USER MOD reduce.3.24.130724 H: found=0, std=0, add=310, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 316 hydrogens (12 hets) HEADER RNA 28-DEC-16 5MRX TITLE 27-NT SRL WITH A 5-HYDROXYMETHYL CYTIDINE MODIFICATION COMPND MOL_ID: 1; COMPND 2 MOLECULE: RNA (27-MER); COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 OTHER_DETAILS: MRC=5HYDROXYMETHYL-CYTOSINE SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 4 ORGANISM_TAXID: 562 KEYWDS RNA, MODIFICATION, TETRALOOP EXPDTA X-RAY DIFFRACTION AUTHOR E.ENNIFAR,R.MICURA REVDAT 1 17-JAN-18 5MRX 0 JRNL AUTH E.ENNIFAR,R.MICURA JRNL TITL XRAY STRUCTURE OF 5HMRC-MODIFIED RNA AT ATOMIC RESOLUTION JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 0.85 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX 1.9_1692 REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 0.85 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 29.51 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.370 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 3 NUMBER OF REFLECTIONS : 57106 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.159 REMARK 3 R VALUE (WORKING SET) : 0.145 REMARK 3 FREE R VALUE : 0.168 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.030 REMARK 3 FREE R VALUE TEST SET COUNT : 2870 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 27.5609 - 2.3092 0.95 2761 146 0.1034 0.1790 REMARK 3 2 2.3092 - 1.8330 0.95 2725 143 0.1365 0.1544 REMARK 3 3 1.8330 - 1.6013 0.95 2740 144 0.1350 0.1436 REMARK 3 4 1.6013 - 1.4549 0.95 2740 145 0.1621 0.1583 REMARK 3 5 1.4549 - 1.3506 0.95 2695 141 0.1706 0.1821 REMARK 3 6 1.3506 - 1.2710 0.95 2736 145 0.1724 0.1740 REMARK 3 7 1.2710 - 1.2073 0.95 2740 144 0.1767 0.1628 REMARK 3 8 1.2073 - 1.1548 0.95 2722 143 0.1767 0.1958 REMARK 3 9 1.1548 - 1.1103 0.95 2721 143 0.1770 0.1693 REMARK 3 10 1.1103 - 1.0720 0.95 2725 144 0.1803 0.1878 REMARK 3 11 1.0720 - 1.0385 0.95 2699 142 0.1776 0.1845 REMARK 3 12 1.0385 - 1.0088 0.95 2732 143 0.1894 0.1919 REMARK 3 13 1.0088 - 0.9822 0.95 2687 142 0.2074 0.2014 REMARK 3 14 0.9822 - 0.9583 0.95 2721 143 0.2282 0.2390 REMARK 3 15 0.9583 - 0.9365 0.95 2751 145 0.2649 0.2613 REMARK 3 16 0.9365 - 0.9166 0.95 2694 142 0.2824 0.2962 REMARK 3 17 0.9166 - 0.8982 0.95 2720 143 0.3180 0.3180 REMARK 3 18 0.8982 - 0.8813 0.95 2711 143 0.3392 0.3515 REMARK 3 19 0.8813 - 0.8655 0.93 2649 139 0.3646 0.4058 REMARK 3 20 0.8655 - 0.8509 0.89 2577 136 0.4112 0.4468 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : NULL REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 18.780 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.006 707 REMARK 3 ANGLE : 1.123 1107 REMARK 3 CHIRALITY : 0.047 147 REMARK 3 PLANARITY : 0.013 30 REMARK 3 DIHEDRAL : 12.481 347 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 5MRX COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 29-DEC-16. REMARK 100 THE DEPOSITION ID IS D_1200002914. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 27-NOV-16 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SLS REMARK 200 BEAMLINE : X06DA REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.77 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 2M REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 57106 REMARK 200 RESOLUTION RANGE HIGH (A) : 0.850 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 200 DATA REDUNDANCY : 22.36 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 30.3200 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: 3DVZ REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 35.45 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.91 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: WELL: 3.0M (NH4)2SO4 DROP: 50MM KMOPS REMARK 280 PH7.0, 10MM MNCL2, 10MM MGCL2, 1.0MM NA-EDTA PH 8.0, 10MM TRIS REMARK 280 PH 8.0, RNA 2.5MG/ML 2VOL DROP + 1VOL WELL, VAPOR DIFFUSION, REMARK 280 SITTING DROP, TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y,X,Z+3/4 REMARK 290 4555 Y,-X,Z+1/4 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 38.40000 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 57.60000 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 19.20000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 0 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 4820 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: 0.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 2709 O HOH A 2741 1.99 REMARK 500 O HOH A 2814 O HOH A 2871 2.04 REMARK 500 O HOH A 2791 O HOH A 2873 2.05 REMARK 500 O HOH A 2834 O HOH A 2873 2.07 REMARK 500 O HOH A 2774 O HOH A 2811 2.08 REMARK 500 O HOH A 2844 O HOH A 2858 2.10 REMARK 500 O HOH A 2896 O HOH A 2901 2.11 REMARK 500 O HOH A 2842 O HOH A 2847 2.12 REMARK 500 O HOH A 2823 O HOH A 2830 2.12 REMARK 500 O HOH A 2797 O HOH A 2823 2.12 REMARK 500 O HOH A 2709 O HOH A 2856 2.13 REMARK 500 O HOH A 2843 O HOH A 2863 2.13 REMARK 500 O HOH A 2802 O HOH A 2846 2.13 REMARK 500 O HOH A 2833 O HOH A 2861 2.14 REMARK 500 O HOH A 2821 O HOH A 2884 2.14 REMARK 500 O HOH A 2805 O HOH A 2875 2.14 REMARK 500 O HOH A 2838 O HOH A 2862 2.15 REMARK 500 O HOH A 2830 O HOH A 2888 2.15 REMARK 500 O HOH A 2755 O HOH A 2775 2.16 REMARK 500 O HOH A 2829 O HOH A 2839 2.17 REMARK 500 O HOH A 2776 O HOH A 2816 2.17 REMARK 500 O HOH A 2728 O HOH A 2840 2.18 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 HO2' U A 2653 H22 G A 2661 1565 1.33 REMARK 500 O HOH A 2782 O HOH A 2791 3674 2.08 REMARK 500 O HOH A 2703 O HOH A 2776 3684 2.08 REMARK 500 O HOH A 2848 O HOH A 2903 4465 2.15 REMARK 500 O HOH A 2893 O HOH A 2906 1645 2.16 REMARK 500 O HOH A 2900 O HOH A 2909 3664 2.16 REMARK 500 O HOH A 2902 O HOH A 2904 1465 2.16 REMARK 500 O HOH A 2782 O HOH A 2873 3674 2.18 REMARK 500 O HOH A 2890 O HOH A 2901 1545 2.19 REMARK 500 O HOH A 2763 O HOH A 2800 4365 2.19 REMARK 500 O HOH A 2797 O HOH A 2836 4365 2.19 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 5HM A2651 O3' - P - OP1 ANGL. DEV. = -16.9 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A2895 DISTANCE = 5.83 ANGSTROMS REMARK 525 HOH A2896 DISTANCE = 5.86 ANGSTROMS REMARK 525 HOH A2897 DISTANCE = 5.91 ANGSTROMS REMARK 525 HOH A2898 DISTANCE = 5.94 ANGSTROMS REMARK 525 HOH A2899 DISTANCE = 6.02 ANGSTROMS REMARK 525 HOH A2900 DISTANCE = 6.17 ANGSTROMS REMARK 525 HOH A2901 DISTANCE = 6.31 ANGSTROMS REMARK 525 HOH A2902 DISTANCE = 6.32 ANGSTROMS REMARK 525 HOH A2903 DISTANCE = 6.38 ANGSTROMS REMARK 525 HOH A2904 DISTANCE = 6.70 ANGSTROMS REMARK 525 HOH A2905 DISTANCE = 6.74 ANGSTROMS REMARK 525 HOH A2906 DISTANCE = 6.83 ANGSTROMS REMARK 525 HOH A2907 DISTANCE = 7.14 ANGSTROMS REMARK 525 HOH A2908 DISTANCE = 8.24 ANGSTROMS REMARK 525 HOH A2909 DISTANCE = 8.93 ANGSTROMS REMARK 525 HOH A2910 DISTANCE = 9.38 ANGSTROMS REMARK 525 HOH A2911 DISTANCE = 10.42 ANGSTROMS DBREF 5MRX A 2647 2673 PDB 5MRX 5MRX 2647 2673 SEQRES 1 A 27 U G C U 5HM C U A G U A C G SEQRES 2 A 27 A G A G G A C C G G A G U SEQRES 3 A 27 G HET 5HM A2651 34 HETNAM 5HM 5-(HYDROXYMETHYL)CYTIDINE 5'-(DIHYDROGEN PHOSPHATE) HETSYN 5HM 5-HYDROXYMETHYLCYTIDINE 5'-MONOPHOSPHATE FORMUL 1 5HM C10 H16 N3 O9 P FORMUL 2 HOH *211(H2 O) LINK O3' U A2650 P 5HM A2651 1555 1555 1.60 LINK O3' 5HM A2651 P C A2652 1555 1555 1.60 CRYST1 29.510 29.510 76.800 90.00 90.00 90.00 P 43 4 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 0.033887 0.000000 0.000000 0.00000 SCALE2 0.000000 0.033887 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013021 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 : A2647 U O2' : rot 152:sc= 0.785 USER MOD Single : A2647 U O5' : rot -98:sc= 0.327 USER MOD Single : A2648 G O2'A: rot -17:sc= 0.0913 USER MOD Single : A2648 G O2'B: rot 180:sc=-0.00846 USER MOD Single : A2649 C O2'A: rot -16:sc= 0.0404 USER MOD Single : A2649 C O2'B: rot -25:sc= 0.025 USER MOD Single : A2650 U O2' : rot -104:sc= 1.44 USER MOD Single : A2652 C O2' : rot 84:sc= 0.879 USER MOD Single : A2653 U O2' : rot -102:sc= 1.23 USER MOD Single : A2654 A O2' : rot -74:sc= 1.51 USER MOD Single : A2655 G O2' : rot 142:sc= 1.94 USER MOD Single : A2656 U O2' : rot -22:sc= 0.0681 USER MOD Single : A2657 A O2' : rot -30:sc= 0.12 USER MOD Single : A2658 C O2' : rot -14:sc= 0.566 USER MOD Single : A2659 G O2' : rot -127:sc= 2.31 USER MOD Single : A2660 A O2' : rot -26:sc= 0.226 USER MOD Single : A2661 G O2' : rot 168:sc= 0.763 USER MOD Single : A2662 A O2' : rot -24:sc= 0.0748 USER MOD Single : A2663 G O2' : rot -29:sc= 0.0789 USER MOD Single : A2664 G O2' : rot -83:sc= 1.16 USER MOD Single : A2665 A O2' : rot -138:sc= 2.45 USER MOD Single : A2666 C O2' : rot -18:sc= 1.08 USER MOD Single : A2667 C O2' : rot -155:sc= 1.61 USER MOD Single : A2668 G O2' : rot -19:sc=0.000848 USER MOD Single : A2669 G O2' : rot -16:sc= 1.06 USER MOD Single : A2670 A O2' : rot -25:sc= 0.0388 USER MOD Single : A2671 G O2' : rot -177:sc= 1.45 USER MOD Single : A2672 U O2' : rot -25:sc= 0.871 USER MOD Single : A2673 G O2' : rot -23:sc= 1.07 USER MOD Single : A2673 G O3' : rot 180:sc= 0.0276 USER MOD ----------------------------------------------------------------- ATOM 1 O5' U A2647 -28.347 51.500 -6.694 1.00 24.93 O ANISOU 1 O5' U A2647 3029 3297 3145 152 -235 -496 O ATOM 2 C5' U A2647 -28.352 51.646 -8.110 1.00 24.55 C ANISOU 2 C5' U A2647 2967 3329 3031 -148 -120 -466 C ATOM 3 C4' U A2647 -27.324 52.645 -8.586 1.00 24.26 C ANISOU 3 C4' U A2647 3018 3347 2851 668 33 -79 C ATOM 4 O4' U A2647 -27.842 53.994 -8.408 1.00 23.04 O ANISOU 4 O4' U A2647 2644 3425 2686 1231 -269 276 O ATOM 5 C3' U A2647 -25.982 52.607 -7.852 1.00 24.63 C ANISOU 5 C3' U A2647 3319 3022 3018 271 162 328 C ATOM 6 O3'A U A2647 -24.938 52.939 -8.768 0.96 27.85 O ANISOU 6 O3'A U A2647 3627 3382 3572 -255 416 665 O ATOM 7 O3'B U A2647 -24.923 52.950 -8.739 0.04 23.59 O ANISOU 7 O3'B U A2647 3281 2823 2857 -123 329 296 O ATOM 8 C2' U A2647 -26.133 53.719 -6.829 1.00 23.15 C ANISOU 8 C2' U A2647 3008 2968 2819 747 -263 447 C ATOM 9 O2' U A2647 -24.916 54.254 -6.361 1.00 25.55 O ANISOU 9 O2' U A2647 3376 3309 3021 1696 -476 611 O ATOM 10 C1' U A2647 -26.942 54.745 -7.618 1.00 22.87 C ANISOU 10 C1' U A2647 2778 3276 2636 940 -383 403 C ATOM 11 N1 U A2647 -27.700 55.662 -6.759 1.00 22.49 N ANISOU 11 N1 U A2647 3043 2924 2577 1063 -902 711 N ATOM 12 C2 U A2647 -27.115 56.867 -6.433 1.00 20.79 C ANISOU 12 C2 U A2647 3033 2228 2639 791 -854 788 C ATOM 13 O2 U A2647 -26.027 57.228 -6.839 1.00 17.72 O ANISOU 13 O2 U A2647 2475 1774 2482 521 -924 560 O ATOM 14 N3 U A2647 -27.865 57.647 -5.602 1.00 21.24 N ANISOU 14 N3 U A2647 2997 2454 2617 668 -898 953 N ATOM 15 C4 U A2647 -29.099 57.354 -5.076 1.00 22.43 C ANISOU 15 C4 U A2647 3131 2834 2557 644 -966 1045 C ATOM 16 O4 U A2647 -29.648 58.173 -4.350 1.00 25.64 O ANISOU 16 O4 U A2647 3892 3312 2536 441 -1052 1232 O ATOM 17 C5 U A2647 -29.633 56.089 -5.447 1.00 22.76 C ANISOU 17 C5 U A2647 2852 2906 2888 1012 -929 855 C ATOM 18 C6 U A2647 -28.924 55.303 -6.255 1.00 22.09 C ANISOU 18 C6 U A2647 2558 3072 2762 1145 -870 533 C ATOM 0 H5' U A2647 -29.233 51.928 -8.401 1.00 24.55 H new ATOM 0 H5'' U A2647 -28.179 50.785 -8.523 1.00 24.55 H new ATOM 0 H4' U A2647 -27.163 52.403 -9.511 1.00 24.26 H new ATOM 0 H3'A U A2647 -25.768 51.745 -7.462 0.96 24.63 H new ATOM 0 H3'B U A2647 -25.779 51.736 -7.477 0.04 24.63 H new ATOM 0 H2' U A2647 -26.547 53.413 -6.007 1.00 23.15 H new ATOM 0 HO2' U A2647 -25.031 55.053 -6.130 1.00 25.55 H new ATOM 0 HO5' U A2647 -27.900 50.820 -6.484 1.00 24.93 H new ATOM 0 H1' U A2647 -26.343 55.301 -8.140 1.00 22.87 H new ATOM 0 H3 U A2647 -27.527 58.407 -5.383 1.00 21.24 H new ATOM 0 H5 U A2647 -30.464 55.815 -5.131 1.00 22.76 H new ATOM 0 H6 U A2647 -29.274 54.474 -6.488 1.00 22.09 H new ATOM 29 P A G A2648 -23.781 51.878 -9.114 0.62 22.01 P ANISOU 29 P A G A2648 2007 2515 3841 522 671 838 P ATOM 30 P B G A2648 -23.490 52.244 -8.575 0.38 17.80 P ANISOU 30 P B G A2648 2310 1933 2520 238 467 142 P ATOM 31 OP1A G A2648 -24.048 50.639 -8.344 0.62 24.13 O ANISOU 31 OP1A G A2648 2869 2237 4061 1019 533 668 O ATOM 32 OP1B G A2648 -23.537 51.375 -7.371 0.38 15.74 O ANISOU 32 OP1B G A2648 1883 1576 2519 324 478 -142 O ATOM 33 OP2A G A2648 -22.474 52.561 -8.950 0.62 23.22 O ANISOU 33 OP2A G A2648 2453 2468 3902 1178 441 924 O ATOM 34 OP2B G A2648 -22.417 53.260 -8.698 0.38 18.07 O ANISOU 34 OP2B G A2648 2523 1876 2466 404 212 122 O ATOM 35 O5'A G A2648 -23.987 51.564 -10.662 0.62 18.08 O ANISOU 35 O5'A G A2648 1706 1610 3553 529 726 586 O ATOM 36 O5'B G A2648 -23.421 51.294 -9.844 0.38 16.15 O ANISOU 36 O5'B G A2648 2115 1777 2243 160 727 1 O ATOM 37 C5'A G A2648 -24.762 50.455 -11.096 0.62 17.89 C ANISOU 37 C5'A G A2648 1752 1704 3339 -68 726 232 C ATOM 38 C5'B G A2648 -24.508 50.440 -10.151 0.38 15.87 C ANISOU 38 C5'B G A2648 2114 1876 2038 70 841 145 C ATOM 39 C4'A G A2648 -25.442 50.732 -12.417 0.62 16.24 C ANISOU 39 C4'A G A2648 1687 1467 3015 -546 707 116 C ATOM 40 C4'B G A2648 -24.985 50.645 -11.563 0.38 14.63 C ANISOU 40 C4'B G A2648 1970 1735 1853 -299 815 431 C ATOM 41 O4'A G A2648 -25.909 52.101 -12.430 0.62 17.00 O ANISOU 41 O4'A G A2648 1959 1495 3005 -697 753 -71 O ATOM 42 O4'B G A2648 -25.621 51.944 -11.705 0.38 15.67 O ANISOU 42 O4'B G A2648 1999 2081 1872 -293 815 465 O ATOM 43 C3'A G A2648 -24.577 50.609 -13.667 0.62 17.94 C ANISOU 43 C3'A G A2648 2134 1746 2934 -696 854 302 C ATOM 44 C3'B G A2648 -23.909 50.663 -12.628 0.38 13.79 C ANISOU 44 C3'B G A2648 1970 1629 1641 -465 511 654 C ATOM 45 O3'A G A2648 -24.510 49.280 -14.157 0.62 20.66 O ANISOU 45 O3'A G A2648 2752 2384 2714 -729 635 215 O ATOM 46 O3'B G A2648 -23.410 49.377 -12.948 0.38 12.09 O ANISOU 46 O3'B G A2648 2060 1106 1426 -115 308 599 O ATOM 47 C2'A G A2648 -25.242 51.566 -14.648 0.62 16.96 C ANISOU 47 C2'A G A2648 1409 2071 2962 -80 994 167 C ATOM 48 C2'B G A2648 -24.611 51.376 -13.776 0.38 13.73 C ANISOU 48 C2'B G A2648 1835 1650 1730 -293 491 760 C ATOM 49 O2'A G A2648 -26.327 50.949 -15.323 0.62 16.55 O ANISOU 49 O2'A G A2648 1469 1874 2943 266 1018 133 O ATOM 50 O2'B G A2648 -25.517 50.517 -14.449 0.38 13.63 O ANISOU 50 O2'B G A2648 1735 1637 1804 -165 350 890 O ATOM 51 C1'A G A2648 -25.782 52.649 -13.721 0.62 16.24 C ANISOU 51 C1'A G A2648 1414 1818 2938 173 889 -83 C ATOM 52 C1'B G A2648 -25.405 52.437 -13.015 0.38 13.68 C ANISOU 52 C1'B G A2648 1513 1854 1829 73 665 689 C ATOM 53 N9 A G A2648 -24.910 53.837 -13.644 0.62 14.25 N ANISOU 53 N9 A G A2648 1268 1517 2630 299 793 -33 N ATOM 54 N9 B G A2648 -24.662 53.710 -12.942 0.38 12.33 N ANISOU 54 N9 B G A2648 1139 1647 1897 337 426 375 N ATOM 55 C8 A G A2648 -24.295 54.336 -12.524 0.62 13.71 C ANISOU 55 C8 A G A2648 1136 1495 2576 118 538 105 C ATOM 56 C8 B G A2648 -24.064 54.284 -11.848 0.38 11.13 C ANISOU 56 C8 B G A2648 945 1369 1915 491 345 315 C ATOM 57 N7 A