USER MOD reduce.3.24.130724 H: found=0, std=0, add=229, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 230 hydrogens (0 hets) HEADER RNA 06-APR-04 1SZY TITLE SOLUTION STRUCTURE OF ITALY1 ("INITIATOR TRNA ANTICODON TITLE 2 LOOP FROM YEAST"), AN UNMODIFIED 21-NT RNA WITH THE TITLE 3 SEQUENCE OF THE ANTICODON STEM-LOOP OF YEAST INITIATOR TRNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'- COMPND 3 R(P*GP*GP*CP*AP*GP*GP*GP*CP*UP*CP*AP*UP*AP*AP*CP*CP*CP*UP*G COMPND 4 P*CP*C)-3'; COMPND 5 CHAIN: A; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES KEYWDS INITIATOR TRNA ANTICODON LOOP EXPDTA SOLUTION NMR AUTHOR D.C.SCHWEISGUTH,P.B.MOORE REVDAT 2 24-FEB-09 1SZY 1 VERSN REVDAT 1 20-APR-04 1SZY 0 JRNL AUTH D.C.SCHWEISGUTH,P.B.MOORE JRNL TITL ON THE CONFORMATION OF THE ANTICODON LOOPS OF JRNL TITL 2 INITIATOR AND ELONGATOR METHIONINE TRNAS. JRNL REF J.MOL.BIOL. V. 267 505 1997 JRNL REFN ISSN 0022-2836 JRNL PMID 9126834 JRNL DOI 10.1006/JMBI.1996.0903 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: RNA TOPOLOGY AND PARAMETERS FROM REMARK 3 RIFE AND MOORE, NAR, 1996. CONSTRAINTS IN LOOP INCLUDED 128 REMARK 3 NOES, 7 CHI DIHEDRALS INFERRED FROM NOES, 20 V0-V4 RIBOSE REMARK 3 DIHEDRALS, 8 A AND Z P DIHEDRALS, 12 B AND G P DIHEDRALS AND 7 REMARK 3 E P DIHEDRALS. STEM WAS CONSTRAINED TO A-FORM BASED ON REMARK 3 QUALITATIVE SPECTRAL ANALYSIS. REMARK 4 REMARK 4 1SZY COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 08-APR-04. REMARK 100 THE RCSB ID CODE IS RCSB022139. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303 REMARK 210 PH : 6.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : S1 NMR BUFFER; 100MM KCL, REMARK 210 50MM NACL, 4MM NA CACODYLATE, REMARK 210 0.2MM EDTA REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY, DQF-COSY, 13C-1H REMARK 210 HSQC, TOCSY, GE JRSE NOESY, REMARK 210 31P-1H COSY, 31P-1H REMARK 210 HETEROTOCSY, 31P-1H REMARK 210 HETEROTOCSY-NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 490 MHZ, 500 MHZ, 600 MHZ REMARK 210 SPECTROMETER MODEL : HOMEBUILT, AM, OMEGA, UNITY, REMARK 210 UNITYPLUS REMARK 210 SPECTROMETER MANUFACTURER : YALE, BRUKER, GE, VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : FELIX UNKNOWN, X-PLOR 3.1 REMARK 210 METHOD USED : DISTANCE GEOMETRY, SIMULATED REMARK 210 ANNEALING 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: SEE DCS DISSERTATION P. 61. 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. DBREF 1SZY A 1 21 PDB 1SZY 1SZY 1 21 SEQRES 1 A 21 G G C A G G G C U C A U A SEQRES 2 A 21 A C C C U G C C 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 G O2' : rot 180:sc= -0.201 USER MOD Single : A 2 G O2' : rot 180:sc= -0.385 USER MOD Single : A 3 C O2' : rot 180:sc= -0.415 USER MOD Single : A 4 A O2' : rot 180:sc= -1.11 USER MOD Single : A 5 G O2' : rot 180:sc= -0.325 USER MOD Single : A 6 G O2' : rot 180:sc= -0.968 USER MOD Single : A 7 G O2' : rot -24:sc= -0.637 USER MOD Single : A 8 C O2' : rot -19:sc= 0.115 USER MOD Single : A 9 U O2' : rot -147:sc= 1.15 USER MOD Single : A 10 C O2' : rot -80:sc= 0.747 USER MOD Single : A 11 A O2' : rot -150:sc= -1.27! USER MOD Single : A 12 U O2' : rot 2:sc= 0.419 USER MOD Single : A 13 A O2' : rot -22:sc=0.000444 USER MOD Single : A 14 A O2' : rot -24:sc= 0.0508 USER MOD Single : A 15 C O2' : rot 180:sc= -0.533 USER MOD Single : A 16 C O2' : rot 180:sc= -0.177 USER MOD Single : A 17 C O2' : rot 180:sc= -1.13 USER MOD Single : A 18 U O2' : rot 180:sc= -0.677 USER MOD Single : A 19 G O2' : rot 180:sc= -0.534 USER MOD Single : A 20 C O2' : rot 180:sc= -0.357 USER MOD Single : A 21 C O2' : rot -18:sc= 0.0936 USER MOD Single : A 21 C O3' : rot 180:sc= 0.107 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 G A 1 5.040 10.290 -1.838 1.00 1.42 O ATOM 2 P G A 1 6.160 11.190 -1.151 1.00 0.44 P ATOM 3 OP1 G A 1 5.813 12.616 -1.381 1.00 1.36 O ATOM 4 OP2 G A 1 6.356 10.697 0.236 1.00 1.55 O ATOM 5 O5' G A 1 7.459 10.833 -2.004 1.00 0.15 O ATOM 6 C5' G A 1 7.986 11.743 -2.971 1.00 0.16 C ATOM 7 C4' G A 1 9.034 11.055 -3.812 1.00 0.17 C ATOM 8 O4' G A 1 10.254 10.921 -3.036 1.00 0.15 O ATOM 9 C3' G A 1 8.705 9.628 -4.222 1.00 0.18 C ATOM 10 O3' G A 1 7.873 9.603 -5.375 1.00 0.21 O ATOM 11 C2' G A 1 10.085 9.037 -4.478 1.00 0.19 C ATOM 12 O2' G A 1 10.592 9.444 -5.736 1.00 0.22 O ATOM 13 C1' G A 1 10.909 9.713 -3.381 1.00 0.16 C ATOM 14 N9 G A 1 11.055 8.906 -2.174 1.00 0.15 N ATOM 15 C8 G A 1 10.413 9.081 -0.972 1.00 0.13 C ATOM 16 N7 G A 1 10.759 8.203 -0.070 1.00 0.12 N ATOM 17 C5 G A 1 11.685 7.395 -0.717 1.00 0.14 C ATOM 18 C6 G A 1 12.416 6.272 -0.246 1.00 0.15 C ATOM 19 O6 G A 1 12.392 5.751 0.875 1.00 0.15 O ATOM 20 N1 G A 1 13.244 5.751 -1.234 1.00 0.18 N ATOM 21 C2 G A 1 13.352 6.242 -2.510 1.00 0.20 C ATOM 22 N2 G A 1 14.184 5.587 -3.321 1.00 0.23 N ATOM 23 N3 G A 1 12.687 7.291 -2.959 1.00 0.19 N ATOM 24 C4 