HEADER TRANSCRIPTION/DNA 23-JUL-01 1J46 TITLE 3D SOLUTION NMR STRUCTURE OF THE WILD TYPE HMG-BOX DOMAIN TITLE 2 OF THE HUMAN MALE SEX DETERMINING FACTOR SRY COMPLEXED TO TITLE 3 DNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: SEX-DETERMINING REGION Y PROTEIN; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: HMG-BOX DOMAIN; COMPND 5 SYNONYM: SRY; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: 5'-D(*CP*CP*TP*GP*CP*AP*CP*AP*AP*AP*CP*AP*CP*C)- COMPND 9 3'; COMPND 10 CHAIN: B; COMPND 11 ENGINEERED: YES; COMPND 12 MOL_ID: 3; COMPND 13 MOLECULE: 5'-D(*GP*GP*TP*GP*TP*TP*TP*GP*TP*GP*CP*AP*GP*G)- COMPND 14 3'; COMPND 15 CHAIN: C; COMPND 16 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 6 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 8 EXPRESSION_SYSTEM_VECTOR: PET21A; SOURCE 9 MOL_ID: 2; SOURCE 10 SYNTHETIC: YES; SOURCE 11 MOL_ID: 3; SOURCE 12 SYNTHETIC: YES KEYWDS MALE SEX DETERMINING FACTOR, SRY, SEX-REVERSAL MUTATION, KEYWDS 2 DNA BENDING MUTANT, DIPOLAR COUPLINGS, MULTIDIMENSIONAL NMR, KEYWDS 3 TRANSCRIPTION/DNA COMPLEX EXPDTA SOLUTION NMR AUTHOR G.M.CLORE,E.C.MURPHY REVDAT 3 24-FEB-09 1J46 1 VERSN REVDAT 2 01-APR-03 1J46 1 JRNL REVDAT 1 03-OCT-01 1J46 0 JRNL AUTH E.C.MURPHY,V.B.ZHURKIN,J.M.LOUIS,G.CORNILESCU, JRNL AUTH 2 G.M.CLORE JRNL TITL STRUCTURAL BASIS FOR SRY-DEPENDENT 46-X,Y SEX JRNL TITL 2 REVERSAL: MODULATION OF DNA BENDING BY A NATURALLY JRNL TITL 3 OCCURRING POINT MUTATION. JRNL REF J.MOL.BIOL. V. 312 481 2001 JRNL REFN ISSN 0022-2836 JRNL PMID 11563911 JRNL DOI 10.1006/JMBI.2001.4977 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR NIH VERSION (HTTP://NMR.CIT.NIH.GOV) REMARK 3 (HTTP://NMR.CIT.NIH.GOV) REMARK 3 AUTHORS : CLORE, KUSZEWSKI, SCHWIETERS REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REMARK 3 THE STRUCTURE WAS CALCULATED BY SIMULATED ANNEALING IN REMARK 3 TORSION ANGLE SPACE (C. SCHWIETERS AND G.M. CLORE. J. MAGN. REMARK 3 RESON., IN PRESS). THE TARGET FUNCTION COMPRISES TERMS FOR REMARK 3 NOE RESTRAINTS, TORSION ANGLE RESTRAINTS, CARBON CHEMICAL REMARK 3 SHIFT RESTRAINTS (KUSZWESKI ET AL. J. MAGN. RESON. SERIES B REMARK 3 106, 92-96 (1995), J COUPLING RESTRAINTS (GARRETT ET AL. J. REMARK 3 MAGN. RESON. SERIES B 104, 99, 103 (1994); DIPOLAR COUPLING REMARK 3 RESTRAINTS (CLORE ET AL. J.MAGN.RESON. 131, 159-162 (1998); REMARK 3 J.MAGN.RESON. 133, 216-221(1998)), AND RADIUS OF GYRATION REMARK 3 (KUSZEWSKI ET AL. JACS 121, 2337 (1999)). THE NON-BONDED REMARK 3 CONTACTS ARE REPRESENTED BY A QUARTIC VAN DER WAALS REMARK 3 REPULSION TERM (NILGES ET AL. (1988) FEBS LETT. 229, REMARK 3 129-136); THE DELPHIC TORSION ANGLE DATABASE POTENTIAL REMARK 3 (KUSZEWSKI & C J. MAGN. RESON. 146, 249 (2000)); AND THE REMARK 3 DELPHIC BASE-BASE POSITIONAL DATABASE POTENTIAL (KUSZEWSKI REMARK 3 ET AL. JACS 123, 3903 (2001)). IN THIS ENTRY THE SECOND TO REMARK 3 LAST COLUMN REPRESENTS THE AVERAGE RMS DIFFERENCE BETWEEN REMARK 3 THE INDIVIDUAL SIMULATED ANNEALING STRUCTURES (400 FOR THE REMARK 3 WILD TYPE COMPLEX) AND THE MEAN COORDINATE POSITIONS REMARK 3 (OBTAINED BY BEST FITTING TO RESIDUES 4-81 OF THE PROTEIN REMARK 3 AND 101-128 OF THE DNA). REMARK 3 REMARK 3 WILD TYPE M9I MUTANT REMARK 3 PDB ID: 1J46 1J47 REMARK 3 REMARK 3 DEVIATIONS FROM IDEALIZED GEOMETRY: REMARK 3 BONDS 0.003 A 0.003 A REMARK 3 ANGLES 0.81 DEG 0.80 DEG REMARK 3 IMPROPERS 0.79 DEG 0.79 DEG REMARK 3 REMARK 3 DEVIATIONS FROM EXPT RESTRAINTS REMARK 3 NOES (1795/1693) 0.04 A 0.03 A REMARK 3 TORSION ANGLES (433/429) 0.29 DEG 0.30 DEG REMARK 3 3JHNA COUPLINGS (70/66) 0.84 HZ 0.90 HZ REMARK 3 13C CHEMICAL SHIFTS (165/165) 0.99 PPM 0.95 PPM REMARK 3 REMARK 3 HETERONUCLEAR DIPOLAR COUPLING R-FACTORS REMARK 3 (CLORE AND GARRETT J. AM. CHEM. SOC. 121, 9008-9012): REMARK 3 REMARK 3 PROTEIN 1DNH (71/66) 5.5% 7.6% REMARK 3 PROTEIN 1DCH (67/67) 6.3% 10.0% REMARK 3 PROTEIN 1DNC' (68/62) 18.9% 28.9% REMARK 3 PROTEIN 2DHNC'(68/62) 18.8% 21.6% REMARK 3 DNA 1DNH (9/10) 10.2% 16.1% REMARK 3 DNA 1DCH (37/33) 11.2% 10.7% REMARK 3 DNA 1H-1H DIPOLAR REMARK 3 REMARK 3 COUPLINGS (55/53) 0.56 HZ 0.75 HZ REMARK 3 % RESIDUES IN MOST FAVORABLE REMARK 3 REGION OF RAMACHADRAN MAP 94.7% 94.7% REMARK 4 REMARK 4 1J46 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 23-JUL-01. REMARK 100 THE RCSB ID CODE IS RCSB001590. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 308.00 REMARK 210 PH : 7.2 REMARK 210 IONIC STRENGTH : 50 MM SODIUM PHOSPHATE REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ, 750 MHZ REMARK 210 SPECTROMETER MODEL : DMX500, DRX600, DRX750 REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : NULL REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 400 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : RESTRAINED REGULARIZED MEAN REMARK 210 STRUCTURE REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: THE FOLLOWING EXPERIMENTS WERE CONDUCTED: (1) DOUBLE REMARK 210 AND TRIPLE RESONANCE FOR ASSIGNMENT OF PROTEIN; (2) DOUBLE REMARK 210 RESONANCE AND HETERONUCLEAR FILTERED FOR DNA; (3) QUANTITATIVE REMARK 210 J CORRELATION FOR COUPLING CONSTANTS; (4) 2D, 3D AND 4D REMARK 210 HETERONUCLEAR SEPARATED AND FILTERED NOE EXPERIMENTS; (4) 2D REMARK 210 AND 3D DOUBLE AND TRIPLE RESONANCE EXPERIMENTS FOR DIPOLAR REMARK 210 COUPLING MEASUREMENTS IN LIQUID CRYSTALLINE MEDIUM OF 4.5-5% REMARK 210 3:1 DMPC:DHPC REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DT C 119 C6 - C5 - C7 ANGL. DEV. = -4.1 DEGREES REMARK 500 DT C 121 C6 - C5 - C7 ANGL. DEV. = -4.5 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1J47 RELATED DB: PDB REMARK 900 M9I MUTANT OF THE HMG-BOX DOMAIN OF THE HUMAN MALE SEX REMARK 900 DETERMINING FACTOR SRY COMPLEXED TO DNA DBREF 1J46 A 2 85 UNP Q05066 SRY_HUMAN 57 140 DBREF 1J46 B 101 114 PDB 1J46 1J46 101 114 DBREF 1J46 C 115 128 PDB 1J46 1J46 115 128 SEQADV 1J46 MET A 1 UNP Q05066 CLONING ARTIFACT SEQRES 1 A 85 MET GLN ASP ARG VAL LYS ARG PRO MET ASN ALA PHE ILE SEQRES 2 A 85 VAL TRP SER ARG ASP GLN ARG ARG LYS MET ALA LEU GLU SEQRES 3 A 85 ASN PRO ARG MET ARG ASN SER GLU ILE SER LYS GLN LEU SEQRES 4 A 85 GLY TYR GLN TRP LYS MET LEU THR GLU ALA GLU LYS TRP SEQRES 5 A 85 PRO PHE PHE GLN GLU ALA GLN LYS LEU GLN ALA MET HIS SEQRES 6 A 85 ARG GLU LYS TYR PRO ASN TYR LYS TYR ARG PRO ARG ARG SEQRES 7 A 85 LYS ALA LYS MET LEU PRO LYS SEQRES 1 B 14 DC DC DT DG DC DA DC DA DA DA DC DA DC SEQRES 2 B 14 DC SEQRES 1 C 14 DG DG DT DG DT DT DT DG DT DG DC DA DG SEQRES 2 C 14 DG HELIX 1 1 ASN A 10 ASN A 27 1 18 HELIX 2 2 ARG A 31 LYS A 44 1 14 HELIX 3 3 THR A 47 TYR A 69 1 23 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 ATOM 1 N MET A 1 0.859 18.821 18.116 1.00 1.76 N ATOM 2 CA MET A 1 1.574 17.759 17.355 1.00 1.10 C ATOM 3 C MET A 1 0.996 16.390 17.724 1.00 0.95 C ATOM 4 O MET A 1 0.888 16.037 18.882 1.00 1.17 O ATOM 5 CB MET A 1 3.067 17.808 17.685 1.00 1.80 C ATOM 6 CG MET A 1 3.654 19.122 17.164 1.00 2.37 C ATOM 7 SD MET A 1 5.463 19.037 17.185 1.00 3.31 S ATOM 8 CE MET A 1 5.707 19.580 18.893 1.00 3.92 C ATOM 9 H1 MET A 1 0.844 18.576 19.126 1.00 2.22 H ATOM 10 H2 MET A 1 -0.117 18.900 17.763 1.00 2.24 H ATOM 11 H3 MET A 1 1.348 19.730 17.989 1.00 2.23 H ATOM 12 HA MET A 1 1.436 17.928 16.297 1.00 1.46 H ATOM 13 HB2 MET A 1 3.201 17.750 18.755 1.00 2.34 H ATOM 14 HB3 MET A 1 3.570 16.978 17.212 1.00 2.29 H ATOM 15 HG2 MET A 1 3.315 19.291 16.153 1.00 2.66 H ATOM 16 HG3 MET A 1 3.324 19.936 17.793 1.00 2.75 H ATOM 17 HE1 MET A 1 4.817 19.369 19.469 1.00 4.27 H ATOM 18 HE2 MET A 1 5.901 20.641 18.910 1.00 4.31 H ATOM 19 HE3 MET A 1 6.552 19.056 19.318 1.00 4.14 H ATOM 20 N GLN A 2 0.609 15.628 16.740 1.00 0.98 N ATOM 21 CA GLN A 2 0.015 14.287 17.001 1.00 1.07 C ATOM 22 C GLN A 2 1.000 13.181 16.630 1.00 0.75 C ATOM 23 O GLN A 2 1.586 13.181 15.565 1.00 0.74 O ATOM 24 CB GLN A 2 -1.236 14.126 16.137 1.00 1.59 C ATOM 25 CG GLN A 2 -2.245 15.218 16.485 1.00 2.16 C ATOM 26 CD GLN A 2 -3.189 15.430 15.301 1.00 2.81 C ATOM 27 OE1 GLN A 2 -3.596 14.485 14.656 1.00 3.24 O ATOM 28 NE2 GLN A 2 -3.548 16.643 14.981 1.00 3.50 N ATOM 29 H GLN A 2 0.697 15.947 15.817 1.00 1.21 H ATOM 30 HA GLN A 2 -0.248 14.172 18.041 1.00 1.26 H ATOM 31 HB2 GLN A 2 -0.964 14.206 15.094 1.00 1.89 H ATOM 32 HB3 GLN A 2 -1.676 13.158 16.321 1.00 2.00 H ATOM 33 HG2 GLN A 2 -2.816 14.916 17.352 1.00 2.54 H ATOM 34 HG3 GLN A 2 -1.724 16.138 16.698 1.00 2.60 H ATOM 35 HE21 GLN A 2 -3.214 17.405 15.499 1.00 3.68 H ATOM 36 HE22 GLN A 2 -4.149 16.792 14.222 1.00 4.12 H ATOM 37 N ASP A 3 1.154 12.213 17.494 1.00 0.73 N ATOM 38 CA ASP A 3 2.060 11.077 17.186 1.00 0.64 C ATOM 39 C ASP A 3 1.211 9.985 16.535 1.00 0.54 C ATOM 40 O ASP A 3 0.177 9.612 17.052 1.00 0.61 O ATOM 41 CB ASP A 3 2.686 10.547 18.480 1.00 0.99 C ATOM 42 CG ASP A 3 3.608 11.611 19.078 1.00 1.10 C ATOM 43 OD1 ASP A 3 3.924 12.556 18.375 1.00 0.93 O ATOM 44 OD2 ASP A 3 3.981 11.464 20.231 1.00 1.42 O ATOM 45 H ASP A 3 0.648 12.221 18.333 1.00 0.97 H ATOM 46 HA ASP A 3 2.833 11.412 16.509 1.00 0.64 H ATOM 47 HB2 ASP A 3 1.904 10.309 19.187 1.00 1.15 H ATOM 48 HB3 ASP A 3 3.259 9.657 18.265 1.00 1.10 H ATOM 49 N ARG A 4 1.606 9.482 15.402 1.00 0.46 N ATOM 50 CA ARG A 4 0.771 8.438 14.743 1.00 0.40 C ATOM 51 C ARG A 4 1.165 7.058 15.264 1.00 0.37 C ATOM 52 O ARG A 4 2.315 6.798 15.557 1.00 0.37 O ATOM 53 CB ARG A 4 0.986 8.490 13.231 1.00 0.40 C ATOM 54 CG ARG A 4 -0.066 7.628 12.535 1.00 0.43 C ATOM 55 CD ARG A 4 0.351 7.392 11.084 1.00 0.93 C ATOM 56 NE ARG A 4 -0.782 6.772 10.344 1.00 1.63 N ATOM 57 CZ ARG A 4 -0.739 6.678 9.044 1.00 2.09 C ATOM 58 NH1 ARG A 4 0.325 7.066 8.398 1.00 2.21 N ATOM 59 NH2 ARG A 4 -1.755 6.182 8.392 1.00 3.11 N ATOM 60 H ARG A 4 2.430 9.798 14.977 1.00 0.51 H ATOM 61 HA ARG A 4 -0.268 8.615 14.975 1.00 0.41 H ATOM 62 HB2 ARG A 4 0.898 9.512 12.891 1.00 0.42 H ATOM 63 HB3 ARG A 4 1.970 8.115 12.995 1.00 0.42 H ATOM 64 HG2 ARG A 4 -0.149 6.679 13.046 1.00 0.80 H ATOM 65 HG3 ARG A 4 -1.018 8.134 12.557 1.00 0.76 H ATOM 66 HD2 ARG A 4 0.607 8.331 10.623 1.00 1.61 H ATOM 67 HD3 ARG A 4 1.211 6.737 11.061 1.00 1.50 H ATOM 68 HE ARG A 4 -1.570 6.455 10.832 1.00 2.34 H ATOM 69 HH11 ARG A 4 1.108 7.437 8.900 1.00 2.03 H ATOM 70 HH12 ARG A 4 0.360 6.992 7.402 1.00 2.96 H ATOM 71 HH21 ARG A 4 -2.566 5.875 8.889 1.00 3.60 H ATOM 72 HH22 ARG A 4 -1.722 6.109 7.395 1.00 3.63 H ATOM 73 N VAL A 5 0.214 6.170 15.393 1.00 0.36 N ATOM 74 CA VAL A 5 0.530 4.812 15.907 1.00 0.34 C ATOM 75 C VAL A 5 0.895 3.897 14.737 1.00 0.31 C ATOM 76 O VAL A 5 0.206 3.825 13.739 1.00 0.30 O ATOM 77 CB VAL A 5 -0.695 4.247 16.636 1.00 0.36 C ATOM 78 CG1 VAL A 5 -0.349 2.889 17.256 1.00 0.35 C ATOM 79 CG2 VAL A 5 -1.128 5.215 17.744 1.00 0.40 C ATOM 80 H VAL A 5 -0.714 6.391 15.166 1.00 0.36 H ATOM 81 HA VAL A 5 1.362 4.867 16.592 1.00 0.35 H ATOM 82 HB VAL A 5 -1.504 4.122 15.931 1.00 0.36 H ATOM 83 HG11 VAL A 5 0.137 2.267 16.519 1.00 1.11 H ATOM 84 HG12 VAL A 5 -1.255 2.407 17.592 1.00 1.08 H ATOM 85 HG13 VAL A 5 0.313 3.036 18.097 1.00 1.03 H ATOM 86 HG21 VAL A 5 -0.590 4.989 18.653 1.00 1.09 H ATOM 87 HG22 VAL A 5 -2.188 5.110 17.918 1.00 1.11 H ATOM 88 HG23 VAL A 5 -0.913 6.230 17.443 1.00 1.09 H ATOM 89 N LYS A 6 1.996 3.222 14.861 1.00 0.29 N ATOM 90 CA LYS A 6 2.464 2.324 13.772 1.00 0.26 C ATOM 91 C LYS A 6 1.870 0.925 13.980 1.00 0.24 C ATOM 92 O LYS A 6 1.482 0.562 15.073 1.00 0.25 O ATOM 93 CB LYS A 6 3.998 2.313 13.806 1.00 0.28 C ATOM 94 CG LYS A 6 4.480 3.763 14.045 1.00 0.43 C ATOM 95 CD LYS A 6 5.721 4.088 13.207 1.00 0.97 C ATOM 96 CE LYS A 6 5.909 5.608 13.158 1.00 1.10 C ATOM 97 NZ LYS A 6 7.353 5.925 12.968 1.00 1.84 N ATOM 98 H LYS A 6 2.535 3.343 15.671 1.00 0.30 H ATOM 99 HA LYS A 6 2.132 2.704 12.816 1.00 0.26 H ATOM 100 HB2 LYS A 6 4.337 1.677 14.612 1.00 0.34 H ATOM 101 HB3 LYS A 6 4.386 1.948 12.867 1.00 0.27 H ATOM 102 HG2 LYS A 6 3.693 4.458 13.785 1.00 1.19 H ATOM 103 HG3 LYS A 6 4.721 3.883 15.091 1.00 1.21 H ATOM 104 HD2 LYS A 6 6.588 3.640 13.660 1.00 1.68 H ATOM 105 HD3 LYS A 6 5.598 3.712 12.203 1.00 1.66 H ATOM 106 HE2 LYS A 6 5.341 6.015 12.335 1.00 1.57 H ATOM 107 HE3 LYS A 6 5.564 6.046 14.084 1.00 1.56 H ATOM 108 HZ1 LYS A 6 7.476 6.955 12.899 1.00 2.33 H ATOM 109 HZ2 LYS A 6 7.693 5.475 12.095 1.00 2.31 H ATOM 110 HZ3 LYS A 6 7.896 5.567 13.779 1.00 2.32 H ATOM 111 N ARG A 7 1.761 0.149 12.930 1.00 0.22 N ATOM 112 CA ARG A 7 1.154 -1.212 13.044 1.00 0.23 C ATOM 113 C ARG A 7 2.064 -2.157 13.829 1.00 0.24 C ATOM 114 O ARG A 7 3.272 -2.029 13.796 1.00 0.26 O ATOM 115 CB ARG A 7 0.968 -1.793 11.638 1.00 0.24 C ATOM 116 CG ARG A 7 -0.049 -0.966 10.856 1.00 0.37 C ATOM 117 CD ARG A 7 -0.192 -1.556 9.454 1.00 0.55 C ATOM 118 NE ARG A 7 -0.966 -2.828 9.534 1.00 0.75 N ATOM 119 CZ ARG A 7 -1.418 -3.389 8.447 1.00 1.00 C ATOM 120 NH1 ARG A 7 -1.159 -2.859 7.283 1.00 1.04 N ATOM 121 NH2 ARG A 7 -2.119 -4.487 8.522 1.00 1.26 N ATOM 122 H ARG A 7 2.067 0.460 12.054 1.00 0.22 H ATOM 123 HA ARG A 7 0.189 -1.133 13.519 1.00 0.25 H ATOM 124 HB2 ARG A 7 1.913 -1.781 11.117 1.00 0.28 H ATOM 125 HB3 ARG A 7 0.618 -2.811 11.712 1.00 0.35 H ATOM 126 HG2 ARG A 7 -1.004 -0.994 11.362 1.00 0.49 H ATOM 127 HG3 ARG A 7 0.293 0.055 10.783 1.00 0.45 H ATOM 128 HD2 ARG A 7 -0.712 -0.860 8.820 1.00 0.66 H ATOM 129 HD3 ARG A 7 0.790 -1.749 9.044 1.00 0.59 H ATOM 130 HE ARG A 7 -1.146 -3.236 10.407 1.00 0.78 H ATOM 131 HH11 ARG A 7 -0.615 -2.022 7.225 1.00 0.94 H ATOM 132 HH12 ARG A 7 -1.505 -3.290 6.450 1.00 1.24 H ATOM 133 HH21 ARG A 7 -2.311 -4.898 9.414 1.00 1.31 H ATOM 134 HH22 ARG A 7 -2.465 -4.918 7.689 1.00 1.45 H ATOM 135 N PRO A 8 1.496 -3.136 14.494 1.00 0.27 N ATOM 136 CA PRO A 8 2.293 -4.141 15.242 1.00 0.30 C ATOM 137 C PRO A 8 3.270 -4.854 14.301 1.00 0.25 C ATOM 138 O PRO A 8 2.954 -5.139 13.162 1.00 0.21 O ATOM 139 CB PRO A 8 1.256 -5.126 15.812 1.00 0.35 C ATOM 140 CG PRO A 8 -0.047 -4.809 15.144 1.00 0.57 C ATOM 141 CD PRO A 8 0.050 -3.383 14.607 1.00 0.32 C ATOM 142 HA PRO A 8 2.836 -3.677 16.051 1.00 0.35 H ATOM 143 HB2 PRO A 8 1.549 -6.146 15.596 1.00 0.49 H ATOM 144 HB3 PRO A 8 1.164 -4.988 16.879 1.00 0.53 H ATOM 145 HG2 PRO A 8 -0.221 -5.500 14.330 1.00 0.92 H ATOM 146 HG3 PRO A 8 -0.854 -4.871 15.858 1.00 0.90 H ATOM 147 HD2 PRO A 8 -0.430 -3.315 13.642 1.00 0.38 H ATOM 148 HD3 PRO A 8 -0.393 -2.686 15.302 1.00 0.35 H ATOM 149 N MET A 9 4.454 -5.131 14.761 1.00 0.27 N ATOM 150 CA MET A 9 5.451 -5.810 13.887 1.00 0.25 C ATOM 151 C MET A 9 5.077 -7.285 13.710 1.00 0.21 C ATOM 152 O MET A 9 4.729 -7.965 14.655 1.00 0.21 O ATOM 153 CB MET A 9 6.833 -5.684 14.522 1.00 0.35 C ATOM 154 CG MET A 9 7.239 -4.209 14.537 1.00 0.55 C ATOM 155 SD MET A 9 8.930 -4.046 15.158 1.00 0.97 S ATOM 156 CE MET A 9 8.596 -4.447 16.891 1.00 0.58 C ATOM 157 H MET A 9 4.684 -4.888 15.681 1.00 0.31 H ATOM 158 HA MET A 9 5.461 -5.329 12.920 1.00 0.25 H ATOM 159 HB2 MET A 9 6.799 -6.062 15.533 1.00 0.37 H ATOM 160 HB3 MET A 9 7.549 -6.248 13.945 1.00 0.33 H ATOM 161 HG2 MET A 9 7.186 -3.811 13.534 1.00 0.59 H ATOM 162 HG3 MET A 9 6.565 -3.657 15.176 1.00 0.53 H ATOM 163 HE1 MET A 9 8.994 -3.663 17.520 1.00 1.29 H ATOM 164 HE2 MET A 9 9.070 -5.382 17.142 1.00 1.29 H ATOM 165 HE3 MET A 9 7.530 -4.532 17.044 1.00 1.30 H ATOM 166 N ASN A 10 5.112 -7.774 12.498 1.00 0.18 N ATOM 167 CA ASN A 10 4.719 -9.192 12.248 1.00 0.17 C ATOM 168 C ASN A 10 5.869 -10.139 12.600 1.00 0.17 C ATOM 169 O ASN A 10 6.987 -9.727 12.833 1.00 0.17 O ATOM 170 CB ASN A 10 4.358 -9.366 10.772 1.00 0.19 C ATOM 171 CG ASN A 10 3.178 -8.459 10.423 1.00 0.19 C ATOM 172 OD1 ASN A 10 2.353 -8.165 11.265 1.00 0.21 O ATOM 173 ND2 ASN A 10 3.062 -7.999 9.207 1.00 0.29 N ATOM 174 H ASN A 10 5.347 -7.189 11.746 1.00 0.19 H ATOM 175 HA ASN A 10 3.862 -9.435 12.857 1.00 0.18 H ATOM 176 HB2 ASN A 10 5.209 -9.102 10.160 1.00 0.22 H ATOM 177 HB3 ASN A 10 4.087 -10.394 10.586 1.00 0.21 H ATOM 178 HD21 ASN A 10 3.728 -8.235 8.529 1.00 0.39 H ATOM 179 HD22 ASN A 10 2.310 -7.416 8.973 1.00 0.31 H ATOM 180 N ALA A 11 5.577 -11.410 12.671 1.00 0.17 N ATOM 181 CA ALA A 11 6.615 -12.409 13.052 1.00 0.17 C ATOM 182 C ALA A 11 7.891 -12.220 12.225 1.00 0.16 C ATOM 183 O ALA A 11 8.985 -12.400 12.724 1.00 0.15 O ATOM 184 CB ALA A 11 6.057 -13.822 12.840 1.00 0.18 C ATOM 185 H ALA A 11 4.656 -11.702 12.508 1.00 0.17 H ATOM 186 HA ALA A 11 6.850 -12.270 14.096 1.00 0.17 H ATOM 187 HB1 ALA A 11 6.409 -14.218 11.898 1.00 1.03 H ATOM 188 HB2 ALA A 11 4.978 -13.782 12.830 1.00 1.03 H ATOM 189 HB3 ALA A 11 6.385 -14.463 13.645 1.00 1.04 H ATOM 190 N PHE A 12 7.781 -11.871 10.973 1.00 0.16 N ATOM 191 CA PHE A 12 9.018 -11.696 10.162 1.00 0.16 C ATOM 192 C PHE A 12 9.707 -10.391 10.540 1.00 0.14 C ATOM 193 O PHE A 12 10.914 -10.343 10.677 1.00 0.14 O ATOM 194 CB PHE A 12 8.683 -11.661 8.675 1.00 0.17 C ATOM 195 CG PHE A 12 9.930 -11.308 7.905 1.00 0.19 C ATOM 196 CD1 PHE A 12 10.283 -9.966 7.727 1.00 0.30 C ATOM 197 CD2 PHE A 12 10.737 -12.321 7.375 1.00 0.26 C ATOM 198 CE1 PHE A 12 11.444 -9.636 7.019 1.00 0.42 C ATOM 199 CE2 PHE A 12 11.898 -11.991 6.666 1.00 0.38 C ATOM 200 CZ PHE A 12 12.252 -10.648 6.488 1.00 0.45 C ATOM 201 H PHE A 12 6.898 -11.738 10.569 1.00 0.17 H ATOM 202 HA PHE A 12 9.686 -12.523 10.349 1.00 0.16 H ATOM 203 HB2 PHE A 12 8.340 -12.632 8.366 1.00 0.21 H ATOM 204 HB3 PHE A 12 7.918 -10.923 8.488 1.00 0.24 H ATOM 205 HD1 