G A2648 -23.606 55.414 -12.758 0.62 13.64 N ANISOU 57 N7 A G A2648 1126 1602 2453 527 488 145 N ATOM 58 N7 B G A2648 -23.473 55.415 -12.122 0.38 12.22 N ANISOU 58 N7 B G A2648 1082 1633 1927 618 389 336 N ATOM 59 C5 A G A2648 -23.789 55.643 -14.110 0.62 13.58 C ANISOU 59 C5 A G A2648 1103 1691 2364 329 691 60 C ATOM 60 C5 B G A2648 -23.688 55.595 -13.479 0.38 11.09 C ANISOU 60 C5 B G A2648 906 1482 1825 469 401 152 C ATOM 61 C6 A G A2648 -23.285 56.675 -14.933 0.62 13.59 C ANISOU 61 C6 A G A2648 1129 1498 2534 207 750 12 C ATOM 62 C6 B G A2648 -23.285 56.644 -14.343 0.38 11.55 C ANISOU 62 C6 B G A2648 914 1515 1958 366 503 34 C ATOM 63 O6 A G A2648 -22.558 57.614 -14.605 0.62 12.88 O ANISOU 63 O6 A G A2648 1319 859 2715 53 946 113 O ATOM 64 O6 B G A2648 -22.634 57.655 -14.066 0.38 11.95 O ANISOU 64 O6 B G A2648 1135 1194 2210 257 701 -4 O ATOM 65 N1 A G A2648 -23.713 56.539 -16.250 0.62 13.39 N ANISOU 65 N1 A G A2648 1095 1403 2590 278 686 202 N ATOM 66 N1 B G A2648 -23.716 56.431 -15.649 0.38 12.18 N ANISOU 66 N1 B G A2648 1110 1596 1921 571 494 99 N ATOM 67 C2 A G A2648 -24.523 55.532 -16.716 0.62 13.93 C ANISOU 67 C2 A G A2648 1216 1329 2745 377 577 -17 C ATOM 68 C2 B G A2648 -24.444 55.344 -16.069 0.38 10.92 C ANISOU 68 C2 B G A2648 1015 1262 1870 469 456 155 C ATOM 69 N2 A G A2648 -24.827 55.566 -18.019 0.62 12.89 N ANISOU 69 N2 A G A2648 1193 1044 2660 -71 197 -304 N ATOM 70 N2 B G A2648 -24.771 55.308 -17.368 0.38 11.54 N ANISOU 70 N2 B G A2648 1217 1168 1998 557 323 -97 N ATOM 71 N3 A G A2648 -25.003 54.564 -15.958 0.62 12.05 N ANISOU 71 N3 A G A2648 1126 837 2616 26 795 50 N ATOM 72 N3 B G A2648 -24.826 54.363 -15.272 0.38 10.98 N ANISOU 72 N3 B G A2648 950 1316 1906 392 511 202 N ATOM 73 C4 A G A2648 -24.596 54.685 -14.676 0.62 12.15 C ANISOU 73 C4 A G A2648 1151 1086 2379 168 778 75 C ATOM 74 C4 B G A2648 -24.416 54.551 -14.001 0.38 11.24 C ANISOU 74 C4 B G A2648 974 1399 1895 470 456 217 C ATOM 0 H5'A G A2648 -25.430 50.245 -10.425 0.62 15.87 H new ATOM 0 H5'B G A2648 -25.237 50.607 -9.534 0.38 15.87 H new ATOM 0 H5''A G A2648 -24.192 49.675 -11.182 0.62 15.87 H new ATOM 0 H5''B G A2648 -24.240 49.516 -10.029 0.38 15.87 H new ATOM 0 H4'A G A2648 -26.133 50.053 -12.462 0.62 14.63 H new ATOM 0 H4'B G A2648 -25.569 49.883 -11.699 0.38 14.63 H new ATOM 0 H3'A G A2648 -23.647 50.831 -13.502 0.62 13.79 H new ATOM 0 H3'B G A2648 -23.094 51.112 -12.353 0.38 13.79 H new ATOM 0 H2'A G A2648 -24.636 51.879 -15.338 0.62 13.73 H new ATOM 0 H2'B G A2648 -24.002 51.707 -14.455 0.38 13.73 H new ATOM 0 HO2'A G A2648 -26.269 50.115 -15.244 0.62 13.63 H new ATOM 0 HO2'B G A2648 -25.889 50.936 -15.074 0.38 13.63 H new ATOM 0 H1'A G A2648 -26.634 52.942 -14.080 0.62 13.68 H new ATOM 0 H1'B G A2648 -26.242 52.610 -13.473 0.38 13.68 H new ATOM 0 H8 A G A2648 -24.364 53.944 -11.684 0.62 11.13 H new ATOM 0 H8 B G A2648 -24.078 53.906 -10.999 0.38 11.13 H new ATOM 0 H1 A G A2648 -23.450 57.131 -16.816 0.62 12.18 H new ATOM 0 H1 B G A2648 -23.511 57.024 -16.237 0.38 12.18 H new ATOM 0 H21A G A2648 -25.331 54.958 -18.359 0.62 11.54 H new ATOM 0 H21B G A2648 -25.226 54.648 -17.679 0.38 11.54 H new ATOM 0 H22A G A2648 -24.518 56.196 -18.516 0.62 11.54 H new ATOM 0 H22B G A2648 -24.526 55.945 -17.891 0.38 11.54 H new ATOM 97 P A C A2649 -23.220 48.760 -14.958 0.62 18.30 P ANISOU 97 P A C A2649 2380 2145 2429 691 835 79 P ATOM 98 P B C A2649 -21.851 49.193 -13.283 0.38 9.70 P ANISOU 98 P B C A2649 1365 1028 1291 150 487 103 P ATOM 99 OP1A C A2649 -23.475 47.338 -15.299 0.62 19.61 O ANISOU 99 OP1A C A2649 2206 2914 2331 924 1058 207 O ATOM 100 OP1B C A2649 -21.558 47.742 -13.305 0.38 9.48 O ANISOU 100 OP1B C A2649 1166 1175 1259 271 613 159 O ATOM 101 OP2A C A2649 -22.021 49.123 -14.152 0.62 17.29 O ANISOU 101 OP2A C A2649 1612 2358 2597 645 903 30 O ATOM 102 OP2B C A2649 -21.059 50.070 -12.389 0.38 9.08 O ANISOU 102 OP2B C A2649 1126 1024 1299 185 580 264 O ATOM 103 O5'A C A2649 -23.220 49.599 -16.318 0.62 18.49 O ANISOU 103 O5'A C A2649 2577 2058 2389 416 580 -511 O ATOM 104 O5'B C A2649 -21.723 49.757 -14.767 0.38 8.53 O ANISOU 104 O5'B C A2649 1024 905 1313 -80 441 -42 O ATOM 105 C5'A C A2649 -24.052 49.247 -17.422 0.62 16.63 C ANISOU 105 C5'A C A2649 2174 1883 2259 -11 478 -614 C ATOM 106 C5'B C A2649 -22.585 49.294 -15.798 0.38 10.97 C ANISOU 106 C5'B C A2649 1434 1285 1447 204 585 115 C ATOM 107 C4'A C A2649 -23.693 50.026 -18.670 0.62 14.44 C ANISOU 107 C4'A C A2649 1805 1583 2097 96 180 -219 C ATOM 108 C4'B C A2649 -22.543 50.183 -17.019 0.38 11.45 C ANISOU 108 C4'B C A2649 1485 1486 1378 -458 613 210 C ATOM 109 O4'A C A2649 -23.952 51.438 -18.460 0.62 13.64 O ANISOU 109 O4'A C A2649 1793 1308 2081 -420 83 199 O ATOM 110 O4'B C A2649 -23.106 51.486 -16.714 0.38 9.95 O ANISOU 110 O4'B C A2649 1195 1343 1240 -349 582 104 O ATOM 111 C3'A C A2649 -22.229 49.967 -19.081 0.62 12.72 C ANISOU 111 C3'A C A2649 1317 1595 1920 -309 50 -54 C ATOM 112 C3'B C A2649 -21.166 50.506 -17.573 0.38 10.11 C ANISOU 112 C3'B C A2649 1348 1135 1359 -567 240 297 C ATOM 113 O3'A C A2649 -21.921 48.817 -19.845 0.62 11.85 O ANISOU 113 O3'A C A2649 1704 1214 1584 -402 -400 102 O ATOM 114 O3'B C A2649 -20.619 49.467 -18.356 0.38 9.78 O ANISOU 114 O3'B C A2649 1670 853 1193 -232 177 444 O ATOM 115 C2'A C A2649 -22.018 51.278 -19.831 0.62 11.00 C ANISOU 115 C2'A C A2649 884 1275 2019 -254 -25 -83 C ATOM 116 C2'B C A2649 -21.423 51.790 -18.344 0.38 9.46 C ANISOU 116 C2'B C A2649 1130 1191 1273 -420 371 339 C ATOM 117 O2'A C A2649 -22.435 51.183 -21.184 0.62 11.42 O ANISOU 117 O2'A C A2649 1099 1299 1941 148 -48 -62 O ATOM 118 O2'B C A2649 -22.077 51.525 -19.579 0.38 9.03 O ANISOU 118 O2'B C A2649 890 1197 1343 201 163 190 O ATOM 119 C1'A C A2649 -22.951 52.221 -19.080 0.62 12.34 C ANISOU 119 C1'A C A2649 953 1626 2108 -249 91 39 C ATOM 120 C1'B C A2649 -22.400 52.491 -17.411 0.38 9.36 C ANISOU 120 C1'B C A2649 953 1422 1180 -250 503 221 C ATOM 121 N1 A C A2649 -22.248 52.998 -18.030 0.62 12.45 N ANISOU 121 N1 A C A2649 662 1872 2195 -123 189 -251 N ATOM 122 N1 B C A2649 -21.712 53.346 -16.417 0.38 9.69 N ANISOU 122 N1 B C A2649 1046 1407 1229 249 595 271 N ATOM 123 C2 A C A2649 -21.647 54.223 -18.338 0.62 11.83 C ANISOU 123 C2 A C A2649 790 1335 2369 126 193 -319 C ATOM 124 C2 B C A2649 -21.193 54.578 -16.815 0.38 7.87 C ANISOU 124 C2 B C A2649 765 1007 1217 97 505 119 C ATOM 125 O2 A C A2649 -21.698 54.651 -19.500 0.62 13.84 O ANISOU 125 O2 A C A2649 1090 1811 2358 5 55 -684 O ATOM 126 O2 B C A2649 -21.311 54.914 -18.001 0.38 8.11 O ANISOU 126 O2 B C A2649 672 1185 1225 -146 432 -128 O ATOM 127 N3 A C A2649 -21.025 54.913 -17.355 0.62 12.55 N ANISOU 127 N3 A C A2649 769 1477 2520 14 311 -341 N ATOM 128 N3 B C A2649 -20.579 55.361 -15.897 0.38 6.75 N ANISOU 128 N3 B C A2649 706 728 1128 196 439 220 N ATOM 129 C4 A C A2649 -20.986 54.432 -16.110 0.62 12.41 C ANISOU 129 C4 A C A2649 796 1488 2432 203 301 -224 C ATOM 130 C4 B C A2649 -20.475 54.957 -14.630 0.38 8.54 C ANISOU 130 C4 B C A2649 825 1152 1267 301 470 99 C ATOM 131 N4 A C A2649 -20.367 55.137 -15.159 0.62 11.68 N ANISOU 131 N4 A C A2649 792 838 2807 -42 225 -380 N ATOM 132 N4 B C A2649 -19.866 55.754 -13.754 0.38 8.30 N ANISOU 132 N4 B C A2649 869 942 1343 292 460 3 N ATOM 133 C5 A C A2649 -21.585 53.191 -15.775 0.62 13.74 C ANISOU 133 C5 A C A2649 817 1961 2440 174 362 -296 C ATOM 134 C5 B C A2649 -20.998 53.711 -14.198 0.38 9.85 C ANISOU 134 C5 B C A2649 983 1483 1274 298 559 35 C ATOM 135 C6 A C A2649 -22.200 52.520 -16.753 0.62 13.10 C ANISOU 135 C6 A C A2649 769 1815 2393 -152 312 -394 C ATOM 136 C6 B C A2649 -21.601 52.947 -15.113 0.38 10.69 C ANISOU 136 C6 B C A2649 1196 1542 1323 237 681 242 C ATOM 0 H5'A C A2649 -24.980 49.413 -17.193 0.62 10.97 H new ATOM 0 H5'B C A2649 -23.494 49.251 -15.462 0.38 10.97 H new ATOM 0 H5''A C A2649 -23.969 48.297 -17.599 0.62 10.97 H new ATOM 0 H5''B C A2649 -22.332 48.392 -16.048 0.38 10.97 H new ATOM 0 H4'A C A2649 -24.233 49.611 -19.361 0.62 11.45 H new ATOM 0 H4'B C A2649 -23.034 49.661 -17.673 0.38 11.45 H new ATOM 0 H3'A C A2649 -21.627 49.882 -18.325 0.62 10.11 H new ATOM 0 H3'B C A2649 -20.489 50.608 -16.886 0.38 10.11 H new ATOM 0 H2'A C A2649 -21.088 51.552 -19.859 0.62 9.46 H new ATOM 0 H2'B C A2649 -20.617 52.283 -18.562 0.38 9.46 H new ATOM 0 HO2'A C A2649 -22.524 50.375 -21.394 0.62 9.03 H new ATOM 0 HO2'B C A2649 -21.901 50.742 -19.827 0.38 9.03 H new ATOM 0 H1'A C A2649 -23.319 52.853 -19.717 0.62 9.36 H new ATOM 0 H1'B C A2649 -22.981 53.061 -17.939 0.38 9.36 H new ATOM 0 H41A C A2649 -20.335 54.837 -14.353 0.62 8.30 H new ATOM 0 H41B C A2649 -19.789 55.511 -12.933 0.38 8.30 H new ATOM 0 H42A C A2649 -20.000 55.890 -15.352 0.62 8.30 H new ATOM 0 H42B C A2649 -19.550 56.512 -14.010 0.38 8.30 H new ATOM 0 H5 A C A2649 -21.551 52.857 -14.908 0.62 9.85 H new ATOM 0 H5 B C A2649 -20.924 53.437 -13.312 0.38 9.85 H new ATOM 0 H6 A C A2649 -22.606 51.706 -16.558 0.62 10.69 H new ATOM 0 H6 B C A2649 -21.953 52.125 -14.858 0.38 10.69 H new ATOM 159 P A U A2650 -20.392 48.397 -20.053 0.28 9.19 P ANISOU 159 P A U A2650 1141 1067 1282 117 -189 -11 P ATOM 160 P B U A2650 -19.052 49.147 -18.257 0.72 12.86 P ANISOU 160 P B U A2650 2540 1047 1300 -225 147 147 P ATOM 161 OP1A U A2650 -20.360 47.191 -20.917 0.28 6.78 O ANISOU 161 OP1A U A2650 805 601 1168 17 -343 -311 O ATOM 162 OP1B U A2650 -18.804 47.818 -18.859 0.72 16.79 O ANISOU 162 OP1B U A2650 3394 1537 1448 -805 234 20 O ATOM 163 OP2A U A2650 -19.746 48.365 -18.713 0.28 10.76 O ANISOU 163 OP2A U A2650 1145 1615 1328 81 -354 19 O ATOM 164 OP2B U A2650 -18.568 49.458 -16.893 0.72 14.19 O ANISOU 164 OP2B U A2650 2616 1562 1211 -460 -24 576 O ATOM 165 O5'A U A2650 -19.779 49.627 -20.864 0.28 11.39 O ANISOU 165 O5'A U A2650 1602 1535 1188 446 -300 -111 O ATOM 166 O5'B U A2650 -18.378 50.213 -19.211 0.72 11.35 O ANISOU 166 O5'B U A2650 1414 1578 1321 -210 -22 -332 O ATOM 167 C5'A U A2650 -18.507 50.151 -20.525 0.28 10.06 C ANISOU 167 C5'A U A2650 1055 1573 1193 -128 -88 -153 C ATOM 168 C5'B U A2650 -18.579 50.148 -20.601 0.72 10.42 C ANISOU 168 C5'B U A2650 1080 1552 1327 -548 63 -292 C ATOM 169 C4' U A2650 -18.195 51.447 -21.235 1.00 11.67 C ANISOU 169 C4' U A2650 1206 2086 1143 -270 -60 -121 C ATOM 170 O4' U A2650 -18.875 52.538 -20.565 1.00 11.96 O ANISOU 170 O4' U A2650 894 2535 1116 -205 -257 376 O ATOM 171 C3' U A2650 -16.735 51.827 -21.152 1.00 12.34 C ANISOU 171 C3' U A2650 1712 1825 1152 -825 5 43 C ATOM 172 O3' U A2650 -15.954 51.151 -22.114 1.00 14.61 O ANISOU 172 O3' U A2650 2618 1805 1129 -1191 541 -387 O ATOM 173 C2' U A2650 -16.783 53.334 -21.317 1.00 11.43 C ANISOU 173 C2' U A2650 1138 2009 1196 -390 -30 177 C ATOM 174 O2' U A2650 -16.994 53.688 -22.673 1.00 11.94 O ANISOU 174 O2' U A2650 1299 1965 1273 -297 -186 135 O ATOM 175 C1' U A2650 -18.037 53.672 -20.528 1.00 11.56 C ANISOU 175 C1' U A2650 992 2255 1146 87 -91 520 C ATOM 176 N1 U A2650 -17.770 54.022 -19.109 1.00 10.73 N ANISOU 176 N1 U A2650 1147 1728 1202 396 75 -40 N ATOM 177 C2 U A2650 -17.165 55.222 -18.819 1.00 9.72 C ANISOU 177 C2 U A2650 772 1747 1175 531 32 -28 C ATOM 178 O2 U A2650 -16.794 56.003 -19.674 1.00 11.51 O ANISOU 178 O2 U A2650 1008 2085 1281 457 -136 -230 O ATOM 179 N3 U A2650 -16.994 55.473 -17.480 1.00 8.48 N ANISOU 179 N3 U A2650 564 1393 1266 330 143 -72 N ATOM 180 C4 U A2650 -17.360 54.681 -16.421 1.00 9.27 C ANISOU 180 C4 U A2650 548 1659 1313 206 -52 272 C ATOM 181 O4 U A2650 -17.144 55.041 -15.273 1.00 9.14 O ANISOU 181 O4 U A2650 664 1665 1142 -100 -50 231 O ATOM 182 C5 U A2650 -17.979 53.460 -16.795 1.00 10.42 C ANISOU 182 C5 U A2650 785 1908 1264 464 145 466 C ATOM 183 C6 U A2650 -18.162 53.193 -18.087 1.00 9.91 C ANISOU 183 C6 U A2650 1014 1696 1054 425 228 93 C ATOM 0 H5'A U A2650 -17.825 49.497 -20.742 0.28 10.42 H new ATOM 0 H5'B U A2650 -19.509 49.949 -20.792 0.72 10.42 H new ATOM 0 H5''A U A2650 -18.467 50.295 -19.567 0.28 10.42 H new ATOM 0 H5''B U A2650 -18.051 49.427 -20.978 0.72 10.42 H new ATOM 0 H4'A U A2650 -18.466 51.311 -22.156 0.28 11.67 H new ATOM 0 H4'B U A2650 -18.433 51.313 -22.166 0.72 11.67 H new ATOM 0 H3' U A2650 -16.300 51.569 -20.324 1.00 12.34 H new ATOM 0 H2' U A2650 -15.971 53.783 -21.034 1.00 11.43 H new ATOM 0 HO2' U A2650 -16.271 53.953 -23.009 1.00 11.94 H new ATOM 0 H1' U A2650 -18.443 54.454 -20.933 1.00 11.56 H new ATOM 0 H3 U A2650 -16.611 56.217 -17.281 1.00 8.48 H new ATOM 0 H5 U A2650 -18.254 52.853 -16.146 1.00 10.42 H new ATOM 0 H6 U A2650 -18.582 52.394 -18.311 1.00 9.91 H new HETATM 195 P 5HM A2651 -14.520 50.555 -21.737 1.00 11.70 P HETATM 196 OP1 5HM A2651 -14.475 49.941 -23.068 1.00 12.41 O1- HETATM 197 OP2 5HM A2651 -14.875 49.924 -20.466 1.00 11.91 O HETATM 198 O5' 5HM A2651 -13.707 51.902 -21.573 1.00 11.17 O HETATM 199 C5' 5HM A2651 -13.446 52.742 -22.679 1.00 9.24 C HETATM 200 C4' 5HM A2651 -12.922 54.073 -22.219 1.00 8.54 C HETATM 201 O4' 5HM A2651 -13.884 54.675 -21.324 1.00 8.53 O HETATM 202 C3' 5HM A2651 -11.650 54.049 -21.395 1.00 7.97 C HETATM 203 O3' 5HM A2651 -10.479 53.891 -22.170 1.00 8.61 O HETATM 204 C2' 5HM A2651 -11.727 55.377 -20.662 1.00 8.70 C HETATM 205 O2' 5HM A2651 -11.376 56.455 -21.509 1.00 9.04 O HETATM 206 C1' 5HM A2651 -13.219 55.455 -20.357 1.00 8.39 C HETATM 207 N1 5HM A2651 -13.515 54.889 -19.025 1.00 8.12 N HETATM 208 C2 5HM A2651 -13.253 55.665 -17.924 1.00 6.47 C HETATM 209 O2 5HM A2651 -12.718 56.945 -18.102 1.00 7.58 O HETATM 210 C6 5HM A2651 -14.045 53.598 -18.861 1.00 7.83 C HETATM 211 C5 5HM A2651 -14.308 53.113 -17.566 1.00 8.85 C HETATM 212 CM5 5HM A2651 -14.873 51.708 -17.387 1.00 9.93 C HETATM 213 OM5 5HM A2651 -13.920 50.904 -16.749 1.00 10.01 O HETATM 214 C4 5HM A2651 -14.034 53.924 -16.452 1.00 8.64 C HETATM 215 N3 5HM A2651 -13.516 55.181 -16.629 1.00 6.92 N HETATM 216 N4 5HM A2651 -14.292 53.455 -15.132 1.00 11.23 N ATOM 229 P C A2652 -9.172 53.236 -21.520 1.00 9.24 P ANISOU 229 P C A2652 1089 1150 1270 38 51 -198 P ATOM 230 OP1 C A2652 -8.213 53.042 -22.617 1.00 9.38 O ANISOU 230 OP1 C A2652 1344 1056 1164 -50 99 -130 O ATOM 231 OP2 C A2652 -9.560 52.084 -20.685 1.00 9.55 O ANISOU 231 OP2 C A2652 1103 1127 1398 190 -166 -186 O ATOM 232 O5' C A2652 -8.625 54.359 -20.544 1.00 9.14 O ANISOU 232 O5' C A2652 916 1713 843 98 -72 168 O ATOM 233 C5' C A2652 -8.161 55.590 -21.067 1.00 8.27 C ANISOU 233 C5' C A2652 1099 1176 867 194 -47 280 C ATOM 234 C4' C A2652 -7.687 56.509 -19.979 1.00 6.96 C ANISOU 234 C4' C A2652 977 798 869 132 64 138 C ATOM 235 O4' C A2652 -8.783 56.843 -19.099 1.00 8.00 O ANISOU 235 O4' C A2652 1167 1013 858 150 98 164 O ATOM 236 C3' C A2652 -6.642 55.947 -19.045 1.00 8.86 C ANISOU 236 C3' C A2652 1834 790 742 -350 145 58 C ATOM 237 O3' C A2652 -5.349 55.962 -19.597 1.00 8.13 O ANISOU 237 