G A 1 11.876 7.814 -2.017 1.00 0.16 C ATOM 0 H5' G A 1 8.421 12.608 -2.469 1.00 0.16 H new ATOM 0 H5'' G A 1 7.183 12.114 -3.608 1.00 0.16 H new ATOM 0 H4' G A 1 9.110 11.678 -4.703 1.00 0.17 H new ATOM 0 H3' G A 1 8.140 9.068 -3.477 1.00 0.18 H new ATOM 0 H2' G A 1 10.094 7.947 -4.475 1.00 0.19 H new ATOM 0 HO2' G A 1 11.479 9.051 -5.874 1.00 0.22 H new ATOM 0 H1' G A 1 11.913 9.872 -3.775 1.00 0.16 H new ATOM 0 H8 G A 1 9.694 9.866 -0.791 1.00 0.13 H new ATOM 0 H1 G A 1 13.815 4.941 -0.991 1.00 0.18 H new ATOM 0 H21 G A 1 14.310 5.900 -4.283 1.00 0.23 H new ATOM 0 H22 G A 1 14.694 4.773 -2.979 1.00 0.23 H new ATOM 37 P G A 2 6.795 8.425 -5.556 1.00 0.23 P ATOM 38 OP1 G A 2 5.917 8.773 -6.702 1.00 1.24 O ATOM 39 OP2 G A 2 6.193 8.172 -4.222 1.00 1.23 O ATOM 40 O5' G A 2 7.675 7.160 -5.962 1.00 0.24 O ATOM 41 C5' G A 2 8.495 7.193 -7.126 1.00 0.27 C ATOM 42 C4' G A 2 9.341 5.942 -7.214 1.00 0.28 C ATOM 43 O4' G A 2 10.397 5.997 -6.219 1.00 0.25 O ATOM 44 C3' G A 2 8.639 4.628 -6.907 1.00 0.28 C ATOM 45 O3' G A 2 7.875 4.160 -8.015 1.00 0.32 O ATOM 46 C2' G A 2 9.814 3.718 -6.574 1.00 0.28 C ATOM 47 O2' G A 2 10.492 3.297 -7.744 1.00 0.32 O ATOM 48 C1' G A 2 10.722 4.680 -5.805 1.00 0.25 C ATOM 49 N9 G A 2 10.568 4.597 -4.355 1.00 0.22 N ATOM 50 C8 G A 2 9.898 5.469 -3.533 1.00 0.19 C ATOM 51 N7 G A 2 9.937 5.124 -2.275 1.00 0.17 N ATOM 52 C5 G A 2 10.680 3.951 -2.266 1.00 0.18 C ATOM 53 C6 G A 2 11.065 3.110 -1.187 1.00 0.17 C ATOM 54 O6 G A 2 10.825 3.243 0.018 1.00 0.14 O ATOM 55 N1 G A 2 11.810 2.021 -1.628 1.00 0.20 N ATOM 56 C2 G A 2 12.143 1.774 -2.937 1.00 0.23 C ATOM 57 N2 G A 2 12.847 0.666 -3.171 1.00 0.25 N ATOM 58 N3 G A 2 11.803 2.554 -3.947 1.00 0.24 N ATOM 59 C4 G A 2 11.076 3.613 -3.543 1.00 0.21 C ATOM 0 H5' G A 2 9.138 8.073 -7.100 1.00 0.27 H new ATOM 0 H5'' G A 2 7.871 7.280 -8.015 1.00 0.27 H new ATOM 0 H4' G A 2 9.664 5.941 -8.255 1.00 0.28 H new ATOM 0 H3' G A 2 7.904 4.693 -6.105 1.00 0.28 H new ATOM 0 H2' G A 2 9.521 2.811 -6.045 1.00 0.28 H new ATOM 0 HO2' G A 2 11.241 2.716 -7.497 1.00 0.32 H new ATOM 0 H1' G A 2 11.755 4.410 -6.026 1.00 0.25 H new ATOM 0 H8 G A 2 9.390 6.352 -3.892 1.00 0.19 H new ATOM 0 H1 G A 2 12.133 1.356 -0.926 1.00 0.20 H new ATOM 0 H21 G A 2 13.124 0.429 -4.124 1.00 0.25 H new ATOM 0 H22 G A 2 13.109 0.055 -2.397 1.00 0.25 H new ATOM 71 P C A 3 6.632 3.169 -7.766 1.00 0.34 P ATOM 72 OP1 C A 3 5.941 2.993 -9.069 1.00 0.40 O ATOM 73 OP2 C A 3 5.867 3.659 -6.591 1.00 0.30 O ATOM 74 O5' C A 3 7.312 1.782 -7.376 1.00 0.34 O ATOM 75 C5' C A 3 8.137 1.086 -8.307 1.00 0.36 C ATOM 76 C4' C A 3 8.684 -0.176 -7.681 1.00 0.35 C ATOM 77 O4' C A 3 9.633 0.176 -6.640 1.00 0.32 O ATOM 78 C3' C A 3 7.669 -1.055 -6.966 1.00 0.34 C ATOM 79 O3' C A 3 6.963 -1.891 -7.878 1.00 0.37 O ATOM 80 C2' C A 3 8.551 -1.845 -6.006 1.00 0.32 C ATOM 81 O2' C A 3 9.237 -2.885 -6.678 1.00 0.34 O ATOM 82 C1' C A 3 9.571 -0.781 -5.595 1.00 0.30 C ATOM 83 N1 C A 3 9.236 -0.083 -4.340 1.00 0.26 N ATOM 84 C2 C A 3 9.501 -0.717 -3.120 1.00 0.24 C ATOM 85 O2 C A 3 10.015 -1.845 -3.126 1.00 0.26 O ATOM 86 N3 C A 3 9.190 -0.084 -1.966 1.00 0.21 N ATOM 87 C4 C A 3 8.639 1.132 -1.999 1.00 0.20 C ATOM 88 N4 C A 3 8.360 1.720 -0.835 1.00 0.17 N ATOM 89 C5 C A 3 8.357 1.800 -3.226 1.00 0.22 C ATOM 90 C6 C A 3 8.672 1.163 -4.361 1.00 0.25 C ATOM 0 H5' C A 3 8.958 1.728 -8.626 1.00 0.36 H new ATOM 0 H5'' C A 3 7.562 0.838 -9.199 1.00 0.36 H new ATOM 0 H4' C A 3 9.096 -0.724 -8.528 1.00 0.35 H new ATOM 0 H3' C A 3 6.879 -0.500 -6.460 1.00 0.34 H new ATOM 0 H2' C A 3 7.994 -2.311 -5.193 1.00 0.32 H new ATOM 0 HO2' C A 3 9.796 -3.374 -6.039 1.00 0.34 H new ATOM 0 H1' C A 3 10.521 -1.287 -5.423 1.00 0.30 H new ATOM 0 H41 C A 3 7.939 2.649 -0.821 1.00 0.17 H new ATOM 0 H42 C A 3 8.568 1.241 0.041 1.00 0.17 H new ATOM 0 H5 C A 3 7.907 2.782 -3.240 1.00 0.22 H new ATOM 0 H6 C A 3 8.477 1.641 -5.310 1.00 0.25 H new ATOM 102 P A A 4 5.468 -2.369 -7.528 1.00 0.38 P ATOM 103 OP1 A A 4 4.885 -2.992 -8.745 1.00 0.43 O ATOM 104 OP2 A A 4 4.771 -1.228 -6.884 1.00 0.35 O ATOM 105 O5' A A 4 5.675 -3.507 -6.431 1.00 0.35 O ATOM 106 C5' A A 4 6.459 -4.663 -6.717 1.00 0.36 C ATOM 107 C4' A A 4 6.591 -5.526 -5.483 1.00 0.32 C ATOM 108 O4' A A 4 7.456 -4.866 -4.521 1.00 0.29 O ATOM 109 C3' A A 4 5.308 -5.770 -4.704 1.00 0.30 C ATOM 110 O3' A A 4 4.532 -6.813 -5.288 1.00 0.31 O ATOM 111 C2' A A 4 5.837 -6.131 -3.321 1.00 0.26 C ATOM 112 O2' A A 4 6.307 -7.466 -3.280 1.00 0.27 O ATOM 113 C1' A A 4 7.039 -5.191 -3.206 1.00 0.26 C ATOM 114 N9 A A 4 6.745 -3.948 -2.494 1.00 0.24 N ATOM 115 C8 A A 4 6.531 -2.699 -3.023 1.00 0.24 C ATOM 116 N7 A A 4 6.288 -1.779 -2.123 1.00 0.22 N ATOM 117 C5 A A 4 6.346 -2.466 -0.919 1.00 0.20 C ATOM 118 C6 A A 4 6.183 -2.054 0.415 1.00 0.16 C ATOM 119 N6 A A 4 5.924 -0.797 0.773 1.00 0.15 N ATOM 120 N1 A A 4 6.300 -2.991 1.382 1.00 0.15 N ATOM 