PHE A 12 9.660 -9.185 8.137 1.00 0.35 H ATOM 206 HD2 PHE A 12 10.465 -13.356 7.516 1.00 0.29 H ATOM 207 HE1 PHE A 12 11.717 -8.601 6.886 1.00 0.52 H ATOM 208 HE2 PHE A 12 12.521 -12.772 6.256 1.00 0.47 H ATOM 209 HZ PHE A 12 13.147 -10.393 5.941 1.00 0.56 H ATOM 210 N ILE A 13 8.976 -9.323 10.697 1.00 0.14 N ATOM 211 CA ILE A 13 9.637 -8.043 11.047 1.00 0.13 C ATOM 212 C ILE A 13 10.317 -8.200 12.412 1.00 0.13 C ATOM 213 O ILE A 13 11.456 -7.820 12.587 1.00 0.12 O ATOM 214 CB ILE A 13 8.585 -6.917 11.042 1.00 0.14 C ATOM 215 CG1 ILE A 13 7.883 -6.898 9.672 1.00 0.15 C ATOM 216 CG2 ILE A 13 9.242 -5.547 11.291 1.00 0.14 C ATOM 217 CD1 ILE A 13 8.820 -6.323 8.589 1.00 0.15 C ATOM 218 H ILE A 13 8.005 -9.347 10.564 1.00 0.15 H ATOM 219 HA ILE A 13 10.385 -7.836 10.312 1.00 0.13 H ATOM 220 HB ILE A 13 7.855 -7.110 11.814 1.00 0.14 H ATOM 221 HG12 ILE A 13 7.601 -7.905 9.402 1.00 0.16 H ATOM 222 HG13 ILE A 13 6.997 -6.284 9.735 1.00 0.16 H ATOM 223 HG21 ILE A 13 9.045 -5.233 12.305 1.00 1.02 H ATOM 224 HG22 ILE A 13 8.827 -4.813 10.608 1.00 1.02 H ATOM 225 HG23 ILE A 13 10.307 -5.618 11.136 1.00 1.02 H ATOM 226 HD11 ILE A 13 8.523 -5.312 8.359 1.00 1.02 H ATOM 227 HD12 ILE A 13 8.756 -6.928 7.698 1.00 1.03 H ATOM 228 HD13 ILE A 13 9.838 -6.315 8.939 1.00 1.03 H ATOM 229 N VAL A 14 9.651 -8.784 13.373 1.00 0.13 N ATOM 230 CA VAL A 14 10.296 -8.987 14.706 1.00 0.13 C ATOM 231 C VAL A 14 11.530 -9.887 14.523 1.00 0.12 C ATOM 232 O VAL A 14 12.620 -9.591 14.989 1.00 0.12 O ATOM 233 CB VAL A 14 9.291 -9.677 15.646 1.00 0.14 C ATOM 234 CG1 VAL A 14 9.879 -9.815 17.057 1.00 0.14 C ATOM 235 CG2 VAL A 14 7.995 -8.857 15.710 1.00 0.16 C ATOM 236 H VAL A 14 8.736 -9.098 13.216 1.00 0.14 H ATOM 237 HA VAL A 14 10.593 -8.033 15.115 1.00 0.12 H ATOM 238 HB VAL A 14 9.069 -10.662 15.260 1.00 0.15 H ATOM 239 HG11 VAL A 14 9.071 -9.884 17.778 1.00 1.03 H ATOM 240 HG12 VAL A 14 10.487 -8.952 17.281 1.00 1.03 H ATOM 241 HG13 VAL A 14 10.482 -10.709 17.110 1.00 1.02 H ATOM 242 HG21 VAL A 14 8.199 -7.834 15.439 1.00 1.04 H ATOM 243 HG22 VAL A 14 7.595 -8.889 16.709 1.00 1.03 H ATOM 244 HG23 VAL A 14 7.273 -9.272 15.026 1.00 1.02 H ATOM 245 N TRP A 15 11.353 -10.985 13.836 1.00 0.13 N ATOM 246 CA TRP A 15 12.475 -11.940 13.592 1.00 0.13 C ATOM 247 C TRP A 15 13.578 -11.291 12.745 1.00 0.12 C ATOM 248 O TRP A 15 14.736 -11.644 12.849 1.00 0.12 O ATOM 249 CB TRP A 15 11.910 -13.163 12.863 1.00 0.14 C ATOM 250 CG TRP A 15 13.017 -14.031 12.355 1.00 0.15 C ATOM 251 CD1 TRP A 15 13.610 -15.030 13.049 1.00 0.17 C ATOM 252 CD2 TRP A 15 13.656 -14.004 11.049 1.00 0.15 C ATOM 253 NE1 TRP A 15 14.576 -15.617 12.249 1.00 0.18 N ATOM 254 CE2 TRP A 15 14.644 -15.017 11.007 1.00 0.17 C ATOM 255 CE3 TRP A 15 13.478 -13.204 9.908 1.00 0.16 C ATOM 256 CZ2 TRP A 15 15.426 -15.228 9.871 1.00 0.18 C ATOM 257 CZ3 TRP A 15 14.262 -13.413 8.764 1.00 0.18 C ATOM 258 CH2 TRP A 15 15.234 -14.423 8.745 1.00 0.19 C ATOM 259 H TRP A 15 10.469 -11.202 13.466 1.00 0.13 H ATOM 260 HA TRP A 15 12.887 -12.253 14.539 1.00 0.13 H ATOM 261 HB2 TRP A 15 11.296 -13.732 13.544 1.00 0.15 H ATOM 262 HB3 TRP A 15 11.305 -12.832 12.031 1.00 0.14 H ATOM 263 HD1 TRP A 15 13.368 -15.322 14.060 1.00 0.18 H ATOM 264 HE1 TRP A 15 15.152 -16.366 12.514 1.00 0.20 H ATOM 265 HE3 TRP A 15 12.731 -12.423 9.912 1.00 0.16 H ATOM 266 HZ2 TRP A 15 16.173 -16.007 9.862 1.00 0.20 H ATOM 267 HZ3 TRP A 15 14.113 -12.792 7.894 1.00 0.20 H ATOM 268 HH2 TRP A 15 15.834 -14.578 7.860 1.00 0.21 H ATOM 269 N SER A 16 13.238 -10.339 11.918 1.00 0.12 N ATOM 270 CA SER A 16 14.293 -9.681 11.092 1.00 0.12 C ATOM 271 C SER A 16 15.008 -8.622 11.932 1.00 0.11 C ATOM 272 O SER A 16 16.195 -8.418 11.804 1.00 0.11 O ATOM 273 CB SER A 16 13.682 -9.041 9.850 1.00 0.12 C ATOM 274 OG SER A 16 12.376 -8.605 10.152 1.00 1.23 O ATOM 275 H SER A 16 12.304 -10.046 11.872 1.00 0.12 H ATOM 276 HA SER A 16 15.010 -10.426 10.786 1.00 0.12 H ATOM 277 HB2 SER A 16 14.275 -8.195 9.544 1.00 0.93 H ATOM 278 HB3 SER A 16 13.655 -9.767 9.048 1.00 0.91 H ATOM 279 HG SER A 16 12.025 -8.158 9.377 1.00 1.80 H ATOM 280 N ARG A 17 14.304 -7.945 12.797 1.00 0.12 N ATOM 281 CA ARG A 17 14.973 -6.912 13.633 1.00 0.12 C ATOM 282 C ARG A 17 16.222 -7.512 14.279 1.00 0.12 C ATOM 283 O ARG A 17 17.298 -6.945 14.212 1.00 0.12 O ATOM 284 CB ARG A 17 14.031 -6.443 14.740 1.00 0.14 C ATOM 285 CG ARG A 17 13.018 -5.443 14.184 1.00 0.15 C ATOM 286 CD ARG A 17 12.176 -4.903 15.340 1.00 0.35 C ATOM 287 NE ARG A 17 13.089 -4.366 16.391 1.00 0.97 N ATOM 288 CZ ARG A 17 12.612 -3.674 17.388 1.00 1.41 C ATOM 289 NH1 ARG A 17 11.328 -3.470 17.485 1.00 1.73 N ATOM 290 NH2 ARG A 17 13.420 -3.195 18.294 1.00 2.17 N ATOM 291 H ARG A 17 13.345 -8.119 12.890 1.00 0.12 H ATOM 292 HA ARG A 17 15.257 -6.063 13.021 1.00 0.12 H ATOM 293 HB2 ARG A 17 13.506 -7.295 15.147 1.00 0.15 H ATOM 294 HB3 ARG A 17 14.607 -5.971 15.521 1.00 0.18 H ATOM 295 HG2 ARG A 17 13.541 -4.628 13.703 1.00 0.31 H ATOM 296 HG3 ARG A 17 12.377 -5.933 13.471 1.00 0.28 H ATOM 297 HD2 ARG A 17 11.539 -4.113 14.985 1.00 0.89 H ATOM 298 HD3 ARG A 17 11.567 -5.701 15.746 1.00 0.98 H ATOM 299 HE ARG A 17 14.053 -4.526 16.328 1.00 1.62 H ATOM 300 HH11 ARG A 17 10.708 -3.843 16.795 1.00 1.72 H ATOM 301 HH12 ARG A 17 10.963 -2.942 18.252 1.00 2.38 H ATOM 302 HH21 ARG A 17 14.404 -3.358 18.222 1.00 2.55 H ATOM 303 HH22 ARG A 17 13.055 -2.667 19.060 1.00 2.60 H ATOM 304 N ASP A 18 16.104 -8.655 14.905 1.00 0.12 N ATOM 305 CA ASP A 18 17.299 -9.271 15.553 1.00 0.13 C ATOM 306 C ASP A 18 18.136 -10.039 14.522 1.00 0.13 C ATOM 307 O ASP A 18 19.350 -10.041 14.585 1.00 0.14 O ATOM 308 CB ASP A 18 16.843 -10.225 16.659 1.00 0.14 C ATOM 309 CG ASP A 18 18.056 -10.689 17.468 1.00 0.17 C ATOM 310 OD1 ASP A 18 19.141 -10.197 17.206 1.00 0.19 O ATOM 311 OD2 ASP A 18 17.878 -11.527 18.336 1.00 0.19 O ATOM 312 H ASP A 18 15.236 -9.114 14.952 1.00 0.13 H ATOM 313 HA ASP A 18 17.917 -8.496 15.981 1.00 0.14 H ATOM 314 HB2 ASP A 18 16.149 -9.714 17.311 1.00 0.15 H ATOM 315 HB3 ASP A 18 16.358 -11.082 16.218 1.00 0.15 H ATOM 316 N GLN A 19 17.516 -10.685 13.572 1.00 0.13 N ATOM 317 CA GLN A 19 18.312 -11.433 12.553 1.00 0.13 C ATOM 318 C GLN A 19 19.009 -10.424 11.633 1.00 0.12 C ATOM 319 O GLN A 19 20.162 -10.576 11.283 1.00 0.13 O ATOM 320 CB GLN A 19 17.383 -12.326 11.727 1.00 0.13 C ATOM 321 CG GLN A 19 18.210 -13.351 10.948 1.00 0.15 C ATOM 322 CD GLN A 19 18.651 -14.473 11.889 1.00 0.25 C ATOM 323 OE1 GLN A 19 17.848 -15.020 12.619 1.00 0.97 O ATOM 324 NE2 GLN A 19 19.902 -14.844 11.902 1.00 1.15 N ATOM 325 H GLN A 19 16.537 -10.669 13.525 1.00 0.13 H ATOM 326 HA GLN A 19 19.058 -12.040 13.045 1.00 0.14 H ATOM 327 HB2 GLN A 19 16.698 -12.841 12.386 1.00 0.15 H ATOM 328 HB3 GLN A 19 16.827 -11.719 11.033 1.00 0.13 H ATOM 329 HG2 GLN A 19 17.610 -13.764 10.149 1.00 0.22 H ATOM 330 HG3 GLN A 19 19.081 -12.869 10.532 1.00 0.21 H ATOM 331 HE21 GLN A 19 20.549 -14.404 11.312 1.00 1.88 H ATOM 332 HE22 GLN A 19 20.194 -15.562 12.501 1.00 1.22 H ATOM 333 N ARG A 20 18.311 -9.389 11.249 1.00 0.12 N ATOM 334 CA ARG A 20 18.912 -8.352 10.360 1.00 0.11 C ATOM 335 C ARG A 20 20.193 -7.804 10.993 1.00 0.12 C ATOM 336 O ARG A 20 21.198 -7.653 10.328 1.00 0.12 O ATOM 337 CB ARG A 20 17.904 -7.214 10.178 1.00 0.11 C ATOM 338 CG ARG A 20 18.427 -6.201 9.155 1.00 0.13 C ATOM 339 CD ARG A 20 17.532 -4.968 9.193 1.00 0.20 C ATOM 340 NE ARG A 20 16.146 -5.351 8.767 1.00 0.55 N ATOM 341 CZ ARG A 20 15.894 -5.745 7.553 1.00 1.01 C ATOM 342 NH1 ARG A 20 16.811 -5.646 6.631 1.00 1.83 N ATOM 343 NH2 ARG A 20 14.707 -6.199 7.247 1.00 1.32 N ATOM 344 H ARG A 20 17.382 -9.296 11.546 1.00 0.12 H ATOM 345 HA ARG A 20 19.153 -8.765 9.395 1.00 0.12 H ATOM 346 HB2 ARG A 20 16.968 -7.621 9.825 1.00 0.11 H ATOM 347 HB3 ARG A 20 17.747 -6.718 11.124 1.00 0.13 H ATOM 348 HG2 ARG A 20 19.441 -5.924 9.406 1.00 0.26 H ATOM 349 HG3 ARG A 20 18.401 -6.635 8.167 1.00 0.21 H ATOM 350 HD2 ARG A 20 17.465 -4.613 10.195 1.00 0.52 H ATOM 351 HD3 ARG A 20 17.968 -4.186 8.568 1.00 0.54 H ATOM 352 HE ARG A 20 15.426 -5.356 9.431 1.00 1.24 H ATOM 353 HH11 ARG A 20 17.708 -5.267 6.856 1.00 1.90 H ATOM 354 HH12 ARG A 20 16.613 -5.941 5.696 1.00 2.56 H ATOM 355 HH21 ARG A 20 13.995 -6.244 7.946 1.00 1.43 H ATOM 356 HH22 ARG A 20 14.511 -6.498 6.312 1.00 1.87 H ATOM 357 N ARG A 21 20.189 -7.522 12.269 1.00 0.12 N ATOM 358 CA ARG A 21 21.433 -7.008 12.911 1.00 0.13 C ATOM 359 C ARG A 21 22.485 -8.120 12.941 1.00 0.14 C ATOM 360 O ARG A 21 23.663 -7.871 12.777 1.00 0.14 O ATOM 361 CB ARG A 21 21.125 -6.536 14.342 1.00 0.13 C ATOM 362 CG ARG A 21 22.251 -5.615 14.845 1.00 0.14 C ATOM 363 CD ARG A 21 22.048 -4.194 14.302 1.00 0.15 C ATOM 364 NE ARG A 21 23.333 -3.429 14.416 1.00 0.37 N ATOM 365 CZ ARG A 21 23.879 -3.182 15.571 1.00 0.87 C ATOM 366 NH1 ARG A 21 23.237 -3.454 16.672 1.00 1.92 N ATOM 367 NH2 ARG A 21 25.057 -2.619 15.624 1.00 0.91 N ATOM 368 H ARG A 21 19.385 -7.655 12.820 1.00 0.12 H ATOM 369 HA ARG A 21 21.841 -6.185 12.349 1.00 0.13 H ATOM 370 HB2 ARG A 21 20.190 -5.996 14.348 1.00 0.13 H ATOM 371 HB3 ARG A 21 21.049 -7.394 14.993 1.00 0.14 H ATOM 372 HG2 ARG A 21 22.240 -5.591 15.925 1.00 0.15 H ATOM 373 HG3 ARG A 21 23.203 -5.994 14.505 1.00 0.16 H ATOM 374 HD2 ARG A 21 21.792 -4.226 13.267 1.00 0.29 H ATOM 375 HD3 ARG A 21 21.232 -3.718 14.848 1.00 0.24 H ATOM 376 HE ARG A 21 23.796 -3.151 13.599 1.00 1.15 H ATOM 377 HH11 ARG A 21 22.321 -3.855 16.632 1.00 2.03 H ATOM 378 HH12 ARG A 21 23.657 -3.254 17.557 1.00 2.68 H ATOM 379 HH21 ARG A 21 25.537 -2.382 14.779 1.00 0.85 H ATOM 380 HH22 ARG A 21 25.479 -2.423 16.510 1.00 1.56 H ATOM 381 N LYS A 22 22.078 -9.343 13.150 1.00 0.14 N ATOM 382 CA LYS A 22 23.062 -10.464 13.189 1.00 0.15 C ATOM 383 C LYS A 22 23.792 -10.530 11.844 1.00 0.15 C ATOM 384 O LYS A 22 25.000 -10.638 11.778 1.00 0.16 O ATOM 385 CB LYS A 22 22.286 -11.766 13.412 1.00 0.16 C ATOM 386 CG LYS A 22 23.238 -12.929 13.701 1.00 0.18 C ATOM 387 CD LYS A 22 22.420 -14.233 13.747 1.00 0.23 C ATOM 388 CE LYS A 22 23.137 -15.312 14.574 1.00 1.19 C ATOM 389 NZ LYS A 22 23.960 -16.168 13.674 1.00 1.97 N ATOM 390 H LYS A 22 21.127 -9.537 13.284 1.00 0.13 H ATOM 391 HA LYS A 22 23.768 -10.306 13.989 1.00 0.16 H ATOM 392 HB2 LYS A 22 21.615 -11.641 14.249 1.00 0.16 H ATOM 393 HB3 LYS A 22 21.710 -11.991 12.527 1.00 0.15 H ATOM 394 HG2 LYS A 22 23.981 -12.990 12.919 1.00 0.23 H ATOM 395 HG3 LYS A 22 23.721 -12.766 14.650 1.00 0.24 H ATOM 396 HD2 LYS A 22 21.456 -14.032 14.188 1.00 0.99 H ATOM 397 HD3 LYS A 22 22.279 -14.596 12.739 1.00 0.99 H ATOM 398 HE2 LYS A 22 23.773 -14.854 15.315 1.00 1.80 H ATOM 399 HE3 LYS A 22 22.399 -15.925 15.070 1.00 1.89 H ATOM 400 HZ1 LYS A 22 24.579 -16.776 14.247 1.00 2.44 H ATOM 401 HZ2 LYS A 22 24.540 -15.565 13.056 1.00 2.45 H ATOM 402 HZ3 LYS A 22 23.336 -16.763 13.094 1.00 2.43 H ATOM 403 N MET A 23 23.051 -10.464 10.776 1.00 0.14 N ATOM 404 CA MET A 23 23.663 -10.519 9.419 1.00 0.15 C ATOM 405 C MET A 23 24.496 -9.266 9.154 1.00 0.15 C ATOM 406 O MET A 23 25.489 -9.312 8.455 1.00 0.15 O ATOM 407 CB MET A 23 22.554 -10.612 8.371 1.00 0.14 C ATOM 408 CG MET A 23 23.164 -11.031 7.031 1.00 0.16 C ATOM 409 SD MET A 23 23.752 -12.741 7.146 1.00 0.97 S ATOM 410 CE MET A 23 22.538 -13.485 6.028 1.00 0.79 C ATOM 411 H MET A 23 22.079 -10.383 10.874 1.00 0.14 H ATOM 412 HA MET A 23 24.293 -11.390 9.328 1.00 0.15 H ATOM 413 HB2 MET A 23 21.824 -11.345 8.682 1.00 0.15 H ATOM 414 HB3 MET A 23 22.077 -9.649 8.262 1.00 0.14 H ATOM 415 HG2 MET A 23 22.417 -10.958 6.256 1.00 0.55 H ATOM 416 HG3 MET A 23 23.992 -10.380 6.794 1.00 0.55 H ATOM 417 HE1 MET A 23 22.817 -14.510 5.827 1.00 1.42 H ATOM 418 HE2 MET A 23 22.514 -12.933 5.103 1.00 1.45 H ATOM 419 HE3 MET A 23 21.561 -13.455 6.490 1.00 1.45 H ATOM 420 N ALA A 24 24.101 -8.141 9.685 1.00 0.14 N ATOM 421 CA ALA A 24 24.882 -6.899 9.427 1.00 0.15 C ATOM 422 C ALA A 24 26.227 -6.966 10.153 1.00 0.16 C ATOM 423 O ALA A 24 27.233 -6.518 9.643 1.00 0.17 O ATOM 424 CB ALA A 24 24.092 -5.677 9.900 1.00 0.15 C ATOM 425 H ALA A 24 23.296 -8.110 10.242 1.00 0.14 H ATOM 426 HA ALA A 24 25.063 -6.828 8.365 1.00 0.15 H ATOM 427 HB1 ALA A 24 23.395 -5.378 9.131 1.00 1.02 H ATOM 428 HB2 ALA A 24 24.774 -4.864 10.104 1.00 1.03 H ATOM 429 HB3 ALA A 24 23.550 -5.926 10.801 1.00 1.04 H ATOM 430 N LEU A 25 26.268 -7.528 11.330 1.00 0.17 N ATOM 431 CA LEU A 25 27.571 -7.613 12.046 1.00 0.19 C ATOM 432 C LEU A 25 28.458 -8.619 11.314 1.00 0.19 C ATOM 433 O LEU A 25 29.650 -8.426 11.172 1.00 0.20 O ATOM 434 CB LEU A 25 27.347 -8.067 13.490 1.00 0.19 C ATOM 435 CG LEU A 25 26.472 -7.045 14.225 1.00 0.18 C ATOM 436 CD1 LEU A 25 25.975 -7.662 15.536 1.00 0.21 C ATOM 437 CD2 LEU A 25 27.282 -5.763 14.525 1.00 0.22 C ATOM 438 H LEU A 25 25.454 -7.896 11.734 1.00 0.16 H ATOM 439 HA LEU A 25 28.045 -6.643 12.033 1.00 0.19 H ATOM 440 HB2 LEU A 25 26.856 -9.029 13.491 1.00 0.19 H ATOM 441 HB3 LEU A 25 28.300 -8.149 13.992 1.00 0.20 H ATOM 442 HG LEU A 25 25.622 -6.796 13.606 1.00 0.19 H ATOM 443 HD11 LEU A 25 25.085 -8.243 15.345 1.00 1.03 H ATOM 444 HD12 LEU A 25 25.747 -6.876 16.240 1.00 1.06 H ATOM 445 HD13 LEU A 25 26.742 -8.302 15.947 1.00 1.04 H ATOM 446 HD21 LEU A 25 26.804 -4.920 14.048 1.00 1.02 H ATOM 447 HD22 LEU A 25 28.288 -5.863 14.144 1.00 1.05 H ATOM 448 HD23 LEU A 25 27.324 -5.591 15.592 1.00 1.04 H ATOM 449 N GLU A 26 27.878 -9.677 10.818 1.00 0.19 N ATOM 450 CA GLU A 26 28.679 -10.677 10.061 1.00 0.20 C ATOM 451 C GLU A 26 28.842 -10.175 8.626 1.00 0.19 C ATOM 452 O GLU A 26 29.826 -10.442 7.966 1.00 0.20 O ATOM 453 CB GLU A 26 27.959 -12.028 10.059 1.00 0.20 C ATOM 454 CG GLU A 26 27.857 -12.552 11.492 1.00 0.22 C ATOM 455 CD GLU A 26 27.368 -14.000 11.476 1.00 1.20 C ATOM 456 OE1 GLU A 26 27.082 -14.494 10.399 1.00 1.90 O ATOM 457 OE2 GLU A 26 27.291 -14.592 12.540 1.00 1.42 O ATOM 458 H GLU A 26 26.911 -9.800 10.922 1.00 0.18 H ATOM 459 HA GLU A 26 29.652 -10.793 10.520 1.00 0.21 H ATOM 460 HB2 GLU A 26 26.968 -11.907 9.646 1.00 0.20 H ATOM 461 HB3 GLU A 26 28.516 -12.732 9.460 1.00 0.21 H ATOM 462 HG2 GLU A 26 28.828 -12.503 11.962 1.00 0.85 H ATOM 463 HG3 GLU A 26 27.157 -11.946 12.047 1.00 0.91 H ATOM 464 N ASN A 27 27.881 -9.423 8.154 1.00 0.18 N ATOM 465 CA ASN A 27 27.962 -8.860 6.773 1.00 0.18 C ATOM 466 C ASN A 27 27.680 -7.355 6.843 1.00 0.17 C ATOM 467 O ASN A 27 26.677 -6.882 6.344 1.00 0.17 O ATOM 468 CB ASN A 27 26.916 -9.530 5.877 1.00 0.18 C ATOM 469 CG ASN A 27 26.967 -11.048 6.062 1.00 0.23 C ATOM 470 OD1 ASN A 27 27.830 -11.561 6.745 1.00 0.68 O ATOM 471 ND2 ASN A 27 26.071 -11.794 5.474 1.00 0.54 N ATOM 472 H ASN A 27 27.114 -9.206 8.727 1.00 0.17 H ATOM 473 HA ASN A 27 28.950 -9.027 6.370 1.00 0.19 H ATOM 474 HB2 ASN A 27 25.933 -9.169 6.141 1.00 0.18 H ATOM 475 HB3 ASN A 27 27.122 -9.289 4.845 1.00 0.19 H ATOM 476 HD21 ASN A 27 25.376 -11.379 4.921 1.00 0.96 H ATOM 477 HD22 ASN A 27 26.093 -12.767 5.585 1.00 0.53 H ATOM 478 N PRO A 28 28.549 -6.613 7.476 1.00 0.19 N ATOM 479 CA PRO A 28 28.385 -5.138 7.640 1.00 0.19 C ATOM 480 C PRO A 28 28.612 -4.349 6.345 1.00 0.19 C ATOM 481 O PRO A 28 28.377 -3.158 6.300 1.00 0.19 O ATOM 482 CB PRO A 28 29.431 -4.766 8.694 1.00 0.20 C ATOM 483 CG PRO A 28 30.478 -5.829 8.610 1.00 0.33 C ATOM 484 CD PRO A 28 29.786 -7.099 8.108 1.00 0.23 C ATOM 485 HA PRO A 28 27.402 -4.920 8.018 1.00 0.18 H ATOM 486 HB2 PRO A 28 29.859 -3.797 8.474 1.00 0.32 H ATOM 487 HB3 PRO A 28 28.987 -4.765 9.677 1.00 0.32 H ATOM 488 HG2 PRO A 28 31.253 -5.528 7.917 1.00 0.64 H ATOM 489 HG3 PRO A 28 30.902 -6.009 9.585 1.00 0.62 H ATOM 490 HD2 PRO A 28 30.411 -7.606 7.386 1.00 0.40 H ATOM 491 HD3 PRO A 28 29.551 -7.753 8.934 1.00 0.39 H ATOM 492 N ARG A 29 29.043 -4.988 5.288 1.00 0.19 N ATOM 493 CA ARG A 29 29.251 -4.248 4.007 1.00 0.20 C ATOM 494 C ARG A 29 28.191 -4.690 3.001 1.00 0.18 C ATOM 495 O ARG A 29 28.115 -4.183 1.899 1.00 0.18 O ATOM 496 CB ARG A 29 30.658 -4.525 3.469 1.00 0.22 C ATOM 497 CG ARG A 29 31.668 -4.366 4.619 1.00 0.27 C ATOM 498 CD ARG A 29 33.039 -3.889 4.113 1.00 1.05 C ATOM 499 NE ARG A 29 34.046 -4.929 4.486 1.00 1.72 N ATOM 500 CZ ARG A 29 35.317 -4.724 4.302 1.00 2.40 C ATOM 501 NH1 ARG A 29 35.741 -3.542 3.948 1.00 2.71 N ATOM 502 NH2 ARG A 29 36.170 -5.689 4.512 1.00 3.35 N ATOM 503 H ARG A 29 29.205 -5.955 5.318 1.00 0.19 H ATOM 504 HA ARG A 29 29.133 -3.185 4.165 1.00 0.20 H ATOM 505 HB2 ARG A 29 30.703 -5.533 3.080 1.00 0.23 H ATOM 506 HB3 ARG A 29 30.881 -3.822 2.683 1.00 0.23 H ATOM 507 HG2 ARG A 29 31.287 -3.647 5.332 1.00 0.84 H ATOM 508 HG3 ARG A 29 31.788 -5.318 5.113 1.00 0.77 H ATOM 509 HD2 ARG A 29 33.044 -3.783 3.052 1.00 1.66 H ATOM 510 HD3 ARG A 29 33.269 -2.922 4.559 1.00 1.63 H ATOM 511 HE ARG A 29 33.741 -5.796 4.822 1.00 2.27 H ATOM 512 HH11 ARG A 29 35.089 -2.794 3.818 1.00 2.48 H ATOM 513 HH12 ARG A 29 36.718 -3.382 3.816 1.00 3.55 H ATOM 514 HH21 ARG A 29 35.847 -6.586 4.811 1.00 3.66 H ATOM 515 HH22 ARG A 29 37.149 -5.530 4.375 1.00 4.00 H ATOM 516 N MET A 30 27.348 -5.609 3.383 1.00 0.16 N ATOM 517 CA MET A 30 26.269 -6.054 2.462 1.00 0.15 C ATOM 518 C MET A 30 25.131 -5.031 2.545 1.00 0.14 C ATOM 519 O MET A 30 24.789 -4.559 3.611 1.00 0.13 O ATOM 520 CB MET A 30 25.772 -7.439 2.884 1.00 0.15 C ATOM 521 CG MET A 30 24.754 -7.956 1.866 