 13 2.249 -3.428 -2.295 1.00 0.00 C ATOM 399 O6 G B 13 1.498 -2.463 -2.336 1.00 0.00 O ATOM 400 N1 G B 13 3.575 -3.281 -2.676 1.00 0.00 N ATOM 401 C2 G B 13 4.511 -4.304 -2.669 1.00 0.00 C ATOM 402 N2 G B 13 5.742 -3.997 -3.070 1.00 0.00 N ATOM 403 N3 G B 13 4.237 -5.556 -2.290 1.00 0.00 N ATOM 404 C4 G B 13 2.948 -5.713 -1.915 1.00 0.00 C ATOM 0 H5' G B 13 0.798 -11.128 1.198 1.00 0.00 H new ATOM 0 H5'' G B 13 0.606 -9.404 1.449 1.00 0.00 H new ATOM 0 H4' G B 13 2.571 -10.905 -0.133 1.00 0.00 H new ATOM 0 H3' G B 13 2.412 -8.425 1.585 1.00 0.00 H new ATOM 0 H2' G B 13 4.030 -7.229 0.360 1.00 0.00 H new ATOM 0 HO2' G B 13 5.777 -8.399 0.322 1.00 0.00 H new ATOM 0 H1' G B 13 3.667 -8.349 -2.174 1.00 0.00 H new ATOM 0 H8 G B 13 0.377 -7.264 -0.861 1.00 0.00 H new ATOM 0 H1 G B 13 3.882 -2.358 -2.982 1.00 0.00 H new ATOM 0 H21 G B 13 6.468 -4.714 -3.083 1.00 0.00 H new ATOM 0 H22 G B 13 5.960 -3.045 -3.364 1.00 0.00 H new ATOM 416 P C B 14 3.524 -10.025 3.339 1.00 0.00 P ATOM 417 OP1 C B 14 3.748 -11.440 3.708 1.00 0.00 O ATOM 418 OP2 C B 14 2.228 -9.377 3.647 1.00 0.00 O ATOM 419 O5' C B 14 4.701 -9.142 3.989 1.00 0.00 O ATOM 420 C5' C B 14 4.811 -7.752 3.674 1.00 0.00 C ATOM 421 C4' C B 14 6.137 -7.422 2.988 1.00 0.00 C ATOM 422 O4' C B 14 5.961 -7.031 1.611 1.00 0.00 O ATOM 423 C3' C B 14 6.831 -6.273 3.692 1.00 0.00 C ATOM 424 O3' C B 14 7.789 -6.758 4.638 1.00 0.00 O ATOM 425 C2' C B 14 7.478 -5.472 2.586 1.00 0.00 C ATOM 426 O2' C B 14 8.840 -5.867 2.387 1.00 0.00 O ATOM 427 C1' C B 14 6.640 -5.781 1.357 1.00 0.00 C ATOM 428 N1 C B 14 5.657 -4.702 1.126 1.00 0.00 N ATOM 429 C2 C B 14 6.095 -3.495 0.593 1.00 0.00 C ATOM 430 O2 C B 14 7.276 -3.337 0.286 1.00 0.00 O ATOM 431 N3 C B 14 5.181 -2.500 0.423 1.00 0.00 N ATOM 432 C4 C B 14 3.897 -2.681 0.761 1.00 0.00 C ATOM 433 N4 C B 14 3.020 -1.695 0.586 1.00 0.00 N ATOM 434 C5 C B 14 3.449 -3.920 1.308 1.00 0.00 C ATOM 435 C6 C B 14 4.355 -4.895 1.466 1.00 0.00 C ATOM 0 H5' C B 14 4.720 -7.165 4.588 1.00 0.00 H new ATOM 0 H5'' C B 14 3.985 -7.461 3.025 1.00 0.00 H new ATOM 0 H4' C B 14 6.733 -8.334 3.035 1.00 0.00 H new ATOM 0 H3' C B 14 6.140 -5.660 4.271 1.00 0.00 H new ATOM 0 H2' C B 14 7.508 -4.407 2.814 1.00 0.00 H new ATOM 0 HO2' C B 14 9.069 -6.581 3.018 1.00 0.00 H new ATOM 0 H1' C B 14 7.266 -5.855 0.468 