121 C2 A A 4 6.571 -4.252 1.021 1.00 0.17 C ATOM 122 N3 A A 4 6.758 -4.758 -0.196 1.00 0.20 N ATOM 123 C4 A A 4 6.628 -3.803 -1.132 1.00 0.21 C ATOM 0 H5' A A 4 7.447 -4.363 -7.067 1.00 0.36 H new ATOM 0 H5'' A A 4 5.996 -5.235 -7.521 1.00 0.36 H new ATOM 0 H4' A A 4 6.959 -6.474 -5.876 1.00 0.32 H new ATOM 0 H3' A A 4 4.627 -4.919 -4.689 1.00 0.30 H new ATOM 0 H2' A A 4 5.085 -6.041 -2.537 1.00 0.26 H new ATOM 0 HO2' A A 4 6.641 -7.668 -2.381 1.00 0.27 H new ATOM 0 H1' A A 4 7.808 -5.708 -2.632 1.00 0.26 H new ATOM 0 H8 A A 4 6.560 -2.494 -4.083 1.00 0.24 H new ATOM 0 H61 A A 4 5.816 -0.559 1.759 1.00 0.15 H new ATOM 0 H62 A A 4 5.834 -0.072 0.061 1.00 0.15 H new ATOM 0 H2 A A 4 6.649 -4.959 1.833 1.00 0.17 H new ATOM 135 P G A 5 2.935 -6.824 -5.098 1.00 0.32 P ATOM 136 OP1 G A 5 2.395 -7.889 -5.982 1.00 0.34 O ATOM 137 OP2 G A 5 2.435 -5.433 -5.237 1.00 0.32 O ATOM 138 O5' G A 5 2.731 -7.283 -3.585 1.00 0.28 O ATOM 139 C5' G A 5 3.302 -8.500 -3.108 1.00 0.26 C ATOM 140 C4' G A 5 3.095 -8.631 -1.616 1.00 0.24 C ATOM 141 O4' G A 5 3.949 -7.686 -0.918 1.00 0.22 O ATOM 142 C3' G A 5 1.705 -8.288 -1.107 1.00 0.23 C ATOM 143 O3' G A 5 0.795 -9.366 -1.301 1.00 0.25 O ATOM 144 C2' G A 5 1.970 -7.996 0.366 1.00 0.21 C ATOM 145 O2' G A 5 2.136 -9.191 1.107 1.00 0.20 O ATOM 146 C1' G A 5 3.322 -7.283 0.289 1.00 0.20 C ATOM 147 N9 G A 5 3.223 -5.825 0.293 1.00 0.19 N ATOM 148 C8 G A 5 3.363 -4.980 -0.782 1.00 0.21 C ATOM 149 N7 G A 5 3.222 -3.721 -0.469 1.00 0.20 N ATOM 150 C5 G A 5 2.975 -3.734 0.898 1.00 0.18 C ATOM 151 C6 G A 5 2.747 -2.662 1.802 1.00 0.16 C ATOM 152 O6 G A 5 2.721 -1.449 1.569 1.00 0.16 O ATOM 153 N1 G A 5 2.538 -3.122 3.098 1.00 0.14 N ATOM 154 C2 G A 5 2.549 -4.441 3.475 1.00 0.15 C ATOM 155 N2 G A 5 2.312 -4.687 4.766 1.00 0.14 N ATOM 156 N3 G A 5 2.770 -5.448 2.647 1.00 0.16 N ATOM 157 C4 G A 5 2.972 -5.025 1.383 1.00 0.17 C ATOM 0 H5' G A 5 4.367 -8.523 -3.337 1.00 0.26 H new ATOM 0 H5'' G A 5 2.847 -9.348 -3.620 1.00 0.26 H new ATOM 0 H4' G A 5 3.303 -9.684 -1.429 1.00 0.24 H new ATOM 0 H3' G A 5 1.232 -7.455 -1.628 1.00 0.23 H new ATOM 0 H2' G A 5 1.164 -7.441 0.846 1.00 0.21 H new ATOM 0 HO2' G A 5 2.306 -8.972 2.047 1.00 0.20 H new ATOM 0 H1' G A 5 3.889 -7.559 1.178 1.00 0.20 H new ATOM 0 H8 G A 5 3.569 -5.324 -1.785 1.00 0.21 H new ATOM 0 H1 G A 5 2.363 -2.426 3.823 1.00 0.14 H new ATOM 0 H21 G A 5 2.306 -5.647 5.110 1.00 0.14 H new ATOM 0 H22 G A 5 2.137 -3.914 5.408 1.00 0.14 H new ATOM 169 P G A 6 -0.774 -9.063 -1.484 1.00 0.26 P ATOM 170 OP1 G A 6 -1.426 -10.341 -1.872 1.00 1.06 O ATOM 171 OP2 G A 6 -0.926 -7.868 -2.354 1.00 1.14 O ATOM 172 O5' G A 6 -1.266 -8.681 -0.016 1.00 0.24 O ATOM 173 C5' G A 6 -1.144 -9.609 1.059 1.00 0.24 C ATOM 174 C4' G A 6 -1.551 -8.961 2.363 1.00 0.22 C ATOM 175 O4' G A 6 -0.565 -7.962 2.740 1.00 0.20 O ATOM 176 C3' G A 6 -2.853 -8.177 2.344 1.00 0.23 C ATOM 177 O3' G A 6 -3.990 -9.032 2.439 1.00 0.25 O ATOM 178 C2' G A 6 -2.687 -7.272 3.558 1.00 0.21 C ATOM 179 O2' G A 6 -2.902 -7.982 4.764 1.00 0.21 O ATOM 180 C1' G A 6 -1.201 -6.920 3.463 1.00 0.19 C ATOM 181 N9 G A 6 -0.937 -5.655 2.782 1.00 0.18 N ATOM 182 C8 G A 6 -0.479 -5.482 1.499 1.00 0.19 C ATOM 183 N7 G A 6 -0.345 -4.229 1.163 1.00 0.18 N ATOM 184 C5 G A 6 -0.737 -3.528 2.295 1.00 0.17 C ATOM 185 C6 G A 6 -0.801 -2.131 2.536 1.00 0.16 C ATOM 186 O6 G A 6 -0.511 -1.203 1.773 1.00 0.15 O ATOM 187 N1 G A 6 -1.254 -1.853 3.821 1.00 0.15 N ATOM 188 C2 G A 6 -1.599 -2.798 4.754 1.00 0.15 C ATOM 189 N2 G A 6 -2.022 -2.335 5.930 1.00 0.15 N ATOM 190 N3 G A 6 -1.537 -4.102 4.547 1.00 0.17 N ATOM 191 C4 G A 6 -1.104 -4.394 3.304 1.00 0.17 C ATOM 0 H5' G A 6 -0.115 -9.963 1.127 1.00 0.24 H new ATOM 0 H5'' G A 6 -1.770 -10.481 0.868 1.00 0.24 H new ATOM 0 H4' G A 6 -1.651 -9.811 3.038 1.00 0.22 H new ATOM 0 H3' G A 6 -3.030 -7.627 1.420 1.00 0.23 H new ATOM 0 H2' G A 6 -3.379 -6.429 3.565 1.00 0.21 H new ATOM 0 HO2' G A 6 -2.787 -7.376 5.525 1.00 0.21 H new ATOM 0 H1' G A 6 -0.821 -6.811 4.479 1.00 0.19 H new ATOM 0 H8 G A 6 -0.252 -6.302 0.834 1.00 0.19 H new ATOM 0 H1 G A 6 -1.336 -0.873 4.090 1.00 0.15 H new ATOM 0 H21 G A 6 -2.294 -2.986 6.667 1.00 0.15 H new ATOM 0 H22 G A 6 -2.074 -1.330 6.093 1.00 0.15 H new ATOM 203 P G A 7 -5.424 -8.514 1.925 1.00 0.27 P ATOM 204 OP1 G A 7 -6.390 -9.639 2.005 1.00 0.30 O ATOM 205 OP2 G A 7 -5.214 -7.821 0.628 1.00 0.26 O ATOM 206 O5' G A 7 -5.843 -7.421 3.005 1.00 0.26 O ATOM 207 C5' G A 7 -6.029 -7.775 4.374 1.00 0.26 C ATOM 208 C4' G A 7 -6.383 -6.551 5.183 1.00 0.25 C ATOM 209 O4' G A 7 -5.260 -5.633 5.162 1.00 0.23 O ATOM 210 C3' G A 7 -7.549 -5.734 4.649 1.00 0.25 C ATOM 211 O3' G A 7 -8.791 -6.256 5.110 1.00 0.27 O ATOM 212 C2' G A 7 -7.264 -4.340 5.200 1.00 0.23 C ATOM 213 O2' G A 7 -7.692 -4.227 6.545 1.00 0.24 O ATOM 214 C1' G A 7 -5.735 -4.300 5.176 1.00 0.21 C ATOM 215 N9 G A 7 -5.178 -3.602 