1.00 0.15 C ATOM 522 SD MET A 30 25.623 -8.620 0.425 1.00 0.20 S ATOM 523 CE MET A 30 25.324 -10.369 0.778 1.00 0.22 C ATOM 524 H MET A 30 27.412 -5.992 4.283 1.00 0.16 H ATOM 525 HA MET A 30 26.648 -6.097 1.450 1.00 0.16 H ATOM 526 HB2 MET A 30 26.609 -8.120 2.932 1.00 0.17 H ATOM 527 HB3 MET A 30 25.308 -7.375 3.853 1.00 0.15 H ATOM 528 HG2 MET A 30 24.162 -8.739 2.318 1.00 0.15 H ATOM 529 HG3 MET A 30 24.108 -7.148 1.558 1.00 0.16 H ATOM 530 HE1 MET A 30 25.699 -10.971 -0.037 1.00 1.04 H ATOM 531 HE2 MET A 30 24.265 -10.537 0.891 1.00 1.05 H ATOM 532 HE3 MET A 30 25.828 -10.639 1.697 1.00 1.04 H ATOM 533 N ARG A 31 24.555 -4.671 1.436 1.00 0.13 N ATOM 534 CA ARG A 31 23.455 -3.662 1.463 1.00 0.12 C ATOM 535 C ARG A 31 22.173 -4.324 1.974 1.00 0.11 C ATOM 536 O ARG A 31 21.941 -5.495 1.749 1.00 0.11 O ATOM 537 CB ARG A 31 23.260 -3.118 0.046 1.00 0.13 C ATOM 538 CG ARG A 31 24.602 -2.559 -0.434 1.00 0.19 C ATOM 539 CD ARG A 31 24.469 -1.921 -1.819 1.00 0.19 C ATOM 540 NE ARG A 31 25.836 -1.827 -2.412 1.00 0.39 N ATOM 541 CZ ARG A 31 26.003 -1.437 -3.644 1.00 0.97 C ATOM 542 NH1 ARG A 31 24.984 -1.016 -4.340 1.00 2.02 N ATOM 543 NH2 ARG A 31 27.197 -1.448 -4.173 1.00 1.02 N ATOM 544 H ARG A 31 24.844 -5.061 0.583 1.00 0.13 H ATOM 545 HA ARG A 31 23.737 -2.850 2.123 1.00 0.13 H ATOM 546 HB2 ARG A 31 22.937 -3.914 -0.610 1.00 0.14 H ATOM 547 HB3 ARG A 31 22.523 -2.329 0.055 1.00 0.14 H ATOM 548 HG2 ARG A 31 24.948 -1.814 0.267 1.00 0.21 H ATOM 549 HG3 ARG A 31 25.323 -3.362 -0.482 1.00 0.22 H ATOM 550 HD2 ARG A 31 23.850 -2.533 -2.448 1.00 0.19 H ATOM 551 HD3 ARG A 31 24.025 -0.936 -1.728 1.00 0.24 H ATOM 552 HE ARG A 31 26.614 -2.096 -1.879 1.00 1.11 H ATOM 553 HH11 ARG A 31 24.073 -0.991 -3.929 1.00 2.09 H ATOM 554 HH12 ARG A 31 25.115 -0.714 -5.284 1.00 2.81 H ATOM 555 HH21 ARG A 31 27.980 -1.755 -3.631 1.00 0.80 H ATOM 556 HH22 ARG A 31 27.329 -1.149 -5.118 1.00 1.72 H ATOM 557 N ASN A 32 21.330 -3.592 2.653 1.00 0.11 N ATOM 558 CA ASN A 32 20.071 -4.213 3.153 1.00 0.10 C ATOM 559 C ASN A 32 19.290 -4.786 1.982 1.00 0.10 C ATOM 560 O ASN A 32 18.528 -5.719 2.143 1.00 0.10 O ATOM 561 CB ASN A 32 19.180 -3.195 3.871 1.00 0.11 C ATOM 562 CG ASN A 32 19.707 -2.949 5.282 1.00 0.11 C ATOM 563 OD1 ASN A 32 20.900 -2.854 5.494 1.00 0.12 O ATOM 564 ND2 ASN A 32 18.857 -2.862 6.269 1.00 0.12 N ATOM 565 H ASN A 32 21.518 -2.642 2.812 1.00 0.11 H ATOM 566 HA ASN A 32 20.312 -5.014 3.837 1.00 0.10 H ATOM 567 HB2 ASN A 32 19.163 -2.270 3.321 1.00 0.12 H ATOM 568 HB3 ASN A 32 18.176 -3.586 3.934 1.00 0.11 H ATOM 569 HD21 ASN A 32 17.896 -2.954 6.097 1.00 0.12 H ATOM 570 HD22 ASN A 32 19.178 -2.704 7.181 1.00 0.13 H ATOM 571 N SER A 33 19.443 -4.247 0.801 1.00 0.11 N ATOM 572 CA SER A 33 18.675 -4.788 -0.343 1.00 0.12 C ATOM 573 C SER A 33 19.046 -6.252 -0.572 1.00 0.11 C ATOM 574 O SER A 33 18.199 -7.082 -0.852 1.00 0.12 O ATOM 575 CB SER A 33 18.993 -3.971 -1.597 1.00 0.13 C ATOM 576 OG SER A 33 18.984 -2.588 -1.268 1.00 0.13 O ATOM 577 H SER A 33 20.049 -3.495 0.633 1.00 0.11 H ATOM 578 HA SER A 33 17.631 -4.711 -0.129 1.00 0.12 H ATOM 579 HB2 SER A 33 19.966 -4.241 -1.971 1.00 0.13 H ATOM 580 HB3 SER A 33 18.248 -4.172 -2.357 1.00 0.14 H ATOM 581 HG SER A 33 18.098 -2.357 -0.979 1.00 0.19 H ATOM 582 N GLU A 34 20.300 -6.595 -0.443 1.00 0.11 N ATOM 583 CA GLU A 34 20.684 -8.011 -0.658 1.00 0.12 C ATOM 584 C GLU A 34 20.426 -8.804 0.620 1.00 0.11 C ATOM 585 O GLU A 34 19.940 -9.917 0.571 1.00 0.11 O ATOM 586 CB GLU A 34 22.158 -8.105 -1.055 1.00 0.13 C ATOM 587 CG GLU A 34 22.362 -7.401 -2.398 1.00 0.16 C ATOM 588 CD GLU A 34 23.778 -7.668 -2.911 1.00 1.16 C ATOM 589 OE1 GLU A 34 24.536 -8.298 -2.194 1.00 1.87 O ATOM 590 OE2 GLU A 34 24.079 -7.240 -4.014 1.00 1.37 O ATOM 591 H GLU A 34 20.976 -5.930 -0.202 1.00 0.11 H ATOM 592 HA GLU A 34 20.073 -8.414 -1.454 1.00 0.12 H ATOM 593 HB2 GLU A 34 22.766 -7.629 -0.299 1.00 0.14 H ATOM 594 HB3 GLU A 34 22.442 -9.142 -1.147 1.00 0.14 H ATOM 595 HG2 GLU A 34 21.643 -7.774 -3.112 1.00 0.86 H ATOM 596 HG3 GLU A 34 22.224 -6.338 -2.271 1.00 0.91 H ATOM 597 N ILE A 35 20.725 -8.257 1.773 1.00 0.11 N ATOM 598 CA ILE A 35 20.458 -9.028 3.016 1.00 0.11 C ATOM 599 C ILE A 35 18.967 -9.323 3.081 1.00 0.10 C ATOM 600 O ILE A 35 18.556 -10.429 3.370 1.00 0.11 O ATOM 601 CB ILE A 35 20.853 -8.223 4.256 1.00 0.11 C ATOM 602 CG1 ILE A 35 22.368 -7.994 4.268 1.00 0.13 C ATOM 603 CG2 ILE A 35 20.415 -8.993 5.506 1.00 0.12 C ATOM 604 CD1 ILE A 35 22.755 -7.155 5.489 1.00 0.14 C ATOM 605 H ILE A 35 21.120 -7.362 1.829 1.00 0.11 H ATOM 606 HA ILE A 35 21.005 -9.959 2.981 1.00 0.11 H ATOM 607 HB ILE A 35 20.345 -7.269 4.233 1.00 0.11 H ATOM 608 HG12 ILE A 35 22.878 -8.945 4.305 1.00 0.15 H ATOM 609 HG13 ILE A 35 22.652 -7.465 3.372 1.00 0.15 H ATOM 610 HG21 ILE A 35 19.372 -8.791 5.699 1.00 1.03 H ATOM 611 HG22 ILE A 35 21.001 -8.685 6.357 1.00 1.03 H ATOM 612 HG23 ILE A 35 20.548 -10.051 5.342 1.00 1.01 H ATOM 613 HD11 ILE A 35 22.538 -7.711 6.389 1.00 1.03 H ATOM 614 HD12 ILE A 35 22.189 -6.236 5.489 1.00 1.03 H ATOM 615 HD13 ILE A 35 23.808 -6.928 5.453 1.00 1.02 H ATOM 616 N SER A 36 18.147 -8.346 2.813 1.00 0.10 N ATOM 617 CA SER A 36 16.685 -8.578 2.860 1.00 0.10 C ATOM 618 C SER A 36 16.333 -9.768 1.972 1.00 0.11 C ATOM 619 O SER A 36 15.471 -10.555 2.295 1.00 0.11 O ATOM 620 CB SER A 36 15.966 -7.333 2.341 1.00 0.11 C ATOM 621 OG SER A 36 16.384 -6.203 3.096 1.00 0.11 O ATOM 622 H SER A 36 18.476 -7.451 2.589 1.00 0.10 H ATOM 623 HA SER A 36 16.376 -8.766 3.874 1.00 0.10 H ATOM 624 HB2 SER A 36 16.213 -7.177 1.304 1.00 0.12 H ATOM 625 HB3 SER A 36 14.897 -7.469 2.438 1.00 0.11 H ATOM 626 HG SER A 36 16.235 -5.418 2.563 1.00 0.79 H ATOM 627 N LYS A 37 17.030 -9.930 0.878 1.00 0.12 N ATOM 628 CA LYS A 37 16.762 -11.096 -0.014 1.00 0.13 C ATOM 629 C LYS A 37 17.243 -12.407 0.617 1.00 0.14 C ATOM 630 O LYS A 37 16.557 -13.407 0.550 1.00 0.15 O ATOM 631 CB LYS A 37 17.459 -10.895 -1.356 1.00 0.15 C ATOM 632 CG LYS A 37 16.763 -9.770 -2.119 1.00 0.31 C ATOM 633 CD LYS A 37 17.314 -9.697 -3.545 1.00 0.21 C ATOM 634 CE LYS A 37 17.296 -8.262 -4.050 1.00 1.09 C ATOM 635 NZ LYS A 37 17.852 -8.225 -5.433 1.00 1.86 N ATOM 636 H LYS A 37 17.778 -9.323 0.671 1.00 0.12 H ATOM 637 HA LYS A 37 15.701 -11.201 -0.182 1.00 0.14 H ATOM 638 HB2 LYS A 37 18.494 -10.632 -1.189 1.00 0.31 H ATOM 639 HB3 LYS A 37 17.405 -11.806 -1.931 1.00 0.23 H ATOM 640 HG2 LYS A 37 15.706 -9.981 -2.157 1.00 0.56 H ATOM 641 HG3 LYS A 37 16.927 -8.832 -1.614 1.00 0.57 H ATOM 642 HD2 LYS A 37 18.323 -10.064 -3.564 1.00 1.00 H ATOM 643 HD3 LYS A 37 16.697 -10.297 -4.189 1.00 0.96 H ATOM 644 HE2 LYS A 37 16.282 -7.906 -4.059 1.00 1.61 H ATOM 645 HE3 LYS A 37 17.896 -7.643 -3.402 1.00 1.69 H ATOM 646 HZ1 LYS A 37 18.483 -7.405 -5.533 1.00 2.27 H ATOM 647 HZ2 LYS A 37 17.072 -8.150 -6.118 1.00 2.33 H ATOM 648 HZ3 LYS A 37 18.389 -9.097 -5.614 1.00 2.37 H ATOM 649 N GLN A 38 18.403 -12.441 1.216 1.00 0.14 N ATOM 650 CA GLN A 38 18.866 -13.727 1.812 1.00 0.15 C ATOM 651 C GLN A 38 18.024 -14.055 3.043 1.00 0.15 C ATOM 652 O GLN A 38 17.674 -15.195 3.276 1.00 0.16 O ATOM 653 CB GLN A 38 20.344 -13.625 2.190 1.00 0.16 C ATOM 654 CG GLN A 38 21.157 -13.333 0.928 1.00 0.19 C ATOM 655 CD GLN A 38 22.622 -13.703 1.155 1.00 1.22 C ATOM 656 OE1 GLN A 38 23.018 -14.015 2.259 1.00 2.10 O ATOM 657 NE2 GLN A 38 23.448 -13.685 0.145 1.00 1.92 N ATOM 658 H GLN A 38 18.972 -11.646 1.277 1.00 0.14 H ATOM 659 HA GLN A 38 18.742 -14.519 1.083 1.00 0.16 H ATOM 660 HB2 GLN A 38 20.481 -12.825 2.904 1.00 0.15 H ATOM 661 HB3 GLN A 38 20.673 -14.557 2.622 1.00 0.18 H ATOM 662 HG2 GLN A 38 20.763 -13.911 0.105 1.00 0.97 H ATOM 663 HG3 GLN A 38 21.087 -12.281 0.694 1.00 0.93 H ATOM 664 HE21 GLN A 38 23.125 -13.435 -0.746 1.00 2.15 H ATOM 665 HE22 GLN A 38 24.389 -13.924 0.275 1.00 2.63 H ATOM 666 N LEU A 39 17.678 -13.072 3.827 1.00 0.14 N ATOM 667 CA LEU A 39 16.843 -13.356 5.024 1.00 0.14 C ATOM 668 C LEU A 39 15.523 -13.963 4.564 1.00 0.15 C ATOM 669 O LEU A 39 15.032 -14.911 5.145 1.00 0.16 O ATOM 670 CB LEU A 39 16.567 -12.060 5.785 1.00 0.13 C ATOM 671 CG LEU A 39 17.876 -11.490 6.334 1.00 0.12 C ATOM 672 CD1 LEU A 39 17.580 -10.190 7.083 1.00 0.14 C ATOM 673 CD2 LEU A 39 18.519 -12.501 7.296 1.00 0.15 C ATOM 674 H LEU A 39 17.960 -12.152 3.633 1.00 0.13 H ATOM 675 HA LEU A 39 17.346 -14.059 5.672 1.00 0.15 H ATOM 676 HB2 LEU A 39 16.114 -11.341 5.118 1.00 0.13 H ATOM 677 HB3 LEU A 39 15.896 -12.261 6.605 1.00 0.14 H ATOM 678 HG LEU A 39 18.552 -11.287 5.515 1.00 0.14 H ATOM 679 HD11 LEU A 39 17.184 -9.459 6.394 1.00 1.03 H ATOM 680 HD12 LEU A 39 18.490 -9.816 7.521 1.00 1.02 H ATOM 681 HD13 LEU A 39 16.857 -10.379 7.862 1.00 1.03 H ATOM 682 HD21 LEU A 39 19.200 -13.134 6.748 1.00 1.03 H ATOM 683 HD22 LEU A 39 17.751 -13.110 7.751 1.00 1.03 H ATOM 684 HD23 LEU A 39 19.061 -11.974 8.068 1.00 1.03 H ATOM 685 N GLY A 40 14.944 -13.441 3.518 1.00 0.14 N ATOM 686 CA GLY A 40 13.665 -14.016 3.031 1.00 0.15 C ATOM 687 C GLY A 40 13.910 -15.453 2.586 1.00 0.16 C ATOM 688 O GLY A 40 13.111 -16.335 2.830 1.00 0.17 O ATOM 689 H GLY A 40 15.346 -12.679 3.049 1.00 0.14 H ATOM 690 HA2 GLY A 40 12.941 -14.005 3.831 1.00 0.16 H ATOM 691 HA3 GLY A 40 13.298 -13.438 2.197 1.00 0.16 H ATOM 692 N TYR A 41 15.025 -15.703 1.954 1.00 0.16 N ATOM 693 CA TYR A 41 15.345 -17.085 1.514 1.00 0.18 C ATOM 694 C TYR A 41 15.536 -17.965 2.749 1.00 0.18 C ATOM 695 O TYR A 41 15.022 -19.063 2.829 1.00 0.19 O ATOM 696 CB TYR A 41 16.638 -17.041 0.696 1.00 0.18 C ATOM 697 CG TYR A 41 16.997 -18.421 0.206 1.00 0.21 C ATOM 698 CD1 TYR A 41 16.360 -18.954 -0.920 1.00 0.26 C ATOM 699 CD2 TYR A 41 17.981 -19.160 0.870 1.00 0.25 C ATOM 700 CE1 TYR A 41 16.707 -20.229 -1.381 1.00 0.31 C ATOM 701 CE2 TYR A 41 18.327 -20.435 0.411 1.00 0.31 C ATOM 702 CZ TYR A 41 17.690 -20.970 -0.715 1.00 0.32 C ATOM 703 OH TYR A 41 18.034 -22.227 -1.170 1.00 0.40 O ATOM 704 H TYR A 41 15.678 -14.994 1.780 1.00 0.16 H ATOM 705 HA TYR A 41 14.544 -17.482 0.907 1.00 0.18 H ATOM 706 HB2 TYR A 41 16.503 -16.385 -0.151 1.00 0.20 H ATOM 707 HB3 TYR A 41 17.439 -16.662 1.315 1.00 0.18 H ATOM 708 HD1 TYR A 41 15.600 -18.382 -1.433 1.00 0.30 H ATOM 709 HD2 TYR A 41 18.472 -18.747 1.738 1.00 0.28 H ATOM 710 HE1 TYR A 41 16.216 -20.641 -2.250 1.00 0.38 H ATOM 711 HE2 TYR A 41 19.086 -21.003 0.925 1.00 0.37 H ATOM 712 HH TYR A 41 17.728 -22.869 -0.525 1.00 0.99 H ATOM 713 N GLN A 42 16.263 -17.483 3.721 1.00 0.18 N ATOM 714 CA GLN A 42 16.477 -18.278 4.962 1.00 0.18 C ATOM 715 C GLN A 42 15.163 -18.384 5.739 1.00 0.18 C ATOM 716 O GLN A 42 14.833 -19.420 6.280 1.00 0.19 O ATOM 717 CB GLN A 42 17.521 -17.578 5.836 1.00 0.18 C ATOM 718 CG GLN A 42 18.880 -17.591 5.132 1.00 0.21 C ATOM 719 CD GLN A 42 19.444 -19.014 5.139 1.00 0.82 C ATOM 720 OE1 GLN A 42 19.163 -19.786 6.034 1.00 1.68 O ATOM 721 NE2 GLN A 42 20.242 -19.392 4.177 1.00 1.42 N ATOM 722 H GLN A 42 16.658 -16.589 3.646 1.00 0.17 H ATOM 723 HA GLN A 42 16.828 -19.266 4.706 1.00 0.19 H ATOM 724 HB2 GLN A 42 17.217 -16.557 6.011 1.00 0.18 H ATOM 725 HB3 GLN A 42 17.603 -18.095 6.780 1.00 0.20 H ATOM 726 HG2 GLN A 42 18.759 -17.256 4.112 1.00 0.73 H ATOM 727 HG3 GLN A 42 19.561 -16.933 5.650 1.00 0.66 H ATOM 728 HE21 GLN A 42 20.474 -18.767 3.459 1.00 1.91 H ATOM 729 HE22 GLN A 42 20.610 -20.300 4.175 1.00 1.83 H ATOM 730 N TRP A 43 14.416 -17.313 5.809 1.00 0.17 N ATOM 731 CA TRP A 43 13.128 -17.332 6.560 1.00 0.17 C ATOM 732 C TRP A 43 12.183 -18.380 5.971 1.00 0.18 C ATOM 733 O TRP A 43 11.454 -19.039 6.686 1.00 0.19 O ATOM 734 CB TRP A 43 12.499 -15.938 6.466 1.00 0.16 C ATOM 735 CG TRP A 43 11.134 -15.928 7.071 1.00 0.18 C ATOM 736 CD1 TRP A 43 9.974 -15.887 6.371 1.00 0.20 C ATOM 737 CD2 TRP A 43 10.763 -15.935 8.479 1.00 0.18 C ATOM 738 NE1 TRP A 43 8.917 -15.871 7.262 1.00 0.22 N ATOM 739 CE2 TRP A 43 9.352 -15.900 8.573 1.00 0.21 C ATOM 740 CE3 TRP A 43 11.506 -15.969 9.672 1.00 0.17 C ATOM 741 CZ2 TRP A 43 8.701 -15.898 9.806 1.00 0.23 C ATOM 742 CZ3 TRP A 43 10.854 -15.968 10.916 1.00 0.20 C ATOM 743 CH2 TRP A 43 9.454 -15.932 10.983 1.00 0.22 C ATOM 744 H TRP A 43 14.694 -16.479 5.377 1.00 0.16 H ATOM 745 HA TRP A 43 13.326 -17.584 7.590 1.00 0.17 H ATOM 746 HB2 TRP A 43 13.124 -15.230 6.989 1.00 0.15 H ATOM 747 HB3 TRP A 43 12.431 -15.649 5.427 1.00 0.17 H ATOM 748 HD1 TRP A 43 9.886 -15.869 5.290 1.00 0.21 H ATOM 749 HE1 TRP A 43 7.971 -15.839 7.015 1.00 0.24 H ATOM 750 HE3 TRP A 43 12.585 -15.996 9.632 1.00 0.16 H ATOM 751 HZ2 TRP A 43 7.623 -15.869 9.851 1.00 0.25 H ATOM 752 HZ3 TRP A 43 11.434 -15.994 11.827 1.00 0.20 H ATOM 753 HH2 TRP A 43 8.958 -15.931 11.942 1.00 0.25 H ATOM 754 N LYS A 44 12.185 -18.544 4.682 1.00 0.19 N ATOM 755 CA LYS A 44 11.280 -19.554 4.069 1.00 0.20 C ATOM 756 C LYS A 44 11.756 -20.972 4.402 1.00 0.21 C ATOM 757 O LYS A 44 11.052 -21.935 4.172 1.00 0.22 O ATOM 758 CB LYS A 44 11.251 -19.373 2.552 1.00 0.21 C ATOM 759 CG LYS A 44 10.411 -18.146 2.198 1.00 0.21 C ATOM 760 CD LYS A 44 10.269 -18.054 0.679 1.00 0.28 C ATOM 761 CE LYS A 44 9.222 -17.000 0.323 1.00 1.27 C ATOM 762 NZ LYS A 44 9.256 -16.742 -1.145 1.00 1.94 N ATOM 763 H LYS A 44 12.781 -18.008 4.118 1.00 0.18 H ATOM 764 HA LYS A 44 10.283 -19.414 4.461 1.00 0.20 H ATOM 765 HB2 LYS A 44 12.259 -19.239 2.186 1.00 0.20 H ATOM 766 HB3 LYS A 44 10.815 -20.248 2.094 1.00 0.22 H ATOM 767 HG2 LYS A 44 9.433 -18.236 2.649 1.00 0.24 H ATOM 768 HG3 LYS A 44 10.899 -17.256 2.567 1.00 0.21 H ATOM 769 HD2 LYS A 44 11.220 -17.777 0.249 1.00 0.98 H ATOM 770 HD3 LYS A 44 9.962 -19.012 0.288 1.00 1.13 H ATOM 771 HE2 LYS A 44 8.242 -17.359 0.602 1.00 1.97 H ATOM 772 HE3 LYS A 44 9.434 -16.087 0.856 1.00 1.93 H ATOM 773 HZ1 LYS A 44 9.088 -15.733 -1.325 1.00 2.35 H ATOM 774 HZ2 LYS A 44 8.517 -17.307 -1.612 1.00 2.39 H ATOM 775 HZ3 LYS A 44 10.187 -17.009 -1.522 1.00 2.42 H ATOM 776 N MET A 45 12.953 -21.125 4.907 1.00 0.20 N ATOM 777 CA MET A 45 13.459 -22.498 5.204 1.00 0.21 C ATOM 778 C MET A 45 13.209 -22.873 6.670 1.00 0.22 C ATOM 779 O MET A 45 13.427 -24.001 7.065 1.00 0.23 O ATOM 780 CB MET A 45 14.963 -22.551 4.926 1.00 0.22 C ATOM 781 CG MET A 45 15.235 -22.159 3.472 1.00 0.23 C ATOM 782 SD MET A 45 15.132 -23.629 2.422 1.00 1.31 S ATOM 783 CE MET A 45 15.230 -22.777 0.829 1.00 2.17 C ATOM 784 H MET A 45 13.533 -20.350 5.059 1.00 0.19 H ATOM 785 HA MET A 45 12.954 -23.207 4.566 1.00 0.22 H ATOM 786 HB2 MET A 45 15.474 -21.864 5.586 1.00 0.21 H ATOM 787 HB3 MET A 45 15.326 -23.553 5.100 1.00 0.23 H ATOM 788 HG2 MET A 45 14.501 -21.434 3.149 1.00 0.80 H ATOM 789 HG3 MET A 45 16.223 -21.729 3.394 1.00 0.74 H ATOM 790 HE1 MET A 45 15.475 -23.490 0.054 1.00 2.62 H ATOM 791 HE2 MET A 45 15.996 -22.019 0.872 1.00 2.63 H ATOM 792 HE3 MET A 45 14.279 -22.312 0.611 1.00 2.61 H ATOM 793 N LEU A 46 12.755 -21.961 7.486 1.00 0.21 N ATOM 794 CA LEU A 46 12.508 -22.321 8.913 1.00 0.22 C ATOM 795 C LEU A 46 11.254 -23.201 8.988 1.00 0.23 C ATOM 796 O LEU A 46 10.362 -23.090 8.170 1.00 0.23 O ATOM 797 CB LEU A 46 12.287 -21.052 9.744 1.00 0.21 C ATOM 798 CG LEU A 46 13.476 -20.099 9.580 1.00 0.21 C ATOM 799 CD1 LEU A 46 13.172 -18.775 10.289 1.00 0.22 C ATOM 800 CD2 LEU A 46 14.726 -20.725 10.204 1.00 0.22 C ATOM 801 H LEU A 46 12.580 -21.050 7.169 1.00 0.21 H ATOM 802 HA LEU A 46 13.362 -22.863 9.292 1.00 0.22 H ATOM 803 HB2 LEU A 46 11.387 -20.560 9.412 1.00 0.21 H ATOM 804 HB3 LEU A 46 12.186 -21.319 10.785 1.00 0.22 H ATOM 805 HG LEU A 46 13.648 -19.915 8.529 1.00 0.22 H ATOM 806 HD11 LEU A 46 13.452 -18.848 11.330 1.00 1.03 H ATOM 807 HD12 LEU A 46 12.116 -18.560 10.217 1.00 1.04 H ATOM 808 HD13 LEU A 46 13.732 -17.979 9.821 1.00 1.02 H ATOM 809 HD21 LEU A 46 15.165 -21.425 9.510 1.00 1.05 H ATOM 810 HD22 LEU A 46 14.455 -21.240 11.113 1.00 1.04 H ATOM 811 HD23 LEU A 46 15.441 -19.946 10.432 1.00 1.05 H ATOM 812 N THR A 47 11.171 -24.072 9.958 1.00 0.24 N ATOM 813 CA THR A 47 9.964 -24.944 10.066 1.00 0.26 C ATOM 814 C THR A 47 8.885 -24.202 10.855 1.00 0.26 C ATOM 815 O THR A 47 9.141 -23.177 11.454 1.00 0.25 O ATOM 816 CB THR A 47 10.323 -26.253 10.781 1.00 0.27 C ATOM 817 OG1 THR A 47 10.641 -25.975 12.137 1.00 0.28 O ATOM 818 CG2 THR A 47 11.526 -26.919 10.098 1.00 0.30 C ATOM 819 H THR A 47 11.896 -24.146 10.613 1.00 0.24 H ATOM 820 HA THR A 47 9.591 -25.158 9.075 1.00 0.26 H ATOM 821 HB THR A 47 9.478 -26.923 10.743 1.00 0.29 H ATOM 822 HG1 THR A 47 9.934 -26.325 12.685 1.00 0.90 H ATOM 823 HG21 THR A 47 12.184 -27.327 10.850 1.00 1.05 H ATOM 824 HG22 THR A 47 12.065 -26.192 9.508 1.00 1.07 H ATOM 825 HG23 THR A 47 11.180 -27.716 9.456 1.00 1.07 H ATOM 826 N GLU A 48 7.678 -24.702 10.864 1.00 0.27 N ATOM 827 CA GLU A 48 6.596 -24.008 11.617 1.00 0.27 C ATOM 828 C GLU A 48 6.891 -24.068 13.113 1.00 0.28 C ATOM 829 O GLU A 48 6.655 -23.122 13.839 1.00 0.27 O ATOM 830 CB GLU A 48 5.253 -24.685 11.335 1.00 0.29 C ATOM 831 CG GLU A 48 4.132 -23.880 11.999 1.00 0.30 C ATOM 832 CD GLU A 48 2.795 -24.593 11.791 1.00 1.23 C ATOM 833 OE1 GLU A 48 2.797 -25.646 11.175 1.00 1.87 O ATOM 834 OE2 GLU A 48 1.792 -24.074 12.253 1.00 1.48 O ATOM 835 H GLU A 48 7.478 -25.533 10.392 1.00 0.28 H ATOM 836 HA GLU A 48 6.548 -22.977 11.300 1.00 0.27 H ATOM 837 HB2 GLU A 48 5.086 -24.725 10.268 1.00 0.29 H ATOM 838 HB3 GLU A 48 5.261 -25.686 11.738 1.00 0.30 H ATOM 839 HG2 GLU A 48 4.333 -23.791 13.057 1.00 0.89 H ATOM 840 HG3 GLU A 48 4.086 -22.896 11.557 1.00 0.90 H ATOM 841 N ALA A 49 7.413 -25.168 13.584 1.00 0.29 N ATOM 842 CA ALA A 49 7.726 -25.269 15.033 1.00 0.30 C ATOM 843 C ALA A 49 8.776 -24.215 15.373 1.00 0.28 C ATOM 844 O ALA A 49 8.678 -23.522 16.365 1.00 0.27 O ATOM 845 CB ALA A 49 8.268 -26.668 15.345 1.00 0.33 C ATOM 846 H ALA A 49 7.606 -25.920 12.986 1.00 0.30 H ATOM 847 HA ALA A 49 6.833 -25.087 15.611 1.00 0.31 H ATOM 848 HB1 ALA A 49 8.752 -27.070 14.467 1.00 1.05 H ATOM 849 HB2 ALA A 49 7.452 -27.313 15.632 1.00 1.09 H ATOM 850 HB3 ALA A 49 8.982 -26.610 16.154 1.00 1.06 H ATOM 851 N GLU A 50 9.772 -24.081 14.544 1.00 0.27 N ATOM 852 CA GLU A 50 10.820 -23.058 14.800 1.00 0.25 C ATOM 853 C GLU A 50 10.229 -21.661 14.601 1.00 0.23 C ATOM 854 O GLU A 50 10.556 -20.735 15.311 1.00 0.23 O ATOM 855 CB GLU A 50 11.992 -23.271 13.842 1.00 0.27 C ATOM 856 CG GLU A 50 12.709 -24.574 14.200 1.00 0.33 C ATOM 857 CD GLU A 50 14.018 -24.672 13.417 1.00 1.28 C ATOM 858 OE1 GLU A 50 14.282 -23.779 12.631 1.00 2.09 O ATOM 859 OE2 GLU A 50 14.737 -25.639 13.619 1.00 1.52 O ATOM 860 H GLU A 50 9.821 -24.644 13.745 1.00 0.28 H ATOM 861 HA GLU A 50 11.168 -23.146 15.819 1.00 0.26 H ATOM 862 HB2 GLU A 50 11.617 -23.332 12.828 1.00 0.27 H ATOM 863 HB3 GLU A 50 12.682 -22.446 13.925 1.00 0.27 H ATOM 864 HG2 GLU A 50 12.919 -24.588 15.259 1.00 0.99 H ATOM 865 HG3 GLU A 50 12.078 -25.412 13.947 1.00 1.07 H ATOM 866 N LYS A 51 9.357 -21.497 13.643 1.00 0.23 N ATOM 867 CA LYS A 51 8.742 -20.157 13.413 1.00 0.23 C ATOM 868 C LYS A 51 7.679 -19.885 14.484 1.00 0.23 C ATOM 869 O LYS A 51 7.422 -18.754 14.841 1.00 0.23 O ATOM 870 CB LYS A 51 8.079 -20.127 12.033 1.00 0.23 C ATOM 871 CG LYS A 51 9.142 -20.216 10.936 1.00 0.23 C ATOM 872 CD LYS A 51 8.458 -20.486 9.592 1.00 0.26 C ATOM 873 CE LYS A 51 7.545 -19.312 9.236 1.00 0.41 C ATOM 874 NZ LYS A 51 7.215 -19.363 7.783 1.00 0.37 N ATOM 875 H LYS A 51 9.101 -22.255 13.079 1.00 0.24 H ATOM 876 HA LYS A 51 9.501 -19.392 13.472 1.00 0.22 H ATOM 877 HB2 LYS A 51 7.401 -20.962 11.943 1.00 0.24 H ATOM 878 HB3 LYS A 51 7.528 -19.205 11.921 1.00 0.24 H ATOM 879 HG2 LYS A 51 9.685 -19.283 10.884 1.00 0.23 H ATOM 880 HG3 LYS A 51 9.827 -21.019 11.159 1.00 0.24 H ATOM 881 HD2 LYS A 51 9.205 -20.606 8.822 1.00 0.27 H ATOM 882 HD3 LYS A 51 7.869 -21.387 9.664 1.00 0.35 H ATOM 883 HE2 LYS A 51 6.635 -19.377 9.813 1.00 0.72 H ATOM 884 HE3 LYS A 51 8.048 -18.383 9.459 1.00 0.62 H ATOM 885 HZ1 LYS A 51 7.944 -19.910 7.282 1.00 1.06 H ATOM 886 HZ2 LYS A 51 7.182 -18.396 7.401 1.00 1.08 H ATOM 887 HZ3 LYS A 51 6.291 -19.821 7.653 1.00 1.04 H ATOM 888 N TRP A 52 7.048 -20.911 14.986 1.00 0.24 N ATOM 889 CA TRP A 52 5.985 -20.708 16.013 1.00 0.26 C ATOM 890 C TRP A 52 6.434 -19.708 17.100 1.00 0.25 C ATOM 891 O TRP A 52 5.746 -18.737 17.345 1.00 0.26 O ATOM 892 CB TRP A 52 5.596 -22.059 16.633 1.00 0.30 C ATOM 893 CG TRP A 52 4.860 -21.843 17.919 1.00 0.31 C ATOM 894 CD1 TRP A 52 5.347 -22.118 19.151 1.00 0.31 C ATOM 895 CD2 TRP A 52 3.515 -21.316 18.121 1.00 0.34 C ATOM 896 NE1 TRP A 52 4.390 -21.792 20.095 1.00 0.33 N ATOM 897 CE2 TRP A 52 3.243 -21.294 19.509 1.00 0.36 C ATOM 898 CE3 TRP A 52 2.516 -20.858 17.243 1.00 0.37 C ATOM 899 CZ2 TRP A 52 2.024 -20.835 20.009 1.00 0.40 C ATOM 900 CZ3 TRP A 52 1.287 -20.396 17.742 1.00 0.41 C ATOM 901 CH2 TRP A 52 1.042 -20.385 19.123 1.00 0.43 C ATOM 902 H TRP A 52 7.262 -21.815 14.677 1.00 0.25 H ATOM 903 HA TRP A 52 5.117 -20.294 15.520 1.00 0.28 H ATOM 904 HB2 TRP A 52 4.956 -22.592 15.945 1.00 0.34 H ATOM 905 HB3 TRP A 52 6.482 -22.644 16.815 1.00 0.30 H ATOM 906 HD1 TRP A 52 6.324 -22.526 19.364 1.00 0.30 H ATOM 907 HE1 TRP A 52 4.493 -21.895 21.064 1.00 0.34 H ATOM 908 HE3 TRP A 52 2.694 -20.863 16.177 1.00 0.36 H ATOM 909 HZ2 TRP A 52 1.840 -20.829 21.073 1.00 0.42 H ATOM 910 HZ3 TRP A 52 0.526 -20.047 17.059 1.00 0.44 H ATOM 911 HH2 TRP A 52 0.095 -20.028 19.501 1.00 0.47 H ATOM 912 N PRO A 53 7.554 -19.916 17.761 1.00 0.23 N ATOM 913 CA PRO A 53 8.009 -18.974 18.822 1.00 0.23 C ATOM 914 C PRO A 53 8.012 -17.515 18.343 1.00 0.21 C ATOM 915 O PRO A 53 7.783 -16.605 19.115 1.00 0.20 O ATOM 916 CB PRO A 53 9.431 -19.436 19.190 1.00 0.27 C ATOM 917 CG PRO A 53 9.784 -20.550 18.249 1.00 0.32 C ATOM 918 CD PRO A 53 8.491 -21.037 17.594 1.00 0.24 C ATOM 919 HA PRO A 53 7.370 -19.070 19.686 1.00 0.24 H ATOM 920 HB2 PRO A 53 10.132 -18.617 19.078 1.00 0.47 H ATOM 921 HB3 PRO A 53 9.451 -19.797 20.209 1.00 0.44 H ATOM 922 HG2 PRO A 53 10.468 -20.189 17.496 1.00 0.58 H ATOM 923 HG3 PRO A 53 10.238 -21.364 18.794 1.00 0.58 H ATOM 924 HD2 PRO A 53 8.660 -21.248 16.552 1.00 0.25 H ATOM 925 HD3 PRO A 53 8.124 -21.910 18.107 1.00 0.32 H ATOM 926 N PHE A 54 8.253 -17.278 17.078 1.00 0.21 N ATOM 927 CA PHE A 54 8.250 -15.877 16.563 1.00 0.20 C ATOM 928 C PHE A 54 6.815 -15.452 16.248 1.00 0.20 C ATOM 929 O PHE A 54 6.464 -14.295 16.370 1.00 0.19 O ATOM 930 CB PHE A 54 9.106 -15.789 15.299 1.00 0.21 C ATOM 931 CG PHE A 54 10.550 -16.040 15.657 1.00 0.21 C ATOM 932 CD1 PHE A 54 11.333 -14.999 16.170 1.00 0.21 C ATOM 933 CD2 PHE A 54 11.105 -17.313 15.481 1.00 0.24 C ATOM 934 CE1 PHE A 54 12.672 -15.231 16.506 1.00 0.22 C ATOM 935 CE2 PHE A 54 12.444 -17.545 15.817 1.00 0.25 C ATOM 936 CZ PHE A 54 13.228 -16.504 16.330 1.00 0.23 C ATOM 937 H PHE A 54 8.422 -18.013 16.456 1.00 0.22 H ATOM 938 HA PHE A 54 8.642 -15.205 17.312 1.00 0.19 H ATOM 939 HB2 PHE A 54 8.775 -16.533 14.588 1.00 0.23 H ATOM 940 HB3 PHE A 54 9.009 -14.806 14.864 1.00 0.21 H ATOM 941 HD1 PHE A 54 10.904 -14.017 16.306 1.00 0.22 H ATOM 942 HD2 PHE A 54 10.501 -18.115 15.085 1.00 0.26 H ATOM 943 HE1 PHE A 54 13.277 -14.428 16.902 1.00 0.24 H ATOM 944 HE2 PHE A 54 12.872 -18.527 15.682 1.00 0.28 H ATOM 945 HZ PHE A 54 14.260 -16.683 16.589 1.00 0.25 H ATOM 946 N PHE A 55 5.975 -16.370 15.858 1.00 0.20 N ATOM 947 CA PHE A 55 4.566 -15.991 15.561 1.00 0.21 C ATOM 948 C PHE A 55 3.866 -15.671 16.879 1.00 0.20 C ATOM 949 O PHE A 55 3.156 -14.692 16.996 1.00 0.21 O ATOM 950 CB PHE A 55 3.848 -17.159 14.870 1.00 0.23 C ATOM 951 CG PHE A 55 4.021 -17.052 13.372 1.00 0.24 C ATOM 952 CD1 PHE A 55 5.265 -17.315 12.789 1.00 0.50 C ATOM 953 CD2 PHE A 55 2.934 -16.692 12.567 1.00 0.56 C ATOM 954 CE1 PHE A 55 5.423 -17.217 11.403 1.00 0.50 C ATOM 955 CE2 PHE A 55 3.092 -16.594 11.180 1.00 0.58 C ATOM 956 CZ PHE A 55 4.337 -16.857 10.597 1.00 0.29 C ATOM 957 H PHE A 55 6.264 -17.303 15.772 1.00 0.21 H ATOM 958 HA PHE A 55 4.543 -15.122 14.919 1.00 0.21 H ATOM 959 HB2 PHE A 55 4.269 -18.092 15.214 1.00 0.24 H ATOM 960 HB3 PHE A 55 2.795 -17.130 15.111 1.00 0.23 H ATOM 961 HD1 PHE A 55 6.103 -17.591 13.409 1.00 0.84 H ATOM 962 HD2 PHE A 55 1.973 -16.489 13.017 1.00 0.90 H ATOM 963 HE1 PHE A 55 6.384 -17.421 10.954 1.00 0.83 H ATOM 964 HE2 PHE A 55 2.254 -16.316 10.559 1.00 0.93 H ATOM 965 HZ PHE A 55 4.460 -16.781 9.527 1.00 0.32 H ATOM 966 N GLN A 56 4.065 -16.486 17.876 1.00 0.21 N ATOM 967 CA GLN A 56 3.412 -16.212 19.182 1.00 0.21 C ATOM 968 C GLN A 56 3.864 -14.845 19.699 1.00 0.20 C ATOM 969 O GLN A 56 3.072 -14.079 20.209 1.00 0.20 O ATOM 970 CB GLN A 56 3.782 -17.299 20.194 1.00 0.22 C ATOM 971 CG GLN A 56 3.044 -17.035 21.509 1.00 0.24 C ATOM 972 CD GLN A 56 2.878 -18.344 22.281 1.00 1.18 C ATOM 973 OE1 GLN A 56 3.507 -19.334 21.966 1.00 1.89 O ATOM 974 NE2 GLN A 56 2.039 -18.392 23.280 1.00 1.90 N ATOM 975 H GLN A 56 4.641 -17.272 17.763 1.00 0.21 H ATOM 976 HA GLN A 56 2.340 -16.202 19.047 1.00 0.22 H ATOM 977 HB2 GLN A 56 3.496 -18.265 19.806 1.00 0.23 H ATOM 978 HB3 GLN A 56 4.847 -17.281 20.370 1.00 0.22 H ATOM 979 HG2 GLN A 56 3.616 -16.337 22.105 1.00 0.82 H ATOM 980 HG3 GLN A 56 2.072 -16.616 21.301 1.00 0.87 H ATOM 981 HE21 GLN A 56 1.525 -17.595 23.528 1.00 2.11 H ATOM 982 HE22 GLN A 56 1.921 -19.226 23.781 1.00 2.56 H ATOM 983 N GLU A 57 5.127 -14.521 19.576 1.00 0.19 N ATOM 984 CA GLU A 57 5.589 -13.198 20.069 1.00 0.18 C ATOM 985 C GLU A 57 4.904 -12.093 19.265 1.00 0.18 C ATOM 986 O GLU A 57 4.426 -11.125 19.821 1.00 0.17 O ATOM 987 CB GLU A 57 7.111 -13.095 19.921 1.00 0.19 C ATOM 988 CG GLU A 57 7.599 -11.778 20.534 1.00 0.19 C ATOM 989 CD GLU A 57 9.032 -11.943 21.045 1.00 1.21 C ATOM 990 OE1 GLU A 57 9.649 -12.939 20.709 1.00 1.84 O ATOM 991 OE2 GLU A 57 9.486 -11.070 21.767 1.00 1.51 O ATOM 992 H GLU A 57 5.768 -15.141 19.170 1.00 0.19 H ATOM 993 HA GLU A 57 5.324 -13.086 21.110 1.00 0.19 H ATOM 994 HB2 GLU A 57 7.577 -13.926 20.430 1.00 0.20 H ATOM 995 HB3 GLU A 57 7.373 -13.121 18.874 1.00 0.20 H ATOM 996 HG2 GLU A 57 7.578 -11.005 19.781 1.00 0.88 H ATOM 997 HG3 GLU A 57 6.956 -11.498 21.355 1.00 0.87 H ATOM 998 N ALA A 58 4.818 -12.229 17.967 1.00 0.17 N ATOM 999 CA ALA A 58 4.128 -11.182 17.168 1.00 0.17 C ATOM 1000 C ALA A 58 2.684 -11.125 17.644 1.00 0.18 C ATOM 1001 O ALA A 58 2.089 -10.072 17.760 1.00 0.18 O ATOM 1002 CB ALA A 58 4.181 -11.546 15.679 1.00 0.18 C ATOM 1003 H ALA A 58 5.182 -13.020 17.526 1.00 0.18 H ATOM 1004 HA ALA A 58 4.598 -10.227 17.332 1.00 0.17 H ATOM 1005 HB1 ALA A 58 3.272 -11.224 15.192 1.00 1.03 H ATOM 1006 HB2 ALA A 58 4.285 -12.616 15.574 1.00 1.03 H ATOM 1007 HB3 ALA A 58 5.027 -11.057 15.221 1.00 1.04 H ATOM 1008 N GLN A 59 2.126 -12.264 17.937 1.00 0.19 N ATOM 1009 CA GLN A 59 0.728 -12.307 18.428 1.00 0.20 C ATOM 1010 C GLN A 59 0.652 -11.590 19.776 1.00 0.20 C ATOM 1011 O GLN A 59 -0.270 -10.846 20.047 1.00 0.20 O ATOM 1012 CB GLN A 59 0.301 -13.765 18.597 1.00 0.21 C ATOM 1013 CG GLN A 59 -1.171 -13.814 18.988 1.00 0.25 C ATOM 1014 CD GLN A 59 -1.616 -15.270 19.134 1.00 1.07 C ATOM 1015 OE1 GLN A 59 -1.401 -15.884 20.160 1.00 1.97 O ATOM 1016 NE2 GLN A 59 -2.225 -15.853 18.138 1.00 1.65 N ATOM 1017 H GLN A 59 2.638 -13.093 17.844 1.00 0.19 H ATOM 1018 HA GLN A 59 0.080 -11.823 17.711 1.00 0.20 H ATOM 1019 HB2 GLN A 59 0.446 -14.293 17.665 1.00 0.23 H ATOM 1020 HB3 GLN A 59 0.894 -14.228 19.370 1.00 0.22 H ATOM 1021 HG2 GLN A 59 -1.306 -13.299 19.928 1.00 0.81 H ATOM 1022 HG3 GLN A 59 -1.760 -13.332 18.225 1.00 0.79 H ATOM 1023 HE21 GLN A 59 -2.393 -15.358 17.309 1.00 2.01 H ATOM 1024 HE22 GLN A 59 -2.515 -16.786 18.219 1.00 2.21 H ATOM 1025 N LYS A 60 1.630 -11.796 20.620 1.00 0.20 N ATOM 1026 CA LYS A 60 1.636 -11.115 21.945 1.00 0.20 C ATOM 1027 C LYS A 60 1.854 -9.617 21.738 1.00 0.20 C ATOM 1028 O LYS A 60 1.201 -8.793 22.348 1.00 0.20 O ATOM 1029 CB LYS A 60 2.754 -11.701 22.810 1.00 0.20 C ATOM 1030 CG LYS A 60 2.775 -11.005 24.171 1.00 0.22 C ATOM 1031 CD LYS A 60 3.697 -11.777 25.124 1.00 1.08 C ATOM 1032 CE LYS A 60 4.039 -10.923 26.357 1.00 1.57 C ATOM 1033 NZ LYS A 60 3.567 -11.617 27.588 1.00 2.24 N ATOM 1034 H LYS A 60 2.374 -12.386 20.376 1.00 0.19 H ATOM 1035 HA LYS A 60 0.686 -11.274 22.435 1.00 0.21 H ATOM 1036 HB2 LYS A 60 2.582 -12.758 22.950 1.00 0.21 H ATOM 1037 HB3 LYS A 60 3.704 -11.553 22.318 1.00 0.20 H ATOM 1038 HG2 LYS A 60 3.143 -9.996 24.050 1.00 0.77 H ATOM 1039 HG3 LYS A 60 1.777 -10.979 24.579 1.00 0.80 H ATOM 1040 HD2 LYS A 60 3.195 -12.679 25.445 1.00 1.79 H ATOM 1041 HD3 LYS A 60 4.605 -12.041 24.605 1.00 1.63 H ATOM 1042 HE2 LYS A 60 5.110 -10.786 26.414 1.00 2.07 H ATOM 1043 HE3 LYS A 60 3.560 -9.957 26.285 1.00 2.07 H ATOM 1044 HZ1 LYS A 60 2.638 -12.046 27.409 1.00 2.69 H ATOM 1045 HZ2 LYS A 60 3.488 -10.929 28.366 1.00 2.66 H ATOM 1046 HZ3 LYS A 60 4.245 -12.360 27.850 1.00 2.66 H ATOM 1047 N LEU A 61 2.747 -9.257 20.856 1.00 0.19 N ATOM 1048 CA LEU A 61 2.981 -7.813 20.581 1.00 0.19 C ATOM 1049 C LEU A 61 1.690 -7.221 20.019 1.00 0.20 C ATOM 1050 O LEU A 61 1.348 -6.086 20.287 1.00 0.20 O ATOM 1051 CB LEU A 61 4.101 -7.648 19.545 1.00 0.20 C ATOM 1052 CG LEU A 61 5.423 -8.230 20.073 1.00 0.21 C ATOM 1053 CD1 LEU A 61 6.357 -8.527 18.890 1.00 0.25 C ATOM 1054 CD2 LEU A 61 6.110 -7.220 21.001 1.00 0.26 C ATOM 1055 H LEU A 61 3.240 -9.939 20.354 1.00 0.19 H ATOM 1056 HA LEU A 61 3.233 -7.284 21.486 1.00 0.20 H ATOM 1057 HB2 LEU A 61 3.824 -8.163 18.637 1.00 0.21 H ATOM 1058 HB3 LEU A 61 4.236 -6.598 19.332 1.00 0.21 H ATOM 1059 HG LEU A 61 5.225 -9.143 20.615 1.00 0.24 H ATOM 1060 HD11 LEU A 61 6.280 -9.568 18.626 1.00 1.04 H ATOM 1061 HD12 LEU A 61 7.380 -8.306 19.162 1.00 1.06 H ATOM 1062 HD13 LEU A 61 6.073 -7.920 18.042 1.00 1.06 H ATOM 1063 HD21 LEU A 61 5.371 -6.663 21.550 1.00 1.06 H ATOM 1064 HD22 LEU A 61 6.708 -6.540 20.410 1.00 1.05 H ATOM 1065 HD23 LEU A 61 6.750 -7.750 21.690 1.00 1.06 H ATOM 1066 N GLN A 62 0.968 -7.979 19.240 1.00 0.20 N ATOM 1067 CA GLN A 62 -0.299 -7.455 18.664 1.00 0.21 C ATOM 1068 C GLN A 62 -1.341 -7.295 19.774 1.00 0.22 C ATOM 1069 O GLN A 62 -2.053 -6.312 19.827 1.00 0.23 O ATOM 1070 CB GLN A 62 -0.814 -8.435 17.609 1.00 0.22 C ATOM 1071 CG GLN A 62 -2.079 -7.879 16.954 1.00 0.26 C ATOM 1072 CD GLN A 62 -2.666 -8.936 16.019 1.00 0.29 C ATOM 1073 OE1 GLN A 62 -3.011 -10.019 16.448 1.00 0.68 O ATOM 1074 NE2 GLN A 62 -2.794 -8.668 14.749 1.00 0.94 N ATOM 1075 H GLN A 62 1.256 -8.892 19.028 1.00 0.20 H ATOM 1076 HA GLN A 62 -0.110 -6.494 18.209 1.00 0.22 H ATOM 1077 HB2 GLN A 62 -0.054 -8.582 16.855 1.00 0.24 H ATOM 1078 HB3 GLN A 62 -1.042 -9.380 18.078 1.00 0.22 H ATOM 1079 HG2 GLN A 62 -2.802 -7.630 17.718 1.00 0.27 H ATOM 1080 HG3 GLN A 62 -1.833 -6.994 16.387 1.00 0.29 H ATOM 1081 HE21 GLN A 62 -2.516 -7.794 14.402 1.00 1.50 H ATOM 1082 HE22 GLN A 62 -3.164 -9.341 14.142 1.00 0.96 H ATOM 1083 N ALA A 63 -1.433 -8.243 20.670 1.00 0.22 N ATOM 1084 CA ALA A 63 -2.426 -8.117 21.774 1.00 0.23 C ATOM 1085 C ALA A 63 -1.988 -6.987 22.707 1.00 0.23 C ATOM 1086 O ALA A 63 -2.780 -6.159 23.112 1.00 0.24 O ATOM 1087 CB ALA A 63 -2.511 -9.433 22.551 1.00 0.24 C ATOM 1088 H ALA A 63 -0.843 -9.024 20.628 1.00 0.21 H ATOM 1089 HA ALA A 63 -3.392 -7.872 21.357 1.00 0.24 H ATOM 1090 HB1 ALA A 63 -3.231 -10.084 22.077 1.00 1.03 H ATOM 1091 HB2 ALA A 63 -2.820 -9.233 23.566 1.00 1.02 H ATOM 1092 HB3 ALA A 63 -1.542 -9.910 22.557 1.00 1.05 H ATOM 1093 N MET A 64 -0.727 -6.941 23.043 1.00 0.22 N ATOM 1094 CA MET A 64 -0.238 -5.859 23.939 1.00 0.23 C ATOM 1095 C MET A 64 -0.373 -4.526 23.200 1.00 0.22 C ATOM 1096 O MET A 64 -0.744 -3.521 23.775 1.00 0.23 O ATOM 1097 CB MET A 64 1.226 -6.137 24.325 1.00 0.24 C ATOM 1098 CG MET A 64 1.411 -5.997 25.847 1.00 1.10 C ATOM 1099 SD MET A 64 2.962 -6.782 26.337 1.00 1.55 S ATOM 1100 CE MET A 64 4.025 -5.829 25.236 1.00 1.47 C ATOM 1101 H MET A 64 -0.107 -7.621 22.704 1.00 0.22 H ATOM 1102 HA MET A 64 -0.848 -5.823 24.824 1.00 0.24 H ATOM 1103 HB2 MET A 64 1.486 -7.142 24.026 1.00 0.88 H ATOM 1104 HB3 MET A 64 1.874 -5.437 23.820 1.00 0.84 H ATOM 1105 HG2 MET A 64 1.439 -4.951 26.112 1.00 1.79 H ATOM 1106 HG3 MET A 64 0.592 -6.477 26.363 1.00 1.80 H ATOM 1107 HE1 MET A 64 4.065 -6.315 24.271 1.00 1.96 H ATOM 1108 HE2 MET A 64 5.018 -5.769 25.651 1.00 1.96 H ATOM 1109 HE3 MET A 64 3.619 -4.833 25.127 1.00 1.93 H ATOM 1110 N HIS A 65 -0.113 -4.516 21.922 1.00 0.22 N ATOM 1111 CA HIS A 65 -0.270 -3.257 21.147 1.00 0.22 C ATOM 1112 C HIS A 65 -1.743 -2.846 21.203 1.00 0.22 C ATOM 1113 O HIS A 65 -2.074 -1.683 21.319 1.00 0.22 O ATOM 1114 CB HIS A 65 0.141 -3.497 19.691 1.00 0.22 C ATOM 1115 CG HIS A 65 0.051 -2.207 18.920 1.00 0.23 C ATOM 1116 ND1 HIS A 65 0.955 -1.169 19.102 1.00 0.24 N ATOM 1117 CD2 HIS A 65 -0.828 -1.774 17.957 1.00 0.27 C ATOM 1118 CE1 HIS A 65 0.603 -0.173 18.268 1.00 0.26 C ATOM 1119 NE2 HIS A 65 -0.475 -0.492 17.550 1.00 0.28 N ATOM 1120 H HIS A 65 0.158 -5.342 21.469 1.00 0.21 H ATOM 1121 HA HIS A 65 0.347 -2.480 21.578 1.00 0.22 H ATOM 1122 HB2 HIS A 65 1.157 -3.864 19.660 1.00 0.21 H ATOM 1123 HB3 HIS A 65 -0.518 -4.227 19.247 1.00 0.23 H ATOM 1124 HD2 HIS A 65 -1.664 -2.341 17.575 1.00 0.32 H ATOM 1125 HE1 HIS A 65 1.128 0.767 18.188 1.00 0.29 H ATOM 1126 HE2 HIS A 65 -0.925 0.061 16.877 1.00 0.31 H ATOM 1127 N ARG A 66 -2.629 -3.807 21.120 1.00 0.22 N ATOM 1128 CA ARG A 66 -4.085 -3.501 21.165 1.00 0.22 C ATOM 1129 C ARG A 66 -4.460 -2.994 22.555 1.00 0.22 C ATOM 1130 O ARG A 66 -5.404 -2.246 22.719 1.00 0.23 O ATOM 1131 CB ARG A 66 -4.901 -4.764 20.860 1.00 0.23 C ATOM 1132 CG ARG A 66 -6.378 -4.374 20.695 1.00 0.26 C ATOM 1133 CD ARG A 66 -7.309 -5.579 20.890 1.00 0.28 C ATOM 1134 NE ARG A 66 -7.844 -5.970 19.550 1.00 1.33 N ATOM 1135 CZ ARG A 66 -8.764 -6.882 19.442 1.00 2.04 C ATOM 1136 NH1 ARG A 66 -9.329 -7.366 20.514 1.00 2.29 N ATOM 1137 NH2 ARG A 66 -9.148 -7.285 18.261 1.00 3.11 N ATOM 1138 H ARG A 66 -2.337 -4.735 21.027 1.00 0.21 H ATOM 1139 HA ARG A 66 -4.305 -2.741 20.431 1.00 0.23 H ATOM 1140 HB2 ARG A 66 -4.539 -5.217 19.948 1.00 0.23 H ATOM 1141 HB3 ARG A 66 -4.798 -5.461 21.677 1.00 0.23 H ATOM 1142 HG2 ARG A 66 -6.627 -3.620 21.420 1.00 0.28 H ATOM 1143 HG3 ARG A 66 -6.526 -3.972 19.704 1.00 0.28 H ATOM 1144 HD2 ARG A 66 -6.780 -6.410 21.297 1.00 1.05 H ATOM 1145 HD3 ARG A 66 -8.108 -5.306 21.582 1.00 1.06 H ATOM 1146 HE ARG A 66 -7.468 -5.564 18.743 1.00 2.02 H ATOM 1147 HH11 ARG A 66 -9.055 -7.035 21.418 1.00 2.05 H ATOM 1148 HH12 ARG A 66 -10.042 -8.060 20.431 1.00 3.13 H ATOM 1149 HH21 ARG A 66 -8.735 -6.894 17.439 1.00 3.51 H ATOM 1150 HH22 ARG A 66 -9.860 -7.984 18.179 1.00 3.74 H ATOM 1151 N GLU A 67 -3.740 -3.391 23.565 1.00 0.22 N ATOM 1152 CA GLU A 