USER MOD reduce.3.24.130724 H: found=0, std=0, add=1086, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1085 hydrogens (0 hets) 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 0 CHAIN: B; COMPND 1 ENGINEERED: YES; COMPND 2 MOL_ID: 3; COMPND 3 MOLECULE: 5'-D(*GP*GP*TP*GP*TP*TP*TP*GP*TP*GP*CP*AP*GP*G)- COMPND 4 3'; COMPND 5 CHAIN: C; COMPND 6 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 0 SYNTHETIC: YES; SOURCE 1 MOL_ID: 3; SOURCE 2 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 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 41 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 45 MET CE :methyl -115:sc= -0.0126 (180deg=-2.04!) USER MOD Set 2.1: A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 38 GLN : amide:sc=-0.00796 K(o=-0.008,f=-1.4!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -171:sc= 0 (180deg=-0.141) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 MET CE :methyl -118:sc= -2.65! (180deg=-6.28!) USER MOD Single : A 10 ASN : amide:sc= -1.91! K(o=-1.9!,f=-2.9) USER MOD Single : A 16 SER OG : rot -85:sc= -0.773! USER MOD Single : A 19 GLN : amide:sc= -0.594 X(o=-0.59,f=-0.63) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -4.74! C(o=-4.7!,f=-9.2!) USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -2.99! C(o=-3!,f=-10!) USER MOD Single : A 33 SER OG : rot -65:sc= 0.036 USER MOD Single : A 36 SER OG : rot 100:sc= 0.344 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -0.159 K(o=-0.16,f=-1.7!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 51 LYS NZ :NH3+ -159:sc= 0.0425 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -0.857 K(o=-0.86,f=-3.6!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -1.06! K(o=-1.1!,f=-1.6) USER MOD Single : A 64 MET CE :methyl 156:sc= -0.158 (180deg=-1.48) USER MOD Single : A 65 HIS : no HD1:sc= -0.0214 X(o=-0.021,f=-0.0046) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 TYR OH : rot 180:sc= -0.573 USER MOD Single : A 71 ASN : amide:sc= -1.54 K(o=-1.5,f=-3.2!) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 157:sc= -0.231! USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ -153:sc= -0.932 (180deg=-1.62) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 162:sc= -0.401 (180deg=-1.23) USER MOD Single : B 101 DC O5' : rot 180:sc= -0.638 USER MOD Single : B 103 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 114 DC O3' : rot 180:sc= 0 USER MOD Single : C 115 DG O5' : rot 47:sc= -1.09! USER MOD Single : C 117 DT C7 :methyl 150:sc= -0.215 (180deg=-0.215) USER MOD Single : C 119 DT C7 :methyl 150:sc= -2.66 (180deg=-2.66) USER MOD Single : C 120 DT C7 :methyl -30:sc=-0.000206 (180deg=-0.546) USER MOD Single : C 121 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 123 DT C7 :methyl -30:sc= -0.684 (180deg=-0.953) USER MOD Single : C 128 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- 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 0 H1 MET A 1 1.142 19.755 17.757 1.00 1.76 H new ATOM 0 H2 MET A 1 -0.167 18.701 17.998 1.00 1.76 H new ATOM 0 H3 MET A 1 1.102 18.749 19.125 1.00 1.76 H new ATOM 0 HA MET A 1 1.443 17.924 16.285 1.00 1.10 H new ATOM 0 HB2 MET A 1 3.216 17.731 18.762 1.00 1.80 H new ATOM 0 HB3 MET A 1 3.580 16.961 17.230 1.00 1.80 H new ATOM 0 HG2 MET A 1 3.301 