4.020 1.00 0.20 N ATOM 216 C8 G A 7 -4.587 -4.162 2.913 1.00 0.20 C ATOM 217 N7 G A 7 -4.170 -3.277 2.049 1.00 0.18 N ATOM 218 C5 G A 7 -4.510 -2.057 2.619 1.00 0.17 C ATOM 219 C6 G A 7 -4.307 -0.733 2.149 1.00 0.16 C ATOM 220 O6 G A 7 -3.768 -0.360 1.101 1.00 0.15 O ATOM 221 N1 G A 7 -4.806 0.208 3.043 1.00 0.15 N ATOM 222 C2 G A 7 -5.427 -0.087 4.231 1.00 0.16 C ATOM 223 N2 G A 7 -5.865 0.951 4.942 1.00 0.16 N ATOM 224 N3 G A 7 -5.612 -1.313 4.685 1.00 0.17 N ATOM 225 C4 G A 7 -5.135 -2.242 3.834 1.00 0.18 C ATOM 0 H5' G A 7 -5.120 -8.230 4.767 1.00 0.26 H new ATOM 0 H5'' G A 7 -6.821 -8.519 4.461 1.00 0.26 H new ATOM 0 H4' G A 7 -6.647 -6.942 6.166 1.00 0.25 H new ATOM 0 H3' G A 7 -7.634 -5.744 3.562 1.00 0.25 H new ATOM 0 H2' G A 7 -7.763 -3.550 4.639 1.00 0.23 H new ATOM 0 HO2' G A 7 -8.402 -4.880 6.718 1.00 0.24 H new ATOM 0 H1' G A 7 -5.417 -3.748 6.060 1.00 0.21 H new ATOM 0 H8 G A 7 -4.478 -5.227 2.772 1.00 0.20 H new ATOM 0 H1 G A 7 -4.703 1.193 2.797 1.00 0.15 H new ATOM 0 H21 G A 7 -6.335 0.796 5.834 1.00 0.16 H new ATOM 0 H22 G A 7 -5.730 1.900 4.594 1.00 0.16 H new ATOM 237 P C A 8 -10.118 -6.066 4.223 1.00 0.30 P ATOM 238 OP1 C A 8 -11.265 -6.619 4.990 1.00 0.34 O ATOM 239 OP2 C A 8 -9.826 -6.585 2.863 1.00 0.34 O ATOM 240 O5' C A 8 -10.295 -4.485 4.121 1.00 0.25 O ATOM 241 C5' C A 8 -10.640 -3.706 5.267 1.00 0.25 C ATOM 242 C4' C A 8 -11.147 -2.347 4.841 1.00 0.26 C ATOM 243 O4' C A 8 -10.015 -1.546 4.403 1.00 0.23 O ATOM 244 C3' C A 8 -12.123 -2.362 3.670 1.00 0.29 C ATOM 245 O3' C A 8 -13.467 -2.402 4.140 1.00 0.34 O ATOM 246 C2' C A 8 -11.809 -1.065 2.930 1.00 0.31 C ATOM 247 O2' C A 8 -12.452 0.038 3.538 1.00 0.35 O ATOM 248 C1' C A 8 -10.304 -0.941 3.158 1.00 0.25 C ATOM 249 N1 C A 8 -9.482 -1.596 2.125 1.00 0.24 N ATOM 250 C2 C A 8 -9.287 -0.948 0.901 1.00 0.30 C ATOM 251 O2 C A 8 -9.814 0.160 0.715 1.00 0.38 O ATOM 252 N3 C A 8 -8.531 -1.544 -0.048 1.00 0.31 N ATOM 253 C4 C A 8 -7.977 -2.735 0.192 1.00 0.27 C ATOM 254 N4 C A 8 -7.239 -3.285 -0.773 1.00 0.31 N ATOM 255 C5 C A 8 -8.157 -3.415 1.431 1.00 0.24 C ATOM 256 C6 C A 8 -8.913 -2.817 2.357 1.00 0.21 C ATOM 0 H5' C A 8 -9.770 -3.591 5.913 1.00 0.25 H new ATOM 0 H5'' C A 8 -11.404 -4.221 5.849 1.00 0.25 H new ATOM 0 H4' C A 8 -11.670 -1.951 5.711 1.00 0.26 H new ATOM 0 H3' C A 8 -12.021 -3.235 3.026 1.00 0.29 H new ATOM 0 H2' C A 8 -12.127 -1.076 1.888 1.00 0.31 H new ATOM 0 HO2' C A 8 -13.190 -0.282 4.098 1.00 0.35 H new ATOM 0 H1' C A 8 -10.056 0.120 3.124 1.00 0.25 H new ATOM 0 H41 C A 8 -6.801 -4.194 -0.624 1.00 0.31 H new ATOM 0 H42 C A 8 -7.113 -2.797 -1.660 1.00 0.31 H new ATOM 0 H5 C A 8 -7.700 -4.376 1.615 1.00 0.24 H new ATOM 0 H6 C A 8 -9.077 -3.307 3.305 1.00 0.21 H new ATOM 268 P U A 9 -14.464 -3.552 3.623 1.00 0.39 P ATOM 269 OP1 U A 9 -15.583 -3.635 4.598 1.00 0.93 O ATOM 270 OP2 U A 9 -13.671 -4.769 3.311 1.00 0.91 O ATOM 271 O5' U A 9 -15.038 -2.973 2.255 1.00 0.42 O ATOM 272 C5' U A 9 -15.338 -1.586 2.111 1.00 0.48 C ATOM 273 C4' U A 9 -15.426 -1.227 0.647 1.00 0.58 C ATOM 274 O4' U A 9 -14.084 -1.111 0.111 1.00 0.51 O ATOM 275 C3' U A 9 -16.096 -2.271 -0.233 1.00 0.61 C ATOM 276 O3' U A 9 -17.510 -2.104 -0.235 1.00 0.80 O ATOM 277 C2' U A 9 -15.480 -2.013 -1.605 1.00 0.63 C ATOM 278 O2' U A 9 -16.142 -0.954 -2.269 1.00 0.80 O ATOM 279 C1' U A 9 -14.070 -1.546 -1.236 1.00 0.56 C ATOM 280 N1 U A 9 -13.042 -2.589 -1.375 1.00 0.45 N ATOM 281 C2 U A 9 -12.598 -2.886 -2.650 1.00 0.52 C ATOM 282 O2 U A 9 -13.027 -2.332 -3.647 1.00 0.65 O ATOM 283 N3 U A 9 -11.631 -3.857 -2.716 1.00 0.46 N ATOM 284 C4 U A 9 -11.077 -4.548 -1.662 1.00 0.36 C ATOM 285 O4 U A 9 -10.205 -5.390 -1.883 1.00 0.38 O ATOM 286 C5 U A 9 -11.592 -4.188 -0.379 1.00 0.27 C ATOM 287 C6 U A 9 -12.535 -3.246 -0.276 1.00 0.31 C ATOM 0 H5' U A 9 -14.567 -0.986 2.595 1.00 0.48 H new ATOM 0 H5'' U A 9 -16.280 -1.356 2.608 1.00 0.48 H new ATOM 0 H4' U A 9 -16.016 -0.311 0.624 1.00 0.58 H new ATOM 0 H3' U A 9 -15.939 -3.295 0.106 1.00 0.61 H new ATOM 0 H2' U A 9 -15.529 -2.881 -2.263 1.00 0.63 H new ATOM 0 HO2' U A 9 -16.139 -1.121 -3.235 1.00 0.80 H new ATOM 0 H1' U A 9 -13.808 -0.748 -1.931 1.00 0.56 H new ATOM 0 H3 U A 9 -11.285 -4.092 -3.646 1.00 0.46 H new ATOM 0 H5 U A 9 -11.219 -4.677 0.509 1.00 0.27 H new ATOM 0 H6 U A 9 -12.912 -2.991 0.703 1.00 0.31 H new ATOM 298 P C A 10 -18.464 -3.383 -0.425 1.00 0.81 P ATOM 299 OP1 C A 10 -19.828 -2.893 -0.747 1.00 1.58 O ATOM 300 OP2 C A 10 -18.262 -4.275 0.746 1.00 1.54 O ATOM 301 O5' C A 10 -17.879 -4.105 -1.719 1.00 0.59 O ATOM 302 C5' C A 10 -17.377 -5.437 -1.651 1.00 0.95 C ATOM 303 C4' C A 10 -17.179 -5.989 -3.041 1.00 1.09 C ATOM 304 O4' C A 10 -18.412 -5.794 -3.776 1.00 1.09 O ATOM 305 C3' C A 10 -16.062 -5.332 -3.848 1.00 1.00 C ATOM 306 O3' C A 10 -15.250 -6.311 -4.487 1.00 1.01 O ATOM 307 C2' C A 10 -16.779 -4.427 -4.851 1.00 0.98 C ATOM 308 