O3' C A2652 1382 1021 684 -68 208 -115 O ATOM 238 C2' C A2652 -6.785 56.841 -17.830 1.00 8.39 C ANISOU 238 C2' C A2652 1689 735 763 87 -403 139 C ATOM 239 O2' C A2652 -6.150 58.090 -18.054 1.00 7.61 O ANISOU 239 O2' C A2652 1045 944 900 269 77 -200 O ATOM 240 C1' C A2652 -8.291 57.056 -17.794 1.00 6.98 C ANISOU 240 C1' C A2652 841 923 889 344 17 -124 C ATOM 241 N1 C A2652 -8.993 56.154 -16.850 1.00 6.55 N ANISOU 241 N1 C A2652 854 778 856 216 -72 -162 N ATOM 242 C2 C A2652 -8.981 56.467 -15.495 1.00 6.02 C ANISOU 242 C2 C A2652 605 856 826 281 79 -101 C ATOM 243 O2 C A2652 -8.360 57.461 -15.102 1.00 6.87 O ANISOU 243 O2 C A2652 845 1034 732 122 115 -170 O ATOM 244 N3 C A2652 -9.646 55.677 -14.633 1.00 6.57 N ANISOU 244 N3 C A2652 911 932 654 450 -56 -25 N ATOM 245 C4 C A2652 -10.305 54.610 -15.077 1.00 7.65 C ANISOU 245 C4 C A2652 1048 1138 719 460 -159 -114 C ATOM 246 N4 C A2652 -10.944 53.863 -14.183 1.00 7.93 N ANISOU 246 N4 C A2652 1037 1178 799 95 5 -326 N ATOM 247 C5 C A2652 -10.336 54.267 -16.453 1.00 7.81 C ANISOU 247 C5 C A2652 978 1059 929 331 -165 -165 C ATOM 248 C6 C A2652 -9.679 55.063 -17.294 1.00 7.01 C ANISOU 248 C6 C A2652 702 1048 914 394 102 40 C ATOM 0 H5' C A2652 -8.873 56.019 -21.567 1.00 8.27 H new ATOM 0 H5'' C A2652 -7.437 55.425 -21.691 1.00 8.27 H new ATOM 0 H4' C A2652 -7.310 57.252 -20.475 1.00 6.96 H new ATOM 0 H3' C A2652 -6.771 55.007 -18.843 1.00 8.86 H new ATOM 0 H2' C A2652 -6.398 56.469 -17.022 1.00 8.39 H new ATOM 0 HO2' C A2652 -6.674 58.601 -18.467 1.00 7.61 H new ATOM 0 H1' C A2652 -8.459 57.959 -17.481 1.00 6.98 H new ATOM 0 H41 C A2652 -11.380 53.166 -14.437 1.00 7.93 H new ATOM 0 H42 C A2652 -10.922 54.076 -13.350 1.00 7.93 H new ATOM 0 H5 C A2652 -10.796 53.517 -16.755 1.00 7.81 H new ATOM 0 H6 C A2652 -9.688 54.871 -18.204 1.00 7.01 H new ATOM 260 P U A2653 -4.297 54.843 -19.172 1.00 8.43 P ANISOU 260 P U A2653 1195 1119 887 138 43 -8 P ATOM 261 OP1 U A2653 -3.001 55.234 -19.770 1.00 9.69 O ANISOU 261 OP1 U A2653 1557 1235 890 158 -75 -40 O ATOM 262 OP2 U A2653 -4.877 53.515 -19.448 1.00 8.01 O ANISOU 262 OP2 U A2653 981 1282 780 470 101 208 O ATOM 263 O5' U A2653 -4.208 54.968 -17.595 1.00 7.66 O ANISOU 263 O5' U A2653 1063 794 1053 178 200 96 O ATOM 264 C5' U A2653 -3.550 56.059 -16.973 1.00 8.25 C ANISOU 264 C5' U A2653 1289 835 1011 210 95 58 C ATOM 265 C4' U A2653 -3.672 55.993 -15.468 1.00 8.20 C ANISOU 265 C4' U A2653 1377 779 957 -67 -139 5 C ATOM 266 O4' U A2653 -5.064 56.033 -15.086 1.00 6.75 O ANISOU 266 O4' U A2653 716 902 945 13 94 -88 O ATOM 267 C3' U A2653 -3.143 54.733 -14.811 1.00 8.44 C ANISOU 267 C3' U A2653 1609 692 906 -462 -163 68 C ATOM 268 O3' U A2653 -1.742 54.764 -14.650 1.00 7.78 O ANISOU 268 O3' U A2653 829 1004 1121 -182 -148 -51 O ATOM 269 C2' U A2653 -3.927 54.682 -13.504 1.00 7.44 C ANISOU 269 C2' U A2653 1229 452 1145 -257 32 67 C ATOM 270 O2' U A2653 -3.359 55.519 -12.511 1.00 6.92 O ANISOU 270 O2' U A2653 936 681 1013 135 -130 26 O ATOM 271 C1' U A2653 -5.274 55.255 -13.933 1.00 6.27 C ANISOU 271 C1' U A2653 735 504 1141 78 128 27 C ATOM 272 N1 U A2653 -6.254 54.195 -14.250 1.00 7.03 N ANISOU 272 N1 U A2653 624 923 1124 300 -10 253 N ATOM 273 C2 U A2653 -7.071 53.764 -13.235 1.00 7.33 C ANISOU 273 C2 U A2653 755 837 1192 382 184 233 C ATOM 274 O2 U A2653 -7.009 54.222 -12.112 1.00 7.29 O ANISOU 274 O2 U A2653 1000 748 1022 -39 145 159 O ATOM 275 N3 U A2653 -7.959 52.779 -13.598 1.00 7.38 N ANISOU 275 N3 U A2653 815 794 1194 169 136 411 N ATOM 276 C4 U A2653 -8.102 52.192 -14.833 1.00 7.93 C ANISOU 276 C4 U A2653 989 728 1297 238 58 251 C ATOM 277 O4 U A2653 -8.944 51.317 -14.994 1.00 8.34 O ANISOU 277 O4 U A2653 861 872 1434 91 73 137 O ATOM 278 C5 U A2653 -7.214 52.687 -15.830 1.00 8.50 C ANISOU 278 C5 U A2653 1446 610 1174 347 9 119 C ATOM 279 C6 U A2653 -6.343 53.646 -15.509 1.00 7.68 C ANISOU 279 C6 U A2653 915 877 1126 278 -4 298 C ATOM 0 H5' U A2653 -3.929 56.892 -17.293 1.00 8.25 H new ATOM 0 H5'' U A2653 -2.613 56.059 -17.223 1.00 8.25 H new ATOM 0 H4' U A2653 -3.141 56.748 -15.172 1.00 8.20 H new ATOM 0 H3' U A2653 -3.271 53.929 -15.339 1.00 8.44 H new ATOM 0 H2' U A2653 -3.955 53.794 -13.115 1.00 7.44 H new ATOM 0 HO2' U A2653 -2.924 55.051 -11.965 1.00 6.92 H new ATOM 0 H1' U A2653 -5.633 55.780 -13.201 1.00 6.27 H new ATOM 0 H3 U A2653 -8.487 52.497 -12.980 1.00 7.38 H new ATOM 0 H5 U A2653 -7.241 52.346 -16.695 1.00 8.50 H new ATOM 0 H6 U A2653 -5.767 53.959 -16.169 1.00 7.68 H new ATOM 290 P A A2654 -0.894 53.408 -14.637 1.00 9.21 P ANISOU 290 P A A2654 985 996 1517 39 -76 28 P ATOM 291 OP1 A A2654 -1.407 52.607 -13.513 1.00 10.94 O ANISOU 291 OP1 A A2654 1571 838 1747 43 -551 -139 O ATOM 292 OP2 A A2654 0.534 53.767 -14.653 1.00 12.72 O ANISOU 292 OP2 A A2654 2309 1164 1358 718 50 37 O ATOM 293 O5' A A2654 -1.258 52.707 -16.014 1.00 10.40 O ANISOU 293 O5' A A2654 1165 1210 1574 308 417 365 O ATOM 294 C5' A A2654 -0.523 51.576 -16.474 1.00 12.14 C ANISOU 294 C5' A A2654 1529 1640 1444 306 710 432 C ATOM 295 C4' A A2654 -1.414 50.522 -17.091 1.00 9.26 C ANISOU 295 C4' A A2654 1307 772 1440 205 535 54 C ATOM 296 O4' A A2654 -2.237 49.929 -16.050 1.00 8.47 O ANISOU 296 O4' A A2654 1406 640 1171 135 303 3 O ATOM 297 C3' A A2654 -2.379 51.022 -18.164 1.00 11.42 C ANISOU 297 C3' A A2654 2044 849 1444 -231 182 328 C ATOM 298 O3'A A A2654 -2.594 49.997 -19.130 0.58 12.29 O ANISOU 298 O3'A A A2654 2126 985 1558 -230 223 128 O ATOM 299 O3'B A A2654 -2.594 49.996 -19.129 0.42 11.76 O ANISOU 299 O3'B A A2654 2031 897 1540 -186 246 107 O ATOM 300 C2' A A2654 -3.670 51.213 -17.377 1.00 8.25 C ANISOU 300 C2' A A2654 1201 744 1187 -63 327 28 C ATOM 301 O2' A A2654 -4.835 51.168 -18.165 1.00 10.23 O ANISOU 301 O2' A A2654 1762 864 1261 -132 518 -126 O ATOM 302 C1' A A2654 -3.598 50.040 -16.414 1.00 8.35 C ANISOU 302 C1' A A2654 1157 751 1263 26 55 47 C ATOM 303 N9 A A2654 -4.411 50.175 -15.198 1.00 7.83 N ANISOU 303 N9 A A2654 956 708 1310 256 -171 53 N ATOM 304 C8 A A2654 -4.165 50.954 -14.099 1.00 7.80 C ANISOU 304 C8 A A2654 1010 637 1316 134 -8 252 C ATOM 305 N7 A A2654 -5.071 50.859 -13.158 1.00 7.84 N ANISOU 305 N7 A A2654 1007 872 1098 128 79 350 N ATOM 306 C5 A A2654 -5.970 49.939 -13.661 1.00 7.46 C ANISOU 306 C5 A A2654 885 724 1225 173 67 438 C ATOM 307 C6 A A2654 -7.155 49.405 -13.132 1.00 7.35 C ANISOU 307 C6 A A2654 848 715 1228 136 64 465 C ATOM 308 N6 A A2654 -7.654 49.734 -11.945 1.00 8.75 N ANISOU 308 N6 A A2654 859 1289 1177 45 293 603 N ATOM 309 N1 A A2654 -7.824 48.516 -13.882 1.00 8.47 N ANISOU 309 N1 A A2654 1245 552 1421 57 126 333 N ATOM 310 C2 A A2654 -7.328 48.187 -15.081 1.00 8.22 C ANISOU 310 C2 A A2654 981 695 1447 183 74 218 C ATOM 311 N3 A A2654 -6.227 48.619 -15.685 1.00 8.02 N ANISOU 311 N3 A A2654 867 774 1405 211 26 113 N ATOM 312 C4 A A2654 -5.577 49.503 -14.911 1.00 7.64 C ANISOU 312 C4 A A2654 804 796 1303 198 -53 162 C ATOM 0 H5' A A2654 -0.033 51.188 -15.732 1.00 12.14 H new ATOM 0 H5'' A A2654 0.133 51.864 -17.127 1.00 12.14 H new ATOM 0 H4' A A2654 -0.801 49.901 -17.516 1.00 9.26 H new ATOM 0 H3'A A A2654 -2.065 51.813 -18.629 0.58 11.42 H new ATOM 0 H3'B A A2654 -2.065 51.813 -18.629 0.42 11.42 H new ATOM 0 H2' A A2654 -3.733 52.087 -16.961 1.00 8.25 H new ATOM 0 HO2' A A2654 -4.901 51.878 -18.608 1.00 10.23 H new ATOM 0 H1' A A2654 -3.958 49.259 -16.863 1.00 8.35 H new ATOM 0 H8 A A2654 -3.418 51.504 -14.027 1.00 7.80 H new ATOM 0 H61 A A2654 -8.386 49.374 -11.671 1.00 8.75 H new ATOM 0 H62 A A2654 -7.245 50.307 -11.451 1.00 8.75 H new ATOM 0 H2 A A2654 -7.827 47.566 -15.561 1.00 8.22 H new ATOM 323 P G A2655 -1.669 49.868 -20.433 1.00 11.37 P ANISOU 323 P G A2655 1705 1234 1380 290 431 106 P ATOM 324 OP1 G A2655 -0.278 50.086 -20.027 1.00 14.36 O ANISOU 324 OP1 G A2655 2641 1396 1418 100 894 -2 O ATOM 325 OP2 G A2655 -2.260 50.655 -21.529 1.00 13.32 O ANISOU 325 OP2 G A2655 2497 1137 1426 -34 641 -44 O ATOM 326 O5' G A2655 -1.886 48.356 -20.879 1.00 16.37 O ANISOU 326 O5' G A2655 1813 2813 1592 723 696 -52 O ATOM 327 C5' G A2655 -1.032 47.307 -20.437 1.00 14.87 C ANISOU 327 C5' G A2655 1716 2292 1642 181 350 -225 C ATOM 328 C4' G A2655 -1.364 46.811 -19.050 1.00 13.33 C ANISOU 328 C4' G A2655 2264 1306 1493 104 426 -173 C ATOM 329 O4' G A2655 -2.712 46.255 -19.029 1.00 12.81 O ANISOU 329 O4' G A2655 2345 1163 1358 491 330 -1 O ATOM 330 C3' G A2655 -0.454 45.689 -18.555 1.00 12.21 C ANISOU 330 C3' G A2655 1837 1280 1520 141 547 115 C ATOM 331 O3' G A2655 -0.361 45.768 -17.131 1.00 12.27 O ANISOU 331 O3' G A2655 1464 1543 1656 161 610 67 O ATOM 332 C2' G A2655 -1.247 44.454 -18.951 1.00 12.01 C ANISOU 332 C2' G A2655 1669 1366 1527 -186 421 287 C ATOM 333 O2' G A2655 -0.867 43.259 -18.309 1.00 12.80 O ANISOU 333 O2' G A2655 1633 1450 1779 508 518 322 O ATOM 334 C1' G A2655 -2.643 44.917 -18.575 1.00 12.25 C ANISOU 334 C1' G A2655 2195 1061 1398 303 344 205 C ATOM 335 N9 G A2655 -3.760 44.140 -19.115 1.00 11.81 N ANISOU 335 N9 G A2655 1987 1002 1499 158 206 322 N ATOM 336 C8 G A2655 -3.926 43.488 -20.309 1.00 13.02 C ANISOU 336 C8 G A2655 1941 1370 1634 128 -5 115 C ATOM 337 N7 G A2655 -5.086 42.892 -20.396 1.00 11.92 N ANISOU 337 N7 G A2655 1403 1529 1597 235 -36 187 N ATOM 338 C5 G A2655 -5.714 43.168 -19.189 1.00 12.06 C ANISOU 338 C5 G A2655 1941 1116 1525 550 24 130 C ATOM 339 C6 G A2655 -6.988 42.805 -18.677 1.00 11.59 C ANISOU 339 C6 G A2655 1981 852 1570 495 -75 -116 C ATOM 340 O6 G A2655 -7.878 42.140 -19.200 1.00 13.12 O ANISOU 340 O6 G A2655 1905 1180 1901 -59 -25 -238 O ATOM 341 N1 G A2655 -7.192 43.311 -17.402 1.00 10.69 N ANISOU 341 N1 G A2655 1563 955 1542 456 -133 129 N ATOM 342 C2 G A2655 -6.294 44.079 -16.703 1.00 11.03 C ANISOU 342 C2 G A2655 1394 1265 1531 481 -190 511 C ATOM 343 N2 G A2655 -6.653 44.500 -15.480 1.00 10.79 N ANISOU 343 N2 G A2655 1285 1158 1657 49 -17 481 N ATOM 344 N3 G A2655 -5.116 44.423 -17.166 1.00 9.89 N ANISOU 344 N3 G A2655 1233 1056 1469 69 -174 510 N ATOM 345 C4 G A2655 -4.898 43.929 -18.397 1.00 10.51 C ANISOU 345 C4 G A2655 1665 833 1493 127 -6 296 C ATOM 0 H5' G A2655 -0.114 47.619 -20.451 1.00 14.87 H new ATOM 0 H5'' G A2655 -1.090 46.567 -21.061 1.00 14.87 H new ATOM 0 H4' G A2655 -1.257 47.587 -18.478 1.00 13.33 H new ATOM 0 H3' G A2655 0.449 45.708 -18.908 1.00 12.21 H new ATOM 0 H2' G A2655 -1.124 44.195 -19.878 1.00 12.01 H new ATOM 0 HO2' G A2655 -1.551 42.803 -18.137 1.00 12.80 H new ATOM 0 H1' G A2655 -2.753 44.805 -17.618 1.00 12.25 H new ATOM 0 H8 G A2655 -3.285 43.471 -20.982 1.00 13.02 H new ATOM 0 H1 G A2655 -7.940 43.129 -17.019 1.00 10.69 H new ATOM 0 H21 G A2655 -6.113 44.983 -15.016 1.00 10.79 H new ATOM 0 H22 G A2655 -7.423 44.287 -15.161 1.00 10.79 H new ATOM 357 P U A2656 0.747 44.945 -16.310 1.00 11.09 P ANISOU 357 P U A2656 1347 1241 1625 234 498 305 P ATOM 358 OP1 U A2656 1.952 44.800 -17.151 1.00 12.40 O ANISOU 358 OP1 U A2656 1804 1116 1791 302 -241 211 O ATOM 359 OP2 U A2656 0.109 43.733 -15.753 1.00 14.20 O ANISOU 359 OP2 U A2656 1617 2055 1721 837 207 -209 O ATOM 360 O5' U A2656 1.101 45.901 -15.090 1.00 11.53 O ANISOU 360 O5' U A2656 1051 1677 1652 304 435 892 O ATOM 361 C5' U A2656 1.856 47.092 -15.273 1.00 12.53 C ANISOU 361 C5' U A2656 1343 1689 1729 129 213 796 C ATOM 362 C4' U A2656 1.476 48.152 -14.262 1.00 11.46 C ANISOU 362 C4' U A2656 1339 1171 1842 -243 178 453 C ATOM 363 O4' U A2656 0.180 48.710 -14.595 1.00 10.43 O ANISOU 363 O4' U A2656 1126 977 1859 -96 176 460 O ATOM 364 C3' U A2656 1.332 47.676 -12.824 1.00 11.10 C ANISOU 364 C3' U A2656 1121 1412 1684 -389 549 24 C ATOM 365 O3' U A2656 2.572 47.648 -12.146 1.00 13.07 O ANISOU 365 O3' U A2656 1122 1896 1946 -513 609 -195 O ATOM 366 C2' U A2656 0.340 48.666 -12.228 1.00 9.82 C ANISOU 366 C2' U A2656 1221 943 1565 112 225 171 C ATOM 367 O2' U A2656 0.986 49.860 -11.824 1.00 11.69 O ANISOU 367 O2' U A2656 1154 1675 1612 -98 13 726 O ATOM 368 C1' U A2656 -0.557 48.974 -13.423 1.00 8.92 C ANISOU 368 C1' U A2656 950 862 1577 130 246 490 C ATOM 369 N1 U A2656 -1.804 48.167 -13.460 1.00 11.02 N ANISOU 369 N1 U A2656 1513 1185 1488 584 156 524 N ATOM 370 C2 U A2656 -2.725 48.272 -12.432 1.00 10.89 C ANISOU 370 C2 U A2656 1352 1483 1301 705 518 629 C ATOM 371 O2 U A2656 -2.552 48.977 -11.460 1.00 8.52 O ANISOU 371 O2 U A2656 1150 978 1108 373 158 202 O ATOM 372 N3 U A2656 -3.851 47.496 -12.578 1.00 11.82 N ANISOU 372 N3 U A2656 1471 1701 1318 802 614 707 N ATOM 373 C4 U A2656 -4.165 46.660 -13.631 1.00 11.10 C ANISOU 373 C4 U A2656 1554 1525 1139 803 538 562 C ATOM 374 O4 U A2656 -5.213 46.026 -13.639 1.00 9.19 O ANISOU 374 O4 U A2656 1153 1336 1003 553 289 437 O ATOM 375 C5 U A2656 -3.179 46.619 -14.661 1.00 11.03 C ANISOU 375 C5 U A2656 1927 941 1322 391 153 365 C ATOM 376 C6 U A2656 -2.071 47.352 -14.538 1.00 10.32 C ANISOU 376 C6 U A2656 1571 919 1430 474 418 440 C ATOM 0 H5' U A2656 1.712 47.433 -16.170 1.00 12.53 H new ATOM 0 H5'' U A2656 2.802 46.892 -15.194 1.00 12.53 H new ATOM 0 H4' U A2656 2.213 48.780 -14.309 1.00 11.46 H new ATOM 0 H3' U A2656 1.021 46.760 -12.752 1.00 11.10 H new ATOM 0 H2' U A2656 -0.117 48.319 -11.446 1.00 9.82 H new ATOM 0 HO2' U A2656 1.804 49.710 -11.707 1.00 11.69 H new ATOM 0 H1' U A2656 -0.828 49.903 -13.350 1.00 8.92 H new ATOM 0 H3 U A2656 -4.426 47.536 -11.940 1.00 11.82 H new ATOM 0 H5 U A2656 -3.307 46.086 -15.412 1.00 11.03 H new ATOM 0 H6 U A2656 -1.441 47.310 -15.221 1.00 10.32 H new ATOM 387 P A A2657 2.979 46.415 -11.206 1.00 11.80 P ANISOU 387 P A A2657 1135 1519 1830 273 155 477 P ATOM 388 OP1 A A2657 4.309 46.725 -10.632 1.00 15.73 O ANISOU 388 OP1 A A2657 1917 2302 1758 1078 390 770 O ATOM 389 OP2 A A2657 2.722 45.139 -11.909 1.00 10.88 O ANISOU 389 OP2 A A2657 1096 1424 1612 412 461 643 O ATOM 390 O5' A A2657 1.950 46.480 -10.006 1.00 10.76 O ANISOU 390 O5' A A2657 974 1291 1821 -97 -233 297 O ATOM 391 C5' A A2657 2.000 47.534 -9.067 1.00 10.61 C ANISOU 391 C5' A A2657 1219 1174 1639 -140 -167 425 C ATOM 392 C4' A A2657 0.887 47.402 -8.070 1.00 9.02 C ANISOU 392 C4' A A2657 1030 903 1492 -215 -55 -136 C ATOM 393 O4' A A2657 -0.389 47.550 -8.732 1.00 8.86 O ANISOU 393 O4' A A2657 1046 909 1409 19 -184 -39 O ATOM 394 C3' A A2657 0.774 46.062 -7.378 1.00 11.02 C ANISOU 394 C3' A A2657 1603 991 1591 -215 -39 -310 C ATOM 395 O3' A A2657 1.716 45.888 -6.340 1.00 12.48 O ANISOU 395 O3' A A2657 1046 1871 1824 -549 -299 -220 O ATOM 396 C2' A A2657 -0.669 46.067 -6.903 1.00 9.32 C ANISOU 396 C2' A A2657 1206 759 1575 26 231 17 C ATOM 397 O2' A A2657 -0.817 46.846 -5.730 1.00 11.59 O ANISOU 397 O2' A A2657 1305 1352 1744 75 136 -101 O ATOM 398 C1' A A2657 -1.362 46.785 -8.053 1.00 9.05 C ANISOU 398 C1' A A2657 773 1250 1416 126 39 -37 C ATOM 399 N9 A A2657 -2.023 45.867 -8.997 1.00 8.83 N ANISOU 399 N9 A A2657 1104 820 