67 -4.093 -2.922 24.928 1.00 0.22 C ATOM 1153 C GLU A 67 -3.721 -1.450 25.059 1.00 0.22 C ATOM 1154 O GLU A 67 -4.402 -0.682 25.710 1.00 0.23 O ATOM 1155 CB GLU A 67 -3.357 -3.752 25.981 1.00 0.22 C ATOM 1156 CG GLU A 67 -3.817 -3.319 27.375 1.00 0.23 C ATOM 1157 CD GLU A 67 -3.571 -4.450 28.374 1.00 1.23 C ATOM 1158 OE1 GLU A 67 -2.954 -5.429 27.989 1.00 1.85 O ATOM 1159 OE2 GLU A 67 -4.010 -4.320 29.505 1.00 1.51 O ATOM 1160 H GLU A 67 -2.971 -3.984 23.429 1.00 0.22 H ATOM 1161 HA GLU A 67 -5.155 -3.032 25.065 1.00 0.23 H ATOM 1162 HB2 GLU A 67 -3.581 -4.799 25.835 1.00 0.23 H ATOM 1163 HB3 GLU A 67 -2.293 -3.593 25.889 1.00 0.22 H ATOM 1164 HG2 GLU A 67 -3.259 -2.444 27.678 1.00 0.89 H ATOM 1165 HG3 GLU A 67 -4.869 -3.084 27.350 1.00 0.87 H ATOM 1166 N LYS A 68 -2.655 -1.044 24.435 1.00 0.22 N ATOM 1167 CA LYS A 68 -2.250 0.381 24.510 1.00 0.22 C ATOM 1168 C LYS A 68 -3.263 1.210 23.717 1.00 0.22 C ATOM 1169 O LYS A 68 -3.686 2.262 24.155 1.00 0.23 O ATOM 1170 CB LYS A 68 -0.853 0.535 23.905 1.00 0.22 C ATOM 1171 CG LYS A 68 -0.259 1.886 24.305 1.00 0.23 C ATOM 1172 CD LYS A 68 1.167 1.995 23.750 1.00 0.25 C ATOM 1173 CE LYS A 68 1.906 3.180 24.395 1.00 1.08 C ATOM 1174 NZ LYS A 68 3.134 2.677 25.074 1.00 1.85 N ATOM 1175 H LYS A 68 -2.117 -1.677 23.915 1.00 0.21 H ATOM 1176 HA LYS A 68 -2.243 0.726 25.534 1.00 0.22 H ATOM 1177 HB2 LYS A 68 -0.216 -0.260 24.267 1.00 0.22 H ATOM 1178 HB3 LYS A 68 -0.920 0.478 22.829 1.00 0.23 H ATOM 1179 HG2 LYS A 68 -0.868 2.681 23.900 1.00 0.26 H ATOM 1180 HG3 LYS A 68 -0.231 1.963 25.381 1.00 0.27 H ATOM 1181 HD2 LYS A 68 1.702 1.082 23.965 1.00 0.87 H ATOM 1182 HD3 LYS A 68 1.124 2.138 22.681 1.00 0.86 H ATOM 1183 HE2 LYS A 68 2.186 3.891 23.631 1.00 1.68 H ATOM 1184 HE3 LYS A 68 1.269 3.666 25.120 1.00 1.76 H ATOM 1185 HZ1 LYS A 68 3.173 1.641 24.999 1.00 2.30 H ATOM 1186 HZ2 LYS A 68 3.111 2.951 26.078 1.00 2.35 H ATOM 1187 HZ3 LYS A 68 3.974 3.087 24.621 1.00 2.34 H ATOM 1188 N TYR A 69 -3.669 0.744 22.561 1.00 0.22 N ATOM 1189 CA TYR A 69 -4.671 1.506 21.754 1.00 0.22 C ATOM 1190 C TYR A 69 -5.820 0.568 21.360 1.00 0.22 C ATOM 1191 O TYR A 69 -5.880 0.083 20.248 1.00 0.23 O ATOM 1192 CB TYR A 69 -3.998 2.039 20.491 1.00 0.23 C ATOM 1193 CG TYR A 69 -2.707 2.729 20.855 1.00 0.24 C ATOM 1194 CD1 TYR A 69 -2.724 3.868 21.668 1.00 0.27 C ATOM 1195 CD2 TYR A 69 -1.492 2.226 20.378 1.00 0.26 C ATOM 1196 CE1 TYR A 69 -1.523 4.505 22.003 1.00 0.29 C ATOM 1197 CE2 TYR A 69 -0.292 2.861 20.712 1.00 0.28 C ATOM 1198 CZ TYR A 69 -0.307 4.001 21.524 1.00 0.28 C ATOM 1199 OH TYR A 69 0.877 4.629 21.854 1.00 0.31 O ATOM 1200 H TYR A 69 -3.321 -0.104 22.217 1.00 0.22 H ATOM 1201 HA TYR A 69 -5.052 2.330 22.339 1.00 0.23 H ATOM 1202 HB2 TYR A 69 -3.786 1.215 19.827 1.00 0.23 H ATOM 1203 HB3 TYR A 69 -4.655 2.741 20.000 1.00 0.24 H ATOM 1204 HD1 TYR A 69 -3.662 4.256 22.036 1.00 0.31 H ATOM 1205 HD2 TYR A 69 -1.481 1.346 19.751 1.00 0.29 H ATOM 1206 HE1 TYR A 69 -1.535 5.384 22.630 1.00 0.34 H ATOM 1207 HE2 TYR A 69 0.645 2.470 20.344 1.00 0.31 H ATOM 1208 HH TYR A 69 1.110 5.219 21.134 1.00 0.95 H ATOM 1209 N PRO A 70 -6.717 0.307 22.274 1.00 0.23 N ATOM 1210 CA PRO A 70 -7.879 -0.600 22.031 1.00 0.23 C ATOM 1211 C PRO A 70 -8.809 -0.093 20.919 1.00 0.24 C ATOM 1212 O PRO A 70 -9.626 -0.829 20.402 1.00 0.24 O ATOM 1213 CB PRO A 70 -8.627 -0.651 23.376 1.00 0.24 C ATOM 1214 CG PRO A 70 -7.746 0.019 24.389 1.00 0.47 C ATOM 1215 CD PRO A 70 -6.715 0.856 23.633 1.00 0.25 C ATOM 1216 HA PRO A 70 -7.529 -1.585 21.781 1.00 0.23 H ATOM 1217 HB2 PRO A 70 -9.571 -0.127 23.299 1.00 0.42 H ATOM 1218 HB3 PRO A 70 -8.799 -1.678 23.663 1.00 0.41 H ATOM 1219 HG2 PRO A 70 -8.342 0.659 25.027 1.00 0.83 H ATOM 1220 HG3 PRO A 70 -7.239 -0.722 24.988 1.00 0.83 H ATOM 1221 HD2 PRO A 70 -7.008 1.897 23.623 1.00 0.36 H ATOM 1222 HD3 PRO A 70 -5.738 0.742 24.078 1.00 0.37 H ATOM 1223 N ASN A 71 -8.699 1.155 20.559 1.00 0.24 N ATOM 1224 CA ASN A 71 -9.592 1.700 19.491 1.00 0.24 C ATOM 1225 C ASN A 71 -8.801 1.905 18.197 1.00 0.24 C ATOM 1226 O ASN A 71 -9.303 2.450 17.234 1.00 0.25 O ATOM 1227 CB ASN A 71 -10.163 3.043 19.949 1.00 0.25 C ATOM 1228 CG ASN A 71 -11.315 3.448 19.029 1.00 0.29 C ATOM 1229 OD1 ASN A 71 -11.541 2.824 18.011 1.00 1.14 O ATOM 1230 ND2 ASN A 71 -12.059 4.472 19.346 1.00 1.04 N ATOM 1231 H ASN A 71 -8.040 1.736 20.995 1.00 0.23 H ATOM 1232 HA ASN A 71 -10.406 1.013 19.310 1.00 0.25 H ATOM 1233 HB2 ASN A 71 -10.525 2.952 20.963 1.00 0.28 H ATOM 1234 HB3 ASN A 71 -9.390 3.796 19.909 1.00 0.26 H ATOM 1235 HD21 ASN A 71 -11.878 4.973 20.168 1.00 1.85 H ATOM 1236 HD22 ASN A 71 -12.800 4.739 18.762 1.00 1.01 H ATOM 1237 N TYR A 72 -7.570 1.475 18.162 1.00 0.23 N ATOM 1238 CA TYR A 72 -6.758 1.650 16.931 1.00 0.23 C ATOM 1239 C TYR A 72 -7.355 0.859 15.765 1.00 0.24 C ATOM 1240 O TYR A 72 -7.821 -0.253 15.920 1.00 0.24 O ATOM 1241 CB TYR A 72 -5.336 1.164 17.182 1.00 0.23 C ATOM 1242 CG TYR A 72 -4.547 1.298 15.908 1.00 0.25 C ATOM 1243 CD1 TYR A 72 -3.963 2.523 15.572 1.00 0.28 C ATOM 1244 CD2 TYR A 72 -4.411 0.199 15.055 1.00 0.27 C ATOM 1245 CE1 TYR A 72 -3.241 2.649 14.382 1.00 0.32 C ATOM 1246 CE2 TYR A 72 -3.688 0.323 13.866 1.00 0.30 C ATOM 1247 CZ TYR A 72 -3.102 1.549 13.527 1.00 0.31 C ATOM 1248 OH TYR A 72 -2.390 1.673 12.352 1.00 0.36 O ATOM 1249 H TYR A 72 -7.177 1.036 18.942 1.00 0.23 H ATOM 1250 HA TYR A 72 -6.725 2.700 16.681 1.00 0.24 H ATOM 1251 HB2 TYR A 72 -4.883 1.769 17.950 1.00 0.24 H ATOM 1252 HB3 TYR A 72 -5.351 0.130 17.492 1.00 0.24 H ATOM 1253 HD1 TYR A 72 -4.069 3.372 16.232 1.00 0.31 H ATOM 1254 HD2 TYR A 72 -4.863 -0.746 15.317 1.00 0.29 H ATOM 1255 HE1 TYR A 72 -2.792 3.594 14.123 1.00 0.37 H ATOM 1256 HE2 TYR A 72 -3.584 -0.526 13.210 1.00 0.34 H ATOM 1257 HH TYR A 72 -1.876 0.871 12.231 1.00 0.99 H ATOM 1258 N LYS A 73 -7.316 1.426 14.596 1.00 0.24 N ATOM 1259 CA LYS A 73 -7.847 0.721 13.394 1.00 0.25 C ATOM 1260 C LYS A 73 -6.850 0.850 12.248 1.00 0.24 C ATOM 1261 O LYS A 73 -6.291 1.903 12.014 1.00 0.25 O ATOM 1262 CB LYS A 73 -9.181 1.331 12.954 1.00 0.27 C ATOM 1263 CG LYS A 73 -9.697 0.557 11.733 1.00 0.32 C ATOM 1264 CD LYS A 73 -11.016 1.156 11.240 1.00 0.85 C ATOM 1265 CE LYS A 73 -11.442 0.463 9.935 1.00 0.74 C ATOM 1266 NZ LYS A 73 -12.920 0.267 9.938 1.00 1.50 N ATOM 1267 H LYS A 73 -6.917 2.318 14.517 1.00 0.24 H ATOM 1268 HA LYS A 73 -7.996 -0.326 13.614 1.00 0.26 H ATOM 1269 HB2 LYS A 73 -9.896 1.258 13.761 1.00 0.25 H ATOM 1270 HB3 LYS A 73 -9.037 2.367 12.689 1.00 0.30 H ATOM 1271 HG2 LYS A 73 -8.969 0.610 10.937 1.00 0.88 H ATOM 1272 HG3 LYS A 73 -9.855 -0.476 12.005 1.00 0.94 H ATOM 1273 HD2 LYS A 73 -11.779 1.010 11.992 1.00 1.41 H ATOM 1274 HD3 LYS A 73 -10.887 2.212 11.059 1.00 1.39 H ATOM 1275 HE2 LYS A 73 -11.164 1.079 9.093 1.00 1.06 H ATOM 1276 HE3 LYS A 73 -10.953 -0.499 9.850 1.00 1.08 H ATOM 1277 HZ1 LYS A 73 -13.194 -0.313 9.120 1.00 2.04 H ATOM 1278 HZ2 LYS A 73 -13.391 1.193 9.882 1.00 1.98 H ATOM 1279 HZ3 LYS A 73 -13.204 -0.216 10.813 1.00 1.99 H ATOM 1280 N TYR A 74 -6.655 -0.201 11.500 1.00 0.25 N ATOM 1281 CA TYR A 74 -5.734 -0.113 10.340 1.00 0.26 C ATOM 1282 C TYR A 74 -6.492 0.581 9.212 1.00 0.26 C ATOM 1283 O TYR A 74 -7.508 0.101 8.750 1.00 0.26 O ATOM 1284 CB TYR A 74 -5.309 -1.522 9.911 1.00 0.27 C ATOM 1285 CG TYR A 74 -4.512 -1.471 8.621 1.00 0.30 C ATOM 1286 CD1 TYR A 74 -3.439 -0.578 8.471 1.00 0.49 C ATOM 1287 CD2 TYR A 74 -4.850 -2.332 7.570 1.00 0.20 C ATOM 1288 CE1 TYR A 74 -2.713 -0.554 7.274 1.00 0.56 C ATOM 1289 CE2 TYR A 74 -4.121 -2.305 6.375 1.00 0.25 C ATOM 1290 CZ TYR A 74 -3.052 -1.417 6.228 1.00 0.42 C ATOM 1291 OH TYR A 74 -2.332 -1.393 5.052 1.00 0.50 O ATOM 1292 H TYR A 74 -7.145 -1.032 11.670 1.00 0.26 H ATOM 1293 HA TYR A 74 -4.866 0.466 10.612 1.00 0.26 H ATOM 1294 HB2 TYR A 74 -4.700 -1.961 10.687 1.00 0.31 H ATOM 1295 HB3 TYR A 74 -6.189 -2.129 9.762 1.00 0.25 H ATOM 1296 HD1 TYR A 74 -3.165 0.086 9.273 1.00 0.61 H ATOM 1297 HD2 TYR A 74 -5.675 -3.014 7.682 1.00 0.22 H ATOM 1298 HE1 TYR A 74 -1.891 0.132 7.158 1.00 0.72 H ATOM 1299 HE2 TYR A 74 -4.379 -2.975 5.567 1.00 0.23 H ATOM 1300 HH TYR A 74 -1.660 -2.076 5.102 1.00 1.02 H ATOM 1301 N ARG A 75 -6.030 1.721 8.789 1.00 0.26 N ATOM 1302 CA ARG A 75 -6.739 2.473 7.718 1.00 0.27 C ATOM 1303 C ARG A 75 -5.735 2.873 6.632 1.00 0.27 C ATOM 1304 O ARG A 75 -5.175 3.950 6.672 1.00 0.29 O ATOM 1305 CB ARG A 75 -7.369 3.709 8.363 1.00 0.28 C ATOM 1306 CG ARG A 75 -8.288 3.223 9.490 1.00 0.40 C ATOM 1307 CD ARG A 75 -9.128 4.372 10.049 1.00 0.49 C ATOM 1308 NE ARG A 75 -8.337 5.632 10.025 1.00 1.42 N ATOM 1309 CZ ARG A 75 -8.926 6.770 10.269 1.00 2.11 C ATOM 1310 NH1 ARG A 75 -10.194 6.792 10.579 1.00 2.33 N ATOM 1311 NH2 ARG A 75 -8.247 7.883 10.217 1.00 3.23 N ATOM 1312 H ARG A 75 -5.224 2.103 9.190 1.00 0.26 H ATOM 1313 HA ARG A 75 -7.530 1.873 7.301 1.00 0.27 H ATOM 1314 HB2 ARG A 75 -6.595 4.347 8.766 1.00 0.36 H ATOM 1315 HB3 ARG A 75 -7.948 4.250 7.631 1.00 0.32 H ATOM 1316 HG2 ARG A 75 -8.947 2.459 9.105 1.00 0.53 H ATOM 1317 HG3 ARG A 75 -7.686 2.805 10.283 1.00 0.55 H ATOM 1318 HD2 ARG A 75 -10.013 4.499 9.451 1.00 1.22 H ATOM 1319 HD3 ARG A 75 -9.420 4.136 11.065 1.00 1.14 H ATOM 1320 HE ARG A 75 -7.381 5.608 9.813 1.00 2.15 H ATOM 1321 HH11 ARG A 75 -10.711 5.936 10.629 1.00 2.08 H ATOM 1322 HH12 ARG A 75 -10.648 7.662 10.770 1.00 3.20 H ATOM 1323 HH21 ARG A 75 -7.274 7.864 9.990 1.00 3.65 H ATOM 1324 HH22 ARG A 75 -8.701 8.753 10.406 1.00 3.87 H ATOM 1325 N PRO A 76 -5.476 2.001 5.686 1.00 0.25 N ATOM 1326 CA PRO A 76 -4.485 2.275 4.606 1.00 0.25 C ATOM 1327 C PRO A 76 -4.936 3.383 3.651 1.00 0.25 C ATOM 1328 O PRO A 76 -6.113 3.598 3.440 1.00 0.26 O ATOM 1329 CB PRO A 76 -4.344 0.937 3.870 1.00 0.25 C ATOM 1330 CG PRO A 76 -5.578 0.158 4.190 1.00 0.25 C ATOM 1331 CD PRO A 76 -6.102 0.672 5.531 1.00 0.25 C ATOM 1332 HA PRO A 76 -3.537 2.541 5.044 1.00 0.25 H ATOM 1333 HB2 PRO A 76 -4.271 1.101 2.804 1.00 0.25 H ATOM 1334 HB3 PRO A 76 -3.474 0.409 4.225 1.00 0.25 H ATOM 1335 HG2 PRO A 76 -6.323 0.311 3.417 1.00 0.25 H ATOM 1336 HG3 PRO A 76 -5.343 -0.892 4.273 1.00 0.25 H ATOM 1337 HD2 PRO A 76 -7.178 0.753 5.490 1.00 0.25 H ATOM 1338 HD3 PRO A 76 -5.798 0.018 6.335 1.00 0.26 H ATOM 1339 N ARG A 77 -4.000 4.080 3.066 1.00 0.26 N ATOM 1340 CA ARG A 77 -4.374 5.163 2.116 1.00 0.27 C ATOM 1341 C ARG A 77 -4.496 4.580 0.713 1.00 0.26 C ATOM 1342 O ARG A 77 -3.585 3.965 0.196 1.00 0.25 O ATOM 1343 CB ARG A 77 -3.318 6.274 2.099 1.00 0.30 C ATOM 1344 CG ARG A 77 -3.866 7.445 1.270 1.00 0.35 C ATOM 1345 CD ARG A 77 -2.758 8.444 0.913 1.00 0.92 C ATOM 1346 NE ARG A 77 -2.962 9.671 1.741 1.00 1.64 N ATOM 1347 CZ ARG A 77 -2.190 10.709 1.597 1.00 2.30 C ATOM 1348 NH1 ARG A 77 -1.298 10.732 0.645 1.00 2.56 N ATOM 1349 NH2 ARG A 77 -2.331 11.740 2.385 1.00 3.30 N ATOM 1350 H ARG A 77 -3.058 3.875 3.248 1.00 0.26 H ATOM 1351 HA ARG A 77 -5.329 5.581 2.399 1.00 0.28 H ATOM 1352 HB2 ARG A 77 -3.118 6.602 3.110 1.00 0.32 H ATOM 1353 HB3 ARG A 77 -2.410 5.905 1.648 1.00 0.30 H ATOM 1354 HG2 ARG A 77 -4.304 7.063 0.360 1.00 0.68 H ATOM 1355 HG3 ARG A 77 -4.628 7.954 1.841 1.00 0.67 H ATOM 1356 HD2 ARG A 77 -1.794 8.036 1.134 1.00 1.60 H ATOM 1357 HD3 ARG A 77 -2.806 8.668 -0.151 1.00 1.49 H ATOM 1358 HE ARG A 77 -3.664 9.682 2.424 1.00 2.25 H ATOM 1359 HH11 ARG A 77 -1.207 9.953 0.025 1.00 2.33 H ATOM 1360 HH12 ARG A 77 -0.711 11.533 0.530 1.00 3.39 H ATOM 1361 HH21 ARG A 77 -3.032 11.732 3.099 1.00 3.67 H ATOM 1362 HH22 ARG A 77 -1.742 12.540 2.272 1.00 3.94 H ATOM 1363 N ARG A 78 -5.621 4.784 0.093 1.00 0.29 N ATOM 1364 CA ARG A 78 -5.825 4.263 -1.281 1.00 0.29 C ATOM 1365 C ARG A 78 -5.292 5.273 -2.300 1.00 0.32 C ATOM 1366 O ARG A 78 -5.477 6.467 -2.168 1.00 0.35 O ATOM 1367 CB ARG A 78 -7.320 4.052 -1.520 1.00 0.33 C ATOM 1368 CG ARG A 78 -7.846 2.928 -0.619 1.00 0.32 C ATOM 1369 CD ARG A 78 -7.531 1.552 -1.215 1.00 0.35 C ATOM 1370 NE ARG A 78 -8.078 1.531 -2.618 1.00 0.47 N ATOM 1371 CZ ARG A 78 -8.565 0.459 -3.156 1.00 1.06 C ATOM 1372 NH1 ARG A 78 -8.739 -0.616 -2.437 1.00 2.03 N ATOM 1373 NH2 ARG A 78 -8.916 0.466 -4.413 1.00 1.11 N ATOM 1374 H ARG A 78 -6.334 5.291 0.533 1.00 0.32 H ATOM 1375 HA ARG A 78 -5.306 3.323 -1.401 1.00 0.27 H ATOM 1376 HB2 ARG A 78 -7.848 4.968 -1.294 1.00 0.35 H ATOM 1377 HB3 ARG A 78 -7.483 3.795 -2.552 1.00 0.36 H ATOM 1378 HG2 ARG A 78 -7.383 3.007 0.354 1.00 0.30 H ATOM 1379 HG3 ARG A 78 -8.916 3.031 -0.511 1.00 0.36 H ATOM 1380 HD2 ARG A 78 -6.483 1.395 -1.278 1.00 0.34 H ATOM 1381 HD3 ARG A 78 -7.950 0.781 -0.557 1.00 0.38 H ATOM 1382 HE ARG A 78 -8.020 2.341 -3.160 1.00 1.05 H ATOM 1383 HH11 ARG A 78 -8.496 -0.615 -1.467 1.00 2.05 H ATOM 1384 HH12 ARG A 78 -9.124 -1.439 -2.854 1.00 2.81 H ATOM 1385 HH21 ARG A 78 -8.806 1.298 -4.958 1.00 0.77 H ATOM 1386 HH22 ARG A 78 -9.297 -0.358 -4.831 1.00 1.82 H ATOM 1387 N LYS A 79 -4.658 4.792 -3.327 1.00 0.32 N ATOM 1388 CA LYS A 79 -4.125 5.685 -4.394 1.00 0.38 C ATOM 1389 C LYS A 79 -5.175 5.812 -5.495 1.00 0.44 C ATOM 1390 O LYS A 79 -6.132 5.064 -5.541 1.00 0.46 O ATOM 1391 CB LYS A 79 -2.848 5.074 -4.962 1.00 0.43 C ATOM 1392 CG LYS A 79 -1.778 5.055 -3.871 1.00 0.46 C ATOM 1393 CD LYS A 79 -0.494 4.447 -4.429 1.00 0.58 C ATOM 1394 CE LYS A 79 0.574 4.424 -3.337 1.00 1.16 C ATOM 1395 NZ LYS A 79 1.899 4.121 -3.948 1.00 2.03 N ATOM 1396 H LYS A 79 -4.550 3.822 -3.420 1.00 0.31 H ATOM 1397 HA LYS A 79 -3.920 6.679 -4.023 1.00 0.42 H ATOM 1398 HB2 LYS A 79 -3.047 4.065 -5.294 1.00 0.43 H ATOM 1399 HB3 LYS A 79 -2.502 5.669 -5.794 1.00 0.51 H ATOM 1400 HG2 LYS A 79 -1.586 6.065 -3.539 1.00 0.52 H ATOM 1401 HG3 LYS A 79 -2.124 4.461 -3.039 1.00 0.43 H ATOM 1402 HD2 LYS A 79 -0.692 3.437 -4.759 1.00 1.09 H ATOM 1403 HD3 LYS A 79 -0.146 5.038 -5.261 1.00 1.05 H ATOM 1404 HE2 LYS A 79 0.614 5.388 -2.851 1.00 1.73 H ATOM 1405 HE3 LYS A 79 0.330 3.664 -2.610 1.00 1.71 H ATOM 1406 HZ1 LYS A 79 2.623 4.738 -3.531 1.00 2.52 H ATOM 1407 HZ2 LYS A 79 1.851 4.285 -4.975 1.00 2.49 H ATOM 1408 HZ3 LYS A 79 2.146 3.128 -3.766 1.00 2.51 H ATOM 1409 N ALA A 80 -5.031 6.778 -6.358 1.00 0.52 N ATOM 1410 CA ALA A 80 -6.074 6.943 -7.404 1.00 0.65 C ATOM 1411 C ALA A 80 -6.011 5.735 -8.338 1.00 0.80 C ATOM 1412 O ALA A 80 -5.062 5.557 -9.075 1.00 0.84 O ATOM 1413 CB ALA A 80 -5.831 8.235 -8.190 1.00 0.65 C ATOM 1414 H ALA A 80 -4.276 7.404 -6.287 1.00 0.52 H ATOM 1415 HA ALA A 80 -7.018 7.000 -6.882 1.00 0.76 H ATOM 1416 HB1 ALA A 80 -6.177 8.112 -9.206 1.00 1.22 H ATOM 1417 HB2 ALA A 80 -4.775 8.462 -8.194 1.00 1.26 H ATOM 1418 HB3 ALA A 80 -6.371 9.047 -7.723 1.00 1.15 H ATOM 1419 N LYS A 81 -6.997 4.889 -8.293 1.00 1.03 N ATOM 1420 CA LYS A 81 -6.977 3.676 -9.154 1.00 1.25 C ATOM 1421 C LYS A 81 -8.368 3.423 -9.727 1.00 1.50 C ATOM 1422 O LYS A 81 -9.335 3.272 -9.008 1.00 1.57 O ATOM 1423 CB LYS A 81 -6.547 2.474 -8.309 1.00 1.30 C ATOM 1424 CG LYS A 81 -6.338 1.264 -9.220 1.00 1.57 C ATOM 1425 CD LYS A 81 -5.841 0.077 -8.392 1.00 1.80 C ATOM 1426 CE LYS A 81 -5.514 -1.092 -9.324 1.00 2.22 C ATOM 1427 NZ LYS A 81 -4.517 -1.986 -8.672 1.00 2.52 N ATOM 1428 H LYS A 81 -7.745 5.038 -7.678 1.00 1.10 H ATOM 1429 HA LYS A 81 -6.279 3.790 -9.971 1.00 1.27 H ATOM 1430 HB2 LYS A 81 -5.624 2.705 -7.798 1.00 1.13 H ATOM 1431 HB3 LYS A 81 -7.315 2.249 -7.585 1.00 1.38 H ATOM 1432 HG2 LYS A 81 -7.274 1.006 -9.694 1.00 1.86 H ATOM 1433 HG3 LYS A 81 -5.605 1.504 -9.975 1.00 1.74 H ATOM 1434 HD2 LYS A 81 -4.953 0.365 -7.848 1.00 2.22 H ATOM 1435 HD3 LYS A 81 -6.609 -0.224 -7.695 1.00 2.16 H ATOM 1436 HE2 LYS A 81 -6.415 -1.649 -9.529 1.00 2.73 H ATOM 1437 HE3 LYS A 81 -5.107 -0.713 -10.250 1.00 2.69 H ATOM 1438 HZ1 LYS A 81 -3.635 -1.462 -8.508 1.00 2.85 H ATOM 1439 HZ2 LYS A 81 -4.328 -2.802 -9.290 1.00 2.86 H ATOM 1440 HZ3 LYS A 81 -4.894 -2.319 -7.763 1.00 2.88 H ATOM 1441 N MET A 82 -8.467 3.371 -11.027 1.00 1.69 N ATOM 1442 CA MET A 82 -9.783 3.122 -11.676 1.00 1.95 C ATOM 1443 C MET A 82 -9.605 2.037 -12.739 1.00 2.17 C ATOM 1444 O MET A 82 -8.902 2.220 -13.713 1.00 2.40 O ATOM 1445 CB MET A 82 -10.271 4.421 -12.327 1.00 2.17 C ATOM 1446 CG MET A 82 -11.760 4.315 -12.666 1.00 2.44 C ATOM 1447 SD MET A 82 -12.439 5.980 -12.888 1.00 3.05 S ATOM 1448 CE MET A 82 -13.136 5.737 -14.540 1.00 3.50 C ATOM 1449 H MET A 82 -7.667 3.489 -11.581 1.00 1.70 H ATOM 1450 HA MET A 82 -10.497 2.792 -10.936 1.00 1.94 H ATOM 1451 HB2 MET A 82 -10.117 5.243 -11.643 1.00 2.09 H ATOM 1452 HB3 MET A 82 -9.711 4.599 -13.233 1.00 2.29 H ATOM 1453 HG2 MET A 82 -11.882 3.749 -13.578 1.00 2.70 H ATOM 1454 HG3 MET A 82 -12.283 3.818 -11.862 1.00 2.47 H ATOM 1455 HE1 MET A 82 -13.489 6.685 -14.923 1.00 3.81 H ATOM 1456 HE2 MET A 82 -13.959 5.044 -14.486 1.00 3.83 H ATOM 1457 HE3 MET A 82 -12.374 5.339 -15.196 1.00 3.79 H ATOM 1458 N LEU A 83 -10.222 0.902 -12.558 1.00 2.25 N ATOM 1459 CA LEU A 83 -10.067 -0.190 -13.559 1.00 2.53 C ATOM 1460 C LEU A 83 -11.172 -0.076 -14.622 1.00 2.77 C ATOM 1461 O LEU A 83 -12.301 0.244 -14.308 1.00 2.78 O ATOM 1462 CB LEU A 83 -10.177 -1.543 -12.850 1.00 2.66 C ATOM 1463 CG LEU A 83 -9.172 -1.600 -11.691 1.00 2.60 C ATOM 1464 CD1 LEU A 83 -9.372 -2.897 -10.883 1.00 2.93 C ATOM 1465 CD2 LEU A 83 -7.739 -1.538 -12.250 1.00 2.75 C ATOM 1466 H LEU A 83 -10.778 0.766 -11.762 1.00 2.21 H ATOM 1467 HA LEU A 83 -9.097 -0.105 -14.021 