O2' C A 10 -16.189 -4.516 -6.134 1.00 1.17 O ATOM 309 C1' C A 10 -18.170 -5.046 -4.944 1.00 1.15 C ATOM 310 N1 C A 10 -19.225 -4.031 -5.061 1.00 1.12 N ATOM 311 C2 C A 10 -19.943 -3.935 -6.255 1.00 1.60 C ATOM 312 O2 C A 10 -19.661 -4.700 -7.190 1.00 1.88 O ATOM 313 N3 C A 10 -20.926 -3.011 -6.361 1.00 1.85 N ATOM 314 C4 C A 10 -21.194 -2.203 -5.332 1.00 1.72 C ATOM 315 N4 C A 10 -22.181 -1.320 -5.472 1.00 2.15 N ATOM 316 C5 C A 10 -20.466 -2.270 -4.111 1.00 1.23 C ATOM 317 C6 C A 10 -19.501 -3.190 -4.019 1.00 0.87 C ATOM 0 H5' C A 10 -18.072 -6.068 -1.097 1.00 0.95 H new ATOM 0 H5'' C A 10 -16.432 -5.450 -1.108 1.00 0.95 H new ATOM 0 H4' C A 10 -16.898 -7.034 -2.912 1.00 1.09 H new ATOM 0 H3' C A 10 -15.377 -4.760 -3.222 1.00 1.00 H new ATOM 0 H2' C A 10 -16.753 -3.382 -4.544 1.00 0.98 H new ATOM 0 HO2' C A 10 -15.382 -3.961 -6.162 1.00 1.17 H new ATOM 0 H1' C A 10 -18.194 -5.669 -5.838 1.00 1.15 H new ATOM 0 H41 C A 10 -22.412 -0.688 -4.706 1.00 2.15 H new ATOM 0 H42 C A 10 -22.706 -1.276 -6.346 1.00 2.15 H new ATOM 0 H5 C A 10 -20.685 -1.603 -3.290 1.00 1.23 H new ATOM 0 H6 C A 10 -18.930 -3.270 -3.106 1.00 0.87 H new ATOM 329 P A A 11 -13.698 -6.446 -4.084 1.00 0.98 P ATOM 330 OP1 A A 11 -13.220 -7.756 -4.597 1.00 1.70 O ATOM 331 OP2 A A 11 -13.551 -6.127 -2.641 1.00 1.56 O ATOM 332 O5' A A 11 -12.987 -5.292 -4.920 1.00 0.76 O ATOM 333 C5' A A 11 -12.346 -5.573 -6.162 1.00 0.66 C ATOM 334 C4' A A 11 -12.256 -4.319 -7.001 1.00 0.60 C ATOM 335 O4' A A 11 -13.589 -3.878 -7.355 1.00 0.61 O ATOM 336 C3' A A 11 -11.661 -3.099 -6.316 1.00 0.56 C ATOM 337 O3' A A 11 -10.237 -3.141 -6.303 1.00 0.59 O ATOM 338 C2' A A 11 -12.196 -1.952 -7.166 1.00 0.55 C ATOM 339 O2' A A 11 -11.430 -1.782 -8.342 1.00 0.60 O ATOM 340 C1' A A 11 -13.573 -2.479 -7.575 1.00 0.59 C ATOM 341 N9 A A 11 -14.675 -1.875 -6.830 1.00 0.60 N ATOM 342 C8 A A 11 -15.124 -2.184 -5.569 1.00 0.62 C ATOM 343 N7 A A 11 -16.139 -1.453 -5.178 1.00 0.65 N ATOM 344 C5 A A 11 -16.377 -0.608 -6.253 1.00 0.66 C ATOM 345 C6 A A 11 -17.324 0.407 -6.469 1.00 0.73 C ATOM 346 N6 A A 11 -18.251 0.757 -5.576 1.00 0.78 N ATOM 347 N1 A A 11 -17.287 1.061 -7.650 1.00 0.77 N ATOM 348 C2 A A 11 -16.358 0.709 -8.548 1.00 0.75 C ATOM 349 N3 A A 11 -15.417 -0.228 -8.462 1.00 0.68 N ATOM 350 C4 A A 11 -15.481 -0.857 -7.276 1.00 0.64 C ATOM 0 H5' A A 11 -12.902 -6.340 -6.701 1.00 0.66 H new ATOM 0 H5'' A A 11 -11.347 -5.971 -5.982 1.00 0.66 H new ATOM 0 H4' A A 11 -11.615 -4.621 -7.829 1.00 0.60 H new ATOM 0 H3' A A 11 -11.932 -3.015 -5.264 1.00 0.56 H new ATOM 0 H2' A A 11 -12.189 -0.999 -6.637 1.00 0.55 H new ATOM 0 HO2' A A 11 -11.444 -0.839 -8.608 1.00 0.60 H new ATOM 0 H1' A A 11 -13.724 -2.221 -8.623 1.00 0.59 H new ATOM 0 H8 A A 11 -14.682 -2.957 -4.957 1.00 0.62 H new ATOM 0 H61 A A 11 -18.912 1.503 -5.793 1.00 0.78 H new ATOM 0 H62 A A 11 -18.299 0.278 -4.677 1.00 0.78 H new ATOM 0 H2 A A 11 -16.375 1.265 -9.474 1.00 0.75 H new ATOM 362 P U A 12 -9.414 -2.079 -5.418 1.00 0.55 P ATOM 363 OP1 U A 12 -7.980 -2.458 -5.495 1.00 0.62 O ATOM 364 OP2 U A 12 -10.069 -1.964 -4.091 1.00 0.54 O ATOM 365 O5' U A 12 -9.602 -0.695 -6.186 1.00 0.50 O ATOM 366 C5' U A 12 -9.082 -0.504 -7.502 1.00 0.58 C ATOM 367 C4' U A 12 -9.606 0.787 -8.091 1.00 0.58 C ATOM 368 O4' U A 12 -11.038 0.823 -7.906 1.00 0.55 O ATOM 369 C3' U A 12 -9.060 2.063 -7.448 1.00 0.55 C ATOM 370 O3' U A 12 -8.219 2.762 -8.360 1.00 0.67 O ATOM 371 C2' U A 12 -10.293 2.897 -7.064 1.00 0.50 C ATOM 372 O2' U A 12 -10.220 4.193 -7.626 1.00 0.57 O ATOM 373 C1' U A 12 -11.446 2.153 -7.733 1.00 0.55 C ATOM 374 N1 U A 12 -12.664 2.159 -6.914 1.00 0.53 N ATOM 375 C2 U A 12 -13.768 2.845 -7.385 1.00 0.60 C ATOM 376 O2 U A 12 -13.781 3.429 -8.454 1.00 0.68 O ATOM 377 N3 U A 12 -14.859 2.821 -6.554 1.00 0.62 N ATOM 378 C4 U A 12 -14.957 2.193 -5.331 1.00 0.57 C ATOM 379 O4 U A 12 -16.001 2.284 -4.685 1.00 0.63 O ATOM 380 C5 U A 12 -13.775 1.499 -4.923 1.00 0.50 C ATOM 381 C6 U A 12 -12.694 1.504 -5.707 1.00 0.47 C ATOM 0 H5' U A 12 -9.365 -1.343 -8.138 1.00 0.58 H new ATOM 0 H5'' U A 12 -7.993 -0.482 -7.470 1.00 0.58 H new ATOM 0 H4' U A 12 -9.286 0.781 -9.133 1.00 0.58 H new ATOM 0 H3' U A 12 -8.447 1.848 -6.573 1.00 0.55 H new ATOM 0 H2' U A 12 -10.391 3.010 -5.984 1.00 0.50 H new ATOM 0 HO2' U A 12 -9.405 4.270 -8.165 1.00 0.57 H new ATOM 0 H1' U A 12 -11.680 2.647 -8.676 1.00 0.55 H new ATOM 0 H3 U A 12 -15.687 3.322 -6.876 1.00 0.62 H new ATOM 0 H5 U A 12 -13.757 0.971 -3.981 1.00 0.50 H new ATOM 0 H6 U A 12 -11.812 0.974 -5.380 1.00 0.47 H new ATOM 392 P A A 13 -6.621 2.606 -8.257 1.00 0.77 P ATOM 393 OP1 A A 13 -6.073 2.821 -9.620 1.00 0.99 O ATOM 394 OP2 A A 13 -6.309 1.348 -7.531 1.00 0.84 O ATOM 395 O5' A A 13 -6.178 3.832 -7.341 1.00 0.60 O ATOM 396 C5' A A 13 -5.811 5.081 -7.920 1.00 0.48 C ATOM 397 C4' A A 13 -6.032 6.203 -6.932 1.00 0.43 C ATOM 398 O4' A