19.312 16.150 1.00 2.37 H new ATOM 0 HG3 MET A 1 3.313 19.953 17.781 1.00 2.37 H new ATOM 0 HE1 MET A 1 6.773 19.600 19.120 1.00 3.92 H new ATOM 0 HE2 MET A 1 5.290 20.579 19.020 1.00 3.92 H new ATOM 0 HE3 MET A 1 5.205 18.889 19.570 1.00 3.92 H new 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 0 H GLN A 2 0.680 15.880 15.754 1.00 0.98 H new ATOM 0 HA GLN A 2 -0.228 14.211 18.061 1.00 1.07 H new ATOM 0 HB2 GLN A 2 -0.971 14.185 15.081 1.00 1.59 H new ATOM 0 HB3 GLN A 2 -1.678 13.143 16.300 1.00 1.59 H new ATOM 0 HG2 GLN A 2 -2.813 14.935 17.371 1.00 2.16 H new ATOM 0 HG3 GLN A 2 -1.726 16.147 16.722 1.00 2.16 H new ATOM 0 HE21 GLN A 2 -3.206 17.436 15.523 1.00 3.50 H new ATOM 0 HE22 GLN A 2 -4.171 16.798 14.188 1.00 3.50 H new 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 0 H ASP A 3 0.689 12.163 18.400 1.00 0.73 H new ATOM 0 HA ASP A 3 2.864 11.391 16.521 1.00 0.64 H new ATOM 0 HB2 ASP A 3 1.904 10.286 19.194 1.00 0.99 H new ATOM 0 HB3 ASP A 3 3.249 9.636 18.277 1.00 0.99 H new 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 0 H ARG A 4 2.459 9.742 14.907 1.00 0.46 H new ATOM 0 HA ARG A 4 -0.279 8.623 14.969 1.00 0.40 H new ATOM 0 HB2 ARG A 4 0.919 9.519 12.879 1.00 0.40 H new ATOM 0 HB3 ARG A 4 1.986 8.133 12.983 1.00 0.40 H new ATOM 0 HG2 ARG A 4 -0.173 6.675 13.054 1.00 0.43 H new ATOM 0 HG3 ARG A 4 -1.038 8.121 12.570 1.00 0.43 H new ATOM 0 HD2 ARG A 4 0.634 8.335 10.616 1.00 0.93 H new ATOM 0 HD3 ARG A 4 1.225 6.742 11.045 1.00 0.93 H new ATOM 0 HE ARG A 4 -1.592 6.420 10.854 1.00 1.63 H new ATOM 0 HH11 ARG A 4 1.123 7.443 8.909 1.00 2.21 H new ATOM 0 HH12 ARG A 4 0.359 6.993 7.381 1.00 2.21 H new ATOM 0 HH21 ARG A 4 -2.582 5.868 8.899 1.00 3.11 H new ATOM 0 HH22 ARG A 4 -1.722 6.108 7.375 1.00 3.11 H new 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 0 H VAL A 5 -0.767 6.330 15.164 1.00 0.36 H new ATOM 0 HA VAL A 5 1.371 4.869 16.598 1.00 0.34 H new ATOM 0 HB VAL A 5 -1.509 4.123 15.922 1.00 0.36 H new ATOM 0 HG11 VAL A 5 -1.223 2.492 17.773 1.00 0.35 H new ATOM 0 HG12 VAL A 5 -0.046 2.197 16.470 1.00 0.35 H new ATOM 0 HG13 VAL A 5 0.468 3.011 17.967 1.00 0.35 H new ATOM 0 HG21 VAL A 5 -1.999 4.811 18.260 1.00 0.40 H new ATOM 0 HG22 VAL A 5 -0.312 5.343 18.455 1.00 0.40 H new ATOM 0 HG23 VAL A 5 -1.382 6.180 17.305 1.00 0.40 H new 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 0 H LYS A 6 2.602 3.253 15.681 1.00 0.29 H new ATOM 0 HA LYS A 6 2.136 2.671 12.792 1.00 0.26 H new ATOM 0 HB2 LYS A 6 4.357 1.656 14.598 1.00 0.28 H new ATOM 0 HB3 LYS A 6 4.397 1.928 12.868 1.00 0.28 H new ATOM 0 HG2 LYS A 6 3.679 4.459 13.796 1.00 0.43 H new ATOM 0 HG3 LYS A 6 4.707 3.903 15.102 1.00 0.43 H new ATOM 0 HD2 LYS A 6 6.602 3.614 13.640 1.00 0.97 H new ATOM 0 HD3 LYS A 6 5.608 3.690 12.198 1.00 0.97 H new ATOM 0 HE2 LYS A 6 5.323 6.031 12.343 1.00 1.10 H new ATOM 0 HE3 LYS A 6 5.545 6.060 14.081 1.00 1.10 H new ATOM 0 HZ1 LYS A 6 7.480 6.957 12.935 1.00 1.84 H new ATOM 0 HZ2 LYS A 6 7.901 5.534 13.760 1.00 1.84 H new ATOM 0 HZ3 LYS A 6 7.686 5.506 12.076 1.00 1.84 H new 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 0 H ARG A 7 2.069 0.403 11.991 1.00 0.22 H new ATOM 0 HA ARG A 7 0.201 -1.118 13.564 1.00 0.23 H new ATOM 0 HB2 ARG A 7 1.922 -1.802 11.111 1.00 0.24 H new ATOM 