1432 143 131 297 N ATOM 400 C8 A A2657 -1.727 45.595 -10.301 1.00 7.59 C ANISOU 400 C8 A A2657 819 798 1266 12 162 310 C ATOM 401 N7 A A2657 -2.552 44.757 -10.862 1.00 7.56 N ANISOU 401 N7 A A2657 922 780 1171 87 13 355 N ATOM 402 C5 A A2657 -3.462 44.460 -9.867 1.00 7.60 C ANISOU 402 C5 A A2657 994 811 1080 278 -119 255 C ATOM 403 C6 A A2657 -4.591 43.627 -9.825 1.00 7.29 C ANISOU 403 C6 A A2657 524 1143 1102 307 -68 161 C ATOM 404 N6 A A2657 -5.013 42.906 -10.856 1.00 8.78 N ANISOU 404 N6 A A2657 657 1454 1223 -8 -19 332 N ATOM 405 N1 A A2657 -5.275 43.551 -8.671 1.00 7.15 N ANISOU 405 N1 A A2657 705 941 1070 159 -130 129 N ATOM 406 C2 A A2657 -4.844 44.273 -7.636 1.00 8.11 C ANISOU 406 C2 A A2657 928 977 1176 230 219 328 C ATOM 407 N3 A A2657 -3.804 45.090 -7.553 1.00 7.59 N ANISOU 407 N3 A A2657 872 737 1273 163 -144 133 N ATOM 408 C4 A A2657 -3.148 45.141 -8.717 1.00 7.91 C ANISOU 408 C4 A A2657 1106 691 1207 281 -187 316 C ATOM 0 H5' A A2657 1.932 48.386 -9.525 1.00 10.61 H new ATOM 0 H5'' A A2657 2.855 47.526 -8.609 1.00 10.61 H new ATOM 0 H4' A A2657 1.099 48.086 -7.416 1.00 9.02 H new ATOM 0 H3' A A2657 0.978 45.311 -7.957 1.00 11.02 H new ATOM 0 H2' A A2657 -1.008 45.182 -6.695 1.00 9.32 H new ATOM 0 HO2' A A2657 -0.106 46.819 -5.284 1.00 11.59 H new ATOM 0 H1' A A2657 -2.064 47.343 -7.683 1.00 9.05 H new ATOM 0 H8 A A2657 -1.004 45.973 -10.748 1.00 7.59 H new ATOM 0 H61 A A2657 -5.712 42.411 -10.777 1.00 8.78 H new ATOM 0 H62 A A2657 -4.588 42.934 -11.603 1.00 8.78 H new ATOM 0 H2 A A2657 -5.347 44.191 -6.858 1.00 8.11 H new ATOM 420 P C A2658 2.420 44.463 -6.129 1.00 12.81 P ANISOU 420 P C A2658 1272 1502 2091 -244 -482 590 P ATOM 421 OP1 C A2658 3.176 44.547 -4.865 1.00 13.24 O ANISOU 421 OP1 C A2658 1808 1027 2194 0 -123 533 O ATOM 422 OP2 C A2658 3.093 44.040 -7.382 1.00 13.26 O ANISOU 422 OP2 C A2658 1620 957 2460 -117 -673 463 O ATOM 423 O5' C A2658 1.200 43.472 -5.926 1.00 11.34 O ANISOU 423 O5' C A2658 1602 1099 1606 390 -529 209 O ATOM 424 C5' C A2658 0.339 43.592 -4.815 1.00 9.69 C ANISOU 424 C5' C A2658 1355 978 1347 449 -500 -136 C ATOM 425 C4' C A2658 -0.835 42.655 -4.932 1.00 8.28 C ANISOU 425 C4' C A2658 911 1067 1166 -88 -82 -159 C ATOM 426 O4' C A2658 -1.673 43.058 -6.040 1.00 8.47 O ANISOU 426 O4' C A2658 1256 913 1049 -42 -179 112 O ATOM 427 C3' C A2658 -0.504 41.205 -5.234 1.00 7.87 C ANISOU 427 C3' C A2658 690 1242 1057 -24 -102 -157 C ATOM 428 O3' C A2658 -0.087 40.483 -4.091 1.00 11.39 O ANISOU 428 O3' C A2658 1728 1817 781 -835 -104 -103 O ATOM 429 C2' C A2658 -1.796 40.699 -5.854 1.00 8.32 C ANISOU 429 C2' C A2658 1322 793 1047 118 -119 -394 C ATOM 430 O2' C A2658 -2.771 40.414 -4.867 1.00 8.90 O ANISOU 430 O2' C A2658 1377 874 1129 -1 -238 4 O ATOM 431 C1' C A2658 -2.245 41.922 -6.649 1.00 8.63 C ANISOU 431 C1' C A2658 1213 1039 1025 176 -36 -30 C ATOM 432 N1 C A2658 -1.794 41.846 -8.055 1.00 7.83 N ANISOU 432 N1 C A2658 1083 710 1181 170 -331 -21 N ATOM 433 C2 C A2658 -2.520 41.028 -8.906 1.00 7.42 C ANISOU 433 C2 C A2658 975 684 1158 139 -343 116 C ATOM 434 O2 C A2658 -3.486 40.428 -8.446 1.00 9.12 O ANISOU 434 O2 C A2658 1305 1192 969 208 -165 0 O ATOM 435 N3 C A2658 -2.153 40.905 -10.191 1.00 8.59 N ANISOU 435 N3 C A2658 1336 738 1190 82 -249 161 N ATOM 436 C4 C A2658 -1.095 41.569 -10.627 1.00 8.20 C ANISOU 436 C4 C A2658 1238 676 1200 218 -56 163 C ATOM 437 N4 C A2658 -0.776 41.412 -11.900 1.00 8.82 N ANISOU 437 N4 C A2658 1277 732 1342 114 -106 30 N ATOM 438 C5 C A2658 -0.327 42.420 -9.793 1.00 7.78 C ANISOU 438 C5 C A2658 757 854 1344 -11 -95 163 C ATOM 439 C6 C A2658 -0.705 42.528 -8.517 1.00 8.19 C ANISOU 439 C6 C A2658 965 795 1352 138 -206 61 C ATOM 0 H5' C A2658 0.021 44.506 -4.746 1.00 9.69 H new ATOM 0 H5'' C A2658 0.829 43.400 -4.000 1.00 9.69 H new ATOM 0 H4' C A2658 -1.248 42.709 -4.056 1.00 8.28 H new ATOM 0 H3' C A2658 0.258 41.095 -5.824 1.00 7.87 H new ATOM 0 H2' C A2658 -1.680 39.883 -6.365 1.00 8.32 H new ATOM 0 HO2' C A2658 -2.406 40.388 -4.111 1.00 8.90 H new ATOM 0 H1' C A2658 -3.214 41.967 -6.651 1.00 8.63 H new ATOM 0 H41 C A2658 -0.096 41.824 -12.227 1.00 8.82 H new ATOM 0 H42 C A2658 -1.249 40.897 -12.401 1.00 8.82 H new ATOM 0 H5 C A2658 0.409 42.884 -10.121 1.00 7.78 H new ATOM 0 H6 C A2658 -0.222 43.073 -7.938 1.00 8.19 H new ATOM 451 P G A2659 1.061 39.373 -4.214 1.00 8.88 P ANISOU 451 P G A2659 1401 1069 904 213 -180 -108 P ATOM 452 OP1 G A2659 1.257 38.790 -2.872 1.00 10.25 O ANISOU 452 OP1 G A2659 1437 1297 1161 2 -49 -454 O ATOM 453 OP2 G A2659 2.216 39.910 -4.952 1.00 9.95 O ANISOU 453 OP2 G A2659 1779 1135 867 679 -297 -312 O ATOM 454 O5' G A2659 0.396 38.262 -5.117 1.00 10.37 O ANISOU 454 O5' G A2659 1844 1302 793 767 212 261 O ATOM 455 C5' G A2659 -0.739 37.544 -4.673 1.00 8.66 C ANISOU 455 C5' G A2659 1626 917 746 336 258 310 C ATOM 456 C4' G A2659 -1.254 36.632 -5.752 1.00 9.49 C ANISOU 456 C4' G A2659 1665 1028 910 -556 207 124 C ATOM 457 O4' G A2659 -1.833 37.417 -6.826 1.00 8.65 O ANISOU 457 O4' G A2659 1389 811 1084 -135 20 42 O ATOM 458 C3' G A2659 -0.210 35.780 -6.454 1.00 11.53 C ANISOU 458 C3' G A2659 2041 1366 973 -915 54 45 C ATOM 459 O3' G A2659 0.206 34.652 -5.705 1.00 12.25 O ANISOU 459 O3' G A2659 2534 1152 966 -512 -61 46 O ATOM 460 C2' G A2659 -0.900 35.448 -7.767 1.00 9.03 C ANISOU 460 C2' G A2659 1473 1178 779 -301 -44 44 C ATOM 461 O2' G A2659 -1.852 34.417 -7.609 1.00 9.84 O ANISOU 461 O2' G A2659 2047 987 705 -80 -96 83 O ATOM 462 C1' G A2659 -1.618 36.769 -8.063 1.00 7.49 C ANISOU 462 C1' G A2659 998 839 1009 -126 -279 113 C ATOM 463 N9 G A2659 -0.754 37.595 -8.921 1.00 9.49 N ANISOU 463 N9 G A2659 1676 988 939 401 -185 -22 N ATOM 464 C8 G A2659 0.131 38.597 -8.626 1.00 8.61 C ANISOU 464 C8 G A2659 1438 792 1042 177 -129 91 C ATOM 465 N7 G A2659 0.783 39.023 -9.670 1.00 8.12 N ANISOU 465 N7 G A2659 1186 770 1127 239 85 103 N ATOM 466 C5 G A2659 0.322 38.232 -10.708 1.00 8.01 C ANISOU 466 C5 G A2659 1096 849 1098 105 -6 130 C ATOM 467 C6 G A2659 0.645 38.202 -12.087 1.00 8.08 C ANISOU 467 C6 G A2659 1181 863 1024 323 -79 7 C ATOM 468 O6 G A2659 1.435 38.890 -12.720 1.00 9.02 O ANISOU 468 O6 G A2659 1295 1164 968 213 116 56 O ATOM 469 N1 G A2659 -0.069 37.226 -12.757 1.00 9.60 N ANISOU 469 N1 G A2659 1591 1122 932 724 124 181 N ATOM 470 C2 G A2659 -0.981 36.382 -12.189 1.00 7.42 C ANISOU 470 C2 G A2659 1271 778 771 501 12 119 C ATOM 471 N2 G A2659 -1.566 35.510 -13.012 1.00 8.42 N ANISOU 471 N2 G A2659 1250 1215 734 480 181 218 N ATOM 472 N3 G A2659 -1.303 36.403 -10.917 1.00 7.78 N ANISOU 472 N3 G A2659 1247 720 990 143 -74 175 N ATOM 473 C4 G A2659 -0.611 37.341 -10.251 1.00 9.17 C ANISOU 473 C4 G A2659 1630 921 933 500 -182 140 C ATOM 0 H5' G A2659 -1.436 38.165 -4.409 1.00 8.66 H new ATOM 0 H5'' G A2659 -0.510 37.024 -3.887 1.00 8.66 H new ATOM 0 H4' G A2659 -1.873 36.056 -5.276 1.00 9.49 H new ATOM 0 H3' G A2659 0.638 36.234 -6.581 1.00 11.53 H new ATOM 0 H2' G A2659 -0.293 35.139 -8.457 1.00 9.03 H new ATOM 0 HO2' G A2659 -1.702 33.809 -8.169 1.00 9.84 H new ATOM 0 H1' G A2659 -2.463 36.621 -8.517 1.00 7.49 H new ATOM 0 H8 G A2659 0.254 38.938 -7.770 1.00 8.61 H new ATOM 0 H1 G A2659 0.073 37.143 -13.601 1.00 9.60 H new ATOM 0 H21 G A2659 -2.148 34.955 -12.707 1.00 8.42 H new ATOM 0 H22 G A2659 -1.361 35.503 -13.847 1.00 8.42 H new ATOM 485 P A A2660 1.770 34.350 -5.530 1.00 10.22 P ANISOU 485 P A A2660 1714 1060 1108 119 -151 -17 P ATOM 486 OP1 A A2660 1.916 33.076 -4.814 1.00 12.44 O ANISOU 486 OP1 A A2660 1333 2046 1346 190 -245 -589 O ATOM 487 OP2 A A2660 2.441 35.553 -5.000 1.00 11.53 O ANISOU 487 OP2 A A2660 1482 1833 1066 603 -60 190 O ATOM 488 O5' A A2660 2.275 34.136 -7.015 1.00 10.79 O ANISOU 488 O5' A A2660 1771 956 1370 171 -607 -44 O ATOM 489 C5' A A2660 3.655 34.064 -7.326 1.00 10.95 C ANISOU 489 C5' A A2660 1517 1319 1324 249 -557 -18 C ATOM 490 C4' A A2660 3.940 32.912 -8.250 1.00 9.57 C ANISOU 490 C4' A A2660 885 1304 1448 -163 -253 -23 C ATOM 491 O4' A A2660 3.567 31.675 -7.593 1.00 9.91 O ANISOU 491 O4' A A2660 1017 1343 1406 102 -159 114 O ATOM 492 C3' A A2660 3.163 32.875 -9.558 1.00 9.97 C ANISOU 492 C3' A A2660 765 1568 1453 87 163 -324 C ATOM 493 O3' A A2660 3.701 33.713 -10.566 1.00 12.49 O ANISOU 493 O3' A A2660 1147 2226 1372 -499 106 -497 O ATOM 494 C2' A A2660 3.220 31.403 -9.916 1.00 9.04 C ANISOU 494 C2' A A2660 979 1067 1386 -77 -56 -95 C ATOM 495 O2' A A2660 4.491 31.074 -10.456 1.00 10.70 O ANISOU 495 O2' A A2660 1292 1401 1371 147 -151 -105 O ATOM 496 C1' A A2660 3.091 30.754 -8.544 1.00 9.59 C ANISOU 496 C1' A A2660 1269 1059 1313 247 -164 -6 C ATOM 497 N9 A A2660 1.706 30.380 -8.196 1.00 11.11 N ANISOU 497 N9 A A2660 2058 870 1293 524 -208 138 N ATOM 498 C8 A A2660 0.899 30.974 -7.259 1.00 11.30 C ANISOU 498 C8 A A2660 2132 849 1310 231 -311 182 C ATOM 499 N7 A A2660 -0.276 30.411 -7.130 1.00 10.57 N ANISOU 499 N7 A A2660 1660 1069 1285 379 -234 114 N ATOM 500 C5 A A2660 -0.257 29.363 -8.043 1.00 12.47 C ANISOU 500 C5 A A2660 1697 1668 1373 538 -476 445 C ATOM 501 C6 A A2660 -1.207 28.374 -8.390 1.00 12.63 C ANISOU 501 C6 A A2660 1952 1328 1519 299 -798 250 C ATOM 502 N6 A A2660 -2.419 28.265 -7.851 1.00 12.01 N ANISOU 502 N6 A A2660 1695 1222 1645 -85 -857 219 N ATOM 503 N1 A A2660 -0.873 27.481 -9.331 1.00 13.63 N ANISOU 503 N1 A A2660 2266 1484 1428 811 -728 -172 N ATOM 504 C2 A A2660 0.340 27.578 -9.880 1.00 15.75 C ANISOU 504 C2 A A2660 2937 1554 1493 657 -900 -98 C ATOM 505 N3 A A2660 1.320 28.448 -9.645 1.00 12.80 N ANISOU 505 N3 A A2660 2332 1109 1423 57 -635 33 N ATOM 506 C4 A A2660 0.961 29.331 -8.702 1.00 11.49 C ANISOU 506 C4 A A2660 1822 1246 1295 509 -376 373 C ATOM 0 H5' A A2660 4.169 33.963 -6.510 1.00 10.95 H new ATOM 0 H5'' A A2660 3.940 34.893 -7.740 1.00 10.95 H new ATOM 0 H4' A A2660 4.882 33.022 -8.455 1.00 9.57 H new ATOM 0 H3' A A2660 2.261 33.220 -9.472 1.00 9.97 H new ATOM 0 H2' A A2660 2.554 31.133 -10.568 1.00 9.04 H new ATOM 0 HO2' A A2660 4.832 31.757 -10.806 1.00 10.70 H new ATOM 0 H1' A A2660 3.604 29.931 -8.555 1.00 9.59 H new ATOM 0 H8 A A2660 1.163 31.712 -6.759 1.00 11.30 H new ATOM 0 H61 A A2660 -2.949 27.639 -8.108 1.00 12.01 H new ATOM 0 H62 A A2660 -2.672 28.821 -7.246 1.00 12.01 H new ATOM 0 H2 A A2660 0.530 26.938 -10.528 1.00 15.75 H new ATOM 518 P G A2661 2.823 34.895 -11.206 1.00 9.79 P ANISOU 518 P G A2661 1132 1106 1480 66 -129 191 P ATOM 519 OP1 G A2661 3.749 35.744 -11.979 1.00 11.12 O ANISOU 519 OP1 G A2661 1451 1277 1498 359 -227 -1 O ATOM 520 OP2 G A2661 2.007 35.495 -10.138 1.00 10.28 O ANISOU 520 OP2 G A2661 1223 1067 1615 -190 -330 342 O ATOM 521 O5' G A2661 1.860 34.161 -12.230 1.00 9.04 O ANISOU 521 O5' G A2661 915 1062 1458 199 108 350 O ATOM 522 C5' G A2661 2.382 33.509 -13.373 1.00 9.55 C ANISOU 522 C5' G A2661 823 1464 1340 1 -99 367 C ATOM 523 C4' G A2661 1.636 32.236 -13.680 1.00 8.85 C ANISOU 523 C4' G A2661 838 1290 1232 238 244 -40 C ATOM 524 O4' G A2661 1.395 31.496 -12.457 1.00 7.92 O ANISOU 524 O4' G A2661 811 1042 1154 182 -57 85 O ATOM 525 C3' G A2661 0.259 32.397 -14.295 1.00 7.32 C ANISOU 525 C3' G A2661 655 935 1190 -18 259 -203 C ATOM 526 O3' G A2661 0.312 32.603 -15.694 1.00 8.46 O ANISOU 526 O3' G A2661 946 962 1307 -119 365 -199 O ATOM 527 C2' G A2661 -0.434 31.105 -13.901 1.00 9.11 C ANISOU 527 C2' G A2661 1133 1203 1126 420 30 -12 C ATOM 528 O2' G A2661 -0.024 30.039 -14.746 1.00 9.03 O ANISOU 528 O2' G A2661 1082 1145 1204 425 145 128 O ATOM 529 C1' G A2661 0.140 30.868 -12.512 1.00 8.35 C ANISOU 529 C1' G A2661 1316 831 1026 175 -277 90 C ATOM 530 N9 G A2661 -0.699 31.388 -11.412 1.00 7.31 N ANISOU 530 N9 G A2661 954 858 966 261 -229 260 N ATOM 531 C8 G A2661 -0.466 32.491 -10.626 1.00 7.30 C ANISOU 531 C8 G A2661 969 739 1063 -242 -182 266 C ATOM 532 N7 G A2661 -1.358 32.670 -9.701 1.00 6.62 N ANISOU 532 N7 G A2661 1101 603 810 160 -240 15 N ATOM 533 C5 G A2661 -2.233 31.608 -9.867 1.00 7.31 C ANISOU 533 C5 G A2661 1241 836 699 116 -181 99 C ATOM 534 C6 G A2661 -3.404 31.255 -9.149 1.00 7.81 C ANISOU 534 C6 G A2661 1306 1101 559 388 -79 193 C ATOM 535 O6 G A2661 -3.930 31.828 -8.191 1.00 9.87 O ANISOU 535 O6 G A2661 1769 1298 682 21 73 199 O ATOM 536 N1 G A2661 -3.982 30.105 -9.656 1.00 7.96 N ANISOU 536 N1 G A2661 853 1265 907 -14 170 234 N ATOM 537 C2 G A2661 -3.503 29.370 -10.704 1.00 6.93 C ANISOU 537 C2 G A2661 707 924 1001 154 114 199 C ATOM 538 N2 G A2661 -4.206 28.297 -11.057 1.00 7.25 N ANISOU 538 N2 G A2661 829 934 992 312 193 136 N ATOM 539 N3 G A2661 -2.421 29.679 -11.379 1.00 7.01 N ANISOU 539 N3 G A2661 1016 806 839 113 -51 -95 N ATOM 540 C4 G A2661 -1.836 30.803 -10.911 1.00 7.50 C ANISOU 540 C4 G A2661 983 1039 827 305 -301 250 C ATOM 0 H5' G A2661 3.320 33.308 -13.231 1.00 9.55 H new ATOM 0 H5'' G A2661 2.332 34.105 -14.137 1.00 9.55 H new ATOM 0 H4' G A2661 2.215 31.796 -14.322 1.00 8.85 H new ATOM 0 H3' G A2661 -0.215 33.183 -13.981 1.00 7.32 H new ATOM 0 H2' G A2661 -1.402 31.152 -13.952 1.00 9.11 H new ATOM 0 HO2' G A2661 -0.280 29.308 -14.420 1.00 9.03 H new ATOM 0 H1' G A2661 0.192 29.908 -12.382 1.00 8.35 H new ATOM 0 H8 G A2661 0.263 33.056 -10.746 1.00 7.30 H new ATOM 0 H1 G A2661 -4.704 29.829 -9.280 1.00 7.96 H new ATOM 0 H21 G A2661 -3.941 27.806 -11.711 1.00 7.25 H new ATOM 0 H22 G A2661 -4.925 28.095 -10.631 1.00 7.25 H new ATOM 552 P A A2662 -0.842 33.427 -16.443 1.00 8.65 P ANISOU 552 P A A2662 1065 1164 1055 71 135 38 P ATOM 553 OP1 A A2662 -0.548 33.381 -17.897 1.00 9.77 O ANISOU 553 OP1 A A2662 1143 1237 1333 63 -79 -94 O ATOM 554 OP2 A A2662 -0.987 34.736 -15.783 1.00 8.58 O ANISOU 554 OP2 A A2662 975 1216 1068 -78 -50 254 O ATOM 555 O5' A A2662 -2.168 32.600 -16.167 1.00 8.95 O ANISOU 555 O5' A A2662 1301 1099 1001 602 50 6 O ATOM 556 C5' A A2662 -2.365 31.308 -16.712 1.00 9.67 C ANISOU 556 C5' A A2662 800 1748 1125 286 42 6 C ATOM 557 C4' A A2662 -3.686 30.741 -16.271 1.00 8.56 C ANISOU 557 C4' A A2662 1067 1073 1111 -155 26 -269 C ATOM 558 O4' A A2662 -3.654 30.440 -14.855 1.00 7.58 O ANISOU 558 O4' A A2662 997 789 1093 -116 168 29 O ATOM 559 C3' A A2662 -4.870 31.671 -16.431 1.00 7.90 C ANISOU 559 C3' A A2662 1133 787 1079 -155 7 -300 C ATOM 560 O3' A A2662 -5.375 31.654 -17.749 1.00 10.00 O ANISOU 560 O3' A A2662 1153 1556 1089 -191 42 -155 O ATOM 561 C2' A A2662 -5.848 31.162 -15.383 1.00 7.94 C ANISOU 561 C2' A A2662 1393 641 983 239 36 -192 C ATOM 562 O2' A A2662 -6.565 30.041 -15.857 1.00 8.56 O ANISOU 562 O2' A A2662 1300 915 1037 222 -103 -99 O ATOM 563 C1' A A2662 -4.902 30.728 -14.265 1.00 7.37 C ANISOU 563 C1' A A2662 1360 501 937 109 -145 79 C ATOM 564 N9 A A2662 -4.716 31.802 -13.268 1.00 7.72 N ANISOU 564 N9 A A2662 972 1056 904 194 -53 185 N ATOM 565 C8 A A2662 -3.807 32.824 -13.332 1.00 7.41 C ANISOU 565 C8 A A2662 827 1324 662 74 -131 