1.00 0.00 H new ATOM 0 H41 C B 14 2.042 -1.831 0.843 1.00 0.00 H new ATOM 0 H42 C B 14 3.326 -0.804 0.195 1.00 0.00 H new ATOM 0 H5 C B 14 2.416 -4.067 1.585 1.00 0.00 H new ATOM 0 H6 C B 14 4.046 -5.848 1.869 1.00 0.00 H new ATOM 447 P G B 15 7.772 -6.240 6.163 1.00 0.00 P ATOM 448 OP1 G B 15 8.680 -7.100 6.954 1.00 0.00 O ATOM 449 OP2 G B 15 6.364 -6.067 6.584 1.00 0.00 O ATOM 450 O5' G B 15 8.441 -4.782 6.034 1.00 0.00 O ATOM 451 C5' G B 15 9.570 -4.572 5.181 1.00 0.00 C ATOM 452 C4' G B 15 9.758 -3.096 4.849 1.00 0.00 C ATOM 453 O4' G B 15 8.881 -2.664 3.798 1.00 0.00 O ATOM 454 C3' G B 15 9.481 -2.222 6.060 1.00 0.00 C ATOM 455 O3' G B 15 10.697 -1.906 6.747 1.00 0.00 O ATOM 456 C2' G B 15 8.817 -0.982 5.505 1.00 0.00 C ATOM 457 O2' G B 15 9.716 0.132 5.507 1.00 0.00 O ATOM 458 C1' G B 15 8.407 -1.337 4.085 1.00 0.00 C ATOM 459 N9 G B 15 6.949 -1.241 3.923 1.00 0.00 N ATOM 460 C8 G B 15 5.988 -2.203 3.989 1.00 0.00 C ATOM 461 N7 G B 15 4.762 -1.823 3.842 1.00 0.00 N ATOM 462 C5 G B 15 4.914 -0.452 3.649 1.00 0.00 C ATOM 463 C6 G B 15 3.929 0.538 3.429 1.00 0.00 C ATOM 464 O6 G B 15 2.720 0.385 3.349 1.00 0.00 O ATOM 465 N1 G B 15 4.485 1.800 3.288 1.00 0.00 N ATOM 466 C2 G B 15 5.835 2.078 3.346 1.00 0.00 C ATOM 467 N2 G B 15 6.185 3.352 3.185 1.00 0.00 N ATOM 468 N3 G B 15 6.772 1.148 3.551 1.00 0.00 N ATOM 469 C4 G B 15 6.241 -0.088 3.695 1.00 0.00 C ATOM 0 H5' G B 15 9.440 -5.139 4.259 1.00 0.00 H new ATOM 0 H5'' G B 15 10.469 -4.953 5.666 1.00 0.00 H new ATOM 0 H4' G B 15 10.795 -2.992 4.529 1.00 0.00 H new ATOM 0 H3' G B 15 8.847 -2.720 6.793 1.00 0.00 H new ATOM 0 H2' G B 15 7.961 -0.686 6.112 1.00 0.00 H new ATOM 0 HO2' G B 15 10.548 -0.120 5.960 1.00 0.00 H new ATOM 0 H1' G B 15 8.850 -0.633 3.380 1.00 0.00 H new ATOM 0 H8 G B 15 6.240 -3.240 4.157 1.00 0.00 H new ATOM 0 H1 G B 15 3.849 2.581 3.130 1.00 0.00 H new ATOM 0 H21 G B 15 7.169 3.619 3.218 1.00 0.00 H new ATOM 0 H22 G B 15 5.469 4.062 3.029 1.00 0.00 H new ATOM 481 P U B 16 10.699 -1.633 8.334 1.00 0.00 P ATOM 482 OP1 U B 16 12.093 -1.741 8.818 1.00 0.00 O ATOM 483 OP2 U B 16 9.638 -2.461 8.951 1.00 0.00 O ATOM 484 O5' U B 16 10.257 -0.086 8.418 1.00 0.00 O ATOM 485 C5' U B 16 8.886 0.286 8.589 1.00 0.00 C ATOM 486 C4' U B 16 8.636 1.708 8.092 1.00 0.00 C ATOM 487 O4' U B 16 7.920 1.738 