1.00 2.63 H ATOM 1468 HB2 LEU A 83 -11.179 -1.667 -12.466 1.00 2.70 H ATOM 1469 HB3 LEU A 83 -9.959 -2.336 -13.550 1.00 2.89 H ATOM 1470 HG LEU A 83 -9.338 -0.752 -11.041 1.00 2.43 H ATOM 1471 HD11 LEU A 83 -9.973 -3.595 -11.449 1.00 3.19 H ATOM 1472 HD12 LEU A 83 -9.873 -2.666 -9.955 1.00 3.18 H ATOM 1473 HD13 LEU A 83 -8.412 -3.346 -10.666 1.00 3.21 H ATOM 1474 HD21 LEU A 83 -7.087 -2.153 -11.647 1.00 3.05 H ATOM 1475 HD22 LEU A 83 -7.389 -0.516 -12.225 1.00 2.98 H ATOM 1476 HD23 LEU A 83 -7.728 -1.896 -13.270 1.00 2.93 H ATOM 1477 N PRO A 84 -10.856 -0.335 -15.871 1.00 3.09 N ATOM 1478 CA PRO A 84 -11.853 -0.254 -16.980 1.00 3.41 C ATOM 1479 C PRO A 84 -12.972 -1.289 -16.823 1.00 3.49 C ATOM 1480 O PRO A 84 -12.792 -2.322 -16.209 1.00 3.52 O ATOM 1481 CB PRO A 84 -11.036 -0.517 -18.252 1.00 3.83 C ATOM 1482 CG PRO A 84 -9.781 -1.187 -17.800 1.00 3.81 C ATOM 1483 CD PRO A 84 -9.527 -0.735 -16.363 1.00 3.32 C ATOM 1484 HA PRO A 84 -12.274 0.738 -17.024 1.00 3.44 H ATOM 1485 HB2 PRO A 84 -11.585 -1.162 -18.925 1.00 4.06 H ATOM 1486 HB3 PRO A 84 -10.799 0.416 -18.741 1.00 4.06 H ATOM 1487 HG2 PRO A 84 -9.902 -2.261 -17.837 1.00 4.01 H ATOM 1488 HG3 PRO A 84 -8.955 -0.886 -18.425 1.00 4.09 H ATOM 1489 HD2 PRO A 84 -9.132 -1.553 -15.777 1.00 3.32 H ATOM 1490 HD3 PRO A 84 -8.853 0.108 -16.344 1.00 3.29 H ATOM 1491 N LYS A 85 -14.127 -1.016 -17.368 1.00 3.67 N ATOM 1492 CA LYS A 85 -15.262 -1.978 -17.247 1.00 3.89 C ATOM 1493 C LYS A 85 -15.900 -2.189 -18.623 1.00 4.30 C ATOM 1494 O LYS A 85 -15.273 -1.830 -19.606 1.00 4.56 O ATOM 1495 CB LYS A 85 -16.301 -1.405 -16.280 1.00 3.97 C ATOM 1496 CG LYS A 85 -15.643 -1.183 -14.916 1.00 4.14 C ATOM 1497 CD LYS A 85 -16.605 -0.431 -13.983 1.00 4.45 C ATOM 1498 CE LYS A 85 -17.677 -1.371 -13.402 1.00 5.03 C ATOM 1499 NZ LYS A 85 -17.132 -2.744 -13.208 1.00 5.55 N ATOM 1500 OXT LYS A 85 -17.003 -2.709 -18.670 1.00 4.64 O ATOM 1501 H LYS A 85 -14.250 -0.175 -17.855 1.00 3.76 H ATOM 1502 HA LYS A 85 -14.902 -2.924 -16.869 1.00 3.90 H ATOM 1503 HB2 LYS A 85 -16.667 -0.463 -16.663 1.00 4.13 H ATOM 1504 HB3 LYS A 85 -17.121 -2.098 -16.176 1.00 4.25 H ATOM 1505 HG2 LYS A 85 -15.378 -2.135 -14.485 1.00 4.40 H ATOM 1506 HG3 LYS A 85 -14.748 -0.595 -15.050 1.00 4.35 H ATOM 1507 HD2 LYS A 85 -16.043 0.009 -13.173 1.00 4.58 H ATOM 1508 HD3 LYS A 85 -17.092 0.355 -14.541 1.00 4.63 H ATOM 1509 HE2 LYS A 85 -18.001 -0.984 -12.449 1.00 5.26 H ATOM 1510 HE3 LYS A 85 -18.520 -1.410 -14.075 1.00 5.32 H ATOM 1511 HZ1 LYS A 85 -17.781 -3.298 -12.609 1.00 5.78 H ATOM 1512 HZ2 LYS A 85 -16.202 -2.684 -12.748 1.00 5.84 H ATOM 1513 HZ3 LYS A 85 -17.035 -3.210 -14.130 1.00 5.78 H TER 1514 LYS A 85 ATOM 1515 O5' DC B 101 -17.544 -17.311 2.671 1.00 0.49 O ATOM 1516 C5' DC B 101 -17.928 -18.325 1.738 1.00 0.51 C ATOM 1517 C4' DC B 101 -17.136 -18.218 0.438 1.00 0.47 C ATOM 1518 O4' DC B 101 -17.450 -16.972 -0.201 1.00 0.45 O ATOM 1519 C3' DC B 101 -15.623 -18.259 0.631 1.00 0.44 C ATOM 1520 O3' DC B 101 -15.014 -19.012 -0.417 1.00 0.44 O ATOM 1521 C2' DC B 101 -15.177 -16.817 0.539 1.00 0.40 C ATOM 1522 C1' DC B 101 -16.277 -16.152 -0.278 1.00 0.41 C ATOM 1523 N1 DC B 101 -16.644 -14.788 0.195 1.00 0.40 N ATOM 1524 C2 DC B 101 -16.703 -13.769 -0.748 1.00 0.38 C ATOM 1525 O2 DC B 101 -16.456 -14.008 -1.928 1.00 0.38 O ATOM 1526 N3 DC B 101 -17.035 -12.517 -0.329 1.00 0.38 N ATOM 1527 C4 DC B 101 -17.297 -12.265 0.958 1.00 0.39 C ATOM 1528 N4 DC B 101 -17.607 -11.023 1.332 1.00 0.40 N ATOM 1529 C5 DC B 101 -17.241 -13.306 1.935 1.00 0.41 C ATOM 1530 C6 DC B 101 -16.916 -14.543 1.515 1.00 0.41 C ATOM 1531 H5' DC B 101 -18.990 -18.221 1.516 1.00 0.53 H ATOM 1532 H5'' DC B 101 -17.750 -19.304 2.183 1.00 0.53 H ATOM 1533 H4' DC B 101 -17.429 -19.036 -0.220 1.00 0.49 H ATOM 1534 H3' DC B 101 -15.370 -18.678 1.605 1.00 0.46 H ATOM 1535 H2' DC B 101 -15.101 -16.381 1.529 1.00 0.40 H ATOM 1536 H2'' DC B 101 -14.227 -16.753 0.020 1.00 0.38 H ATOM 1537 H1' DC B 101 -15.950 -16.107 -1.323 1.00 0.40 H ATOM 1538 H41 DC B 101 -17.647 -10.285 0.644 1.00 0.39 H ATOM 1539 H42 DC B 101 -17.801 -10.821 2.302 1.00 0.41 H ATOM 1540 H5 DC B 101 -17.447 -13.105 2.986 1.00 0.43 H ATOM 1541 H6 DC B 101 -16.897 -15.358 2.233 1.00 0.43 H ATOM 1542 HO5' DC B 101 -17.835 -17.599 3.540 1.00 0.96 H ATOM 1543 P DC B 102 -13.419 -19.229 -0.426 1.00 0.42 P ATOM 1544 OP1 DC B 102 -13.133 -20.529 -1.073 1.00 0.45 O ATOM 1545 OP2 DC B 102 -12.907 -18.955 0.935 1.00 0.42 O ATOM 1546 O5' DC B 102 -12.901 -18.054 -1.406 1.00 0.37 O ATOM 1547 C5' DC B 102 -13.367 -18.018 -2.758 1.00 0.37 C ATOM 1548 C4' DC B 102 -12.732 -16.898 -3.585 1.00 0.34 C ATOM 1549 O4' DC B 102 -13.221 -15.639 -3.116 1.00 0.32 O ATOM 1550 C3' DC B 102 -11.201 -16.849 -3.527 1.00 0.32 C ATOM 1551 O3' DC B 102 -10.668 -16.705 -4.843 1.00 0.31 O ATOM 1552 C2' DC B 102 -10.873 -15.590 -2.744 1.00 0.29 C ATOM 1553 C1' DC B 102 -12.126 -14.747 -2.917 1.00 0.29 C ATOM 1554 N1 DC B 102 -12.471 -13.874 -1.762 1.00 0.28 N ATOM 1555 C2 DC B 102 -12.807 -12.560 -2.039 1.00 0.26 C ATOM 1556 O2 DC B 102 -12.760 -12.146 -3.194 1.00 0.26 O ATOM 1557 N3 DC B 102 -13.181 -11.756 -1.012 1.00 0.26 N ATOM 1558 C4 DC B 102 -13.226 -12.207 0.243 1.00 0.27 C ATOM 1559 N4 DC B 102 -13.610 -11.382 1.220 1.00 0.27 N ATOM 1560 C5 DC B 102 -12.879 -13.558 0.546 1.00 0.29 C ATOM 1561 C6 DC B 102 -12.509 -14.355 -0.478 1.00 0.29 C ATOM 1562 H5' DC B 102 -14.450 -17.865 -2.742 1.00 0.39 H ATOM 1563 H5'' DC B 102 -13.150 -18.975 -3.232 1.00 0.40 H ATOM 1564 H4' DC B 102 -13.035 -17.021 -4.625 1.00 0.34 H ATOM 1565 H3' DC B 102 -10.798 -17.734 -3.034 1.00 0.34 H ATOM 1566 H2' DC B 102 -10.683 -15.822 -1.701 1.00 0.30 H ATOM 1567 H2'' DC B 102 -10.016 -15.085 -3.189 1.00 0.27 H ATOM 1568 H1' DC B 102 -12.003 -14.138 -3.820 1.00 0.27 H ATOM 1569 H41 DC B 102 -13.859 -10.424 1.005 1.00 0.27 H ATOM 1570 H42 DC B 102 -13.654 -11.713 2.173 1.00 0.29 H ATOM 1571 H5 DC B 102 -12.918 -13.934 1.568 1.00 0.30 H ATOM 1572 H6 DC B 102 -12.247 -15.389 -0.277 1.00 0.31 H ATOM 1573 P DT B 103 -9.073 -16.662 -5.056 1.00 0.30 P ATOM 1574 OP1 DT B 103 -8.764 -17.303 -6.353 1.00 0.32 O ATOM 1575 OP2 DT B 103 -8.428 -17.154 -3.818 1.00 0.31 O ATOM 1576 O5' DT B 103 -8.770 -15.083 -5.189 1.00 0.27 O ATOM 1577 C5' DT B 103 -9.388 -14.355 -6.253 1.00 0.26 C ATOM 1578 C4' DT B 103 -8.940 -12.895 -6.335 1.00 0.24 C ATOM 1579 O4' DT B 103 -9.519 -12.163 -5.251 1.00 0.22 O ATOM 1580 C3' DT B 103 -7.420 -12.691 -6.284 1.00 0.24 C ATOM 1581 O3' DT B 103 -7.013 -11.823 -7.339 1.00 0.24 O ATOM 1582 C2' DT B 103 -7.156 -11.990 -4.956 1.00 0.22 C ATOM 1583 C1' DT B 103 -8.512 -11.387 -4.605 1.00 0.21 C ATOM 1584 N1 DT B 103 -8.833 -11.366 -3.157 1.00 0.20 N ATOM 1585 C2 DT B 103 -9.310 -10.181 -2.626 1.00 0.20 C ATOM 1586 O2 DT B 103 -9.486 -9.184 -3.326 1.00 0.19 O ATOM 1587 N3 DT B 103 -9.589 -10.191 -1.274 1.00 0.20 N ATOM 1588 C4 DT B 103 -9.433 -11.267 -0.419 1.00 0.20 C ATOM 1589 O4 DT B 103 -9.740 -11.170 0.767 1.00 0.21 O ATOM 1590 C5 DT B 103 -8.926 -12.462 -1.061 1.00 0.21 C ATOM 1591 C7 DT B 103 -8.641 -13.698 -0.211 1.00 0.23 C ATOM 1592 C6 DT B 103 -8.658 -12.476 -2.385 1.00 0.21 C ATOM 1593 H5' DT B 103 -10.471 -14.376 -6.094 1.00 0.27 H ATOM 1594 H5'' DT B 103 -9.160 -14.848 -7.198 1.00 0.28 H ATOM 1595 H4' DT B 103 -9.310 -12.476 -7.270 1.00 0.24 H ATOM 1596 H3' DT B 103 -6.895 -13.645 -6.335 1.00 0.25 H ATOM 1597 H2' DT B 103 -6.830 -12.703 -4.205 1.00 0.22 H ATOM 1598 H2'' DT B 103 -6.412 -11.203 -5.079 1.00 0.21 H ATOM 1599 H1' DT B 103 -8.557 -10.366 -4.982 1.00 0.20 H ATOM 1600 H3 DT B 103 -9.925 -9.328 -0.862 1.00 0.20 H ATOM 1601 H71 DT B 103 -8.091 -13.400 0.683 1.00 0.23 H ATOM 1602 H72 DT B 103 -8.043 -14.407 -0.782 1.00 0.24 H ATOM 1603 H73 DT B 103 -9.579 -14.163 0.084 1.00 0.24 H ATOM 1604 H6 DT B 103 -8.378 -13.397 -2.883 1.00 0.22 H ATOM 1605 P DG B 104 -5.453 -11.488 -7.544 1.00 0.24 P ATOM 1606 OP1 DG B 104 -5.211 -11.263 -8.987 1.00 0.26 O ATOM 1607 OP2 DG B 104 -4.659 -12.499 -6.810 1.00 0.25 O ATOM 1608 O5' DG B 104 -5.306 -10.078 -6.780 1.00 0.22 O ATOM 1609 C5' DG B 104 -6.115 -8.987 -7.218 1.00 0.20 C ATOM 1610 C4' DG B 104 -5.842 -7.685 -6.470 1.00 0.19 C ATOM 1611 O4' DG B 104 -6.361 -7.790 -5.139 1.00 0.17 O ATOM 1612 C3' DG B 104 -4.362 -7.305 -6.363 1.00 0.20 C ATOM 1613 O3' DG B 104 -4.196 -5.954 -6.793 1.00 0.20 O ATOM 1614 C2' DG B 104 -4.036 -7.403 -4.874 1.00 0.19 C ATOM 1615 C1' DG B 104 -5.401 -7.288 -4.210 1.00 0.17 C ATOM 1616 N9 DG B 104 -5.546 -8.065 -2.963 1.00 0.16 N ATOM 1617 C8 DG B 104 -5.134 -9.339 -2.689 1.00 0.17 C ATOM 1618 N7 DG B 104 -5.452 -9.781 -1.511 1.00 0.17 N ATOM 1619 C5 DG B 104 -6.139 -8.712 -0.943 1.00 0.16 C ATOM 1620 C6 DG B 104 -6.743 -8.603 0.336 1.00 0.15 C ATOM 1621 O6 DG B 104 -6.766 -9.438 1.236 1.00 0.16 O ATOM 1622 N1 DG B 104 -7.352 -7.367 0.514 1.00 0.15 N ATOM 1623 C2 DG B 104 -7.358 -6.347 -0.418 1.00 0.15 C ATOM 1624 N2 DG B 104 -7.975 -5.219 -0.059 1.00 0.15 N ATOM 1625 N3 DG B 104 -6.785 -6.445 -1.625 1.00 0.15 N ATOM 1626 C4 DG B 104 -6.200 -7.653 -1.820 1.00 0.15 C ATOM 1627 H5' DG B 104 -7.165 -9.258 -7.066 1.00 0.20 H ATOM 1628 H5'' DG B 104 -5.942 -8.824 -8.282 1.00 0.22 H ATOM 1629 H4' DG B 104 -6.367 -6.879 -6.981 1.00 0.19 H ATOM 1630 H3' DG B 104 -3.739 -7.983 -6.946 1.00 0.21 H ATOM 1631 H2' DG B 104 -3.573 -8.361 -4.645 1.00 0.19 H ATOM 1632 H2'' DG B 104 -3.390 -6.580 -4.568 1.00 0.19 H ATOM 1633 H1' DG B 104 -5.613 -6.238 -4.006 1.00 0.17 H ATOM 1634 H8 DG B 104 -4.597 -9.951 -3.414 1.00 0.19 H ATOM 1635 H1 DG B 104 -7.942 -7.290 1.331 1.00 0.15 H ATOM 1636 H21 DG B 104 -8.407 -5.146 0.855 1.00 0.15 H ATOM 1637 H22 DG B 104 -8.012 -4.438 -0.699 1.00 0.16 H ATOM 1638 P DC B 105 -2.749 -5.251 -6.780 1.00 0.21 P ATOM 1639 OP1 DC B 105 -2.600 -4.459 -8.021 1.00 0.23 O ATOM 1640 OP2 DC B 105 -1.736 -6.269 -6.422 1.00 0.22 O ATOM 1641 O5' DC B 105 -2.909 -4.237 -5.544 1.00 0.20 O ATOM 1642 C5' DC B 105 -3.962 -3.276 -5.611 1.00 0.20 C ATOM 1643 C4' DC B 105 -4.096 -2.431 -4.353 1.00 0.19 C ATOM 1644 O4' DC B 105 -4.425 -3.312 -3.271 1.00 0.18 O ATOM 1645 C3' DC B 105 -2.835 -1.659 -3.965 1.00 0.20 C ATOM 1646 O3' DC B 105 -3.167 -0.286 -3.765 1.00 0.21 O ATOM 1647 C2' DC B 105 -2.385 -2.252 -2.631 1.00 0.19 C ATOM 1648 C1' DC B 105 -3.594 -3.042 -2.147 1.00 0.18 C ATOM 1649 N1 DC B 105 -3.265 -4.346 -1.508 1.00 0.17 N ATOM 1650 C2 DC B 105 -3.782 -4.601 -0.241 1.00 0.16 C ATOM 1651 O2 DC B 105 -4.445 -3.744 0.339 1.00 0.16 O ATOM 1652 N3 DC B 105 -3.525 -5.808 0.331 1.00 0.15 N ATOM 1653 C4 DC B 105 -2.796 -6.734 -0.302 1.00 0.15 C ATOM 1654 N4 DC B 105 -2.564 -7.904 0.295 1.00 0.15 N ATOM 1655 C5 DC B 105 -2.261 -6.484 -1.605 1.00 0.16 C ATOM 1656 C6 DC B 105 -2.515 -5.282 -2.168 1.00 0.17 C ATOM 1657 H5' DC B 105 -4.902 -3.800 -5.782 1.00 0.19 H ATOM 1658 H5'' DC B 105 -3.773 -2.613 -6.455 1.00 0.21 H ATOM 1659 H4' DC B 105 -4.914 -1.720 -4.487 1.00 0.20 H ATOM 1660 H3' DC B 105 -2.044 -1.752 -4.705 1.00 0.21 H ATOM 1661 H2' DC B 105 -1.527 -2.905 -2.777 1.00 0.19 H ATOM 1662 H2'' DC B 105 -2.144 -1.458 -1.925 1.00 0.19 H ATOM 1663 H1' DC B 105 -4.173 -2.431 -1.456 1.00 0.18 H ATOM 1664 H41 DC B 105 -2.941 -8.085 1.216 1.00 0.14 H ATOM 1665 H42 DC B 105 -2.013 -8.609 -0.172 1.00 0.15 H ATOM 1666 H5 DC B 105 -1.686 -7.250 -2.133 1.00 0.16 H ATOM 1667 H6 DC B 105 -2.114 -5.053 -3.155 1.00 0.17 H ATOM 1668 P DA B 106 -1.987 0.793 -3.601 1.00 0.23 P ATOM 1669 OP1 DA B 106 -2.496 2.109 -4.047 1.00 0.26 O ATOM 1670 OP2 DA B 106 -0.758 0.232 -4.205 1.00 0.25 O ATOM 1671 O5' DA B 106 -1.787 0.845 -2.011 1.00 0.21 O ATOM 1672 C5' DA B 106 -2.865 1.296 -1.197 1.00 0.20 C ATOM 1673 C4' DA B 106 -2.533 1.237 0.284 1.00 0.19 C ATOM 1674 O4' DA B 106 -2.448 -0.139 0.698 1.00 0.18 O ATOM 1675 C3' DA B 106 -1.207 1.905 0.649 1.00 0.20 C ATOM 1676 O3' DA B 106 -1.358 2.685 1.834 1.00 0.21 O ATOM 1677 C2' DA B 106 -0.270 0.746 0.940 1.00 0.19 C ATOM 1678 C1' DA B 106 -1.224 -0.335 1.410 1.00 0.18 C ATOM 1679 N9 DA B 106 -0.748 -1.716 1.169 1.00 0.17 N ATOM 1680 C8 DA B 106 -0.092 -2.239 0.087 1.00 0.17 C ATOM 1681 N7 DA B 106 0.224 -3.496 0.190 1.00 0.16 N ATOM 1682 C5 DA B 106 -0.267 -3.843 1.446 1.00 0.15 C ATOM 1683 C6 DA B 106 -0.260 -5.043 2.167 1.00 0.15 C ATOM 1684 N6 DA B 106 0.276 -6.172 1.698 1.00 0.14 N ATOM 1685 N1 DA B 106 -0.832 -5.038 3.384 1.00 0.14 N ATOM 1686 C2 DA B 106 -1.381 -3.922 3.865 1.00 0.15 C ATOM 1687 N3 DA B 106 -1.440 -2.736 3.265 1.00 0.16 N ATOM 1688 C4 DA B 106 -0.859 -2.769 2.049 1.00 0.16 C ATOM 1689 H5' DA B 106 -3.738 0.672 -1.388 1.00 0.20 H ATOM 1690 H5'' DA B 106 -3.103 2.326 -1.464 1.00 0.21 H ATOM 1691 H4' DA B 106 -3.334 1.727 0.834 1.00 0.19 H ATOM 1692 H3' DA B 106 -0.833 2.512 -0.176 1.00 0.21 H ATOM 1693 H2' DA B 106 0.258 0.438 0.039 1.00 0.20 H ATOM 1694 H2'' DA B 106 0.426 1.013 1.729 1.00 0.20 H ATOM 1695 H1' DA B 106 -1.408 -0.206 2.476 1.00 0.18 H ATOM 1696 H8 DA B 106 0.122 -1.665 -0.813 1.00 0.18 H ATOM 1697 H61 DA B 106 0.255 -7.013 2.259 1.00 0.14 H ATOM 1698 H62 DA B 106 0.704 -6.186 0.783 1.00 0.15 H ATOM 1699 H2 DA B 106 -1.835 -3.990 4.857 1.00 0.15 H ATOM 1700 P DC B 107 -0.110 3.541 2.378 1.00 0.22 P ATOM 1701 OP1 DC B 107 -0.637 4.731 3.082 1.00 0.24 O ATOM 1702 OP2 DC B 107 0.856 3.707 1.269 1.00 0.23 O ATOM 1703 O5' DC B 107 0.544 2.554 3.474 1.00 0.20 O ATOM 1704 C5' DC B 107 -0.226 2.184 4.621 1.00 0.20 C ATOM 1705 C4' DC B 107 0.543 1.298 5.601 1.00 0.18 C ATOM 1706 O4' DC B 107 0.685 -0.026 5.050 1.00 0.17 O ATOM 1707 C3' DC B 107 1.947 1.818 5.935 1.00 0.19 C ATOM 1708 O3' DC B 107 2.121 1.887 7.358 1.00 0.19 O ATOM 1709 C2' DC B 107 2.888 0.757 5.359 1.00 0.18 C ATOM 1710 C1' DC B 107 2.005 -0.487 5.329 1.00 0.17 C ATOM 1711 N1 DC B 107 2.377 -1.529 4.317 1.00 0.16 N ATOM 1712 C2 DC B 107 2.467 -2.855 4.755 1.00 0.15 C ATOM 1713 O2 DC B 107 2.223 -3.140 5.928 1.00 0.15 O ATOM 1714 N3 DC B 107 2.823 -3.816 3.859 1.00 0.15 N ATOM 1715 C4 DC B 107 3.083 -3.514 2.585 1.00 0.15 C ATOM 1716 N4 DC B 107 3.431 -4.487 1.741 1.00 0.15 N ATOM 1717 C5 DC B 107 2.995 -2.169 2.112 1.00 0.17 C ATOM 1718 C6 DC B 107 2.634 -1.203 3.008 1.00 0.17 C ATOM 1719 H5' DC B 107 -1.115 1.647 4.287 1.00 0.19 H ATOM 1720 H5'' DC B 107 -0.539 3.090 5.140 1.00 0.21 H ATOM 1721 H4' DC B 107 -0.026 1.231 6.526 1.00 0.19 H ATOM 1722 H3' DC B 107 2.126 2.788 5.472 1.00 0.20 H ATOM 1723 H2' DC B 107 3.215 1.037 4.362 1.00 0.18 H ATOM 1724 H2'' DC B 107 3.741 0.608 6.015 1.00 0.18 H ATOM 1725 H1' DC B 107 2.012 -0.937 6.323 1.00 0.16 H ATOM 1726 H41 DC B 107 3.495 -5.439 2.068 1.00 0.15 H ATOM 1727 H42 DC B 107 3.630 -4.270 0.775 1.00 0.16 H ATOM 1728 H5 DC B 107 3.233 -1.932 1.067 1.00 0.17 H ATOM 1729 H6 DC B 107 2.509 -0.166 2.677 1.00 0.18 H ATOM 1730 P DA B 108 3.468 2.538 7.958 1.00 0.21 P ATOM 1731 OP1 DA B 108 3.081 3.592 8.922 1.00 0.23 O ATOM 1732 OP2 DA B 108 4.364 2.869 6.827 1.00 0.22 O ATOM 1733 O5' DA B 108 4.128 1.323 8.781 1.00 0.19 O ATOM 1734 C5' DA B 108 3.547 0.898 10.022 1.00 0.19 C ATOM 1735 C4' DA B 108 4.202 -0.377 10.542 1.00 0.17 C ATOM 1736 O4' DA B 108 3.916 -1.462 9.682 1.00 0.16 O ATOM 1737 C3' DA B 108 5.707 -0.295 10.691 1.00 0.16 C ATOM 1738 O3' DA B 108 6.031 0.164 12.004 1.00 0.17 O ATOM 1739 C2' DA B 108 6.165 -1.734 10.470 1.00 0.15 C ATOM 1740 C1' DA B 108 5.048 -2.330 9.600 1.00 0.15 C ATOM 1741 N9 DA B 108 5.368 -2.416 8.171 1.00 0.15 N ATOM 1742 C8 DA B 108 5.332 -1.439 7.224 1.00 0.15 C ATOM 1743 N7 DA B 108 5.661 -1.822 6.023 1.00 0.15 N ATOM 1744 C5 DA B 108 5.946 -3.177 6.204 1.00 0.14 C ATOM 1745 C6 DA B 108 6.352 -4.194 5.334 1.00 0.13 C ATOM 1746 N6 DA B 108 6.540 -4.016 4.023 1.00 0.14 N ATOM 1747 N1 DA B 108 6.534 -5.414 5.866 1.00 0.13 N ATOM 1748 C2 DA B 108 6.330 -5.626 7.164 1.00 0.14 C ATOM 1749 N3 DA B 108 5.946 -4.742 8.062 1.00 0.14 N ATOM 1750 C4 DA B 108 5.772 -3.533 7.512 1.00 0.14 C ATOM 1751 H5' DA B 108 2.484 0.715 9.871 1.00 0.20 H ATOM 1752 H5'' DA B 108 3.669 1.689 10.758 1.00 0.20 H ATOM 1753 H4' DA B 108 3.782 -0.595 11.523 1.00 0.18 H ATOM 1754 H3' DA B 108 6.129 0.368 9.937 1.00 0.17 H ATOM 1755 H2' DA B 108 7.119 -1.757 9.942 1.00 0.15 H ATOM 1756 H2'' DA B 108 6.236 -2.265 11.419 1.00 0.16 H ATOM 1757 H1' DA B 108 4.789 -3.322 9.975 1.00 0.15 H ATOM 1758 H8 DA B 108 5.089 -0.407 7.476 1.00 0.16 H ATOM 1759 H61 DA B 108 6.834 -4.794 3.443 1.00 0.14 H ATOM 1760 H62 DA B 108 6.388 -3.107 3.609 1.00 0.14 H ATOM 1761 H2 DA B 108 6.506 -6.634 7.531 1.00 0.14 H ATOM 1762 P DA B 109 7.331 1.073 12.256 1.00 0.17 P ATOM 1763 OP1 DA B 109 7.313 1.502 13.670 1.00 0.20 O ATOM 1764 OP2 DA B 109 7.408 2.082 11.176 1.00 0.19 O ATOM 1765 O5' DA B 109 8.565 0.057 12.085 1.00 0.15 O ATOM 1766 C5' DA B 109 8.734 -1.038 12.987 1.00 0.14 C ATOM 1767 C4' DA B 109 10.063 -1.741 12.745 1.00 0.13 C ATOM 1768 O4' DA B 109 10.018 -2.406 11.480 1.00 0.13 O ATOM 1769 C3' DA B 109 11.238 -0.767 12.729 1.00 0.13 C ATOM 1770 O3' DA B 109 12.318 -1.293 13.497 1.00 0.13 O ATOM 1771 C2' DA B 109 11.642 -0.667 11.258 1.00 0.13 C ATOM 1772 C1' DA B 109 11.072 -1.938 10.638 1.00 0.12 C ATOM 1773 N9 DA B 109 10.505 -1.763 9.282 1.00 0.12 N ATOM 1774 C8 DA B 109 9.721 -0.758 8.783 1.00 0.13 C ATOM 1775 N7 DA B 109 9.356 -0.910 7.540 1.00 0.13 N ATOM 1776 C5 DA B 109 9.950 -2.123 7.185 1.00 0.12 C ATOM 1777 C6 