400 C ATOM 566 N7 A A2662 -3.861 33.663 -12.342 1.00 7.19 N ANISOU 566 N7 A A2662 1191 990 549 -117 -241 265 N ATOM 567 C5 A A2662 -4.882 33.167 -11.552 1.00 7.71 C ANISOU 567 C5 A A2662 1209 1019 699 80 -429 158 C ATOM 568 C6 A A2662 -5.427 33.616 -10.338 1.00 9.39 C ANISOU 568 C6 A A2662 1588 1203 774 373 -288 240 C ATOM 569 N6 A A2662 -4.998 34.699 -9.683 1.00 9.51 N ANISOU 569 N6 A A2662 1500 1048 1065 91 -74 215 N ATOM 570 N1 A A2662 -6.436 32.896 -9.818 1.00 9.29 N ANISOU 570 N1 A A2662 1193 1704 633 534 7 -73 N ATOM 571 C2 A A2662 -6.854 31.805 -10.463 1.00 8.73 C ANISOU 571 C2 A A2662 982 1691 645 24 -252 221 C ATOM 572 N3 A A2662 -6.425 31.282 -11.604 1.00 6.68 N ANISOU 572 N3 A A2662 1125 755 657 -50 -236 97 N ATOM 573 C4 A A2662 -5.423 32.019 -12.107 1.00 7.25 C ANISOU 573 C4 A A2662 913 1121 718 348 -355 -96 C ATOM 0 H5' A A2662 -1.646 30.721 -16.432 1.00 9.67 H new ATOM 0 H5'' A A2662 -2.334 31.352 -17.680 1.00 9.67 H new ATOM 0 H4' A A2662 -3.803 29.967 -16.843 1.00 8.56 H new ATOM 0 H3' A A2662 -4.657 32.608 -16.295 1.00 7.90 H new ATOM 0 H2' A A2662 -6.514 31.818 -15.125 1.00 7.94 H new ATOM 0 HO2' A A2662 -6.576 30.050 -16.697 1.00 8.56 H new ATOM 0 H1' A A2662 -5.276 29.957 -13.811 1.00 7.37 H new ATOM 0 H8 A A2662 -3.198 32.911 -14.030 1.00 7.41 H new ATOM 0 H61 A A2662 -5.369 34.928 -8.942 1.00 9.51 H new ATOM 0 H62 A A2662 -4.351 35.166 -10.003 1.00 9.51 H new ATOM 0 H2 A A2662 -7.549 31.343 -10.052 1.00 8.73 H new ATOM 585 P G A2663 -5.896 33.000 -18.426 1.00 10.27 P ANISOU 585 P G A2663 1348 1507 1045 -17 -9 108 P ATOM 586 OP1 G A2663 -6.419 32.632 -19.752 1.00 11.77 O ANISOU 586 OP1 G A2663 1647 1612 1214 -17 96 364 O ATOM 587 OP2 G A2663 -4.845 34.037 -18.330 1.00 11.85 O ANISOU 587 OP2 G A2663 2185 1477 838 884 -1 128 O ATOM 588 O5' G A2663 -7.137 33.378 -17.513 1.00 11.93 O ANISOU 588 O5' G A2663 1931 1254 1347 -528 -617 523 O ATOM 589 C5' G A2663 -7.434 34.716 -17.181 1.00 11.43 C ANISOU 589 C5' G A2663 2184 863 1296 -82 -457 260 C ATOM 590 C4' G A2663 -7.800 34.855 -15.732 1.00 9.54 C ANISOU 590 C4' G A2663 1713 571 1339 -76 -329 38 C ATOM 591 O4' G A2663 -6.660 34.514 -14.898 1.00 8.82 O ANISOU 591 O4' G A2663 1339 661 1352 234 -117 65 O ATOM 592 C3' G A2663 -8.154 36.265 -15.309 1.00 9.42 C ANISOU 592 C3' G A2663 1299 807 1474 -80 -357 -45 C ATOM 593 O3' G A2663 -9.478 36.627 -15.642 1.00 9.08 O ANISOU 593 O3' G A2663 1115 973 1360 96 -174 -304 O ATOM 594 C2' G A2663 -7.837 36.254 -13.822 1.00 9.67 C ANISOU 594 C2' G A2663 1665 706 1301 -30 -260 54 C ATOM 595 O2' G A2663 -8.839 35.595 -13.076 1.00 11.17 O ANISOU 595 O2' G A2663 2202 801 1241 188 -469 -142 O ATOM 596 C1' G A2663 -6.565 35.416 -13.816 1.00 10.26 C ANISOU 596 C1' G A2663 1847 745 1307 151 -293 334 C ATOM 597 N9 G A2663 -5.395 36.284 -14.044 1.00 9.87 N ANISOU 597 N9 G A2663 1603 762 1386 403 -294 184 N ATOM 598 C8 G A2663 -4.662 36.421 -15.199 1.00 9.41 C ANISOU 598 C8 G A2663 1439 784 1353 456 -201 186 C ATOM 599 N7 G A2663 -3.711 37.301 -15.099 1.00 9.90 N ANISOU 599 N7 G A2663 1373 1064 1322 327 -177 8 N ATOM 600 C5 G A2663 -3.837 37.784 -13.800 1.00 9.60 C ANISOU 600 C5 G A2663 1379 933 1333 355 -353 339 C ATOM 601 C6 G A2663 -3.092 38.766 -13.102 1.00 9.96 C ANISOU 601 C6 G A2663 1418 1024 1341 395 -676 -88 C ATOM 602 O6 G A2663 -2.134 39.432 -13.504 1.00 11.97 O ANISOU 602 O6 G A2663 2120 1172 1254 518 -739 -105 O ATOM 603 N1 G A2663 -3.565 38.940 -11.810 1.00 9.25 N ANISOU 603 N1 G A2663 1336 981 1197 512 -600 -330 N ATOM 604 C2 G A2663 -4.615 38.267 -11.254 1.00 8.22 C ANISOU 604 C2 G A2663 1132 739 1253 49 -551 195 C ATOM 605 N2 G A2663 -4.927 38.575 -9.995 1.00 10.60 N ANISOU 605 N2 G A2663 1699 923 1403 -146 -774 110 N ATOM 606 N3 G A2663 -5.316 37.360 -11.889 1.00 8.45 N ANISOU 606 N3 G A2663 1258 695 1255 47 -234 201 N ATOM 607 C4 G A2663 -4.877 37.175 -13.145 1.00 9.08 C ANISOU 607 C4 G A2663 1303 779 1368 359 -215 334 C ATOM 0 H5' G A2663 -8.166 35.033 -17.733 1.00 11.43 H new ATOM 0 H5'' G A2663 -6.668 35.277 -17.378 1.00 11.43 H new ATOM 0 H4' G A2663 -8.567 34.272 -15.624 1.00 9.54 H new ATOM 0 H3' G A2663 -7.655 36.953 -15.776 1.00 9.42 H new ATOM 0 H2' G A2663 -7.764 37.139 -13.431 1.00 9.67 H new ATOM 0 HO2' G A2663 -9.577 35.672 -13.469 1.00 11.17 H new ATOM 0 H1' G A2663 -6.465 34.957 -12.967 1.00 10.26 H new ATOM 0 H8 G A2663 -4.830 35.934 -15.973 1.00 9.41 H new ATOM 0 H1 G A2663 -3.164 39.520 -11.318 1.00 9.25 H new ATOM 0 H21 G A2663 -5.581 38.176 -9.604 1.00 10.60 H new ATOM 0 H22 G A2663 -4.474 39.172 -9.574 1.00 10.60 H new ATOM 619 P G A2664 -9.755 38.028 -16.362 1.00 9.37 P ANISOU 619 P G A2664 1410 875 1273 230 -341 42 P ATOM 620 OP1 G A2664 -11.215 38.156 -16.506 1.00 13.53 O ANISOU 620 OP1 G A2664 3005 799 1337 -55 12 -53 O ATOM 621 OP2 G A2664 -8.891 38.185 -17.543 1.00 9.13 O ANISOU 621 OP2 G A2664 1186 762 1521 178 -454 -38 O ATOM 622 O5' G A2664 -9.239 39.098 -15.317 1.00 8.74 O ANISOU 622 O5' G A2664 885 840 1596 110 -79 405 O ATOM 623 C5' G A2664 -9.744 39.144 -13.994 1.00 8.55 C ANISOU 623 C5' G A2664 1045 601 1601 -18 -124 371 C ATOM 624 C4' G A2664 -8.946 40.093 -13.144 1.00 8.26 C ANISOU 624 C4' G A2664 1034 840 1264 -45 131 -19 C ATOM 625 O4' G A2664 -7.576 39.630 -13.051 1.00 8.14 O ANISOU 625 O4' G A2664 1120 711 1260 141 -95 -44 O ATOM 626 C3' G A2664 -8.810 41.505 -13.679 1.00 8.69 C ANISOU 626 C3' G A2664 995 1121 1184 -191 220 -298 C ATOM 627 O3' G A2664 -9.953 42.299 -13.452 1.00 8.06 O ANISOU 627 O3' G A2664 872 1103 1088 -129 -73 -217 O ATOM 628 C2' G A2664 -7.556 41.988 -12.974 1.00 9.26 C ANISOU 628 C2' G A2664 1283 1019 1217 220 286 -54 C ATOM 629 O2' G A2664 -7.810 42.281 -11.606 1.00 8.18 O ANISOU 629 O2' G A2664 1011 892 1203 -73 -22 -7 O ATOM 630 C1' G A2664 -6.697 40.734 -13.051 1.00 9.30 C ANISOU 630 C1' G A2664 1601 651 1279 352 -54 26 C ATOM 631 N9 G A2664 -5.889 40.699 -14.291 1.00 10.74 N ANISOU 631 N9 G A2664 1905 832 1343 572 -82 24 N ATOM 632 C8 G A2664 -6.130 39.954 -15.422 1.00 9.52 C ANISOU 632 C8 G A2664 1609 698 1310 393 -240 134 C ATOM 633 N7 G A2664 -5.251 40.126 -16.369 1.00 10.07 N ANISOU 633 N7 G A2664 1760 857 1208 465 -110 180 N ATOM 634 C5 G A2664 -4.364 41.050 -15.841 1.00 8.53 C ANISOU 634 C5 G A2664 1283 756 1201 395 -56 284 C ATOM 635 C6 G A2664 -3.194 41.620 -16.402 1.00 8.61 C ANISOU 635 C6 G A2664 1248 802 1219 426 118 270 C ATOM 636 O6 G A2664 -2.694 41.430 -17.510 1.00 10.57 O ANISOU 636 O6 G A2664 1615 1067 1335 389 180 376 O ATOM 637 N1 G A2664 -2.593 42.509 -15.524 1.00 8.44 N ANISOU 637 N1 G A2664 971 826 1408 147 131 395 N ATOM 638 C2 G A2664 -3.052 42.805 -14.268 1.00 8.49 C ANISOU 638 C2 G A2664 1035 858 1333 262 48 423 C ATOM 639 N2 G A2664 -2.337 43.689 -13.572 1.00 8.83 N ANISOU 639 N2 G A2664 958 1009 1389 303 230 315 N ATOM 640 N3 G A2664 -4.138 42.280 -13.733 1.00 8.82 N ANISOU 640 N3 G A2664 1256 787 1306 394 37 257 N ATOM 641 C4 G A2664 -4.743 41.413 -14.564 1.00 8.26 C ANISOU 641 C4 G A2664 1328 610 1198 338 102 234 C ATOM 0 H5' G A2664 -9.719 38.256 -13.604 1.00 8.55 H new ATOM 0 H5'' G A2664 -10.673 39.421 -14.009 1.00 8.55 H new ATOM 0 H4' G A2664 -9.439 40.112 -12.309 1.00 8.26 H new ATOM 0 H3' G A2664 -8.737 41.554 -14.645 1.00 8.69 H new ATOM 0 H2' G A2664 -7.177 42.794 -13.359 1.00 9.26 H new ATOM 0 HO2' G A2664 -8.124 43.057 -11.539 1.00 8.18 H new ATOM 0 H1' G A2664 -6.084 40.717 -12.299 1.00 9.30 H new ATOM 0 H8 G A2664 -6.856 39.378 -15.504 1.00 9.52 H new ATOM 0 H1 G A2664 -1.877 42.905 -15.788 1.00 8.44 H new ATOM 0 H21 G A2664 -2.582 43.910 -12.778 1.00 8.83 H new ATOM 0 H22 G A2664 -1.631 44.038 -13.917 1.00 8.83 H new ATOM 653 P A A2665 -10.221 43.597 -14.342 1.00 8.49 P ANISOU 653 P A A2665 1039 915 1272 28 -79 -83 P ATOM 654 OP1 A A2665 -11.625 43.984 -14.070 1.00 9.77 O ANISOU 654 OP1 A A2665 1650 669 1392 -72 -494 -234 O ATOM 655 OP2 A A2665 -9.773 43.366 -15.728 1.00 8.89 O ANISOU 655 OP2 A A2665 1058 890 1428 36 -258 -46 O ATOM 656 O5' A A2665 -9.229 44.668 -13.716 1.00 8.04 O ANISOU 656 O5' A A2665 942 1036 1075 214 33 137 O ATOM 657 C5' A A2665 -9.708 45.776 -12.979 1.00 7.06 C ANISOU 657 C5' A A2665 637 715 1331 27 57 159 C ATOM 658 C4' A A2665 -9.959 45.426 -11.539 1.00 7.36 C ANISOU 658 C4' A A2665 758 822 1217 -90 110 25 C ATOM 659 O4' A A2665 -8.805 44.740 -10.975 1.00 8.12 O ANISOU 659 O4' A A2665 1371 677 1035 18 216 -7 O ATOM 660 C3' A A2665 -10.155 46.615 -10.623 1.00 6.60 C ANISOU 660 C3' A A2665 596 758 1152 87 122 141 C ATOM 661 O3' A A2665 -11.439 47.192 -10.705 1.00 8.27 O ANISOU 661 O3' A A2665 1057 1082 1002 -274 194 98 O ATOM 662 C2' A A2665 -9.786 46.031 -9.271 1.00 8.17 C ANISOU 662 C2' A A2665 1002 922 1180 -45 109 95 C ATOM 663 O2' A A2665 -10.787 45.145 -8.790 1.00 9.65 O ANISOU 663 O2' A A2665 1302 1078 1287 266 -60 59 O ATOM 664 C1' A A2665 -8.565 45.214 -9.667 1.00 9.19 C ANISOU 664 C1' A A2665 1415 865 1210 333 246 409 C ATOM 665 N9 A A2665 -7.367 46.075 -9.710 1.00 9.04 N ANISOU 665 N9 A A2665 1476 854 1103 430 13 245 N ATOM 666 C8 A A2665 -6.645 46.433 -10.817 1.00 8.00 C ANISOU 666 C8 A A2665 945 1055 1037 423 -328 99 C ATOM 667 N7 A A2665 -5.642 47.236 -10.564 1.00 7.96 N ANISOU 667 N7 A A2665 847 1088 1089 315 -151 37 N ATOM 668 C5 A A2665 -5.718 47.431 -9.200 1.00 7.81 C ANISOU 668 C5 A A2665 613 1149 1205 411 11 72 C ATOM 669 C6 A A2665 -4.930 48.185 -8.319 1.00 8.50 C ANISOU 669 C6 A A2665 892 994 1344 513 -61 118 C ATOM 670 N6 A A2665 -3.884 48.913 -8.693 1.00 8.97 N ANISOU 670 N6 A A2665 1068 993 1346 391 -181 -15 N ATOM 671 N1 A A2665 -5.259 48.166 -7.020 1.00 8.38 N ANISOU 671 N1 A A2665 1108 891 1184 348 -49 -83 N ATOM 672 C2 A A2665 -6.307 47.429 -6.645 1.00 8.73 C ANISOU 672 C2 A A2665 1304 814 1197 486 43 115 C ATOM 673 N3 A A2665 -7.123 46.678 -7.377 1.00 8.66 N ANISOU 673 N3 A A2665 1192 950 1146 452 -49 -9 N ATOM 674 C4 A A2665 -6.770 46.722 -8.661 1.00 7.91 C ANISOU 674 C4 A A2665 743 1141 1119 484 -93 4 C ATOM 0 H5' A A2665 -10.529 46.100 -13.380 1.00 7.06 H new ATOM 0 H5'' A A2665 -9.064 46.499 -13.028 1.00 7.06 H new ATOM 0 H4' A A2665 -10.768 44.892 -11.573 1.00 7.36 H new ATOM 0 H3' A A2665 -9.611 47.384 -10.853 1.00 6.60 H new ATOM 0 H2' A A2665 -9.662 46.696 -8.575 1.00 8.17 H new ATOM 0 HO2' A A2665 -10.908 45.278 -7.969 1.00 9.65 H new ATOM 0 H1' A A2665 -8.418 44.496 -9.031 1.00 9.19 H new ATOM 0 H8 A A2665 -6.849 46.132 -11.673 1.00 8.00 H new ATOM 0 H61 A A2665 -3.437 49.356 -8.107 1.00 8.97 H new ATOM 0 H62 A A2665 -3.654 48.941 -9.521 1.00 8.97 H new ATOM 0 H2 A A2665 -6.494 47.443 -5.734 1.00 8.73 H new ATOM 686 P C A2666 -11.624 48.761 -10.442 1.00 8.25 P ANISOU 686 P C A2666 1037 1028 1070 112 178 95 P ATOM 687 OP1 C A2666 -13.004 49.089 -10.839 1.00 7.93 O ANISOU 687 OP1 C A2666 942 1192 878 -39 88 119 O ATOM 688 OP2 C A2666 -10.496 49.518 -11.032 1.00 8.45 O ANISOU 688 OP2 C A2666 1179 1162 869 348 215 -28 O ATOM 689 O5' C A2666 -11.477 48.897 -8.869 1.00 7.69 O ANISOU 689 O5' C A2666 908 774 1240 65 243 -102 O ATOM 690 C5' C A2666 -12.329 48.191 -7.987 1.00 9.75 C ANISOU 690 C5' C A2666 1911 633 1161 206 -226 -46 C ATOM 691 C4' C A2666 -11.854 48.318 -6.564 1.00 9.65 C ANISOU 691 C4' C A2666 1857 638 1172 -257 293 106 C ATOM 692 O4' C A2666 -10.451 47.963 -6.477 1.00 9.52 O ANISOU 692 O4' C A2666 1605 925 1087 62 410 224 O ATOM 693 C3' C A2666 -11.911 49.710 -5.964 1.00 11.35 C ANISOU 693 C3' C A2666 2088 1002 1220 -636 448 -70 C ATOM 694 O3' C A2666 -13.202 50.072 -5.528 1.00 10.26 O ANISOU 694 O3' C A2666 1413 1117 1368 -294 767 -153 O ATOM 695 C2' C A2666 -10.899 49.610 -4.841 1.00 10.94 C ANISOU 695 C2' C A2666 2201 830 1123 -454 294 23 C ATOM 696 O2' C A2666 -11.444 48.898 -3.741 1.00 10.95 O ANISOU 696 O2' C A2666 1657 1134 1370 -448 290 -41 O ATOM 697 C1' C A2666 -9.822 48.754 -5.493 1.00 8.50 C ANISOU 697 C1' C A2666 1363 779 1085 -29 79 38 C ATOM 698 N1 C A2666 -8.756 49.560 -6.135 1.00 8.48 N ANISOU 698 N1 C A2666 1286 897 1038 307 22 -34 N ATOM 699 C2 C A2666 -7.862 50.240 -5.312 1.00 8.98 C ANISOU 699 C2 C A2666 1499 888 1025 241 79 82 C ATOM 700 O2 C A2666 -8.030 50.155 -4.101 1.00 9.05 O ANISOU 700 O2 C A2666 1754 837 848 -160 336 22 O ATOM 701 N3 C A2666 -6.860 50.970 -5.846 1.00 8.30 N ANISOU 701 N3 C A2666 1374 729 1049 127 -3 26 N ATOM 702 C4 C A2666 -6.727 51.023 -7.163 1.00 8.87 C ANISOU 702 C4 C A2666 1458 784 1127 273 205 -15 C ATOM 703 N4 C A2666 -5.729 51.750 -7.656 1.00 9.23 N ANISOU 703 N4 C A2666 1065 1205 1235 210 209 27 N ATOM 704 C5 C A2666 -7.616 50.336 -8.035 1.00 8.70 C ANISOU 704 C5 C A2666 1723 589 994 300 129 -70 C ATOM 705 C6 C A2666 -8.603 49.622 -7.489 1.00 8.21 C ANISOU 705 C6 C A2666 1316 710 1093 115 58 60 C ATOM 0 H5' C A2666 -12.358 47.255 -8.240 1.00 9.75 H new ATOM 0 H5'' C A2666 -13.233 48.533 -8.062 1.00 9.75 H new ATOM 0 H4' C A2666 -12.461 47.737 -6.080 1.00 9.65 H new ATOM 0 H3' C A2666 -11.707 50.415 -6.599 1.00 11.35 H new ATOM 0 H2' C A2666 -10.602 50.469 -4.502 1.00 10.94 H new ATOM 0 HO2' C A2666 -12.281 48.881 -3.805 1.00 10.95 H new ATOM 0 H1' C A2666 -9.396 48.220 -4.804 1.00 8.50 H new ATOM 0 H41 C A2666 -5.616 51.804 -8.507 1.00 9.23 H new ATOM 0 H42 C A2666 -5.196 52.166 -7.124 1.00 9.23 H new ATOM 0 H5 C A2666 -7.513 50.383 -8.958 1.00 8.70 H new ATOM 0 H6 C A2666 -9.194 49.161 -8.039 1.00 8.21 H new ATOM 717 P C A2667 -13.862 51.455 -5.990 1.00 10.92 P ANISOU 717 P C A2667 1335 1200 1612 -56 622 -99 P ATOM 718 OP1 C A2667 -15.235 51.466 -5.441 1.00 13.37 O ANISOU 718 OP1 C A2667 2222 1165 1691 157 344 -564 O ATOM 719 OP2 C A2667 -13.644 51.640 -7.434 1.00 10.47 O ANISOU 719 OP2 C A2667 1162 968 1846 115 -47 -23 O ATOM 720 O5' C A2667 -13.017 52.567 -5.244 1.00 9.95 O ANISOU 720 O5' C A2667 1078 1341 1359 52 571 258 O ATOM 721 C5' C A2667 -12.969 52.632 -3.830 1.00 9.69 C ANISOU 721 C5' C A2667 1000 1329 1352 199 469 181 C ATOM 722 C4' C A2667 -11.789 53.445 -3.365 1.00 11.90 C ANISOU 722 C4' C A2667 1917 1432 1170 -183 337 -59 C ATOM 723 O4' C A2667 -10.565 52.824 -3.830 1.00 12.03 O ANISOU 723 O4' C A2667 1834 1443 1292 175 199 -160 O ATOM 724 C3' C A2667 -11.697 54.868 -3.897 1.00 12.87 C ANISOU 724 C3' C A2667 2361 1331 1199 -558 369 29 C ATOM 725 O3' C A2667 -12.510 55.789 -3.201 1.00 11.07 O ANISOU 725 O3' C A2667 2061 939 1206 -265 748 -241 O ATOM 726 C2' C A2667 -10.214 55.163 -3.778 1.00 11.46 C ANISOU 726 C2' C A2667 2008 1059 1286 -512 129 307 C ATOM 727 O2' C A2667 -9.867 55.475 -2.443 1.00 11.20 O ANISOU 727 O2' C A2667 2092 854 1307 301 232 -156 O ATOM 728 C1' C A2667 -9.611 53.813 -4.143 1.00 9.87 C ANISOU 728 C1' C A2667 1440 1001 1307 -306 12 199 C ATOM 729 N1 C A2667 -9.285 53.735 -5.582 1.00 9.08 N ANISOU 729 N1 C A2667 1405 838 1207 61 220 63 N ATOM 730 C2 C A2667 -8.129 54.366 -6.007 1.00 9.09 C ANISOU 730 C2 C A2667 1665 576 1212 233 205 -138 