6.844 1.00 0.00 O ATOM 488 C3' U B 16 7.806 2.496 9.085 1.00 0.00 C ATOM 489 O3' U B 16 8.626 3.171 10.043 1.00 0.00 O ATOM 490 C2' U B 16 7.027 3.465 8.231 1.00 0.00 C ATOM 491 O2' U B 16 7.704 4.722 8.122 1.00 0.00 O ATOM 492 C1' U B 16 6.924 2.785 6.875 1.00 0.00 C ATOM 493 N1 U B 16 5.560 2.241 6.702 1.00 0.00 N ATOM 494 C2 U B 16 4.543 3.125 6.368 1.00 0.00 C ATOM 495 O2 U B 16 4.735 4.327 6.198 1.00 0.00 O ATOM 496 N3 U B 16 3.280 2.574 6.241 1.00 0.00 N ATOM 497 C4 U B 16 2.945 1.247 6.417 1.00 0.00 C ATOM 498 O4 U B 16 1.780 0.881 6.275 1.00 0.00 O ATOM 499 C5 U B 16 4.064 0.401 6.762 1.00 0.00 C ATOM 500 C6 U B 16 5.311 0.909 6.887 1.00 0.00 C ATOM 0 H5' U B 16 8.615 0.213 9.642 1.00 0.00 H new ATOM 0 H5'' U B 16 8.247 -0.410 8.046 1.00 0.00 H new ATOM 0 H4' U B 16 9.626 2.146 7.964 1.00 0.00 H new ATOM 0 H3' U B 16 7.154 1.856 9.680 1.00 0.00 H new ATOM 0 H2' U B 16 6.049 3.690 8.657 1.00 0.00 H new ATOM 0 HO2' U B 16 7.775 5.133 9.009 1.00 0.00 H new ATOM 0 H1' U B 16 7.104 3.484 6.058 1.00 0.00 H new ATOM 0 H3 U B 16 2.523 3.211 5.993 1.00 0.00 H new ATOM 0 H5 U B 16 3.902 -0.655 6.923 1.00 0.00 H new ATOM 0 H6 U B 16 6.128 0.249 7.138 1.00 0.00 H new ATOM 511 P C B 17 7.989 3.730 11.412 1.00 0.00 P ATOM 512 OP1 C B 17 9.095 4.011 12.355 1.00 0.00 O ATOM 513 OP2 C B 17 6.886 2.828 11.817 1.00 0.00 O ATOM 514 O5' C B 17 7.346 5.133 10.952 1.00 0.00 O ATOM 515 C5' C B 17 7.084 6.157 11.915 1.00 0.00 C ATOM 516 C4' C B 17 6.162 7.247 11.367 1.00 0.00 C ATOM 517 O4' C B 17 5.453 6.803 10.198 1.00 0.00 O ATOM 518 C3' C B 17 5.136 7.669 12.410 1.00 0.00 C ATOM 519 O3' C B 17 5.388 9.012 12.840 1.00 0.00 O ATOM 520 C2' C B 17 3.781 7.557 11.740 1.00 0.00 C ATOM 521 O2' C B 17 3.124 8.827 11.707 1.00 0.00 O ATOM 522 C1' C B 17 4.045 7.071 10.325 1.00 0.00 C ATOM 523 N1 C B 17 3.242 5.878 9.971 1.00 0.00 N ATOM 524 C2 C B 17 1.868 6.030 9.829 1.00 0.00 C ATOM 525 O2 C B 17 1.333 7.118 10.006 1.00 0.00 O ATOM 526 N3 C B 17 1.135 4.949 9.466 1.00 0.00 N ATOM 527 C4 C B 17 1.711 3.772 9.246 1.00 0.00 C ATOM 528 N4 C B 17 1.001 2.719 8.864 1.00 0.00 N ATOM 529 C5 C B 17 3.104 3.609 9.388 1.00 0.00 C ATOM 530 C6 C B 17 3.837 4.670 9.751 1.00 0.00 C ATOM 0 H5' C B 17 8.026 6.606 12.230 1.00 0.00 H new ATOM 0 H5'' C B 17 6.631 5.712 12.801 1.00 0.00 H new ATOM 0 