DA B 109 9.956 -2.873 5.997 1.00 0.12 C ATOM 1778 N6 DA B 109 9.329 -2.483 4.883 1.00 0.13 N ATOM 1779 N1 DA B 109 10.646 -4.033 6.000 1.00 0.12 N ATOM 1780 C2 DA B 109 11.292 -4.424 7.102 1.00 0.12 C ATOM 1781 N3 DA B 109 11.347 -3.790 8.265 1.00 0.12 N ATOM 1782 C4 DA B 109 10.649 -2.642 8.237 1.00 0.12 C ATOM 1783 H5' DA B 109 7.922 -1.749 12.845 1.00 0.14 H ATOM 1784 H5'' DA B 109 8.707 -0.665 14.011 1.00 0.15 H ATOM 1785 H4' DA B 109 10.231 -2.483 13.528 1.00 0.13 H ATOM 1786 H3' DA B 109 10.940 0.209 13.112 1.00 0.14 H ATOM 1787 H2' DA B 109 11.198 0.216 10.799 1.00 0.14 H ATOM 1788 H2'' DA B 109 12.727 -0.647 11.160 1.00 0.14 H ATOM 1789 H1' DA B 109 11.857 -2.694 10.598 1.00 0.12 H ATOM 1790 H8 DA B 109 9.415 0.101 9.381 1.00 0.14 H ATOM 1791 H61 DA B 109 9.365 -3.061 4.054 1.00 0.13 H ATOM 1792 H62 DA B 109 8.820 -1.612 4.870 1.00 0.14 H ATOM 1793 H2 DA B 109 11.845 -5.361 7.041 1.00 0.12 H ATOM 1794 P DA B 110 13.572 -0.344 13.821 1.00 0.14 P ATOM 1795 OP1 DA B 110 14.118 -0.735 15.139 1.00 0.16 O ATOM 1796 OP2 DA B 110 13.167 1.058 13.576 1.00 0.16 O ATOM 1797 O5' DA B 110 14.634 -0.763 12.694 1.00 0.12 O ATOM 1798 C5' DA B 110 15.150 -2.092 12.697 1.00 0.11 C ATOM 1799 C4' DA B 110 16.177 -2.311 11.598 1.00 0.10 C ATOM 1800 O4' DA B 110 15.504 -2.372 10.332 1.00 0.09 O ATOM 1801 C3' DA B 110 17.229 -1.199 11.525 1.00 0.10 C ATOM 1802 O3' DA B 110 18.544 -1.747 11.519 1.00 0.10 O ATOM 1803 C2' DA B 110 16.978 -0.514 10.182 1.00 0.10 C ATOM 1804 C1' DA B 110 16.189 -1.549 9.391 1.00 0.09 C ATOM 1805 N9 DA B 110 15.190 -0.972 8.470 1.00 0.10 N ATOM 1806 C8 DA B 110 14.267 0.007 8.699 1.00 0.11 C ATOM 1807 N7 DA B 110 13.498 0.288 7.685 1.00 0.11 N ATOM 1808 C5 DA B 110 13.959 -0.581 6.692 1.00 0.10 C ATOM 1809 C6 DA B 110 13.581 -0.801 5.357 1.00 0.11 C ATOM 1810 N6 DA B 110 12.602 -0.129 4.743 1.00 0.12 N ATOM 1811 N1 DA B 110 14.259 -1.736 4.672 1.00 0.10 N ATOM 1812 C2 DA B 110 15.245 -2.413 5.245 1.00 0.10 C ATOM 1813 N3 DA B 110 15.682 -2.289 6.494 1.00 0.09 N ATOM 1814 C4 DA B 110 14.988 -1.348 7.165 1.00 0.10 C ATOM 1815 H5' DA B 110 14.326 -2.791 12.556 1.00 0.11 H ATOM 1816 H5'' DA B 110 15.618 -2.287 13.662 1.00 0.13 H ATOM 1817 H4' DA B 110 16.679 -3.261 11.779 1.00 0.10 H ATOM 1818 H3' DA B 110 17.109 -0.491 12.346 1.00 0.11 H ATOM 1819 H2' DA B 110 16.392 0.394 10.319 1.00 0.11 H ATOM 1820 H2'' DA B 110 17.922 -0.291 9.684 1.00 0.10 H ATOM 1821 H1' DA B 110 16.873 -2.172 8.816 1.00 0.09 H ATOM 1822 H8 DA B 110 14.222 0.545 9.645 1.00 0.11 H ATOM 1823 H61 DA B 110 12.376 -0.334 3.774 1.00 0.12 H ATOM 1824 H62 DA B 110 12.086 0.581 5.242 1.00 0.12 H ATOM 1825 H2 DA B 110 15.763 -3.136 4.611 1.00 0.10 H ATOM 1826 P DC B 111 19.795 -0.745 11.656 1.00 0.11 P ATOM 1827 OP1 DC B 111 20.879 -1.455 12.371 1.00 0.12 O ATOM 1828 OP2 DC B 111 19.297 0.549 12.171 1.00 0.12 O ATOM 1829 O5' DC B 111 20.256 -0.535 10.131 1.00 0.11 O ATOM 1830 C5' DC B 111 20.751 -1.658 9.408 1.00 0.11 C ATOM 1831 C4' DC B 111 21.207 -1.305 7.999 1.00 0.11 C ATOM 1832 O4' DC B 111 20.057 -1.062 7.182 1.00 0.10 O ATOM 1833 C3' DC B 111 22.108 -0.066 7.927 1.00 0.13 C ATOM 1834 O3' DC B 111 23.306 -0.411 7.227 1.00 0.14 O ATOM 1835 C2' DC B 111 21.300 0.949 7.102 1.00 0.13 C ATOM 1836 C1' DC B 111 20.299 0.068 6.353 1.00 0.11 C ATOM 1837 N1 DC B 111 18.970 0.690 6.039 1.00 0.11 N ATOM 1838 C2 DC B 111 18.491 0.558 4.735 1.00 0.11 C ATOM 1839 O2 DC B 111 19.155 -0.034 3.889 1.00 0.11 O ATOM 1840 N3 DC B 111 17.272 1.081 4.431 1.00 0.12 N ATOM 1841 C4 DC B 111 16.535 1.707 5.344 1.00 0.12 C ATOM 1842 N4 DC B 111 15.350 2.212 4.979 1.00 0.14 N ATOM 1843 C5 DC B 111 17.003 1.850 6.693 1.00 0.12 C ATOM 1844 C6 DC B 111 18.224 1.330 6.998 1.00 0.12 C ATOM 1845 H5' DC B 111 19.963 -2.409 9.343 1.00 0.10 H ATOM 1846 H5'' DC B 111 21.595 -2.082 9.953 1.00 0.12 H ATOM 1847 H4' DC B 111 21.753 -2.154 7.588 1.00 0.11 H ATOM 1848 H3' DC B 111 22.329 0.321 8.922 1.00 0.13 H ATOM 1849 H2' DC B 111 20.792 1.655 7.755 1.00 0.13 H ATOM 1850 H2'' DC B 111 21.948 1.473 6.400 1.00 0.14 H ATOM 1851 H1' DC B 111 20.768 -0.275 5.425 1.00 0.11 H ATOM 1852 H41 DC B 111 15.026 2.108 4.022 1.00 0.14 H ATOM 1853 H42 DC B 111 14.778 2.697 5.656 1.00 0.14 H ATOM 1854 H5 DC B 111 16.387 2.342 7.452 1.00 0.13 H ATOM 1855 H6 DC B 111 18.606 1.412 8.016 1.00 0.12 H ATOM 1856 P DA B 112 24.545 0.615 7.136 1.00 0.16 P ATOM 1857 OP1 DA B 112 25.714 -0.001 7.803 1.00 0.17 O ATOM 1858 OP2 DA B 112 24.074 1.955 7.552 1.00 0.17 O ATOM 1859 O5' DA B 112 24.820 0.643 5.557 1.00 0.16 O ATOM 1860 C5' DA B 112 25.165 -0.579 4.900 1.00 0.15 C ATOM 1861 C4' DA B 112 25.127 -0.439 3.391 1.00 0.16 C ATOM 1862 O4' DA B 112 23.793 -0.089 3.011 1.00 0.15 O ATOM 1863 C3' DA B 112 26.048 0.631 2.821 1.00 0.17 C ATOM 1864 O3' DA B 112 26.579 0.180 1.577 1.00 0.18 O ATOM 1865 C2' DA B 112 25.154 1.833 2.597 1.00 0.18 C ATOM 1866 C1' DA B 112 23.784 1.201 2.389 1.00 0.16 C ATOM 1867 N9 DA B 112 22.665 1.969 2.969 1.00 0.16 N ATOM 1868 C8 DA B 112 22.594 2.642 4.159 1.00 0.17 C ATOM 1869 N7 DA B 112 21.459 3.238 4.388 1.00 0.17 N ATOM 1870 C5 DA B 112 20.716 2.932 3.244 1.00 0.17 C ATOM 1871 C6 DA B 112 19.418 3.254 2.829 1.00 0.17 C ATOM 1872 N6 DA B 112 18.569 4.009 3.535 1.00 0.18 N ATOM 1873 N1 DA B 112 19.028 2.779 1.642 1.00 0.17 N ATOM 1874 C2 DA B 112 19.833 2.036 0.898 1.00 0.16 C ATOM 1875 N3 DA B 112 21.070 1.675 1.188 1.00 0.16 N ATOM 1876 C4 DA B 112 21.450 2.161 2.384 1.00 0.16 C ATOM 1877 H5' DA B 112 24.462 -1.355 5.203 1.00 0.14 H ATOM 1878 H5'' DA B 112 26.170 -0.872 5.204 1.00 0.16 H ATOM 1879 H4' DA B 112 25.382 -1.399 2.942 1.00 0.16 H ATOM 1880 H3' DA B 112 26.867 0.858 3.500 1.00 0.18 H ATOM 1881 H2' DA B 112 25.162 2.484 3.466 1.00 0.18 H ATOM 1882 H2'' DA B 112 25.463 2.376 1.708 1.00 0.19 H ATOM 1883 H1' DA B 112 23.625 1.063 1.320 1.00 0.17 H ATOM 1884 H8 DA B 112 23.448 2.706 4.829 1.00 0.17 H ATOM 1885 H61 DA B 112 17.641 4.204 3.171 1.00 0.18 H ATOM 1886 H62 DA B 112 18.851 4.385 4.429 1.00 0.18 H ATOM 1887 H2 DA B 112 19.429 1.687 -0.053 1.00 0.16 H ATOM 1888 P DC B 113 27.657 1.082 0.797 1.00 0.21 P ATOM 1889 OP1 DC B 113 28.497 0.190 -0.033 1.00 0.22 O ATOM 1890 OP2 DC B 113 28.290 1.998 1.772 1.00 0.22 O ATOM 1891 O5' DC B 113 26.723 1.954 -0.183 1.00 0.21 O ATOM 1892 C5' DC B 113 25.920 1.275 -1.149 1.00 0.20 C ATOM 1893 C4' DC B 113 25.100 2.224 -2.019 1.00 0.21 C ATOM 1894 O4' DC B 113 24.027 2.788 -1.250 1.00 0.21 O ATOM 1895 C3' DC B 113 25.920 3.383 -2.598 1.00 0.24 C ATOM 1896 O3' DC B 113 25.701 3.481 -4.008 1.00 0.25 O ATOM 1897 C2' DC B 113 25.356 4.629 -1.912 1.00 0.25 C ATOM 1898 C1' DC B 113 23.954 4.188 -1.515 1.00 0.23 C ATOM 1899 N1 DC B 113 23.378 4.851 -0.306 1.00 0.22 N ATOM 1900 C2 DC B 113 22.093 5.379 -0.410 1.00 0.23 C ATOM 1901 O2 DC B 113 21.507 5.384 -1.491 1.00 0.24 O ATOM 1902 N3 DC B 113 21.519 5.907 0.700 1.00 0.22 N ATOM 1903 C4 DC B 113 22.151 5.932 1.871 1.00 0.22 C ATOM 1904 N4 DC B 113 21.524 6.448 2.935 1.00 0.22 N ATOM 1905 C5 DC B 113 23.475 5.402 1.997 1.00 0.22 C ATOM 1906 C6 DC B 113 24.050 4.874 0.890 1.00 0.22 C ATOM 1907 H5' DC B 113 25.240 0.607 -0.624 1.00 0.19 H ATOM 1908 H5'' DC B 113 26.570 0.682 -1.792 1.00 0.21 H ATOM 1909 H4' DC B 113 24.672 1.650 -2.842 1.00 0.21 H ATOM 1910 H3' DC B 113 26.981 3.264 -2.375 1.00 0.24 H ATOM 1911 H2' DC B 113 25.951 4.891 -1.040 1.00 0.25 H ATOM 1912 H2'' DC B 113 25.311 5.460 -2.612 1.00 0.27 H ATOM 1913 H1' DC B 113 23.289 4.347 -2.367 1.00 0.24 H ATOM 1914 H41 DC B 113 20.584 6.816 2.840 1.00 0.22 H ATOM 1915 H42 DC B 113 21.986 6.466 3.833 1.00 0.22 H ATOM 1916 H5 DC B 113 24.002 5.424 2.951 1.00 0.22 H ATOM 1917 H6 DC B 113 25.056 4.463 0.953 1.00 0.22 H ATOM 1918 P DC B 114 26.616 4.476 -4.884 1.00 0.28 P ATOM 1919 OP1 DC B 114 26.789 3.878 -6.227 1.00 0.30 O ATOM 1920 OP2 DC B 114 27.807 4.834 -4.081 1.00 0.29 O ATOM 1921 O5' DC B 114 25.701 5.791 -5.037 1.00 0.30 O ATOM 1922 C5' DC B 114 24.485 5.713 -5.784 1.00 0.31 C ATOM 1923 C4' DC B 114 23.771 7.059 -5.877 1.00 0.33 C ATOM 1924 O4' DC B 114 23.175 7.362 -4.618 1.00 0.32 O ATOM 1925 C3' DC B 114 24.684 8.228 -6.272 1.00 0.37 C ATOM 1926 O3' DC B 114 24.159 8.947 -7.392 1.00 0.41 O ATOM 1927 C2' DC B 114 24.706 9.126 -5.036 1.00 0.36 C ATOM 1928 C1' DC B 114 23.448 8.715 -4.284 1.00 0.33 C ATOM 1929 N1 DC B 114 23.540 8.781 -2.807 1.00 0.32 N ATOM 1930 C2 DC B 114 22.498 9.397 -2.134 1.00 0.31 C ATOM 1931 O2 DC B 114 21.582 9.907 -2.770 1.00 0.33 O ATOM 1932 N3 DC B 114 22.518 9.410 -0.777 1.00 0.30 N ATOM 1933 C4 DC B 114 23.520 8.843 -0.097 1.00 0.29 C ATOM 1934 N4 DC B 114 23.496 8.869 1.238 1.00 0.28 N ATOM 1935 C5 DC B 114 24.605 8.207 -0.783 1.00 0.29 C ATOM 1936 C6 DC B 114 24.575 8.198 -2.133 1.00 0.30 C ATOM 1937 H5' DC B 114 23.821 4.995 -5.301 1.00 0.29 H ATOM 1938 H5'' DC B 114 24.711 5.364 -6.792 1.00 0.32 H ATOM 1939 H4' DC B 114 22.979 6.976 -6.621 1.00 0.35 H ATOM 1940 H3' DC B 114 25.689 7.867 -6.483 1.00 0.37 H ATOM 1941 HO3' DC B 114 23.201 8.899 -7.339 1.00 1.00 H ATOM 1942 H2' DC B 114 25.599 8.947 -4.445 1.00 0.36 H ATOM 1943 H2'' DC B 114 24.648 10.174 -5.330 1.00 0.39 H ATOM 1944 H1' DC B 114 22.617 9.337 -4.628 1.00 0.35 H ATOM 1945 H41 DC B 114 22.729 9.317 1.722 1.00 0.29 H ATOM 1946 H42 DC B 114 24.244 8.441 1.764 1.00 0.28 H ATOM 1947 H5 DC B 114 25.426 7.746 -0.234 1.00 0.29 H ATOM 1948 H6 DC B 114 25.378 7.711 -2.689 1.00 0.31 H TER 1949 DC B 114 ATOM 1950 O5' DG C 115 15.525 12.985 5.254 1.00 0.35 O ATOM 1951 C5' DG C 115 14.938 14.168 4.704 1.00 0.37 C ATOM 1952 C4' DG C 115 14.545 13.972 3.244 1.00 0.36 C ATOM 1953 O4' DG C 115 15.728 13.733 2.472 1.00 0.36 O ATOM 1954 C3' DG C 115 13.599 12.796 3.011 1.00 0.35 C ATOM 1955 O3' DG C 115 12.627 13.140 2.014 1.00 0.36 O ATOM 1956 C2' DG C 115 14.489 11.674 2.501 1.00 0.33 C ATOM 1957 C1' DG C 115 15.741 12.381 2.000 1.00 0.33 C ATOM 1958 N9 DG C 115 16.996 11.750 2.455 1.00 0.32 N ATOM 1959 C8 DG C 115 17.376 11.394 3.717 1.00 0.31 C ATOM 1960 N7 DG C 115 18.554 10.851 3.807 1.00 0.30 N ATOM 1961 C5 DG C 115 19.002 10.843 2.488 1.00 0.30 C ATOM 1962 C6 DG C 115 20.228 10.369 1.943 1.00 0.29 C ATOM 1963 O6 DG C 115 21.177 9.846 2.530 1.00 0.29 O ATOM 1964 N1 DG C 115 20.271 10.548 0.566 1.00 0.30 N ATOM 1965 C2 DG C 115 19.266 11.114 -0.192 1.00 0.32 C ATOM 1966 N2 DG C 115 19.493 11.207 -1.501 1.00 0.33 N ATOM 1967 N3 DG C 115 18.118 11.559 0.316 1.00 0.32 N ATOM 1968 C4 DG C 115 18.053 11.394 1.655 1.00 0.31 C ATOM 1969 H5' DG C 115 15.656 14.985 4.772 1.00 0.38 H ATOM 1970 H5'' DG C 115 14.050 14.425 5.280 1.00 0.38 H ATOM 1971 H4' DG C 115 14.067 14.883 2.884 1.00 0.38 H ATOM 1972 H3' DG C 115 13.111 12.506 3.940 1.00 0.35 H ATOM 1973 H2' DG C 115 14.737 10.985 3.309 1.00 0.32 H ATOM 1974 H2'' DG C 115 14.003 11.148 1.686 1.00 0.32 H ATOM 1975 H1' DG C 115 15.729 12.391 0.910 1.00 0.34 H ATOM 1976 H8 DG C 115 16.738 11.554 4.586 1.00 0.31 H ATOM 1977 H1 DG C 115 21.111 10.233 0.105 1.00 0.30 H ATOM 1978 H21 DG C 115 20.362 10.870 -1.887 1.00 0.33 H ATOM 1979 H22 DG C 115 18.795 11.614 -2.106 1.00 0.35 H ATOM 1980 HO5' DG C 115 15.132 12.846 6.118 1.00 0.81 H ATOM 1981 P DG C 116 11.429 12.120 1.651 1.00 0.35 P ATOM 1982 OP1 DG C 116 10.304 12.904 1.095 1.00 0.38 O ATOM 1983 OP2 DG C 116 11.208 11.231 2.814 1.00 0.34 O ATOM 1984 O5' DG C 116 12.072 11.243 0.460 1.00 0.34 O ATOM 1985 C5' DG C 116 12.488 11.891 -0.744 1.00 0.35 C ATOM 1986 C4' DG C 116 13.266 10.965 -1.678 1.00 0.33 C ATOM 1987 O4' DG C 116 14.481 10.573 -1.016 1.00 0.31 O ATOM 1988 C3' DG C 116 12.540 9.671 -2.074 1.00 0.32 C ATOM 1989 O3' DG C 116 12.718 9.430 -3.474 1.00 0.32 O ATOM 1990 C2' DG C 116 13.248 8.578 -1.302 1.00 0.30 C ATOM 1991 C1' DG C 116 14.633 9.159 -1.132 1.00 0.29 C ATOM 1992 N9 DG C 116 15.368 8.665 0.045 1.00 0.28 N ATOM 1993 C8 DG C 116 15.002 8.632 1.360 1.00 0.27 C ATOM 1994 N7 DG C 116 15.912 8.182 2.173 1.00 0.26 N ATOM 1995 C5 DG C 116 16.977 7.882 1.322 1.00 0.25 C ATOM 1996 C6 DG C 116 18.264 7.347 1.613 1.00 0.24 C ATOM 1997 O6 DG C 116 18.742 7.043 2.707 1.00 0.23 O ATOM 1998 N1 DG C 116 19.019 7.193 0.458 1.00 0.24 N ATOM 1999 C2 DG C 116 18.602 7.514 -0.817 1.00 0.25 C ATOM 2000 N2 DG C 116 19.467 7.273 -1.806 1.00 0.25 N ATOM 2001 N3 DG C 116 17.400 8.021 -1.090 1.00 0.26 N ATOM 2002 C4 DG C 116 16.645 8.176 0.020 1.00 0.26 C ATOM 2003 H5' DG C 116 13.121 12.740 -0.486 1.00 0.36 H ATOM 2004 H5'' DG C 116 11.606 12.257 -1.269 1.00 0.36 H ATOM 2005 H4' DG C 116 13.520 11.515 -2.584 1.00 0.34 H ATOM 2006 H3' DG C 116 11.484 9.716 -1.812 1.00 0.33 H ATOM 2007 H2' DG C 116 12.772 8.415 -0.336 1.00 0.29 H ATOM 2008 H2'' DG C 116 13.281 7.660 -1.882 1.00 0.29 H ATOM 2009 H1' DG C 116 15.241 8.964 -2.014 1.00 0.29 H ATOM 2010 H8 DG C 116 14.010 8.924 1.700 1.00 0.28 H ATOM 2011 H1 DG C 116 19.945 6.817 0.584 1.00 0.23 H ATOM 2012 H21 DG C 116 20.381 6.884 -1.597 1.00 0.25 H ATOM 2013 H22 DG C 116 19.211 7.477 -2.761 1.00 0.26 H ATOM 2014 P DT C 117 12.039 8.144 -4.164 1.00 0.31 P ATOM 2015 OP1 DT C 117 11.695 8.496 -5.559 1.00 0.33 O ATOM 2016 OP2 DT C 117 10.990 7.632 -3.254 1.00 0.31 O ATOM 2017 O5' DT C 117 13.246 7.065 -4.199 1.00 0.28 O ATOM 2018 C5' DT C 117 14.425 7.351 -4.966 1.00 0.28 C ATOM 2019 C4' DT C 117 15.450 6.210 -4.948 1.00 0.26 C ATOM 2020 O4' DT C 117 16.012 6.094 -3.636 1.00 0.24 O ATOM 2021 C3' DT C 117 14.859 4.845 -5.328 1.00 0.25 C ATOM 2022 O3' DT C 117 15.674 4.190 -6.305 1.00 0.24 O ATOM 2023 C2' DT C 117 14.928 4.033 -4.039 1.00 0.23 C ATOM 2024 C1' DT C 117 16.050 4.717 -3.277 1.00 0.22 C ATOM 2025 N1 DT C 117 15.956 4.631 -1.797 1.00 0.21 N ATOM 2026 C2 DT C 117 17.052 4.142 -1.120 1.00 0.20 C ATOM 2027 O2 DT C 117 18.053 3.733 -1.711 1.00 0.20 O ATOM 2028 N3 DT C 117 16.968 4.136 0.254 1.00 0.20 N ATOM 2029 C4 DT C 117 15.895 4.560 1.012 1.00 0.20 C ATOM 2030 O4 DT C 117 15.951 4.534 2.246 1.00 0.20 O ATOM 2031 C5 DT C 117 14.782 5.053 0.221 1.00 0.22 C ATOM 2032 C7 DT C 117 13.520 5.536 0.926 1.00 0.23 C ATOM 2033 C6 DT C 117 14.849 5.081 -1.132 1.00 0.22 C ATOM 2034 H5' DT C 117 14.894 8.249 -4.564 1.00 0.29 H ATOM 2035 H5'' DT C 117 14.132 7.541 -5.998 1.00 0.30 H ATOM 2036 H4' DT C 117 16.249 6.450 -5.650 1.00 0.26 H ATOM 2037 H3' DT C 117 13.830 4.943 -5.675 1.00 0.26 H ATOM 2038 H2' DT C 117 13.988 4.093 -3.492 1.00 0.23 H ATOM 2039 H2'' DT C 117 15.188 2.997 -4.255 1.00 0.22 H ATOM 2040 H1' DT C 117 17.013 4.311 -3.596 1.00 0.22 H ATOM 2041 H3 DT C 117 17.795 3.844 0.746 1.00 0.19 H ATOM 2042 H71 DT C 117 13.473 6.622 0.887 1.00 0.24 H ATOM 2043 H72 DT C 117 13.537 5.210 1.966 1.00 0.22 H ATOM 2044 H73 DT C 117 12.644 5.118 0.429 1.00 0.23 H ATOM 2045 H6 DT C 117 14.079 5.581 -1.710 1.00 0.23 H ATOM 2046 P DG C 118 15.047 2.939 -7.101 1.00 0.24 P ATOM 2047 OP1 DG C 118 15.803 2.777 -8.362 1.00 0.24 O ATOM 2048 OP2 DG C 118 13.578 3.120 -7.148 1.00 0.25 O ATOM 2049 O5' DG C 118 15.359 1.658 -6.167 1.00 0.21 O ATOM 2050 C5' DG C 118 16.685 1.123 -6.053 1.00 0.19 C ATOM 2051 C4' DG C 118 16.705 -0.124 -5.162 1.00 0.17 C ATOM 2052 O4' DG C 118 16.705 0.269 -3.786 1.00 0.16 O ATOM 2053 C3' DG C 118 15.493 -1.037 -5.395 1.00 0.16 C ATOM 2054 O3' DG C 118 15.862 -2.410 -5.508 1.00 0.15 O ATOM 2055 C2' DG C 118 14.653 -0.859 -4.132 1.00 0.16 C ATOM 2056 C1' DG C 118 15.710 -0.476 -3.089 1.00 0.15 C ATOM 2057 N9 DG C 118 15.224 0.372 -1.975 1.00 0.15 N ATOM 2058 C8 DG C 118 14.286 1.360 -2.003 1.00 0.17 C ATOM 2059 N7 DG C 118 14.049 1.936 -0.857 1.00 0.17 N ATOM 2060 C5 DG C 118 14.928 1.269 0.013 1.00 0.15 C ATOM 2061 C6 DG C 118 15.161 1.446 1.410 1.00 0.15 C ATOM 2062 O6 DG C 118 14.611 2.220 2.198 1.00 0.16 O ATOM 2063 N1 DG C 118 16.139 0.582 1.881 1.00 0.13 N ATOM 2064 C2 DG C 118 16.816 -0.351 1.119 1.00 0.12 C ATOM 2065 N2 DG C 118 17.745 -1.081 1.744 1.00 0.11 N ATOM 2066 N3 DG C 118 16.595 -0.528 -0.187 1.00 0.13 N ATOM 2067 C4 DG C 118 15.647 0.312 -0.671 1.00 0.14 C ATOM 2068 H5' DG C 118 17.339 1.881 -5.622 1.00 0.19 H ATOM 2069 H5'' DG C 118 17.050 0.859 -7.046 1.00 0.20 H ATOM 2070 H4' DG C 118 17.615 -0.688 -5.367 1.00 0.16 H ATOM 2071 H3' DG C 118 14.965 -0.732 -6.300 1.00 0.18 H ATOM 2072 H2' DG C 118 13.923 -0.066 -4.267 1.00 0.17 H ATOM 2073 H2'' DG C 118 14.165 -1.794 -3.859 1.00 0.16 H ATOM 2074 H1' DG C 118 16.161 -1.385 -2.682 1.00 0.14 H ATOM 2075 H8 DG C 118 13.893 1.698 -2.956 1.00 0.18 H ATOM 2076 H1 DG C 118 16.328 0.667 2.869 1.00 0.13 H ATOM 2077 H21 DG C 118 17.934 -0.928 2.730 1.00 0.11 H ATOM 2078 H22 DG C 118 18.276 -1.768 1.229 1.00 0.11 H ATOM 2079 P DT C 119 14.691 -3.453 -5.890 1.00 0.16 P ATOM 2080 OP1 DT C 119 15.239 -4.427 -6.860 1.00 0.17 O ATOM 2081 OP2 DT C 119 13.475 -2.680 -6.228 1.00 0.17 O ATOM 2082 O5' DT C 119 14.429 -4.221 -4.503 1.00 0.15 O ATOM 2083 C5' DT C 119 15.396 -5.172 -4.076 1.00 0.14 C ATOM 2084 C4' DT C 119 15.191 -5.662 -2.646 1.00 0.13 C ATOM 2085 O4' DT C 119 15.286 -4.563 -1.752 1.00 0.12 O ATOM 2086 C3' DT C 119 13.845 -6.268 -2.310 1.00 0.13 C ATOM 2087 O3' DT C 119 13.781 -7.634 -2.711 1.00 0.14 O ATOM 2088 C2' DT C 119 13.799 -6.136 -0.777 1.00 0.12 C ATOM 2089 C1' DT C 119 14.766 -4.983 -0.482 1.00 0.12 C ATOM 2090 N1 DT C 119 14.126 -3.799 0.130 1.00 0.12 N ATOM 2091 C2 DT C 119 14.164 -3.661 1.494 1.00 0.11 C ATOM 2092 O2 DT C 119 14.718 -4.480 2.220 