C ATOM 731 O2 C A2667 -7.435 54.938 -5.171 1.00 11.78 O ANISOU 731 O2 C A2667 2144 955 1376 58 513 4 O ATOM 732 N3 C A2667 -7.784 54.334 -7.306 1.00 8.55 N ANISOU 732 N3 C A2667 1132 761 1356 7 202 152 N ATOM 733 C4 C A2667 -8.548 53.699 -8.178 1.00 7.98 C ANISOU 733 C4 C A2667 981 875 1176 223 38 342 C ATOM 734 N4 C A2667 -8.153 53.698 -9.443 1.00 7.91 N ANISOU 734 N4 C A2667 837 1024 1144 44 120 288 N ATOM 735 C5 C A2667 -9.747 53.039 -7.781 1.00 8.62 C ANISOU 735 C5 C A2667 1271 883 1120 350 80 137 C ATOM 736 C6 C A2667 -10.075 53.088 -6.484 1.00 8.89 C ANISOU 736 C6 C A2667 1391 958 1028 325 246 259 C ATOM 0 H5' C A2667 -12.913 51.736 -3.464 1.00 9.69 H new ATOM 0 H5'' C A2667 -13.789 53.025 -3.493 1.00 9.69 H new ATOM 0 H4' C A2667 -11.909 53.478 -2.403 1.00 11.90 H new ATOM 0 H3' C A2667 -12.033 54.955 -4.803 1.00 12.87 H new ATOM 0 H2' C A2667 -9.922 55.911 -4.322 1.00 11.46 H new ATOM 0 HO2' C A2667 -9.177 55.954 -2.437 1.00 11.20 H new ATOM 0 H1' C A2667 -8.787 53.685 -3.648 1.00 9.87 H new ATOM 0 H41 C A2667 -8.623 53.296 -10.040 1.00 7.91 H new ATOM 0 H42 C A2667 -7.426 54.100 -9.667 1.00 7.91 H new ATOM 0 H5 C A2667 -10.280 52.592 -8.398 1.00 8.62 H new ATOM 0 H6 C A2667 -10.855 52.673 -6.194 1.00 8.89 H new ATOM 748 P G A2668 -13.320 56.903 -4.010 1.00 11.85 P ANISOU 748 P G A2668 1837 1442 1221 -97 657 -127 P ATOM 749 OP1 G A2668 -13.899 57.862 -3.053 1.00 13.57 O ANISOU 749 OP1 G A2668 1466 2261 1427 -276 582 465 O ATOM 750 OP2 G A2668 -14.195 56.227 -4.986 1.00 13.61 O ANISOU 750 OP2 G A2668 2128 1634 1410 338 937 187 O ATOM 751 O5' G A2668 -12.200 57.673 -4.832 1.00 11.98 O ANISOU 751 O5' G A2668 1990 1502 1060 739 211 -265 O ATOM 752 C5' G A2668 -11.349 58.628 -4.221 1.00 10.41 C ANISOU 752 C5' G A2668 1767 1090 1099 403 344 -275 C ATOM 753 C4' G A2668 -10.315 59.153 -5.190 1.00 11.52 C ANISOU 753 C4' G A2668 1954 1311 1112 -176 1 -102 C ATOM 754 O4' G A2668 -9.526 58.052 -5.720 1.00 10.51 O ANISOU 754 O4' G A2668 1327 1694 973 51 118 -154 O ATOM 755 C3' G A2668 -10.845 59.837 -6.437 1.00 12.67 C ANISOU 755 C3' G A2668 2177 1425 1212 -848 2 101 C ATOM 756 O3' G A2668 -11.332 61.152 -6.225 1.00 12.21 O ANISOU 756 O3' G A2668 1787 1500 1350 -360 42 -273 O ATOM 757 C2' G A2668 -9.657 59.727 -7.382 1.00 8.92 C ANISOU 757 C2' G A2668 1418 944 1025 -153 175 -305 C ATOM 758 O2' G A2668 -8.623 60.633 -7.042 1.00 10.30 O ANISOU 758 O2' G A2668 1588 1191 1134 -10 404 -68 O ATOM 759 C1' G A2668 -9.185 58.316 -7.067 1.00 9.06 C ANISOU 759 C1' G A2668 843 1708 892 41 155 -48 C ATOM 760 N9 G A2668 -9.874 57.344 -7.926 1.00 7.83 N ANISOU 760 N9 G A2668 703 1373 897 185 198 161 N ATOM 761 C8 G A2668 -10.883 56.494 -7.566 1.00 7.78 C ANISOU 761 C8 G A2668 1069 964 924 291 57 82 C ATOM 762 N7 G A2668 -11.310 55.768 -8.552 1.00 7.82 N ANISOU 762 N7 G A2668 987 992 992 210 185 -64 N ATOM 763 C5 G A2668 -10.539 56.172 -9.629 1.00 8.26 C ANISOU 763 C5 G A2668 948 1103 1085 386 73 -109 C ATOM 764 C6 G A2668 -10.552 55.746 -10.974 1.00 7.80 C ANISOU 764 C6 G A2668 1062 1261 641 458 144 -154 C ATOM 765 O6 G A2668 -11.261 54.884 -11.490 1.00 7.61 O ANISOU 765 O6 G A2668 1099 1014 777 155 82 -400 O ATOM 766 N1 G A2668 -9.615 56.423 -11.736 1.00 7.85 N ANISOU 766 N1 G A2668 1240 1057 684 557 -24 -209 N ATOM 767 C2 G A2668 -8.765 57.383 -11.276 1.00 6.55 C ANISOU 767 C2 G A2668 1211 652 624 294 -45 -216 C ATOM 768 N2 G A2668 -7.936 57.909 -12.175 1.00 6.46 N ANISOU 768 N2 G A2668 989 689 775 57 92 -64 N ATOM 769 N3 G A2668 -8.738 57.793 -10.031 1.00 6.81 N ANISOU 769 N3 G A2668 788 877 921 211 85 55 N ATOM 770 C4 G A2668 -9.650 57.151 -9.265 1.00 8.63 C ANISOU 770 C4 G A2668 754 1517 1008 329 52 -81 C ATOM 0 H5' G A2668 -10.904 58.225 -3.459 1.00 10.41 H new ATOM 0 H5'' G A2668 -11.880 59.366 -3.882 1.00 10.41 H new ATOM 0 H4' G A2668 -9.830 59.798 -4.652 1.00 11.52 H new ATOM 0 H3' G A2668 -11.647 59.425 -6.794 1.00 12.67 H new ATOM 0 H2' G A2668 -9.882 59.914 -8.307 1.00 8.92 H new ATOM 0 HO2' G A2668 -8.934 61.245 -6.558 1.00 10.30 H new ATOM 0 H1' G A2668 -8.230 58.242 -7.217 1.00 9.06 H new ATOM 0 H8 G A2668 -11.227 56.442 -6.704 1.00 7.78 H new ATOM 0 H1 G A2668 -9.565 56.220 -12.570 1.00 7.85 H new ATOM 0 H21 G A2668 -7.378 58.519 -11.940 1.00 6.46 H new ATOM 0 H22 G A2668 -7.959 57.638 -12.991 1.00 6.46 H new ATOM 782 P G A2669 -12.633 61.653 -7.025 1.00 13.69 P ANISOU 782 P G A2669 1908 1464 1830 199 96 -230 P ATOM 783 OP1 G A2669 -13.030 62.961 -6.452 1.00 16.55 O ANISOU 783 OP1 G A2669 1912 2349 2026 -565 -298 109 O ATOM 784 OP2 G A2669 -13.627 60.558 -7.089 1.00 18.31 O ANISOU 784 OP2 G A2669 2814 2273 1870 1467 57 -7 O ATOM 785 O5' G A2669 -12.105 61.903 -8.502 1.00 10.01 O ANISOU 785 O5' G A2669 1286 1062 1453 191 -260 -230 O ATOM 786 C5' G A2669 -10.986 62.731 -8.748 1.00 10.15 C ANISOU 786 C5' G A2669 1479 1089 1289 339 -126 -175 C ATOM 787 C4' G A2669 -10.430 62.495 -10.124 1.00 9.50 C ANISOU 787 C4' G A2669 1025 1450 1133 272 -18 -234 C ATOM 788 O4' G A2669 -10.134 61.088 -10.289 1.00 8.19 O ANISOU 788 O4' G A2669 1196 901 1013 97 -126 -112 O ATOM 789 C3' G A2669 -11.351 62.805 -11.290 1.00 10.34 C ANISOU 789 C3' G A2669 1339 1494 1094 -202 167 -265 C ATOM 790 O3' G A2669 -11.420 64.179 -11.605 1.00 11.86 O ANISOU 790 O3' G A2669 2385 1158 963 -3 494 -42 O ATOM 791 C2' G A2669 -10.758 61.957 -12.400 1.00 8.74 C ANISOU 791 C2' G A2669 913 1351 1056 457 -49 -131 C ATOM 792 O2' G A2669 -9.583 62.553 -12.919 1.00 8.52 O ANISOU 792 O2' G A2669 1223 843 1169 223 -150 -75 O ATOM 793 C1' G A2669 -10.346 60.710 -11.630 1.00 7.54 C ANISOU 793 C1' G A2669 888 1024 951 137 -26 -26 C ATOM 794 N9 G A2669 -11.342 59.614 -11.682 1.00 9.30 N ANISOU 794 N9 G A2669 1137 1521 873 619 2 -76 N ATOM 795 C8 G A2669 -12.044 59.070 -10.636 1.00 9.54 C ANISOU 795 C8 G A2669 1432 1128 1062 618 152 -210 C ATOM 796 N7 G A2669 -12.826 58.087 -10.986 1.00 9.07 N ANISOU 796 N7 G A2669 1427 921 1097 348 -147 -198 N ATOM 797 C5 G A2669 -12.611 57.952 -12.343 1.00 9.24 C ANISOU 797 C5 G A2669 1338 1118 1054 609 -111 -15 C ATOM 798 C6 G A2669 -13.171 57.039 -13.272 1.00 8.51 C ANISOU 798 C6 G A2669 818 1410 1005 439 -159 -81 C ATOM 799 O6 G A2669 -13.992 56.138 -13.064 1.00 9.09 O ANISOU 799 O6 G A2669 836 1599 1017 177 -259 -384 O ATOM 800 N1 G A2669 -12.675 57.259 -14.555 1.00 8.01 N ANISOU 800 N1 G A2669 999 994 1049 417 -389 -390 N ATOM 801 C2 G A2669 -11.761 58.221 -14.895 1.00 7.08 C ANISOU 801 C2 G A2669 725 926 1039 321 -185 -127 C ATOM 802 N2 G A2669 -11.410 58.276 -16.179 1.00 7.40 N ANISOU 802 N2 G A2669 776 878 1158 237 -24 -111 N ATOM 803 N3 G A2669 -11.233 59.070 -14.037 1.00 7.73 N ANISOU 803 N3 G A2669 918 942 1076 406 -34 -36 N ATOM 804 C4 G A2669 -11.694 58.880 -12.786 1.00 8.00 C ANISOU 804 C4 G A2669 1155 926 959 368 -201 -97 C ATOM 0 H5' G A2669 -10.300 62.558 -8.085 1.00 10.15 H new ATOM 0 H5'' G A2669 -11.242 63.662 -8.655 1.00 10.15 H new ATOM 0 H4' G A2669 -9.670 63.096 -10.157 1.00 9.50 H new ATOM 0 H3' G A2669 -12.281 62.599 -11.107 1.00 10.34 H new ATOM 0 H2' G A2669 -11.365 61.820 -13.144 1.00 8.74 H new ATOM 0 HO2' G A2669 -9.550 63.359 -12.684 1.00 8.52 H new ATOM 0 H1' G A2669 -9.544 60.358 -12.046 1.00 7.54 H new ATOM 0 H8 G A2669 -11.969 59.374 -9.760 1.00 9.54 H new ATOM 0 H1 G A2669 -12.966 56.750 -15.184 1.00 8.01 H new ATOM 0 H21 G A2669 -10.839 58.862 -16.444 1.00 7.40 H new ATOM 0 H22 G A2669 -11.754 57.725 -16.743 1.00 7.40 H new ATOM 816 P A A2670 -12.827 64.848 -11.982 1.00 13.53 P ANISOU 816 P A A2670 2104 1472 1563 719 242 186 P ATOM 817 OP1 A A2670 -12.651 66.316 -11.842 1.00 14.22 O ANISOU 817 OP1 A A2670 2244 1602 1556 615 288 168 O ATOM 818 OP2 A A2670 -13.931 64.159 -11.286 1.00 17.96 O ANISOU 818 OP2 A A2670 3173 2057 1593 1317 -118 242 O ATOM 819 O5' A A2670 -13.018 64.496 -13.517 1.00 12.44 O ANISOU 819 O5' A A2670 1138 1468 2118 434 30 423 O ATOM 820 C5' A A2670 -12.188 65.091 -14.496 1.00 12.62 C ANISOU 820 C5' A A2670 1340 1476 1979 -111 -89 485 C ATOM 821 C4' A A2670 -12.345 64.453 -15.851 1.00 11.00 C ANISOU 821 C4' A A2670 1096 1425 1659 -34 -57 244 C ATOM 822 O4' A A2670 -11.964 63.055 -15.802 1.00 10.48 O ANISOU 822 O4' A A2670 1023 1452 1507 60 122 81 O ATOM 823 C3' A A2670 -13.745 64.423 -16.424 1.00 11.97 C ANISOU 823 C3' A A2670 1259 1554 1735 -254 -106 245 C ATOM 824 O3' A A2670 -14.143 65.651 -16.985 1.00 17.63 O ANISOU 824 O3' A A2670 2219 2534 1946 -524 -281 426 O ATOM 825 C2' A A2670 -13.644 63.305 -17.441 1.00 10.89 C ANISOU 825 C2' A A2670 1056 1449 1631 -216 -152 -74 C ATOM 826 O2' A A2670 -12.941 63.740 -18.594 1.00 11.84 O ANISOU 826 O2' A A2670 1063 1790 1646 27 -319 144 O ATOM 827 C1' A A2670 -12.778 62.312 -16.683 1.00 9.83 C ANISOU 827 C1' A A2670 707 1596 1431 285 7 -132 C ATOM 828 N9 A A2670 -13.577 61.375 -15.877 1.00 10.61 N ANISOU 828 N9 A A2670 907 1795 1330 563 -229 -45 N ATOM 829 C8 A A2670 -13.788 61.428 -14.528 1.00 10.30 C ANISOU 829 C8 A A2670 978 1486 1447 96 -340 81 C ATOM 830 N7 A A2670 -14.526 60.457 -14.065 1.00 10.47 N ANISOU 830 N7 A A2670 1063 1457 1459 312 -375 97 N ATOM 831 C5 A A2670 -14.816 59.707 -15.190 1.00 10.52 C ANISOU 831 C5 A A2670 822 1793 1383 550 -124 60 C ATOM 832 C6 A A2670 -15.560 58.536 -15.376 1.00 10.26 C ANISOU 832 C6 A A2670 586 1825 1485 266 -32 -191 C ATOM 833 N6 A A2670 -16.172 57.875 -14.399 1.00 10.53 N ANISOU 833 N6 A A2670 802 1678 1521 366 -407 -266 N ATOM 834 N1 A A2670 -15.657 58.056 -16.626 1.00 9.85 N ANISOU 834 N1 A A2670 871 1399 1470 362 0 -186 N ATOM 835 C2 A A2670 -15.041 58.705 -17.611 1.00 9.23 C ANISOU 835 C2 A A2670 1068 1014 1425 446 -30 120 C ATOM 836 N3 A A2670 -14.311 59.807 -17.561 1.00 10.02 N ANISOU 836 N3 A A2670 1187 1141 1477 551 -151 65 N ATOM 837 C4 A A2670 -14.235 60.263 -16.310 1.00 10.46 C ANISOU 837 C4 A A2670 988 1649 1336 678 -23 69 C ATOM 0 H5' A A2670 -11.262 65.023 -14.215 1.00 12.62 H new ATOM 0 H5'' A A2670 -12.396 66.036 -14.561 1.00 12.62 H new ATOM 0 H4' A A2670 -11.785 65.016 -16.408 1.00 11.00 H new ATOM 0 H3' A A2670 -14.431 64.274 -15.755 1.00 11.97 H new ATOM 0 H2' A A2670 -14.501 62.969 -17.748 1.00 10.89 H new ATOM 0 HO2' A A2670 -13.005 64.575 -18.663 1.00 11.84 H new ATOM 0 H1' A A2670 -12.267 61.794 -17.325 1.00 9.83 H new ATOM 0 H8 A A2670 -13.436 62.098 -13.987 1.00 10.30 H new ATOM 0 H61 A A2670 -16.615 57.160 -14.576 1.00 10.53 H new ATOM 0 H62 A A2670 -16.125 58.163 -13.590 1.00 10.53 H new ATOM 0 H2 A A2670 -15.138 58.330 -18.456 1.00 9.23 H new ATOM 849 P G A2671 -15.701 65.982 -17.137 1.00 17.23 P ANISOU 849 P G A2671 1648 2428 2471 781 -171 627 P ATOM 850 OP1 G A2671 -15.767 67.288 -17.824 1.00 17.75 O ANISOU 850 OP1 G A2671 1582 2681 2482 624 -314 47 O ATOM 851 OP2 G A2671 -16.312 65.828 -15.804 1.00 15.79 O ANISOU 851 OP2 G A2671 1300 2082 2618 735 -369 239 O ATOM 852 O5' G A2671 -16.264 64.840 -18.102 1.00 16.40 O ANISOU 852 O5' G A2671 1188 2490 2551 106 -152 1333 O ATOM 853 C5' G A2671 -16.035 64.893 -19.504 1.00 19.06 C ANISOU 853 C5' G A2671 2015 2491 2735 239 121 1450 C ATOM 854 C4' G A2671 -16.583 63.691 -20.247 1.00 19.24 C ANISOU 854 C4' G A2671 1987 2558 2764 449 30 1462 C ATOM 855 O4' G A2671 -16.128 62.462 -19.628 1.00 20.42 O ANISOU 855 O4' G A2671 1833 3028 2897 738 -25 1352 O ATOM 856 C3' G A2671 -18.094 63.518 -20.306 1.00 17.65 C ANISOU 856 C3' G A2671 1872 2102 2732 -207 -575 1226 C ATOM 857 O3' G A2671 -18.727 64.360 -21.247 1.00 16.18 O ANISOU 857 O3' G A2671 2244 1411 2493 -475 -830 801 O ATOM 858 C2' G A2671 -18.230 62.042 -20.643 1.00 17.44 C ANISOU 858 C2' G A2671 1658 1974 2992 -295 -361 746 C ATOM 859 O2' G A2671 -17.979 61.800 -22.018 1.00 16.74 O ANISOU 859 O2' G A2671 1323 1953 3085 102 -341 642 O ATOM 860 C1' G A2671 -17.090 61.444 -19.827 1.00 17.47 C ANISOU 860 C1' G A2671 1482 1988 3168 397 -122 806 C ATOM 861 N9 G A2671 -17.544 60.950 -18.516 1.00 17.92 N ANISOU 861 N9 G A2671 1379 1999 3431 524 -245 639 N ATOM 862 C8 G A2671 -17.349 61.538 -17.292 1.00 17.40 C ANISOU 862 C8 G A2671 1164 1888 3558 68 -391 860 C ATOM 863 N7 G A2671 -17.859 60.861 -16.310 1.00 18.07 N ANISOU 863 N7 G A2671 1085 2453 3325 280 -118 805 N ATOM 864 C5 G A2671 -18.425 59.750 -16.917 1.00 20.14 C ANISOU 864 C5 G A2671 1363 2807 3480 672 -98 744 C ATOM 865 C6 G A2671 -19.125 58.651 -16.354 1.00 19.24 C ANISOU 865 C6 G A2671 1224 2484 3601 500 208 739 C ATOM 866 O6 G A2671 -19.385 58.438 -15.167 1.00 18.15 O ANISOU 866 O6 G A2671 1228 1876 3793 205 -146 927 O ATOM 867 N1 G A2671 -19.529 57.750 -17.327 1.00 18.26 N ANISOU 867 N1 G A2671 1489 1903 3545 620 594 573 N ATOM 868 C2 G A2671 -19.300 57.884 -18.671 1.00 18.68 C ANISOU 868 C2 G A2671 1542 2151 3404 741 597 645 C ATOM 869 N2 G A2671 -19.781 56.910 -19.453 1.00 19.57 N ANISOU 869 N2 G A2671 1916 1902 3618 767 869 756 N ATOM 870 N3 G A2671 -18.647 58.899 -19.212 1.00 18.31 N ANISOU 870 N3 G A2671 1211 2314 3432 541 122 636 N ATOM 871 C4 G A2671 -18.241 59.789 -18.281 1.00 19.83 C ANISOU 871 C4 G A2671 1396 2678 3459 716 -74 704 C ATOM 0 H5' G A2671 -15.081 64.959 -19.667 1.00 19.06 H new ATOM 0 H5'' G A2671 -16.440 65.699 -19.861 1.00 19.06 H new ATOM 0 H4' G A2671 -16.259 63.863 -21.145 1.00 19.24 H new ATOM 0 H3' G A2671 -18.536 63.772 -19.481 1.00 17.65 H new ATOM 0 H2' G A2671 -19.113 61.687 -20.458 1.00 17.44 H new ATOM 0 HO2' G A2671 -18.095 60.985 -22.185 1.00 16.74 H new ATOM 0 H1' G A2671 -16.723 60.687 -20.310 1.00 17.47 H new ATOM 0 H8 G A2671 -16.896 62.342 -17.178 1.00 17.40 H new ATOM 0 H1 G A2671 -19.957 57.051 -17.066 1.00 18.26 H new ATOM 0 H21 G A2671 -19.665 56.945 -20.304 1.00 19.57 H new ATOM 0 H22 G A2671 -20.206 56.249 -19.104 1.00 19.57 H new ATOM 883 P U A2672 -20.181 64.967 -20.948 1.00 14.92 P ANISOU 883 P U A2672 2057 1378 2234 184 -704 175 P ATOM 884 OP1 U A2672 -20.489 65.811 -22.119 1.00 15.83 O ANISOU 884 OP1 U A2672 1589 2066 2358 238 -645 -440 O ATOM 885 OP2 U A2672 -20.211 65.552 -19.600 1.00 14.84 O ANISOU 885 OP2 U A2672 2397 1138 2103 359 -172 89 O ATOM 886 O5' U A2672 -21.162 63.716 -20.962 1.00 15.00 O ANISOU 886 O5' U A2672 1262 2454 1983 716 -428 85 O ATOM 887 C5' U A2672 -21.459 63.056 -22.179 1.00 14.45 C ANISOU 887 C5' U A2672 1572 1935 1981 753 -297 149 C ATOM 888 C4' U A2672 -22.102 61.712 -21.960 1.00 13.89 C ANISOU 888 C4' U A2672 1491 1678 2109 330 -151 -106 C ATOM 889 O4' U A2672 -21.268 60.882 -21.112 1.00 12.50 O ANISOU 889 O4' U A2672 1281 1272 2196 -79 169 -80 O ATOM 890 C3' U A2672 -23.437 61.709 -21.247 1.00 14.81 C ANISOU 890 C3' U A2672 1740 1759 2126 -680 -336 -157 C ATOM 891 O3' U A2672 -24.521 62.129 -22.056 1.00 17.35 O ANISOU 891 O3' U A2672 2510 2124 1956 -868 -799 -300 O ATOM 892 C2' U A2672 -23.523 60.268 -20.767 1.00 15.99 C ANISOU 892 C2' U A2672 1672 2014 2388 351 121 -313 C ATOM 893 O2' U A2672 -23.813 59.378 -21.836 1.00 16.42 