H4' C B 17 6.801 8.091 11.106 1.00 0.00 H new ATOM 0 H3' C B 17 5.184 7.039 13.298 1.00 0.00 H new ATOM 0 H2' C B 17 3.132 6.872 12.286 1.00 0.00 H new ATOM 0 HO2' C B 17 2.260 8.760 12.164 1.00 0.00 H new ATOM 0 H1' C B 17 3.741 7.849 9.625 1.00 0.00 H new ATOM 0 H41 C B 17 1.463 1.824 8.700 1.00 0.00 H new ATOM 0 H42 C B 17 -0.007 2.804 8.734 1.00 0.00 H new ATOM 0 H5 C B 17 3.569 2.651 9.208 1.00 0.00 H new ATOM 0 H6 C B 17 4.906 4.569 9.870 1.00 0.00 H new ATOM 542 P G B 18 5.727 9.347 14.379 1.00 0.00 P ATOM 543 OP1 G B 18 6.682 10.478 14.403 1.00 0.00 O ATOM 544 OP2 G B 18 6.065 8.084 15.075 1.00 0.00 O ATOM 545 O5' G B 18 4.312 9.874 14.940 1.00 0.00 O ATOM 546 C5' G B 18 3.207 8.981 15.112 1.00 0.00 C ATOM 547 C4' G B 18 1.884 9.668 14.781 1.00 0.00 C ATOM 548 O4' G B 18 1.427 9.309 13.467 1.00 0.00 O ATOM 549 C3' G B 18 0.795 9.271 15.766 1.00 0.00 C ATOM 550 O3' G B 18 0.615 10.271 16.775 1.00 0.00 O ATOM 551 C2' G B 18 -0.451 9.098 14.928 1.00 0.00 C ATOM 552 O2' G B 18 -1.278 10.265 14.986 1.00 0.00 O ATOM 553 C1' G B 18 0.058 8.868 13.514 1.00 0.00 C ATOM 554 N9 G B 18 -0.047 7.437 13.179 1.00 0.00 N ATOM 555 C8 G B 18 0.871 6.449 13.324 1.00 0.00 C ATOM 556 N7 G B 18 0.524 5.253 12.976 1.00 0.00 N ATOM 557 C5 G B 18 -0.786 5.459 12.544 1.00 0.00 C ATOM 558 C6 G B 18 -1.724 4.528 12.034 1.00 0.00 C ATOM 559 O6 G B 18 -1.580 3.324 11.859 1.00 0.00 O ATOM 560 N1 G B 18 -2.928 5.135 11.715 1.00 0.00 N ATOM 561 C2 G B 18 -3.200 6.478 11.867 1.00 0.00 C ATOM 562 N2 G B 18 -4.414 6.880 11.503 1.00 0.00 N ATOM 563 N3 G B 18 -2.323 7.363 12.347 1.00 0.00 N ATOM 564 C4 G B 18 -1.142 6.788 12.664 1.00 0.00 C ATOM 0 H5' G B 18 3.185 8.620 16.140 1.00 0.00 H new ATOM 0 H5'' G B 18 3.337 8.109 14.471 1.00 0.00 H new ATOM 0 H4' G B 18 2.071 10.740 14.837 1.00 0.00 H new ATOM 0 H3' G B 18 1.048 8.357 16.304 1.00 0.00 H new ATOM 0 H2' G B 18 -1.068 8.272 15.283 1.00 0.00 H new ATOM 0 HO2' G B 18 -0.955 10.860 15.695 1.00 0.00 H new ATOM 0 HO3' G B 18 -0.092 9.989 17.392 1.00 0.00 H new ATOM 0 H1' G B 18 -0.533 9.425 12.787 1.00 0.00 H new ATOM 0 H8 G B 18 1.856 6.654 13.716 1.00 0.00 H new ATOM 0 H1 G B 18 -3.669 4.543 11.339 1.00 0.00 H new ATOM 0 H21 G B 18 -4.674 7.862 11.592 1.00 0.00 H new ATOM 0 H22 G B 18 -5.085 6.206 11.135 1.00 0.00 H new TER 577 G B 18 END