A 13 -7.454 6.313 -6.631 1.00 0.42 O ATOM 399 C3' A A 13 -5.380 6.031 -5.566 1.00 0.38 C ATOM 400 O3' A A 13 -4.013 6.425 -5.558 1.00 0.38 O ATOM 401 C2' A A 13 -6.251 6.926 -4.701 1.00 0.33 C ATOM 402 O2' A A 13 -6.008 8.296 -4.958 1.00 0.34 O ATOM 403 C1' A A 13 -7.626 6.560 -5.244 1.00 0.36 C ATOM 404 N9 A A 13 -8.176 5.357 -4.624 1.00 0.35 N ATOM 405 C8 A A 13 -8.131 4.080 -5.116 1.00 0.41 C ATOM 406 N7 A A 13 -8.706 3.194 -4.339 1.00 0.39 N ATOM 407 C5 A A 13 -9.156 3.941 -3.259 1.00 0.33 C ATOM 408 C6 A A 13 -9.847 3.590 -2.085 1.00 0.32 C ATOM 409 N6 A A 13 -10.225 2.344 -1.791 1.00 0.35 N ATOM 410 N1 A A 13 -10.140 4.578 -1.211 1.00 0.29 N ATOM 411 C2 A A 13 -9.761 5.829 -1.507 1.00 0.27 C ATOM 412 N3 A A 13 -9.113 6.282 -2.576 1.00 0.27 N ATOM 413 C4 A A 13 -8.836 5.276 -3.423 1.00 0.30 C ATOM 0 H5' A A 13 -6.399 5.259 -8.820 1.00 0.48 H new ATOM 0 H5'' A A 13 -4.764 5.055 -8.223 1.00 0.48 H new ATOM 0 H4' A A 13 -5.588 7.066 -7.429 1.00 0.43 H new ATOM 0 H3' A A 13 -5.337 4.996 -5.226 1.00 0.38 H new ATOM 0 H2' A A 13 -6.098 6.792 -3.630 1.00 0.33 H new ATOM 0 HO2' A A 13 -5.123 8.400 -5.365 1.00 0.34 H new ATOM 0 H1' A A 13 -8.321 7.373 -5.033 1.00 0.36 H new ATOM 0 H8 A A 13 -7.665 3.826 -6.057 1.00 0.41 H new ATOM 0 H61 A A 13 -10.724 2.154 -0.922 1.00 0.35 H new ATOM 0 H62 A A 13 -10.015 1.582 -2.435 1.00 0.35 H new ATOM 0 H2 A A 13 -10.019 6.577 -0.772 1.00 0.27 H new ATOM 425 P A A 14 -3.037 5.886 -4.398 1.00 0.37 P ATOM 426 OP1 A A 14 -1.664 6.353 -4.720 1.00 0.41 O ATOM 427 OP2 A A 14 -3.292 4.435 -4.207 1.00 0.40 O ATOM 428 O5' A A 14 -3.527 6.654 -3.090 1.00 0.29 O ATOM 429 C5' A A 14 -3.405 8.069 -2.986 1.00 0.27 C ATOM 430 C4' A A 14 -4.519 8.632 -2.131 1.00 0.21 C ATOM 431 O4' A A 14 -5.719 7.833 -2.312 1.00 0.22 O ATOM 432 C3' A A 14 -4.285 8.604 -0.628 1.00 0.18 C ATOM 433 O3' A A 14 -3.476 9.706 -0.228 1.00 0.19 O ATOM 434 C2' A A 14 -5.706 8.652 -0.086 1.00 0.15 C ATOM 435 O2' A A 14 -6.249 9.956 -0.181 1.00 0.14 O ATOM 436 C1' A A 14 -6.425 7.745 -1.087 1.00 0.17 C ATOM 437 N9 A A 14 -6.480 6.335 -0.694 1.00 0.15 N ATOM 438 C8 A A 14 -5.998 5.254 -1.392 1.00 0.17 C ATOM 439 N7 A A 14 -6.206 4.105 -0.796 1.00 0.16 N ATOM 440 C5 A A 14 -6.865 4.452 0.375 1.00 0.14 C ATOM 441 C6 A A 14 -7.361 3.684 1.442 1.00 0.14 C ATOM 442 N6 A A 14 -7.270 2.354 1.502 1.00 0.16 N ATOM 443 N1 A A 14 -7.963 4.337 2.459 1.00 0.14 N ATOM 444 C2 A A 14 -8.055 5.672 2.398 1.00 0.12 C ATOM 445 N3 A A 14 -7.632 6.503 1.447 1.00 0.12 N ATOM 446 C4 A A 14 -7.037 5.822 0.453 1.00 0.13 C ATOM 0 H5' A A 14 -3.438 8.517 -3.979 1.00 0.27 H new ATOM 0 H5'' A A 14 -2.439 8.326 -2.552 1.00 0.27 H new ATOM 0 H4' A A 14 -4.590 9.669 -2.460 1.00 0.21 H new ATOM 0 H3' A A 14 -3.738 7.737 -0.259 1.00 0.18 H new ATOM 0 H2' A A 14 -5.784 8.363 0.962 1.00 0.15 H new ATOM 0 HO2' A A 14 -5.522 10.612 -0.203 1.00 0.14 H new ATOM 0 H1' A A 14 -7.458 8.087 -1.151 1.00 0.17 H new ATOM 0 H8 A A 14 -5.495 5.343 -2.343 1.00 0.17 H new ATOM 0 H61 A A 14 -7.650 1.852 2.305 1.00 0.16 H new ATOM 0 H62 A A 14 -6.820 1.839 0.745 1.00 0.16 H new ATOM 0 H2 A A 14 -8.542 6.141 3.240 1.00 0.12 H new ATOM 458 P C A 15 -2.036 9.436 0.436 1.00 0.21 P ATOM 459 OP1 C A 15 -1.386 10.748 0.685 1.00 0.23 O ATOM 460 OP2 C A 15 -1.337 8.414 -0.384 1.00 0.23 O ATOM 461 O5' C A 15 -2.404 8.782 1.839 1.00 0.19 O ATOM 462 C5' C A 15 -3.314 9.432 2.717 1.00 0.17 C ATOM 463 C4' C A 15 -3.825 8.462 3.750 1.00 0.16 C ATOM 464 O4' C A 15 -4.735 7.528 3.113 1.00 0.15 O ATOM 465 C3' C A 15 -2.785 7.555 4.387 1.00 0.15 C ATOM 466 O3' C A 15 -2.051 8.216 5.413 1.00 0.16 O ATOM 467 C2' C A 15 -3.649 6.417 4.911 1.00 0.14 C ATOM 468 O2' C A 15 -4.335 6.786 6.094 1.00 0.15 O ATOM 469 C1' C A 15 -4.668 6.279 3.777 1.00 0.14 C ATOM 470 N1 C A 15 -4.321 5.237 2.795 1.00 0.14 N ATOM 471 C2 C A 15 -4.549 3.897 3.128 1.00 0.14 C ATOM 472 O2 C A 15 -5.040 3.626 4.234 1.00 0.14 O ATOM 473 N3 C A 15 -4.228 2.931 2.239 1.00 0.14 N ATOM 474 C4 C A 15 -3.704 3.261 1.057 1.00 0.14 C ATOM 475 N4 C A 15 -3.410 2.278 0.209 1.00 0.14 N ATOM 476 C5 C A 15 -3.461 4.616 0.690 1.00 0.14 C ATOM 477 C6 C A 15 -3.783 5.565 1.581 1.00 0.14 C ATOM 0 H5' C A 15 -4.149 9.842 2.149 1.00 0.17 H new ATOM 0 H5'' C A 15 -2.820 10.271 3.208 1.00 0.17 H new ATOM 0 H4' C A 15 -4.255 9.109 4.515 1.00 0.16 H new ATOM 0 H3' C A 15 -2.004 7.223 3.703 1.00 0.15 H new ATOM 0 H2' C A 15 -3.080 5.520 5.155 1.00 0.14 H new ATOM 0 HO2' C A 15 -4.882 6.034 6.403 1.00 0.15 H new ATOM 0 H1' C A 15 -5.620 5.984 4.217 1.00 0.14 H new ATOM 0 H41 C A 15 -3.008 2.494 -0.703 1.00 0.14 H new ATOM 0 H42 C A 15 -3.587 1.308 0.471 1.00 0.14 H new ATOM 0 H5 C A 15 -3.034 4.869 -0.269 1.00 0.14 H new ATOM 0 H6 C A 15 -3.615 6.603 1.336 1.00 0.14 H new ATOM 489 P C A 16 -0.542 7.759 5.734 1.00 0.15 P ATOM 490 OP1 C A 16 0.103 8.819 6.551 1.00 1.08 O ATOM 491 OP2 C A 16 