1.00 0.10 O ATOM 2093 N3 DT C 119 13.540 -2.544 2.010 1.00 0.12 N ATOM 2094 C4 DT C 119 12.866 -1.565 1.279 1.00 0.13 C ATOM 2095 O4 DT C 119 12.307 -0.622 1.849 1.00 0.14 O ATOM 2096 C5 DT C 119 12.884 -1.807 -0.163 1.00 0.14 C ATOM 2097 C7 DT C 119 12.245 -0.812 -1.131 1.00 0.15 C ATOM 2098 C6 DT C 119 13.504 -2.895 -0.665 1.00 0.13 C ATOM 2099 H5' DT C 119 16.385 -4.720 -4.150 1.00 0.14 H ATOM 2100 H5'' DT C 119 15.351 -6.025 -4.749 1.00 0.15 H ATOM 2101 H4' DT C 119 15.988 -6.384 -2.410 1.00 0.13 H ATOM 2102 H3' DT C 119 13.037 -5.699 -2.765 1.00 0.14 H ATOM 2103 H2' DT C 119 12.801 -5.859 -0.458 1.00 0.13 H ATOM 2104 H2'' DT C 119 14.126 -7.056 -0.293 1.00 0.12 H ATOM 2105 H1' DT C 119 15.612 -5.312 0.108 1.00 0.11 H ATOM 2106 H3 DT C 119 13.642 -2.423 3.011 1.00 0.12 H ATOM 2107 H71 DT C 119 11.189 -1.053 -1.254 1.00 0.16 H ATOM 2108 H72 DT C 119 12.744 -0.879 -2.100 1.00 0.16 H ATOM 2109 H73 DT C 119 12.344 0.201 -0.739 1.00 0.15 H ATOM 2110 H6 DT C 119 13.530 -3.095 -1.729 1.00 0.13 H ATOM 2111 P DT C 120 12.345 -8.362 -2.804 1.00 0.15 P ATOM 2112 OP1 DT C 120 12.490 -9.578 -3.635 1.00 0.17 O ATOM 2113 OP2 DT C 120 11.324 -7.346 -3.142 1.00 0.16 O ATOM 2114 O5' DT C 120 12.134 -8.810 -1.277 1.00 0.14 O ATOM 2115 C5' DT C 120 13.086 -9.722 -0.750 1.00 0.15 C ATOM 2116 C4' DT C 120 12.954 -9.983 0.736 1.00 0.14 C ATOM 2117 O4' DT C 120 13.233 -8.803 1.481 1.00 0.14 O ATOM 2118 C3' DT C 120 11.621 -10.524 1.221 1.00 0.14 C ATOM 2119 O3' DT C 120 11.640 -11.957 1.107 1.00 0.15 O ATOM 2120 C2' DT C 120 11.610 -10.092 2.686 1.00 0.14 C ATOM 2121 C1' DT C 120 12.440 -8.798 2.673 1.00 0.13 C ATOM 2122 N1 DT C 120 11.639 -7.562 2.629 1.00 0.13 N ATOM 2123 C2 DT C 120 11.273 -6.971 3.827 1.00 0.13 C ATOM 2124 O2 DT C 120 11.641 -7.407 4.912 1.00 0.14 O ATOM 2125 N3 DT C 120 10.506 -5.828 3.725 1.00 0.13 N ATOM 2126 C4 DT C 120 10.079 -5.244 2.547 1.00 0.13 C ATOM 2127 O4 DT C 120 9.419 -4.207 2.560 1.00 0.13 O ATOM 2128 C5 DT C 120 10.509 -5.943 1.355 1.00 0.13 C ATOM 2129 C7 DT C 120 10.001 -5.468 0.007 1.00 0.15 C ATOM 2130 C6 DT C 120 11.266 -7.038 1.429 1.00 0.13 C ATOM 2131 H5' DT C 120 14.072 -9.311 -0.926 1.00 0.15 H ATOM 2132 H5'' DT C 120 12.999 -10.669 -1.282 1.00 0.16 H ATOM 2133 H4' DT C 120 13.705 -10.731 0.976 1.00 0.15 H ATOM 2134 H3' DT C 120 10.750 -10.117 0.705 1.00 0.15 H ATOM 2135 H2' DT C 120 10.592 -9.893 3.022 1.00 0.14 H ATOM 2136 H2'' DT C 120 12.083 -10.847 3.314 1.00 0.14 H ATOM 2137 H1' DT C 120 13.088 -8.773 3.544 1.00 0.13 H ATOM 2138 H3 DT C 120 10.176 -5.412 4.592 1.00 0.13 H ATOM 2139 H71 DT C 120 10.145 -4.398 -0.086 1.00 0.16 H ATOM 2140 H72 DT C 120 8.950 -5.712 -0.089 1.00 0.16 H ATOM 2141 H73 DT C 120 10.561 -5.979 -0.779 1.00 0.16 H ATOM 2142 H6 DT C 120 11.749 -7.393 0.540 1.00 0.14 H ATOM 2143 P DT C 121 10.302 -12.797 0.753 1.00 0.16 P ATOM 2144 OP1 DT C 121 10.704 -14.192 0.471 1.00 0.17 O ATOM 2145 OP2 DT C 121 9.540 -12.035 -0.261 1.00 0.16 O ATOM 2146 O5' DT C 121 9.457 -12.783 2.125 1.00 0.15 O ATOM 2147 C5' DT C 121 9.989 -13.380 3.311 1.00 0.15 C ATOM 2148 C4' DT C 121 9.109 -13.102 4.524 1.00 0.14 C ATOM 2149 O4' DT C 121 9.043 -11.675 4.624 1.00 0.13 O ATOM 2150 C3' DT C 121 7.659 -13.623 4.474 1.00 0.15 C ATOM 2151 O3' DT C 121 7.395 -14.373 5.670 1.00 0.15 O ATOM 2152 C2' DT C 121 6.768 -12.386 4.518 1.00 0.14 C ATOM 2153 C1' DT C 121 7.714 -11.252 4.889 1.00 0.13 C ATOM 2154 N1 DT C 121 7.480 -9.970 4.155 1.00 0.13 N ATOM 2155 C2 DT C 121 7.474 -8.821 4.911 1.00 0.13 C ATOM 2156 O2 DT C 121 7.706 -8.846 6.117 1.00 0.14 O ATOM 2157 N3 DT C 121 7.196 -7.643 4.248 1.00 0.14 N ATOM 2158 C4 DT C 121 6.941 -7.508 2.892 1.00 0.13 C ATOM 2159 O4 DT C 121 6.721 -6.403 2.394 1.00 0.14 O ATOM 2160 C5 DT C 121 6.968 -8.766 2.174 1.00 0.14 C ATOM 2161 C7 DT C 121 6.633 -8.805 0.694 1.00 0.14 C ATOM 2162 C6 DT C 121 7.226 -9.926 2.801 1.00 0.14 C ATOM 2163 H5' DT C 121 10.979 -12.970 3.494 1.00 0.14 H ATOM 2164 H5'' DT C 121 10.068 -14.456 3.164 1.00 0.16 H ATOM 2165 H4' DT C 121 9.547 -13.475 5.447 1.00 0.14 H ATOM 2166 H3' DT C 121 7.417 -14.214 3.592 1.00 0.16 H ATOM 2167 H2' DT C 121 6.301 -12.220 3.556 1.00 0.15 H ATOM 2168 H2'' DT C 121 6.004 -12.502 5.286 1.00 0.14 H ATOM 2169 H1' DT C 121 7.624 -11.072 5.965 1.00 0.13 H ATOM 2170 H3 DT C 121 7.092 -6.827 4.836 1.00 0.14 H ATOM 2171 H71 DT C 121 5.685 -9.324 0.560 1.00 0.16 H ATOM 2172 H72 DT C 121 7.413 -9.341 0.161 1.00 0.16 H ATOM 2173 H73 DT C 121 6.553 -7.794 0.309 1.00 0.16 H ATOM 2174 H6 DT C 121 7.146 -10.851 2.242 1.00 0.15 H ATOM 2175 P DG C 122 6.025 -15.218 5.815 1.00 0.17 P ATOM 2176 OP1 DG C 122 6.271 -16.348 6.739 1.00 0.18 O ATOM 2177 OP2 DG C 122 5.503 -15.482 4.456 1.00 0.18 O ATOM 2178 O5' DG C 122 5.024 -14.185 6.543 1.00 0.16 O ATOM 2179 C5' DG C 122 5.313 -13.712 7.864 1.00 0.15 C ATOM 2180 C4' DG C 122 4.314 -12.656 8.325 1.00 0.14 C ATOM 2181 O4' DG C 122 4.469 -11.481 7.512 1.00 0.14 O ATOM 2182 C3' DG C 122 2.846 -13.074 8.227 1.00 0.14 C ATOM 2183 O3' DG C 122 2.195 -12.694 9.437 1.00 0.14 O ATOM 2184 C2' DG C 122 2.282 -12.258 7.079 1.00 0.14 C ATOM 2185 C1' DG C 122 3.177 -11.034 7.104 1.00 0.14 C ATOM 2186 N9 DG C 122 3.305 -10.356 5.808 1.00 0.14 N ATOM 2187 C8 DG C 122 3.530 -10.894 4.575 1.00 0.14 C ATOM 2188 N7 DG C 122 3.585 -10.037 3.603 1.00 0.14 N ATOM 2189 C5 DG C 122 3.379 -8.816 4.243 1.00 0.14 C ATOM 2190 C6 DG C 122 3.327 -7.505 3.702 1.00 0.14 C ATOM 2191 O6 DG C 122 3.454 -7.163 2.532 1.00 0.14 O ATOM 2192 N1 DG C 122 3.096 -6.553 4.687 1.00 0.14 N ATOM 2193 C2 DG C 122 2.935 -6.825 6.030 1.00 0.14 C ATOM 2194 N2 DG C 122 2.715 -5.774 6.824 1.00 0.15 N ATOM 2195 N3 DG C 122 2.985 -8.060 6.544 1.00 0.13 N ATOM 2196 C4 DG C 122 3.208 -9.001 5.594 1.00 0.13 C ATOM 2197 H5' DG C 122 6.306 -13.281 7.871 1.00 0.15 H ATOM 2198 H5'' DG C 122 5.285 -14.553 8.557 1.00 0.16 H ATOM 2199 H4' DG C 122 4.487 -12.374 9.365 1.00 0.14 H ATOM 2200 H3' DG C 122 2.733 -14.145 8.059 1.00 0.15 H ATOM 2201 H2' DG C 122 2.381 -12.794 6.135 1.00 0.15 H ATOM 2202 H2'' DG C 122 1.239 -11.989 7.270 1.00 0.14 H ATOM 2203 H1' DG C 122 2.801 -10.325 7.839 1.00 0.13 H ATOM 2204 H8 DG C 122 3.654 -11.965 4.419 1.00 0.15 H ATOM 2205 H1 DG C 122 3.048 -5.594 4.373 1.00 0.14 H ATOM 2206 H21 DG C 122 2.675 -4.841 6.431 1.00 0.15 H ATOM 2207 H22 DG C 122 2.586 -5.909 7.816 1.00 0.15 H ATOM 2208 P DT C 123 0.645 -13.038 9.664 1.00 0.14 P ATOM 2209 OP1 DT C 123 0.484 -13.562 11.039 1.00 0.15 O ATOM 2210 OP2 DT C 123 0.174 -13.836 8.510 1.00 0.16 O ATOM 2211 O5' DT C 123 -0.049 -11.588 9.591 1.00 0.14 O ATOM 2212 C5' DT C 123 0.334 -10.593 10.547 1.00 0.14 C ATOM 2213 C4' DT C 123 -0.536 -9.341 10.471 1.00 0.14 C ATOM 2214 O4' DT C 123 -0.213 -8.582 9.296 1.00 0.14 O ATOM 2215 C3' DT C 123 -2.029 -9.659 10.443 1.00 0.15 C ATOM 2216 O3' DT C 123 -2.706 -8.873 11.418 1.00 0.17 O ATOM 2217 C2' DT C 123 -2.496 -9.255 9.045 1.00 0.16 C ATOM 2218 C1' DT C 123 -1.402 -8.311 8.550 1.00 0.15 C ATOM 2219 N1 DT C 123 -1.068 -8.440 7.101 1.00 0.14 N ATOM 2220 C2 DT C 123 -1.047 -7.274 6.337 1.00 0.14 C ATOM 2221 O2 DT C 123 -1.304 -6.169 6.818 1.00 0.15 O ATOM 2222 N3 DT C 123 -0.722 -7.422 5.002 1.00 0.13 N ATOM 2223 C4 DT C 123 -0.419 -8.611 4.365 1.00 0.13 C ATOM 2224 O4 DT C 123 -0.139 -8.626 3.167 1.00 0.14 O ATOM 2225 C5 DT C 123 -0.463 -9.769 5.230 1.00 0.13 C ATOM 2226 C7 DT C 123 -0.155 -11.146 4.651 1.00 0.15 C ATOM 2227 C6 DT C 123 -0.776 -9.657 6.540 1.00 0.13 C ATOM 2228 H5' DT C 123 1.371 -10.313 10.366 1.00 0.13 H ATOM 2229 H5'' DT C 123 0.253 -11.018 11.548 1.00 0.14 H ATOM 2230 H4' DT C 123 -0.332 -8.726 11.347 1.00 0.15 H ATOM 2231 H3' DT C 123 -2.208 -10.721 10.616 1.00 0.15 H ATOM 2232 H2' DT C 123 -2.578 -10.128 8.401 1.00 0.16 H ATOM 2233 H2'' DT C 123 -3.451 -8.732 9.101 1.00 0.18 H ATOM 2234 H1' DT C 123 -1.724 -7.282 8.730 1.00 0.16 H ATOM 2235 H3 DT C 123 -0.707 -6.580 4.436 1.00 0.14 H ATOM 2236 H71 DT C 123 -0.968 -11.831 4.892 1.00 0.15 H ATOM 2237 H72 DT C 123 0.775 -11.520 5.079 1.00 0.14 H ATOM 2238 H73 DT C 123 -0.052 -11.070 3.569 1.00 0.16 H ATOM 2239 H6 DT C 123 -0.778 -10.551 7.162 1.00 0.14 H ATOM 2240 P DG C 124 -4.262 -9.148 11.703 1.00 0.18 P ATOM 2241 OP1 DG C 124 -4.544 -8.827 13.119 1.00 0.21 O ATOM 2242 OP2 DG C 124 -4.605 -10.483 11.164 1.00 0.20 O ATOM 2243 O5' DG C 124 -4.968 -8.040 10.789 1.00 0.17 O ATOM 2244 C5' DG C 124 -4.708 -6.665 11.061 1.00 0.17 C ATOM 2245 C4' DG C 124 -5.482 -5.747 10.133 1.00 0.17 C ATOM 2246 O4' DG C 124 -4.934 -5.823 8.806 1.00 0.16 O ATOM 2247 C3' DG C 124 -6.967 -6.088 10.042 1.00 0.17 C ATOM 2248 O3' DG C 124 -7.724 -4.886 10.147 1.00 0.19 O ATOM 2249 C2' DG C 124 -7.132 -6.703 8.658 1.00 0.16 C ATOM 2250 C1' DG C 124 -5.986 -6.087 7.873 1.00 0.15 C ATOM 2251 N9 DG C 124 -5.439 -6.947 6.802 1.00 0.14 N ATOM 2252 C8 DG C 124 -5.125 -8.276 6.838 1.00 0.14 C ATOM 2253 N7 DG C 124 -4.638 -8.760 5.734 1.00 0.14 N ATOM 2254 C5 DG C 124 -4.624 -7.659 4.880 1.00 0.14 C ATOM 2255 C6 DG C 124 -4.197 -7.561 3.525 1.00 0.14 C ATOM 2256 O6 DG C 124 -3.732 -8.443 2.804 1.00 0.14 O ATOM 2257 N1 DG C 124 -4.352 -6.273 3.034 1.00 0.14 N ATOM 2258 C2 DG C 124 -4.854 -5.205 3.749 1.00 0.15 C ATOM 2259 N2 DG C 124 -4.930 -4.043 3.098 1.00 0.16 N ATOM 2260 N3 DG C 124 -5.255 -5.291 5.023 1.00 0.15 N ATOM 2261 C4 DG C 124 -5.113 -6.543 5.524 1.00 0.14 C ATOM 2262 H5' DG C 124 -3.642 -6.475 10.938 1.00 0.17 H ATOM 2263 H5'' DG C 124 -4.991 -6.448 12.091 1.00 0.19 H ATOM 2264 H4' DG C 124 -5.382 -4.723 10.494 1.00 0.18 H ATOM 2265 H3' DG C 124 -7.255 -6.798 10.819 1.00 0.18 H ATOM 2266 H2' DG C 124 -7.030 -7.788 8.703 1.00 0.16 H ATOM 2267 H2'' DG C 124 -8.089 -6.423 8.228 1.00 0.16 H ATOM 2268 H1' DG C 124 -6.322 -5.150 7.436 1.00 0.16 H ATOM 2269 H8 DG C 124 -5.274 -8.887 7.728 1.00 0.14 H ATOM 2270 H1 DG C 124 -4.071 -6.127 2.076 1.00 0.15 H ATOM 2271 H21 DG C 124 -4.626 -3.982 2.135 1.00 0.16 H ATOM 2272 H22 DG C 124 -5.291 -3.224 3.567 1.00 0.17 H ATOM 2273 P DC C 125 -9.328 -4.910 10.089 1.00 0.20 P ATOM 2274 OP1 DC C 125 -9.850 -3.970 11.106 1.00 0.22 O ATOM 2275 OP2 DC C 125 -9.777 -6.320 10.078 1.00 0.21 O ATOM 2276 O5' DC C 125 -9.586 -4.282 8.636 1.00 0.19 O ATOM 2277 C5' DC C 125 -9.045 -2.988 8.375 1.00 0.19 C ATOM 2278 C4' DC C 125 -9.321 -2.493 6.966 1.00 0.19 C ATOM 2279 O4' DC C 125 -8.633 -3.339 6.028 1.00 0.18 O ATOM 2280 C3' DC C 125 -10.797 -2.480 6.585 1.00 0.20 C ATOM 2281 O3' DC C 125 -11.096 -1.230 5.979 1.00 0.22 O ATOM 2282 C2' DC C 125 -10.969 -3.592 5.560 1.00 0.20 C ATOM 2283 C1' DC C 125 -9.548 -3.812 5.034 1.00 0.18 C ATOM 2284 N1 DC C 125 -9.180 -5.232 4.704 1.00 0.16 N ATOM 2285 C2 DC C 125 -8.696 -5.492 3.420 1.00 0.16 C ATOM 2286 O2 DC C 125 -8.596 -4.583 2.599 1.00 0.16 O ATOM 2287 N3 DC C 125 -8.336 -6.768 3.108 1.00 0.15 N ATOM 2288 C4 DC C 125 -8.438 -7.756 4.002 1.00 0.16 C ATOM 2289 N4 DC C 125 -8.069 -8.992 3.663 1.00 0.16 N ATOM 2290 C5 DC C 125 -8.929 -7.505 5.315 1.00 0.16 C ATOM 2291 C6 DC C 125 -9.282 -6.245 5.629 1.00 0.17 C ATOM 2292 H5' DC C 125 -7.967 -3.023 8.527 1.00 0.19 H ATOM 2293 H5'' DC C 125 -9.476 -2.281 9.084 1.00 0.21 H ATOM 2294 H4' DC C 125 -8.934 -1.477 6.876 1.00 0.20 H ATOM 2295 H3' DC C 125 -11.428 -2.652 7.456 1.00 0.21 H ATOM 2296 H2' DC C 125 -11.376 -4.478 6.035 1.00 0.20 H ATOM 2297 H2'' DC C 125 -11.623 -3.262 4.753 1.00 0.21 H ATOM 2298 H1' DC C 125 -9.425 -3.194 4.139 1.00 0.19 H ATOM 2299 H41 DC C 125 -7.722 -9.178 2.734 1.00 0.16 H ATOM 2300 H42 DC C 125 -8.138 -9.742 4.336 1.00 0.17 H ATOM 2301 H5 DC C 125 -9.031 -8.310 6.038 1.00 0.17 H ATOM 2302 H6 DC C 125 -9.603 -6.033 6.639 1.00 0.18 H ATOM 2303 P DA C 126 -12.588 -0.898 5.508 1.00 0.25 P ATOM 2304 OP1 DA C 126 -12.808 0.560 5.641 1.00 0.27 O ATOM 2305 OP2 DA C 126 -13.509 -1.851 6.167 1.00 0.25 O ATOM 2306 O5' DA C 126 -12.517 -1.259 3.948 1.00 0.24 O ATOM 2307 C5' DA C 126 -11.556 -0.585 3.134 1.00 0.24 C ATOM 2308 C4' DA C 126 -11.704 -0.942 1.664 1.00 0.24 C ATOM 2309 O4' DA C 126 -11.258 -2.284 1.440 1.00 0.22 O ATOM 2310 C3' DA C 126 -13.146 -0.848 1.170 1.00 0.27 C ATOM 2311 O3' DA C 126 -13.175 -0.224 -0.109 1.00 0.29 O ATOM 2312 C2' DA C 126 -13.597 -2.296 1.053 1.00 0.25 C ATOM 2313 C1' DA C 126 -12.290 -3.022 0.780 1.00 0.23 C ATOM 2314 N9 DA C 126 -12.227 -4.409 1.287 1.00 0.21 N ATOM 2315 C8 DA C 126 -12.658 -4.921 2.480 1.00 0.21 C ATOM 2316 N7 DA C 126 -12.421 -6.190 2.651 1.00 0.20 N ATOM 2317 C5 DA C 126 -11.777 -6.552 1.469 1.00 0.19 C ATOM 2318 C6 DA C 126 -11.252 -7.765 1.003 1.00 0.19 C ATOM 2319 N6 DA C 126 -11.285 -8.900 1.705 1.00 0.20 N ATOM 2320 N1 DA C 126 -10.683 -7.763 -0.212 1.00 0.19 N ATOM 2321 C2 DA C 126 -10.630 -6.642 -0.931 1.00 0.19 C ATOM 2322 N3 DA C 126 -11.092 -5.449 -0.587 1.00 0.20 N ATOM 2323 C4 DA C 126 -11.658 -5.475 0.636 1.00 0.20 C ATOM 2324 H5' DA C 126 -10.554 -0.873 3.466 1.00 0.22 H ATOM 2325 H5'' DA C 126 -11.677 0.491 3.255 1.00 0.26 H ATOM 2326 H4' DA C 126 -11.082 -0.264 1.078 1.00 0.25 H ATOM 2327 H3' DA C 126 -13.756 -0.298 1.887 1.00 0.28 H ATOM 2328 H2' DA C 126 -14.046 -2.638 1.984 1.00 0.25 H ATOM 2329 H2'' DA C 126 -14.286 -2.416 0.220 1.00 0.27 H ATOM 2330 H1' DA C 126 -12.104 -3.022 -0.298 1.00 0.23 H ATOM 2331 H8 DA C 126 -13.155 -4.313 3.235 1.00 0.22 H ATOM 2332 H61 DA C 126 -10.889 -9.747 1.317 1.00 0.20 H ATOM 2333 H62 DA C 126 -11.705 -8.913 2.624 1.00 0.20 H ATOM 2334 H2 DA C 126 -10.154 -6.714 -1.908 1.00 0.20 H ATOM 2335 P DG C 127 -14.577 0.025 -0.848 1.00 0.32 P ATOM 2336 OP1 DG C 127 -14.499 1.312 -1.574 1.00 0.35 O ATOM 2337 OP2 DG C 127 -15.665 -0.209 0.128 1.00 0.33 O ATOM 2338 O5' DG C 127 -14.603 -1.165 -1.928 1.00 0.32 O ATOM 2339 C5' DG C 127 -13.549 -1.229 -2.889 1.00 0.32 C ATOM 2340 C4' DG C 127 -13.753 -2.336 -3.915 1.00 0.33 C ATOM 2341 O4' DG C 127 -13.552 -3.611 -3.295 1.00 0.30 O ATOM 2342 C3' DG C 127 -15.144 -2.340 -4.545 1.00 0.37 C ATOM 2343 O3' DG C 127 -15.028 -2.519 -5.957 1.00 0.40 O ATOM 2344 C2' DG C 127 -15.833 -3.554 -3.932 1.00 0.36 C ATOM 2345 C1' DG C 127 -14.664 -4.460 -3.580 1.00 0.32 C ATOM 2346 N9 DG C 127 -14.870 -5.326 -2.394 1.00 0.29 N ATOM 2347 C8 DG C 127 -15.457 -5.037 -1.192 1.00 0.30 C ATOM 2348 N7 DG C 127 -15.456 -6.011 -0.325 1.00 0.29 N ATOM 2349 C5 DG C 127 -14.814 -7.040 -1.007 1.00 0.27 C ATOM 2350 C6 DG C 127 -14.507 -8.364 -0.584 1.00 0.26 C ATOM 2351 O6 DG C 127 -14.739 -8.897 0.504 1.00 0.27 O ATOM 2352 N1 DG C 127 -13.853 -9.072 -1.584 1.00 0.25 N ATOM 2353 C2 DG C 127 -13.532 -8.577 -2.830 1.00 0.26 C ATOM 2354 N2 DG C 127 -12.900 -9.410 -3.657 1.00 0.26 N ATOM 2355 N3 DG C 127 -13.817 -7.340 -3.227 1.00 0.27 N ATOM 2356 C4 DG C 127 -14.454 -6.629 -2.273 1.00 0.28 C ATOM 2357 H5' DG C 127 -12.610 -1.413 -2.361 1.00 0.29 H ATOM 2358 H5'' DG C 127 -13.483 -0.273 -3.408 1.00 0.34 H ATOM 2359 H4' DG C 127 -13.014 -2.214 -4.707 1.00 0.34 H ATOM 2360 H3' DG C 127 -15.686 -1.423 -4.309 1.00 0.38 H ATOM 2361 H2' DG C 127 -16.392 -3.273 -3.041 1.00 0.36 H ATOM 2362 H2'' DG C 127 -16.480 -4.030 -4.663 1.00 0.38 H ATOM 2363 H1' DG C 127 -14.431 -5.084 -4.448 1.00 0.33 H ATOM 2364 H8 DG C 127 -15.891 -4.064 -0.974 1.00 0.31 H ATOM 2365 H1 DG C 127 -13.602 -10.021 -1.359 1.00 0.25 H ATOM 2366 H21 DG C 127 -12.682 -10.351 -3.359 1.00 0.26 H ATOM 2367 H22 DG C 127 -12.638 -9.100 -4.583 1.00 0.28 H ATOM 2368 P DG C 128 -16.335 -2.443 -6.890 1.00 0.45 P ATOM 2369 OP1 DG C 128 -15.933 -1.905 -8.209 1.00 0.48 O ATOM 2370 OP2 DG C 128 -17.416 -1.785 -6.122 1.00 0.47 O ATOM 2371 O5' DG C 128 -16.719 -3.994 -7.074 1.00 0.46 O ATOM 2372 C5' DG C 128 -15.783 -4.867 -7.712 1.00 0.45 C ATOM 2373 C4' DG C 128 -16.316 -6.287 -7.860 1.00 0.47 C ATOM 2374 O4' DG C 128 -16.329 -6.923 -6.579 1.00 0.43 O ATOM 2375 C3' DG C 128 -17.734 -6.371 -8.441 1.00 0.53 C ATOM 2376 O3' DG C 128 -17.841 -7.414 -9.414 1.00 0.56 O ATOM 2377 C2' DG C 128 -18.582 -6.691 -7.213 1.00 0.52 C ATOM 2378 C1' DG C 128 -17.607 -7.511 -6.383 1.00 0.46 C ATOM 2379 N9 DG C 128 -17.859 -7.559 -4.929 1.00 0.44 N ATOM 2380 C8 DG C 128 -18.300 -6.586 -4.073 1.00 0.44 C ATOM 2381 N7 DG C 128 -18.357 -6.938 -2.823 1.00 0.42 N ATOM 2382 C5 DG C 128 -17.920 -8.260 -2.845 1.00 0.41 C ATOM 2383 C6 DG C 128 -17.763 -9.187 -1.781 1.00 0.39 C ATOM 2384 O6 DG C 128 -17.976 -9.015 -0.583 1.00 0.40 O ATOM 2385 N1 DG C 128 -17.299 -10.414 -2.239 1.00 0.38 N ATOM 2386 C2 DG C 128 -17.019 -10.714 -3.557 1.00 0.39 C ATOM 2387 N2 DG C 128 -16.580 -11.947 -3.807 1.00 0.39 N ATOM 2388 N3 DG C 128 -17.164 -9.845 -4.556 1.00 0.41 N ATOM 2389 C4 DG C 128 -17.616 -8.645 -4.130 1.00 0.41 C ATOM 2390 H5' DG C 128 -14.872 -4.897 -7.108 1.00 0.41 H ATOM 2391 H5'' DG C 128 -15.544 -4.471 -8.699 1.00 0.48 H ATOM 2392 H4' DG C 128 -15.645 -6.841 -8.515 1.00 0.47 H ATOM 2393 H3' DG C 128 -18.029 -5.414 -8.870 1.00 0.55 H ATOM 2394 HO3' DG C 128 -18.149 -8.200 -8.958 1.00 1.09 H ATOM 2395 H2' DG C 128 -18.873 -5.779 -6.698 1.00 0.52 H ATOM 2396 H2'' DG C 128 -19.454 -7.283 -7.488 1.00 0.56 H ATOM 2397 H1' DG C 128 -17.586 -8.530 -6.768 1.00 0.47 H ATOM 2398 H8 DG C 128 -18.587 -5.593 -4.408 1.00 0.46 H ATOM 2399 H1 DG C 128 -17.164 -11.127 -1.538 1.00 0.38 H ATOM 2400 H21 DG C 128 -16.470 -12.608 -3.050 1.00 0.38 H ATOM 2401 H22 DG C 128 -16.359 -12.222 -4.753 1.00 0.40 H TER 2402 DG C 128 MASTER 129 0 0 3 0 0 0 6 2399 3 0 11 END