O ANISOU 893 O2' U A2672 1618 1943 2677 384 291 -521 O ATOM 894 C1' U A2672 -22.082 60.036 -20.329 1.00 13.77 C ANISOU 894 C1' U A2672 1274 1402 2556 330 7 -134 C ATOM 895 N1 U A2672 -21.884 60.371 -18.902 1.00 13.44 N ANISOU 895 N1 U A2672 1107 1237 2762 419 93 238 N ATOM 896 C2 U A2672 -22.327 59.458 -17.974 1.00 15.62 C ANISOU 896 C2 U A2672 1075 1840 3019 524 158 133 C ATOM 897 O2 U A2672 -22.862 58.409 -18.279 1.00 16.64 O ANISOU 897 O2 U A2672 1330 1925 3068 746 72 194 O ATOM 898 N3 U A2672 -22.119 59.817 -16.670 1.00 16.60 N ANISOU 898 N3 U A2672 1025 2056 3225 281 454 299 N ATOM 899 C4 U A2672 -21.526 60.969 -16.206 1.00 16.43 C ANISOU 899 C4 U A2672 1026 1855 3359 293 327 331 C ATOM 900 O4 U A2672 -21.415 61.145 -14.992 1.00 14.72 O ANISOU 900 O4 U A2672 977 1204 3412 140 220 108 O ATOM 901 C5 U A2672 -21.092 61.863 -17.230 1.00 15.32 C ANISOU 901 C5 U A2672 1057 1490 3274 167 207 532 C ATOM 902 C6 U A2672 -21.285 61.541 -18.509 1.00 14.36 C ANISOU 902 C6 U A2672 994 1368 3093 125 58 445 C ATOM 0 H5' U A2672 -20.642 62.942 -22.690 1.00 14.45 H new ATOM 0 H5'' U A2672 -22.050 63.612 -22.710 1.00 14.45 H new ATOM 0 H4' U A2672 -22.222 61.394 -22.869 1.00 13.89 H new ATOM 0 H3' U A2672 -23.497 62.354 -20.525 1.00 14.81 H new ATOM 0 H2' U A2672 -24.209 60.123 -20.096 1.00 15.99 H new ATOM 0 HO2' U A2672 -24.215 59.793 -22.446 1.00 16.42 H new ATOM 0 H1' U A2672 -21.857 59.100 -20.446 1.00 13.77 H new ATOM 0 H3 U A2672 -22.389 59.260 -16.073 1.00 16.60 H new ATOM 0 H5 U A2672 -20.677 62.665 -17.007 1.00 15.32 H new ATOM 0 H6 U A2672 -21.001 62.136 -19.165 1.00 14.36 H new ATOM 913 P G A2673 -25.778 62.881 -21.391 1.00 14.72 P ANISOU 913 P G A2673 1391 2390 1811 370 -262 -369 P ATOM 914 OP1 G A2673 -26.678 63.282 -22.491 1.00 13.74 O ANISOU 914 OP1 G A2673 1335 1926 1959 25 104 -220 O ATOM 915 OP2 G A2673 -25.316 63.916 -20.443 1.00 15.04 O ANISOU 915 OP2 G A2673 1155 2881 1676 759 -213 -117 O ATOM 916 O5' G A2673 -26.500 61.744 -20.550 1.00 15.66 O ANISOU 916 O5' G A2673 1293 2933 1723 803 -253 -824 O ATOM 917 C5' G A2673 -27.042 60.611 -21.204 1.00 16.55 C ANISOU 917 C5' G A2673 1295 3204 1787 575 -130 -1003 C ATOM 918 C4' G A2673 -27.630 59.602 -20.250 1.00 13.91 C ANISOU 918 C4' G A2673 1353 2057 1873 -77 246 -926 C ATOM 919 O4' G A2673 -26.603 58.999 -19.427 1.00 12.26 O ANISOU 919 O4' G A2673 1075 1613 1969 -371 190 -676 O ATOM 920 C3' G A2673 -28.639 60.102 -19.237 1.00 16.85 C ANISOU 920 C3' G A2673 1876 2601 1925 628 323 -921 C ATOM 921 O3' G A2673 -29.910 60.388 -19.797 1.00 26.33 O ANISOU 921 O3' G A2673 3342 4447 2215 27 989 -1160 O ATOM 922 C2' G A2673 -28.652 58.964 -18.225 1.00 17.44 C ANISOU 922 C2' G A2673 2193 2492 1942 686 404 -899 C ATOM 923 O2' G A2673 -29.433 57.871 -18.685 1.00 18.50 O ANISOU 923 O2' G A2673 1932 2937 2158 -138 711 -824 O ATOM 924 C1' G A2673 -27.177 58.552 -18.216 1.00 12.75 C ANISOU 924 C1' G A2673 1217 1732 1895 12 241 -888 C ATOM 925 N9 G A2673 -26.445 59.140 -17.078 1.00 12.14 N ANISOU 925 N9 G A2673 1096 1502 2012 316 342 -482 N ATOM 926 C8 G A2673 -25.712 60.293 -17.093 1.00 11.99 C ANISOU 926 C8 G A2673 866 1809 1879 477 330 -203 C ATOM 927 N7 G A2673 -25.181 60.577 -15.942 1.00 11.78 N ANISOU 927 N7 G A2673 914 1715 1847 531 153 -329 N ATOM 928 C5 G A2673 -25.583 59.552 -15.108 1.00 10.98 C ANISOU 928 C5 G A2673 1049 1249 1874 486 245 -306 C ATOM 929 C6 G A2673 -25.311 59.342 -13.731 1.00 12.74 C ANISOU 929 C6 G A2673 1168 1807 1865 795 54 45 C ATOM 930 O6 G A2673 -24.633 60.032 -12.962 1.00 11.72 O ANISOU 930 O6 G A2673 947 1684 1822 368 -34 -144 O ATOM 931 N1 G A2673 -25.917 58.184 -13.266 1.00 10.40 N ANISOU 931 N1 G A2673 996 1213 1742 554 243 25 N ATOM 932 C2 G A2673 -26.687 57.348 -14.025 1.00 10.25 C ANISOU 932 C2 G A2673 763 1168 1963 352 176 202 C ATOM 933 N2 G A2673 -27.181 56.287 -13.380 1.00 12.20 N ANISOU 933 N2 G A2673 1127 1525 1983 624 -87 261 N ATOM 934 N3 G A2673 -26.953 57.536 -15.309 1.00 10.31 N ANISOU 934 N3 G A2673 928 1009 1981 186 250 -304 N ATOM 935 C4 G A2673 -26.373 58.657 -15.789 1.00 11.55 C ANISOU 935 C4 G A2673 1144 1289 1955 511 234 -350 C ATOM 0 H5' G A2673 -26.347 60.184 -21.729 1.00 16.55 H new ATOM 0 H5'' G A2673 -27.729 60.900 -21.824 1.00 16.55 H new ATOM 0 H4' G A2673 -28.075 59.004 -20.871 1.00 13.91 H new ATOM 0 H3' G A2673 -28.405 60.959 -18.846 1.00 16.85 H new ATOM 0 H2' G A2673 -29.021 59.219 -17.365 1.00 17.44 H new ATOM 0 HO2' G A2673 -29.992 58.144 -19.249 1.00 18.50 H new ATOM 0 HO3' G A2673 -30.428 60.659 -19.194 1.00 26.33 H new ATOM 0 H1' G A2673 -27.118 57.588 -18.126 1.00 12.75 H new ATOM 0 H8 G A2673 -25.604 60.821 -17.851 1.00 11.99 H new ATOM 0 H1 G A2673 -25.800 57.977 -12.440 1.00 10.40 H new ATOM 0 H21 G A2673 -27.674 55.720 -13.799 1.00 12.20 H new ATOM 0 H22 G A2673 -27.006 56.171 -12.546 1.00 12.20 H new TER 948 G A2673 HETATM 949 O HOH A2701 3.352 43.405 -9.512 1.00 18.68 O ANISOU 949 O HOH A2701 1227 2107 3764 -185 -198 1367 O HETATM 950 O HOH A2702 -15.556 60.560 -8.386 1.00 29.56 O ANISOU 950 O HOH A2702 3326 3144 4762 -1631 783 608 O HETATM 951 O HOH A2703 -19.001 60.235 -23.465 1.00 32.83 O ANISOU 951 O HOH A2703 3871 4496 4106 968 1965 -721 O HETATM 952 O HOH A2704 -18.522 50.771 -14.876 1.00 21.33 O ANISOU 952 O HOH A2704 1881 1356 4868 134 430 -299 O HETATM 953 O HOH A2705 -11.937 44.488 -6.720 1.00 22.14 O ANISOU 953 O HOH A2705 4027 1899 2484 344 1635 196 O HETATM 954 O HOH A2706 -15.826 55.545 -23.799 1.00 12.87 O ANISOU 954 O HOH A2706 1401 2234 1255 -132 -94 587 O HETATM 955 O HOH A2707 3.297 40.990 -6.899 1.00 15.88 O ANISOU 955 O HOH A2707 2235 1000 2796 264 820 -134 O HETATM 956 O HOH A2708 1.353 43.330 -12.905 1.00 13.69 O ANISOU 956 O HOH A2708 1356 1514 2331 352 476 1001 O HETATM 957 O HOH A2709 -5.790 53.683 -22.634 1.00 26.54 O ANISOU 957 O HOH A2709 3086 4252 2744 176 -844 -1682 O HETATM 958 O HOH A2710 -15.000 50.217 -25.525 1.00 13.53 O ANISOU 958 O HOH A2710 2074 1671 1396 521 137 -156 O HETATM 959 O HOH A2711 -15.786 50.015 -3.431 1.00 19.74 O ANISOU 959 O HOH A2711 1502 3111 2886 151 719 1067 O HETATM 960 O HOH A2712 -20.221 56.894 -21.975 1.00 23.92 O ANISOU 960 O HOH A2712 2303 2429 4357 892 1153 248 O HETATM 961 O HOH A2713 -13.277 62.713 -3.904 1.00 39.85 O ANISOU 961 O HOH A2713 4389 4910 5843 -1439 715 2141 O HETATM 962 O HOH A2714 0.663 36.705 -15.449 1.00 8.95 O ANISOU 962 O HOH A2714 1301 782 1318 13 -207 -163 O HETATM 963 O HOH A2715 -18.215 59.132 -21.760 0.59 16.71 O ANISOU 963 O HOH A2715 1452 2279 2617 963 -61 -287 O HETATM 964 O HOH A2716 -14.818 50.365 -9.477 1.00 11.84 O ANISOU 964 O HOH A2716 1387 1602 1510 369 12 -126 O HETATM 965 O HOH A2717 -20.713 52.373 -11.168 1.00 24.12 O ANISOU 965 O HOH A2717 1797 2209 5156 609 -396 -170 O HETATM 966 O HOH A2718 -12.229 51.106 -14.732 1.00 9.37 O ANISOU 966 O HOH A2718 1072 1267 1221 -171 -17 -83 O HETATM 967 O HOH A2719 3.566 27.548 -10.749 1.00 11.96 O ANISOU 967 O HOH A2719 1845 1632 1067 625 89 165 O HETATM 968 O HOH A2720 -1.838 54.572 -10.543 1.00 12.21 O ANISOU 968 O HOH A2720 1680 1675 1283 430 -495 -414 O HETATM 969 O HOH A2721 -5.531 53.808 -3.681 1.00 28.62 O ANISOU 969 O HOH A2721 3556 3263 4055 -1204 -2050 1350 O HETATM 970 O HOH A2722 -9.937 52.129 -11.376 1.00 7.81 O ANISOU 970 O HOH A2722 1099 938 930 171 228 -39 O HETATM 971 O HOH A2723 3.451 37.751 -6.182 1.00 10.79 O ANISOU 971 O HOH A2723 1409 1212 1479 115 153 -162 O HETATM 972 O HOH A2724 -8.800 49.503 -20.444 1.00 35.15 O ANISOU 972 O HOH A2724 3726 4090 5539 1912 1050 1644 O HETATM 973 O HOH A2725 -7.648 57.027 -2.232 1.00 12.56 O ANISOU 973 O HOH A2725 1307 1393 2073 -46 185 -404 O HETATM 974 O HOH A2726 -1.024 27.918 -13.375 0.87 8.10 O ANISOU 974 O HOH A2726 915 772 1389 -146 47 -232 O HETATM 975 O HOH A2727 -15.860 51.614 -13.882 1.00 12.93 O ANISOU 975 O HOH A2727 1901 1107 1905 -3 -5 -274 O HETATM 976 O HOH A2728 -16.281 65.533 -11.333 1.00 28.55 O ANISOU 976 O HOH A2728 2175 4002 4669 -279 51 2434 O HETATM 977 O HOH A2729 2.971 40.663 -9.734 1.00 17.38 O ANISOU 977 O HOH A2729 1090 2249 3263 322 -116 528 O HETATM 978 O HOH A2730 -6.146 28.801 -8.591 1.00 9.35 O ANISOU 978 O HOH A2730 830 1499 1224 -38 128 -60 O HETATM 979 O HOH A2731 -15.155 60.283 -3.334 1.00 14.59 O ANISOU 979 O HOH A2731 2219 2112 1212 865 -393 -504 O HETATM 980 O HOH A2732 -5.894 31.220 -6.366 1.00 16.02 O ANISOU 980 O HOH A2732 2137 2255 1695 -465 -254 -148 O HETATM 981 O HOH A2733 0.719 41.080 -17.759 1.00 29.50 O ANISOU 981 O HOH A2733 2380 4096 4732 1091 392 1966 O HETATM 982 O HOH A2734 -0.919 39.187 -15.980 0.98 13.45 O ANISOU 982 O HOH A2734 2873 1069 1167 698 -8 5 O HETATM 983 O HOH A2735 -8.944 60.663 -14.840 1.00 6.86 O ANISOU 983 O HOH A2735 633 974 1000 66 87 7 O HETATM 984 O HOH A2736 -28.825 55.907 -16.812 0.73 19.11 O ANISOU 984 O HOH A2736 2541 3066 1652 -803 -191 368 O HETATM 985 O HOH A2737 -15.673 57.550 -21.718 1.00 14.40 O ANISOU 985 O HOH A2737 2417 1933 1121 568 661 184 O HETATM 986 O HOH A2738 -5.775 51.822 -10.622 1.00 8.66 O ANISOU 986 O HOH A2738 1237 1077 974 359 47 93 O HETATM 987 O HOH A2739 -6.276 38.567 -18.505 1.00 25.44 O HETATM 988 O HOH A2740 -12.002 46.147 -3.564 1.00 19.39 O ANISOU 988 O HOH A2740 3248 1459 2659 -297 -907 778 O HETATM 989 O HOH A2741 -4.781 52.131 -21.896 1.00 16.29 O ANISOU 989 O HOH A2741 2806 1904 1480 -1278 440 -279 O HETATM 990 O HOH A2742 -7.523 41.984 -8.031 1.00 15.91 O ANISOU 990 O HOH A2742 1538 1613 2895 -229 -5 -536 O HETATM 991 O HOH A2743 -0.153 40.275 -0.934 1.00 9.14 O ANISOU 991 O HOH A2743 1588 1111 774 -157 174 -155 O HETATM 992 O HOH A2744 -15.604 56.085 -7.427 1.00 28.13 O ANISOU 992 O HOH A2744 2227 4099 4361 919 767 -1137 O HETATM 993 O HOH A2745 -5.073 59.278 -20.383 1.00 14.32 O ANISOU 993 O HOH A2745 2235 1824 1380 -505 -97 414 O HETATM 994 O HOH A2746 3.098 38.942 -0.731 1.00 15.13 O ANISOU 994 O HOH A2746 2616 1823 1308 681 -824 -185 O HETATM 995 O HOH A2747 -9.409 49.960 -17.434 1.00 9.86 O ANISOU 995 O HOH A2747 1344 910 1490 64 144 -88 O HETATM 996 O HOH A2748 -13.646 54.186 -8.785 1.00 9.89 O ANISOU 996 O HOH A2748 1325 1009 1421 -130 -148 121 O HETATM 997 O HOH A2749 -7.340 50.498 -23.508 1.00 19.52 O ANISOU 997 O HOH A2749 1785 2463 3169 -302 189 -537 O HETATM 998 O HOH A2750 -9.926 40.199 -19.575 1.00 28.40 O ANISOU 998 O HOH A2750 3448 5246 2095 -2356 -658 957 O HETATM 999 O HOH A2751 -5.642 47.498 -18.239 1.00 16.36 O ANISOU 999 O HOH A2751 2801 1052 2364 214 -648 -502 O HETATM 1000 O HOH A2752 4.212 43.308 -16.247 1.00 40.73 O ANISOU 1000 O HOH A2752 4543 3706 7227 1451 2871 2268 O HETATM 1001 O HOH A2753 -22.392 55.599 -7.049 1.00 34.41 O ANISOU 1001 O HOH A2753 3425 4862 4785 -1184 2070 -471 O HETATM 1002 O HOH A2754 -15.110 57.011 -9.629 1.00 13.33 O ANISOU 1002 O HOH A2754 1405 2420 1239 -147 263 -350 O HETATM 1003 O HOH A2755 3.635 37.553 -8.984 1.00 12.69 O ANISOU 1003 O HOH A2755 1237 1536 2049 224 -219 -648 O HETATM 1004 O HOH A2756 1.784 48.968 -18.375 1.00 15.27 O ANISOU 1004 O HOH A2756 1669 1955 2176 754 444 714 O HETATM 1005 O HOH A2757 -0.521 53.794 -19.665 0.97 17.99 O ANISOU 1005 O HOH A2757 3245 1366 2225 124 597 718 O HETATM 1006 O HOH A2758 -17.017 54.165 -12.539 1.00 13.12 O ANISOU 1006 O HOH A2758 786 2091 2109 191 187 -155 O HETATM 1007 O HOH A2759 -13.334 44.642 -10.034 1.00 14.43 O ANISOU 1007 O HOH A2759 1351 1825 2306 -714 -125 -237 O HETATM 1008 O HOH A2760 -4.845 36.616 -19.619 1.00 19.19 O ANISOU 1008 O HOH A2760 1800 2708 2781 435 927 -694 O HETATM 1009 O HOH A2761 -14.324 53.959 -11.201 1.00 11.42 O ANISOU 1009 O HOH A2761 988 1541 1808 -10 -116 -189 O HETATM 1010 O HOH A2762 -3.287 48.927 -5.050 1.00 25.16 O ANISOU 1010 O HOH A2762 3264 3499 2796 785 760 749 O HETATM 1011 O HOH A2763 -2.162 32.486 -5.477 1.00 13.40 O ANISOU 1011 O HOH A2763 1662 2010 1419 -685 -236 612 O HETATM 1012 O HOH A2764 -24.526 56.836 -20.615 1.00 21.09 O ANISOU 1012 O HOH A2764 3522 1373 3118 -557 1335 -281 O HETATM 1013 O HOH A2765 -30.237 60.974 -3.782 0.64 20.37 O ANISOU 1013 O HOH A2765 4385 1400 1955 478 -1344 -171 O HETATM 1014 O HOH A2766 -6.382 57.602 -4.605 1.00 20.46 O ANISOU 1014 O HOH A2766 1318 3473 2981 -483 -537 668 O HETATM 1015 O HOH A2767 -23.473 64.559 -18.252 0.90 22.30 O ANISOU 1015 O HOH A2767 3248 2738 2485 1707 -83 -353 O HETATM 1016 O HOH A2768 3.646 30.707 -4.718 0.98 19.62 O ANISOU 1016 O HOH A2768 3036 1270 3147 48 -1584 138 O HETATM 1017 O HOH A2769 -11.632 50.921 -18.962 1.00 20.04 O ANISOU 1017 O HOH A2769 2770 2743 2101 1566 -48 304 O HETATM 1018 O HOH A2770 -13.332 60.172 -20.305 1.00 13.44 O ANISOU 1018 O HOH A2770 1123 2050 1933 588 196 -62 O HETATM 1019 O HOH A2771 -5.539 55.110 -9.039 0.96 39.26 O ANISOU 1019 O HOH A2771 2554 5742 6622 -359 -405 3642 O HETATM 1020 O HOH A2772 -1.673 57.695 -20.706 0.69 25.63 O ANISOU 1020 O HOH A2772 3109 2563 4065 -1125 -1742 1505 O HETATM 1021 O HOH A2773 -2.103 50.299 -6.761 1.00 11.12 O ANISOU 1021 O HOH A2773 907 1608 1710 -113 -64 -209 O HETATM 1022 O HOH A2774 -11.568 49.519 -23.523 1.00 17.48 O ANISOU 1022 O HOH A2774 1694 2186 2761 1024 403 187 O HETATM 1023 O HOH A2775 4.684 38.276 -10.727 1.00 24.52 O ANISOU 1023 O HOH A2775 2066 1831 5417 82 -554 -580 O HETATM 1024 O HOH A2776 -26.895 49.099 -5.690 1.00 24.22 O ANISOU 1024 O HOH A2776 3947 2583 2672 287 -1826 -317 O HETATM 1025 O HOH A2777 -5.357 36.550 -7.354 1.00 38.38 O ANISOU 1025 O HOH A2777 3345 6142 5096 -1226 1987 -921 O HETATM 1026 O HOH A2778 -13.043 51.778 -12.169 1.00 13.09 O ANISOU 1026 O HOH A2778 2418 1571 984 958 -156 -68 O HETATM 1027 O HOH A2779 4.487 41.094 -3.389 1.00 18.75 O ANISOU 1027 O HOH A2779 2622 2121 2379 -411 -251 777 O HETATM 1028 O HOH A2780 -10.863 49.128 -13.990 1.00 11.52 O ANISOU 1028 O HOH A2780 1177 1708 1491 82 -179 32 O HETATM 1029 O HOH A2781 4.820 44.681 -14.022 1.00 15.18 O ANISOU 1029 O HOH A2781 1584 1634 2548 266 -28 -681 O HETATM 1030 O HOH A2782 -23.303 57.504 -24.152 1.00 48.06 O ANISOU 1030 O HOH A2782 7212 5521 5527 1743 -1069 2570 O HETATM 1031 O HOH A2783 -18.164 49.894 -11.515 1.00 27.02 O ANISOU 1031 O HOH A2783 5672 3056 1536 383 145 -141 O HETATM 1032 O HOH A2784 -5.110 38.813 -5.947 1.00 19.01 O ANISOU 1032 O HOH A2784 2766 3194 1261 -819 499 -348 O HETATM 1033 O HOH A2785 -11.872 56.208 -0.262 1.00 14.15 O ANISOU 1033 O HOH A2785 2408 1898 1068 -205 -203 236 O HETATM 1034 O HOH A2786 -6.198 33.961 -22.480 1.00 14.00 O ANISOU 1034 O HOH A2786 1249 2392 1678 -10 -198 -184 O HETATM 1035 O HOH A2787 -3.675 40.197 -20.502 1.00 26.33 O ANISOU 1035 O HOH A2787 4780 1686 3537 -437 447 -446 O HETATM 1036 O HOH A2788 -24.186 63.454 -15.695 0.92 20.08 O ANISOU 1036 O HOH A2788 2867 1319 3443 -182 1654 -324 O HETATM 1037 O HOH A2789 -16.171 47.156 -20.572 1.00 19.91 O ANISOU 1037 O