0.087 7.334 4.456 1.00 1.07 O ATOM 492 O5' C A 16 -0.720 6.463 6.642 1.00 0.14 O ATOM 493 C5' C A 16 -1.533 6.494 7.811 1.00 0.15 C ATOM 494 C4' C A 16 -1.618 5.115 8.417 1.00 0.14 C ATOM 495 O4' C A 16 -2.510 4.297 7.613 1.00 0.13 O ATOM 496 C3' C A 16 -0.314 4.333 8.440 1.00 0.12 C ATOM 497 O3' C A 16 0.488 4.677 9.565 1.00 0.13 O ATOM 498 C2' C A 16 -0.802 2.890 8.483 1.00 0.12 C ATOM 499 O2' C A 16 -1.225 2.524 9.784 1.00 0.13 O ATOM 500 C1' C A 16 -2.030 2.964 7.575 1.00 0.13 C ATOM 501 N1 C A 16 -1.762 2.605 6.170 1.00 0.13 N ATOM 502 C2 C A 16 -1.669 1.251 5.821 1.00 0.13 C ATOM 503 O2 C A 16 -1.819 0.390 6.701 1.00 0.13 O ATOM 504 N3 C A 16 -1.417 0.917 4.534 1.00 0.13 N ATOM 505 C4 C A 16 -1.263 1.873 3.615 1.00 0.13 C ATOM 506 N4 C A 16 -1.018 1.499 2.359 1.00 0.14 N ATOM 507 C5 C A 16 -1.354 3.256 3.941 1.00 0.13 C ATOM 508 C6 C A 16 -1.602 3.573 5.218 1.00 0.13 C ATOM 0 H5' C A 16 -2.531 6.852 7.560 1.00 0.15 H new ATOM 0 H5'' C A 16 -1.116 7.194 8.536 1.00 0.15 H new ATOM 0 H4' C A 16 -1.945 5.293 9.441 1.00 0.14 H new ATOM 0 H3' C A 16 0.337 4.535 7.589 1.00 0.12 H new ATOM 0 H2' C A 16 -0.038 2.169 8.193 1.00 0.12 H new ATOM 0 HO2' C A 16 -1.533 1.594 9.778 1.00 0.13 H new ATOM 0 H1' C A 16 -2.753 2.238 7.947 1.00 0.13 H new ATOM 0 H41 C A 16 -0.895 2.204 1.632 1.00 0.14 H new ATOM 0 H42 C A 16 -0.953 0.508 2.125 1.00 0.14 H new ATOM 0 H5 C A 16 -1.228 4.020 3.188 1.00 0.13 H new ATOM 0 H6 C A 16 -1.677 4.613 5.501 1.00 0.13 H new ATOM 520 P C A 17 2.090 4.614 9.451 1.00 0.12 P ATOM 521 OP1 C A 17 2.666 5.290 10.643 1.00 0.80 O ATOM 522 OP2 C A 17 2.464 5.082 8.091 1.00 0.83 O ATOM 523 O5' C A 17 2.420 3.058 9.547 1.00 0.11 O ATOM 524 C5' C A 17 2.012 2.295 10.680 1.00 0.12 C ATOM 525 C4' C A 17 2.271 0.824 10.445 1.00 0.12 C ATOM 526 O4' C A 17 1.331 0.320 9.457 1.00 0.12 O ATOM 527 C3' C A 17 3.628 0.468 9.858 1.00 0.11 C ATOM 528 O3' C A 17 4.653 0.449 10.847 1.00 0.12 O ATOM 529 C2' C A 17 3.358 -0.906 9.259 1.00 0.11 C ATOM 530 O2' C A 17 3.314 -1.909 10.256 1.00 0.12 O ATOM 531 C1' C A 17 1.948 -0.710 8.700 1.00 0.12 C ATOM 532 N1 C A 17 1.929 -0.328 7.277 1.00 0.11 N ATOM 533 C2 C A 17 2.142 -1.316 6.308 1.00 0.12 C ATOM 534 O2 C A 17 2.318 -2.488 6.673 1.00 0.12 O ATOM 535 N3 C A 17 2.149 -0.970 5.001 1.00 0.12 N ATOM 536 C4 C A 17 1.953 0.302 4.648 1.00 0.12 C ATOM 537 N4 C A 17 1.982 0.599 3.349 1.00 0.12 N ATOM 538 C5 C A 17 1.721 1.326 5.611 1.00 0.11 C ATOM 539 C6 C A 17 1.718 0.970 6.901 1.00 0.11 C ATOM 0 H5' C A 17 0.952 2.458 10.874 1.00 0.12 H new ATOM 0 H5'' C A 17 2.553 2.629 11.565 1.00 0.12 H new ATOM 0 H4' C A 17 2.189 0.394 11.443 1.00 0.12 H new ATOM 0 H3' C A 17 3.999 1.190 9.130 1.00 0.11 H new ATOM 0 H2' C A 17 4.117 -1.220 8.543 1.00 0.11 H new ATOM 0 HO2' C A 17 3.138 -2.778 9.838 1.00 0.12 H new ATOM 0 H1' C A 17 1.421 -1.661 8.774 1.00 0.12 H new ATOM 0 H41 C A 17 1.836 1.561 3.042 1.00 0.12 H new ATOM 0 H42 C A 17 2.150 -0.136 2.662 1.00 0.12 H new ATOM 0 H5 C A 17 1.554 2.350 5.311 1.00 0.11 H new ATOM 0 H6 C A 17 1.546 1.721 7.658 1.00 0.11 H new ATOM 551 P U A 18 6.180 0.721 10.419 1.00 0.11 P ATOM 552 OP1 U A 18 6.975 0.948 11.653 1.00 0.81 O ATOM 553 OP2 U A 18 6.174 1.754 9.350 1.00 0.82 O ATOM 554 O5' U A 18 6.645 -0.657 9.769 1.00 0.11 O ATOM 555 C5' U A 18 6.497 -1.885 10.476 1.00 0.13 C ATOM 556 C4' U A 18 6.922 -3.043 9.604 1.00 0.12 C ATOM 557 O4' U A 18 5.901 -3.286 8.599 1.00 0.12 O ATOM 558 C3' U A 18 8.193 -2.824 8.798 1.00 0.13 C ATOM 559 O3' U A 18 9.355 -3.082 9.580 1.00 0.15 O ATOM 560 C2' U A 18 8.016 -3.807 7.647 1.00 0.13 C ATOM 561 O2' U A 18 8.302 -5.134 8.050 1.00 0.14 O ATOM 562 C1' U A 18 6.513 -3.691 7.385 1.00 0.12 C ATOM 563 N1 U A 18 6.164 -2.715 6.341 1.00 0.11 N ATOM 564 C2 U A 18 6.314 -3.102 5.020 1.00 0.12 C ATOM 565 O2 U A 18 6.712 -4.207 4.694 1.00 0.13 O ATOM 566 N3 U A 18 5.979 -2.146 4.094 1.00 0.12 N ATOM 567 C4 U A 18 5.520 -0.870 4.347 1.00 0.12 C ATOM 568 O4 U A 18 5.249 -0.125 3.406 1.00 0.12 O ATOM 569 C5 U A 18 5.393 -0.549 5.733 1.00 0.10 C ATOM 570 C6 U A 18 5.708 -1.455 6.662 1.00 0.10 C ATOM 0 H5' U A 18 5.459 -2.013 10.783 1.00 0.13 H new ATOM 0 H5'' U A 18 7.098 -1.865 11.385 1.00 0.13 H new ATOM 0 H4' U A 18 7.084 -3.857 10.310 1.00 0.12 H new ATOM 0 H3' U A 18 8.337 -1.799 8.456 1.00 0.13 H new ATOM 0 H2' U A 18 8.665 -3.596 6.798 1.00 0.13 H new ATOM 0 HO2' U A 18 8.178 -5.741 7.290 1.00 0.14 H new ATOM 0 H1' U A 18 6.164 -4.662 7.032 1.00 0.12 H new ATOM 0 H3 U A 18 6.080 -2.407 3.113 1.00 0.12 H new ATOM 0 H5 U A 18 5.042 0.428 6.030 1.00 0.10 H new ATOM 0 H6 U A 18 5.601 -1.190 7.704 1.00 0.10 H new ATOM 581 P G A 19 10.714 -2.274 9.284 1.00 0.16 P ATOM 582 OP1 G A 19 11.648 -2.513 10.412 1.00 1.30 O ATOM 583 OP2 G A 19 10.345 -0.881 8.923 1.00 1.27 O ATOM 584 O5' G A 19 11.303 -2.985 7.987 1.00 0.17 O ATOM 585 C5' G A 19 11.490 -4.397 7.952 1.00 0.18 C ATOM 586 C4' G A 19 11.866 -4.841 6.558 1.00 0.18 C ATOM 587 O4' G A 19 10.698 -4.778 5.697 1.00 0.17 O ATOM 588 C3' G A 19 12.881 -3.969 5.839 1.00 0.19 C ATOM 589 O3' G A 19 14.213 -4.252 6.256 1.00 0.22 O ATOM 590 C2' G A 19 12.626 -4.329 4.381 1.00 0.20 C ATOM 591 O2' G A 19 13.190 -5.585 4.050 1.00 0.21 O ATOM 592 C1' G A 19 11.103 -4.463 4.374 1.00 0.18 C ATOM 593 N9 G A 19 10.408 -3.248 3.953 1.00 0.16 N ATOM 594 C8 G A 19 9.751 -2.345 4.753 1.00 0.14 C ATOM 595 N7 G A 19 9.221 -1.357 4.085 1.00 0.13 N ATOM 596 C5 G A 19 9.550 -1.622 2.763 1.00 0.15 C ATOM 597 C6 G A 19 9.246 -0.902 1.578 1.00 0.16 C ATOM 598 O6 G A 19 8.600 0.144 1.455 1.00 0.15 O ATOM 599 N1 G A 19 9.779 -1.522 0.453 1.00 0.18 N ATOM 600 C2 G A 19 10.507 -2.685 0.466 1.00 0.20 C ATOM 601 N2 G A 19 10.951 -3.114 -0.715 1.00 0.22 N ATOM 602 N3 G A 19 10.787 -3.371 1.560 1.00 0.19 N ATOM 603 C4 G A 19 10.284 -2.785 2.665 1.00 0.17 C ATOM 0 H5' G A 19 10.576 -4.900 8.267 1.00 0.18 H new ATOM 0 H5'' G A 19 12.271 -4.685 8.656 1.00 0.18 H new ATOM 0 H4' G A 19 12.286 -5.835 6.714 1.00 0.18 H new ATOM 0 H3' G A 19 12.776 -2.903 6.041 1.00 0.19 H new ATOM 0 H2' G A 19 13.046 -3.608 3.679 1.00 0.20 H new ATOM 0 HO2' G A 19 13.008 -5.788 3.109 1.00 0.21 H new ATOM 0 H1' G A 19 10.842 -5.237 3.653 1.00 0.18 H new ATOM 0 H8 G A 19 9.680 -2.443 5.826 1.00 0.14 H new ATOM 0 H1 G A 19 9.616 -1.078 -0.451 1.00 0.18 H new ATOM 0 H21 G A 19 11.498 -3.973 -0.773 1.00 0.22 H new ATOM 0 H22 G A 19 10.743 -2.584 -1.561 1.00 0.22 H new ATOM 615 P C A 20 15.340 -3.111 6.154 1.00 0.24 P ATOM 616 OP1 C A 20 16.572 -3.612 6.816 1.00 0.27 O ATOM 617 OP2 C A 20 14.734 -1.833 6.604 1.00 0.22 O ATOM 618 O5' C A 20 15.628 -2.997 4.591 1.00 0.25 O ATOM 619 C5' C A 20 16.113 -4.116 3.853 1.00 0.26 C ATOM 620 C4' C A 20 16.251 -3.758 2.392 1.00 0.27 C ATOM 621 O4' C A 20 14.930 -3.620 1.804 1.00 0.25 O ATOM 622 C3' C A 20 16.919 -2.423 2.099 1.00 0.28 C ATOM 623 O3' C A 20 18.339 -2.515 2.146 1.00 0.31 O ATOM 624 C2' C A 20 16.395 -2.102 0.705 1.00 0.28 C ATOM 625 O2' C A 20 17.072 -2.849 -0.289 1.00 0.31 O ATOM 626 C1' C A 20 14.957 -2.614 0.804 1.00 0.25 C ATOM 627 N1 C A 20 13.978 -1.569 1.163 1.00 0.22 N ATOM 628 C2 C A 20 13.539 -0.681 0.172 1.00 0.22 C ATOM 629 O2 C A 20 13.978 -0.800 -0.981 1.00 0.24 O ATOM 630 N3 C A 20 12.648 0.284 0.499 1.00 0.19 N ATOM 631 C4 C A 20 12.197 0.380 1.752 1.00 0.17 C ATOM 632 N4 C A 20 11.313 1.340 2.027 1.00 0.14 N ATOM 633 C5 C A 20 12.627 -0.509 2.779 1.00 0.17 C ATOM 634 C6 C A 20 13.507 -1.460 2.442 1.00 0.20 C ATOM 0 H5' C A 20 15.430 -4.958 3.965 1.00 0.26 H new ATOM 0 H5'' C A 20 17.078 -4.432 4.250 1.00 0.26 H new ATOM 0 H4' C A 20 16.865 -4.562 1.988 1.00 0.27 H new ATOM 0 H3' C A 20 16.692 -1.647 2.830 1.00 0.28 H new ATOM 0 H2' C A 20 16.510 -1.053 0.433 1.00 0.28 H new ATOM 0 HO2' C A 20 16.712 -2.621 -1.171 1.00 0.31 H new ATOM 0 H1' C A 20 14.670 -2.985 -0.180 1.00 0.25 H new ATOM 0 H41 C A 20 10.948 1.441 2.974 1.00 0.14 H new ATOM 0 H42 C A 20 11.002 1.973 1.290 1.00 0.14 H new ATOM 0 H5 C A 20 12.257 -0.419 3.790 1.00 0.17 H new ATOM 0 H6 C A 20 13.851 -2.154 3.194 1.00 0.20 H new ATOM 646 P C A 21 19.211 -1.205 2.475 1.00 0.32 P ATOM 647 OP1 C A 21 20.620 -1.624 2.684 1.00 0.35 O ATOM 648 OP2 C A 21 18.505 -0.448 3.541 1.00 0.30 O ATOM 649 O5' C A 21 19.138 -0.350 1.133 1.00 0.32 O ATOM 650 C5' C A 21 19.670 -0.859 -0.087 1.00 0.34 C ATOM 651 C4' C A 21 19.420 0.116 -1.214 1.00 0.34 C ATOM 652 O4' C A 21 17.994 0.182 -1.469 1.00 0.31 O ATOM 653 C3' C A 21 19.821 1.557 -0.935 1.00 0.34 C ATOM 654 O3' C A 21 21.207 1.795 -1.191 1.00 0.37 O ATOM 655 C2' C A 21 18.917 2.339 -1.881 1.00 0.32 C ATOM 656 O2' C A 21 19.430 2.329 -3.201 1.00 0.35 O ATOM 657 C1' C A 21 17.637 1.500 -1.846 1.00 0.30 C ATOM 658 N1 C A 21 16.622 1.996 -0.898 1.00 0.27 N ATOM 659 C2 C A 21 15.825 3.087 -1.266 1.00 0.25 C ATOM 660 O2 C A 21 15.986 3.601 -2.383 1.00 0.26 O ATOM 661 N3 C A 21 14.899 3.552 -0.395 1.00 0.21 N ATOM 662 C4 C A 21 14.755 2.971 0.798 1.00 0.20 C ATOM 663 N4 C A 21 13.837 3.467 1.628 1.00 0.17 N ATOM 664 C5 C A 21 15.546 1.857 1.196 1.00 0.22 C ATOM 665 C6 C A 21 16.460 1.407 0.326 1.00 0.25 C ATOM 0 H5' C A 21 19.211 -1.820 -0.319 1.00 0.34 H new ATOM 0 H5'' C A 21 20.740 -1.035 0.020 1.00 0.34 H new ATOM 0 H4' C A 21 20.026 -0.263 -2.037 1.00 0.34 H new ATOM 0 H3' C A 21 19.701 1.841 0.110 1.00 0.34 H new ATOM 0 H2' C A 21 18.800 3.385 -1.598 1.00 0.32 H new ATOM 0 HO2' C A 21 20.377 2.076 -3.182 1.00 0.35 H new ATOM 0 HO3' C A 21 21.419 2.733 -1.000 1.00 0.37 H new ATOM 0 H1' C A 21 17.189 1.552 -2.838 1.00 0.30 H new ATOM 0 H41 C A 21 13.701 3.047 2.547 1.00 0.17 H new ATOM 0 H42 C A 21 13.271 4.266 1.343 1.00 0.17 H new ATOM 0 H5 C A 21 15.415 1.392 2.162 1.00 0.22 H new ATOM 0 H6 C A 21 17.080 0.565 0.596 1.00 0.25 H new TER 678 C A 21 END