HOH A2789 1621 2631 3313 522 319 953 O HETATM 1038 O HOH A2790 -22.141 45.537 -11.265 1.00 25.44 O ANISOU 1038 O HOH A2790 1889 4405 3371 -697 -983 1008 O HETATM 1039 O HOH A2791 -3.359 52.458 -5.853 1.00 25.20 O ANISOU 1039 O HOH A2791 2222 4449 2903 -9 -1137 -888 O HETATM 1040 O HOH A2792 -28.173 54.089 -11.491 0.98 16.62 O ANISOU 1040 O HOH A2792 2671 2008 1636 611 1029 561 O HETATM 1041 O HOH A2793 -11.777 65.765 -6.738 1.00 24.02 O ANISOU 1041 O HOH A2793 2756 3326 3045 -1387 1229 -1651 O HETATM 1042 O HOH A2794 -9.795 60.464 -17.636 1.00 9.50 O ANISOU 1042 O HOH A2794 1165 1297 1147 117 -43 27 O HETATM 1043 O HOH A2795 3.657 42.868 -2.314 1.00 17.41 O ANISOU 1043 O HOH A2795 1712 2845 2058 -278 -453 -548 O HETATM 1044 O HOH A2796 -1.779 52.203 -10.470 1.00 22.58 O ANISOU 1044 O HOH A2796 3469 2758 2353 -1055 -928 842 O HETATM 1045 O HOH A2797 -7.618 33.901 -7.111 1.00 25.97 O ANISOU 1045 O HOH A2797 3154 2957 3756 -1687 739 -294 O HETATM 1046 O HOH A2798 3.423 41.275 -13.044 1.00 29.36 O ANISOU 1046 O HOH A2798 2239 3047 5869 634 1079 2125 O HETATM 1047 O HOH A2799 -15.990 56.897 -0.926 1.00 31.46 O ANISOU 1047 O HOH A2799 5797 3348 2806 -1841 1356 -1141 O HETATM 1048 O HOH A2800 -3.613 56.313 -22.655 1.00 22.76 O ANISOU 1048 O HOH A2800 2849 3911 1885 -1821 -747 926 O HETATM 1049 O HOH A2801 5.716 45.744 -7.733 1.00 20.50 O ANISOU 1049 O HOH A2801 2806 2660 2323 314 632 1006 O HETATM 1050 O HOH A2802 -9.641 42.788 -21.727 1.00 30.96 O ANISOU 1050 O HOH A2802 3126 6116 2519 861 -100 1615 O HETATM 1051 O HOH A2803 -15.253 60.931 -11.037 0.99 31.04 O ANISOU 1051 O HOH A2803 4093 4369 3331 327 -1656 170 O HETATM 1052 O HOH A2804 -5.835 49.097 -20.355 1.00 20.38 O ANISOU 1052 O HOH A2804 1514 3891 2337 -638 627 -816 O HETATM 1053 O HOH A2805 6.218 43.586 -7.837 1.00 51.71 O ANISOU 1053 O HOH A2805 4822 6218 8605 645 139 4156 O HETATM 1054 O HOH A2806 -15.081 68.386 -11.715 1.00 21.25 O ANISOU 1054 O HOH A2806 2567 1837 3671 -992 126 624 O HETATM 1055 O HOH A2807 -19.606 64.929 -16.520 0.85 25.32 O ANISOU 1055 O HOH A2807 2743 2541 4334 -1012 1714 -1551 O HETATM 1056 O HOH A2808 -9.703 45.778 -17.848 1.00 19.55 O ANISOU 1056 O HOH A2808 2233 2056 3139 454 -39 -533 O HETATM 1057 O HOH A2809 6.949 29.602 -8.989 1.00 38.43 O ANISOU 1057 O HOH A2809 4683 6252 3665 2925 44 997 O HETATM 1058 O HOH A2810 -13.296 40.252 -15.222 0.83 18.27 O ANISOU 1058 O HOH A2810 1168 2210 3561 -349 -497 596 O HETATM 1059 O HOH A2811 -10.576 49.177 -21.728 1.00 21.73 O ANISOU 1059 O HOH A2811 3622 2201 2433 727 501 -521 O HETATM 1060 O HOH A2812 -13.668 68.667 -19.905 1.00 28.59 O ANISOU 1060 O HOH A2812 1959 3669 5233 294 -407 -1998 O HETATM 1061 O HOH A2813 -2.347 54.254 -22.821 1.00 27.60 O ANISOU 1061 O HOH A2813 3257 3864 3366 -1765 901 239 O HETATM 1062 O HOH A2814 -12.330 47.957 -19.789 1.00 27.65 O ANISOU 1062 O HOH A2814 2436 4978 3092 -753 -1028 1652 O HETATM 1063 O HOH A2815 6.408 30.571 -6.351 1.00 33.70 O ANISOU 1063 O HOH A2815 4330 3636 4837 -853 -2460 1509 O HETATM 1064 O HOH A2816 -25.019 48.209 -6.335 1.00 35.11 O ANISOU 1064 O HOH A2816 5014 4885 3441 -1355 -1758 -766 O HETATM 1065 O HOH A2817 -8.895 37.213 -10.192 1.00 23.36 O ANISOU 1065 O HOH A2817 2503 1599 4774 278 1611 166 O HETATM 1066 O HOH A2818 -24.216 66.675 -21.922 1.00 38.87 O ANISOU 1066 O HOH A2818 5575 2753 6441 1764 703 679 O HETATM 1067 O HOH A2819 -10.013 37.299 -20.572 1.00 31.38 O ANISOU 1067 O HOH A2819 4876 4798 2248 2709 45 -306 O HETATM 1068 O HOH A2820 -16.716 57.231 -11.150 1.00 24.87 O ANISOU 1068 O HOH A2820 2307 4711 2432 -1387 669 -209 O HETATM 1069 O HOH A2821 -21.137 60.457 -11.682 1.00 45.15 O ANISOU 1069 O HOH A2821 5084 8267 3804 3443 1386 2186 O HETATM 1070 O HOH A2822 -20.326 56.467 -10.456 1.00 28.98 O ANISOU 1070 O HOH A2822 5096 2026 3890 -909 1895 -206 O HETATM 1071 O HOH A2823 -8.276 35.428 -8.432 1.00 31.23 O ANISOU 1071 O HOH A2823 3109 6695 2062 1808 367 269 O HETATM 1072 O HOH A2824 -3.013 35.199 -21.025 0.91 30.92 O ANISOU 1072 O HOH A2824 2452 4169 5125 963 1397 1860 O HETATM 1073 O HOH A2825 -18.950 54.279 -10.725 1.00 40.89 O ANISOU 1073 O HOH A2825 3457 6912 5165 -144 2379 18 O HETATM 1074 O HOH A2826 -5.531 40.002 -22.308 1.00 35.63 O ANISOU 1074 O HOH A2826 6988 3226 3321 288 1293 -112 O HETATM 1075 O HOH A2827 -16.764 45.492 -17.222 1.00 36.45 O ANISOU 1075 O HOH A2827 4501 3964 5383 2197 -116 1196 O HETATM 1076 O HOH A2828 -12.034 36.905 -19.699 1.00 33.72 O ANISOU 1076 O HOH A2828 5149 3245 4416 853 227 2029 O HETATM 1077 O HOH A2829 -16.235 48.536 -7.176 1.00 38.49 O ANISOU 1077 O HOH A2829 4586 3985 6053 -1361 -439 2415 O HETATM 1078 O HOH A2830 -7.755 37.446 -8.065 1.00 42.97 O ANISOU 1078 O HOH A2830 3548 5583 7193 1549 -451 -2770 O HETATM 1079 O HOH A2831 -6.258 55.364 -1.788 1.00 27.98 O ANISOU 1079 O HOH A2831 2794 4174 3661 -1851 610 -218 O HETATM 1080 O HOH A2832 -5.694 26.928 -7.145 1.00 14.38 O ANISOU 1080 O HOH A2832 1979 2063 1422 -616 325 384 O HETATM 1081 O HOH A2833 -17.158 57.999 -6.063 1.00 47.21 O ANISOU 1081 O HOH A2833 3457 6857 7623 1777 702 1388 O HETATM 1082 O HOH A2834 -3.198 54.353 -8.004 1.00 20.69 O ANISOU 1082 O HOH A2834 1422 2284 4155 -124 -785 -493 O HETATM 1083 O HOH A2835 -8.082 46.159 -19.619 1.00 19.01 O ANISOU 1083 O HOH A2835 1862 1196 4164 -122 -601 266 O HETATM 1084 O HOH A2836 -4.277 50.031 -24.602 1.00 29.00 O ANISOU 1084 O HOH A2836 4052 2496 4471 -477 2400 -854 O HETATM 1085 O HOH A2837 0.596 36.300 -19.974 1.00 25.78 O ANISOU 1085 O HOH A2837 1868 4599 3328 -1200 390 -576 O HETATM 1086 O HOH A2838 -20.455 49.280 -6.766 1.00 31.26 O ANISOU 1086 O HOH A2838 3960 4490 3428 2173 1674 1854 O HETATM 1087 O HOH A2839 -18.156 49.404 -6.676 1.00 36.48 O ANISOU 1087 O HOH A2839 7097 2709 4053 -1742 -1295 207 O HETATM 1088 O HOH A2840 -16.250 66.437 -9.350 1.00 27.75 O ANISOU 1088 O HOH A2840 3007 2611 4924 -1158 -425 1211 O HETATM 1089 O HOH A2841 -17.806 61.541 -12.499 0.99 30.40 O ANISOU 1089 O HOH A2841 3973 4110 3465 2231 925 259 O HETATM 1090 O HOH A2842 -5.006 48.471 -23.047 1.00 37.60 O ANISOU 1090 O HOH A2842 4507 5801 3979 2619 -1018 186 O HETATM 1091 O HOH A2843 -17.746 68.458 -22.102 1.00 26.47 O ANISOU 1091 O HOH A2843 3981 2215 3862 -740 853 -1379 O HETATM 1092 O HOH A2844 -11.493 40.894 -10.258 1.00 25.84 O ANISOU 1092 O HOH A2844 4242 2177 3399 -535 2190 -346 O HETATM 1093 O HOH A2845 -15.071 46.076 -9.743 1.00 28.75 O ANISOU 1093 O HOH A2845 2747 3444 4732 -1292 -305 -1010 O HETATM 1094 O HOH A2846 -10.622 44.364 -20.678 1.00 33.39 O ANISOU 1094 O HOH A2846 4613 5081 2990 -1733 -1534 1562 O HETATM 1095 O HOH A2847 -5.484 47.036 -21.567 1.00 41.55 O ANISOU 1095 O HOH A2847 4217 5853 5716 -1480 1534 1117 O HETATM 1096 O HOH A2848 6.685 42.969 -5.129 1.00 22.71 O ANISOU 1096 O HOH A2848 3062 1975 3590 -1137 -969 197 O HETATM 1097 O HOH A2849 -0.173 39.253 -19.541 1.00 41.81 O ANISOU 1097 O HOH A2849 6115 5114 4657 2008 1982 2427 O HETATM 1098 O HOH A2850 -18.579 58.460 -11.199 1.00 31.18 O ANISOU 1098 O HOH A2850 4127 4836 2882 1389 -1138 -1771 O HETATM 1099 O HOH A2851 -21.417 43.829 -13.804 1.00 31.47 O ANISOU 1099 O HOH A2851 3005 3623 5329 1192 -320 1602 O HETATM 1100 O HOH A2852 -29.082 66.404 -22.244 1.00 33.09 O ANISOU 1100 O HOH A2852 3942 5642 2988 949 -1723 -383 O HETATM 1101 O HOH A2853 -16.408 47.485 -12.161 1.00 22.77 O ANISOU 1101 O HOH A2853 2203 3355 3094 -623 703 -177 O HETATM 1102 O HOH A2854 -14.008 46.924 -17.021 1.00 36.74 O ANISOU 1102 O HOH A2854 4819 2056 7084 741 -627 -320 O HETATM 1103 O HOH A2855 -14.853 46.412 -5.605 1.00 26.29 O ANISOU 1103 O HOH A2855 2292 4312 3383 -379 -36 2170 O HETATM 1104 O HOH A2856 -4.793 54.323 -24.399 1.00 33.56 O ANISOU 1104 O HOH A2856 3645 4630 4477 -268 825 2422 O HETATM 1105 O HOH A2857 -1.877 40.735 -21.662 1.00 25.23 O ANISOU 1105 O HOH A2857 4334 1449 3803 -170 438 338 O HETATM 1106 O HOH A2858 -10.358 41.105 -8.502 1.00 24.17 O ANISOU 1106 O HOH A2858 2753 3414 3015 1141 -440 -493 O HETATM 1107 O HOH A2859 2.512 35.881 -19.056 0.71 32.32 O ANISOU 1107 O HOH A2859 3851 2735 5695 782 2017 -354 O HETATM 1108 O HOH A2860 -7.179 40.215 -6.589 1.00 22.51 O ANISOU 1108 O HOH A2860 1809 1928 4816 144 -635 -1302 O HETATM 1109 O HOH A2861 -18.356 56.444 -5.210 1.00 34.03 O ANISOU 1109 O HOH A2861 2593 4869 5467 1476 -1155 -441 O HETATM 1110 O HOH A2862 -20.693 48.148 -8.573 1.00 46.20 O ANISOU 1110 O HOH A2862 3400 6801 7352 -2197 1193 307 O HETATM 1111 O HOH A2863 -15.836 67.513 -22.035 1.00 26.51 O ANISOU 1111 O HOH A2863 2699 4815 2556 870 933 1521 O HETATM 1112 O HOH A2864 -18.727 49.997 -8.867 1.00 55.55 O ANISOU 1112 O HOH A2864 9291 7219 4597 -1879 305 -621 O HETATM 1113 O HOH A2865 6.320 36.477 -8.676 1.00 29.48 O ANISOU 1113 O HOH A2865 1644 4314 5243 -154 -46 -1502 O HETATM 1114 O HOH A2866 -14.684 43.372 -8.812 1.00 52.58 O ANISOU 1114 O HOH A2866 9669 5180 5128 2887 3416 1332 O HETATM 1115 O HOH A2867 -14.256 67.029 -5.887 1.00 42.52 O ANISOU 1115 O HOH A2867 6926 4904 4326 -696 -940 2499 O HETATM 1116 O HOH A2868 -33.134 55.983 -3.157 1.00 39.60 O ANISOU 1116 O HOH A2868 4031 7379 3637 2769 895 1283 O HETATM 1117 O HOH A2869 -11.084 47.629 -16.827 1.00 19.22 O ANISOU 1117 O HOH A2869 2091 2030 3182 87 -531 -214 O HETATM 1118 O HOH A2870 -8.811 45.499 -21.806 1.00 24.55 O ANISOU 1118 O HOH A2870 3669 1411 4246 204 159 837 O HETATM 1119 O HOH A2871 -12.362 46.433 -21.143 1.00 25.31 O ANISOU 1119 O HOH A2871 3107 2792 3716 -271 696 -222 O HETATM 1120 O HOH A2872 1.702 41.014 -21.030 1.00 27.80 O ANISOU 1120 O HOH A2872 1990 3111 5461 -846 -80 935 O HETATM 1121 O HOH A2873 -2.614 54.365 -6.023 1.00 24.00 O ANISOU 1121 O HOH A2873 2138 2253 4728 -100 1414 545 O HETATM 1122 O HOH A2874 6.806 34.929 -5.336 1.00 28.33 O ANISOU 1122 O HOH A2874 5252 3551 1962 1099 -255 -932 O HETATM 1123 O HOH A2875 6.661 42.733 -9.754 1.00 41.38 O ANISOU 1123 O HOH A2875 4919 3755 7047 1285 1715 -1017 O HETATM 1124 O HOH A2876 -18.591 55.781 -8.279 1.00 41.90 O ANISOU 1124 O HOH A2876 3625 2579 9716 -323 71 304 O HETATM 1125 O HOH A2877 -22.965 69.558 -23.313 1.00 26.62 O ANISOU 1125 O HOH A2877 1928 4073 4113 -875 523 1061 O HETATM 1126 O HOH A2878 -17.107 52.572 -10.393 1.00 22.52 O ANISOU 1126 O HOH A2878 2646 3257 2653 -605 -652 269 O HETATM 1127 O HOH A2879 -11.571 39.733 -21.048 1.00 35.84 O ANISOU 1127 O HOH A2879 6690 3470 3457 1319 2399 442 O HETATM 1128 O HOH A2880 5.465 42.126 -18.902 1.00 32.30 O ANISOU 1128 O HOH A2880 4007 2435 5828 709 2601 626 O HETATM 1129 O HOH A2881 -3.243 37.379 -21.322 0.93 27.52 O ANISOU 1129 O HOH A2881 4671 3130 2655 833 -1434 -869 O HETATM 1130 O HOH A2882 -22.410 63.279 -10.269 0.84 31.78 O ANISOU 1130 O HOH A2882 3530 3099 5444 -335 2424 19 O HETATM 1131 O HOH A2883 -10.901 47.809 -25.692 1.00 40.37 O ANISOU 1131 O HOH A2883 5295 5031 5013 889 2863 -271 O HETATM 1132 O HOH A2884 -20.514 61.824 -10.156 1.00 27.97 O ANISOU 1132 O HOH A2884 2383 3380 4865 1394 -651 -123 O HETATM 1133 O HOH A2885 -7.859 47.727 -22.364 1.00 36.43 O ANISOU 1133 O HOH A2885 4052 5923 3864 -1522 1510 -1527 O HETATM 1134 O HOH A2886 -26.367 65.842 -15.885 0.83 30.60 O ANISOU 1134 O HOH A2886 2441 3389 5795 -648 1157 881 O HETATM 1135 O HOH A2887 -13.979 44.898 -20.129 1.00 34.91 O ANISOU 1135 O HOH A2887 6357 4734 2172 1112 -527 -1011 O HETATM 1136 O HOH A2888 -9.819 38.037 -8.135 1.00 56.12 O ANISOU 1136 O HOH A2888 9863 4644 6815 -1820 -1741 -326 O HETATM 1137 O HOH A2889 7.121 39.332 -10.081 1.00 46.37 O ANISOU 1137 O HOH A2889 4329 7220 6068 1886 2190 3173 O HETATM 1138 O HOH A2890 -13.034 42.158 -20.344 1.00 42.06 O ANISOU 1138 O HOH A2890 5746 4391 5843 -1083 2363 1406 O HETATM 1139 O HOH A2891 -10.293 67.346 -5.231 1.00 35.53 O ANISOU 1139 O HOH A2891 5030 2588 5882 -1512 -544 -956 O HETATM 1140 O HOH A2892 -3.508 58.770 -5.378 1.00 20.19 O ANISOU 1140 O HOH A2892 1262 4347 2063 -178 -64 -1001 O HETATM 1141 O HOH A2893 8.554 33.512 -6.027 1.00 43.02 O ANISOU 1141 O HOH A2893 6470 2652 7222 -1762 368 534 O HETATM 1142 O HOH A2894 -22.033 71.165 -22.141 1.00 49.22 O ANISOU 1142 O HOH A2894 4806 7621 6273 1791 2535 -858 O HETATM 1143 O HOH A2895 -19.978 45.597 -8.116 1.00 36.31 O ANISOU 1143 O HOH A2895 3129 5956 4709 972 1290 1494 O HETATM 1144 O HOH A2896 -14.945 70.164 -22.866 1.00 34.28 O ANISOU 1144 O HOH A2896 3935 7108 1982 -589 -522 -40 O HETATM 1145 O HOH A2897 7.656 28.181 -5.136 0.87 35.39 O ANISOU 1145 O HOH A2897 3774 3975 5695 -551 1878 -348 O HETATM 1146 O HOH A2898 -9.973 46.189 -24.028 1.00 43.44 O ANISOU 1146 O HOH A2898 5211 5790 5504 -292 3163 -358 O HETATM 1147 O HOH A2899 -20.187 58.662 -7.002 1.00 47.67 O ANISOU 1147 O HOH A2899 5025 5337 7751 2999 570 17 O HETATM 1148 O HOH A2900 3.313 39.341 -20.598 1.00 26.33 O ANISOU 1148 O HOH A2900 1735 2733 5536 235 554 -9 O HETATM 1149 O HOH A2901 -14.570 71.983 -21.869 1.00 37.26 O ANISOU 1149 O HOH A2901 6216 3803 4138 -1331 -599 1398 O HETATM 1150 O HOH A2902 -19.317 61.195 -4.409 1.00 35.58 O ANISOU 1150 O HOH A2902 2881 6085 4550 1346 1050 2962 O HETATM 1151 O HOH A2903 -12.286 36.107 -22.526 1.00 45.62 O ANISOU 1151 O HOH A2903 5746 6188 5398 -236 3027 1256 O HETATM 1152 O HOH A2904 9.278 29.742 -4.671 1.00 35.38 O ANISOU 1152 O HOH A2904 4610 4250 4582 825 -1684 1662 O HETATM 1153 O HOH A2905 -24.182 71.371 -23.056 1.00 46.22 O ANISOU 1153 O HOH A2905 6078 7500 3982 -1482 -7 603 O HETATM 1154 O HOH A2906 -21.672 63.635 -7.967 1.00 59.83 O ANISOU 1154 O HOH A2906 6710 8283 7737 -2079 3130 1904 O HETATM 1155 O HOH A2907 8.942 40.432 -9.328 1.00 48.92 O ANISOU 1155 O HOH A2907 5835 5718 7035 3412 -244 245 O HETATM 1156 O HOH A2908 10.356 37.099 -7.093 1.00 45.12 O ANISOU 1156 O HOH A2908 6525 4963 5653 764 2774 -1499 O HETATM 1157 O HOH A2909 9.764 26.714 -3.494 1.00 39.26 O ANISOU 1157 O HOH A2909 6113 4347 4455 371 2968 -206 O HETATM 1158 O HOH A2910 -19.129 42.461 -5.435 1.00 44.42 O ANISOU 1158 O HOH A2910 3797 6294 6784 -2096 844 -482 O HETATM 1159 O HOH A2911 12.443 38.161 -6.287 1.00 45.00 O ANISOU 1159 O HOH A2911 7296 4894 4906 -752 2592 -324 O CONECT 172 195 CONECT 195 172 196 197 198 CONECT 196 195 CONECT 197 195 CONECT 198 195 199 CONECT 199 198 200 217 218 CONECT 200 199 201 202 219 CONECT 201 200 206 CONECT 202 200 203 204 220 CONECT 203 202 229 CONECT 204 202 205 206 221 CONECT 205 204 CONECT 206 201 204 207 222 CONECT 207 206 208 210 CONECT 208 207 209 215 CONECT 209 208 CONECT 210 207 211 223 CONECT 211 210 212 214 CONECT 212 211 213 224 225 CONECT 213 212 226 CONECT 214 211 215 216 CONECT 215 208 214 CONECT 216 214 227 228 CONECT 217 199 CONECT 218 199 CONECT 219 200 CONECT 220 202 CONECT 221 204 CONECT 222 206 CONECT 223 210 CONECT 224 212 CONECT 225 212 CONECT 226 213 CONECT 227 216 CONECT 228 216 CONECT 229 203 END