0 HB3 ARG A 7 0.631 -2.828 11.706 1.00 0.24 H new ATOM 0 HG2 ARG A 7 -1.012 -0.971 11.367 1.00 0.37 H new ATOM 0 HG3 ARG A 7 0.275 0.073 10.797 1.00 0.37 H new ATOM 0 HD2 ARG A 7 -0.699 -0.848 8.799 1.00 0.55 H new ATOM 0 HD3 ARG A 7 0.792 -1.741 9.022 1.00 0.55 H new ATOM 0 HE ARG A 7 -1.142 -3.260 10.441 1.00 0.75 H new ATOM 0 HH11 ARG A 7 -0.603 -2.006 7.223 1.00 1.04 H new ATOM 0 HH12 ARG A 7 -1.513 -3.298 6.433 1.00 1.04 H new ATOM 0 HH21 ARG A 7 -2.314 -4.907 9.431 1.00 1.26 H new ATOM 0 HH22 ARG A 7 -2.472 -4.926 7.672 1.00 1.26 H new 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 0 HA PRO A 8 2.896 -3.690 16.030 1.00 0.30 H new ATOM 0 HB2 PRO A 8 1.552 -6.157 15.616 1.00 0.35 H new ATOM 0 HB3 PRO A 8 1.173 -5.019 16.894 1.00 0.35 H new ATOM 0 HG2 PRO A 8 -0.244 -5.511 14.334 1.00 0.57 H new ATOM 0 HG3 PRO A 8 -0.872 -4.898 15.851 1.00 0.57 H new ATOM 0 HD2 PRO A 8 -0.447 -3.287 13.642 1.00 0.32 H new ATOM 0 HD3 PRO A 8 -0.424 -2.670 15.282 1.00 0.32 H new 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 0 H MET A 9 4.777 -4.917 15.705 1.00 0.27 H new ATOM 0 HA MET A 9 5.460 -5.340 12.904 1.00 0.25 H new ATOM 0 HB2 MET A 9 6.819 -6.081 15.537 1.00 0.35 H new ATOM 0 HB3 MET A 9 7.561 -6.270 13.960 1.00 0.35 H new ATOM 0 HG2 MET A 9 7.169 -3.793 13.532 1.00 0.55 H new ATOM 0 HG3 MET A 9 6.554 -3.640 15.166 1.00 0.55 H new ATOM 0 HE1 MET A 9 8.848 -3.591 17.517 1.00 0.58 H new ATOM 0 HE2 MET A 9 7.540 -4.687 17.012 1.00 0.58 H new ATOM 0 HE3 MET A 9 9.199 -5.304 17.189 1.00 0.58 H new 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 0 H ASN A 10 5.396 -7.252 11.669 1.00 0.18 H new ATOM 0 HA ASN A 10 3.860 -9.432 12.874 1.00 0.17 H new ATOM 0 HB2 ASN A 10 5.216 -9.121 10.146 1.00 0.19 H new ATOM 0 HB3 ASN A 10 4.103 -10.406 10.570 1.00 0.19 H new ATOM 0 HD21 ASN A 10 2.279 -7.393 8.964 1.00 0.29 H new ATOM 0 HD22 ASN A 10 3.755 -8.246 8.500 1.00 0.29 H new 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 0 H ALA A 11 4.655 -11.802 12.479 1.00 0.17 H new ATOM 0 HA ALA A 11 6.871 -12.266 14.102 1.00 0.17 H new ATOM 0 HB1 ALA A 11 6.813 -14.557 13.117 1.00 0.18 H new ATOM 0 HB2 ALA A 11 5.171 -13.960 13.460 1.00 0.18 H new ATOM 0 HB3 ALA A 11 5.790 -13.954 11.792 1.00 0.18 H new 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 0 H PHE A 12 6.903 -11.702 10.483 1.00 0.16 H new ATOM 0 HA PHE A 12 9.679 -12.539 10.364 1.00 0.16 H new ATOM 0 HB2 PHE A 12 8.301 -12.629 8.351 1.00 0.17 H new ATOM 0 HB3 PHE A 12 7.900 -10.928 8.482 1.00 0.17 H new ATOM 0 HD1 PHE A 12 9.659 -9.185 8.136 1.00 0.30 H new ATOM 0 HD2 PHE A 12 10.464 -13.357 7.513 1.00 0.26 H new ATOM 0 HE1 PHE A 12 11.717 -8.600 6.882 1.00 0.42 H new ATOM 0 HE2 PHE A 12 12.521 -12.772 6.256 1.00 0.38 H new ATOM 0 HZ PHE A 12 13.148 -10.393 5.941 1.00 0.45 H new 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 0 H ILE A 13 7.962 -9.284 10.599 1.00 0.14 H new ATOM 0 HA ILE A 13 10.404 -7.780 10.318 1.00 0.13 H new ATOM 0 HB ILE A 13 7.866 -7.106 11.839 1.00 0.14 H new ATOM 0 HG12 ILE A 13 7.580 -7.909 9.399 1.00 0.15 H new ATOM 0 HG13 ILE A 13 6.975 -6.298 9.731 1.00 0.15 H new ATOM 0 HG21 ILE A 13 8.478 -4.770 11.282 1.00 0.14 H new ATOM 0 HG22 ILE A 13 9.742 -5.554 12.260 1.00 0.14 H new ATOM 0 HG23 ILE A 13 9.972 -5.346 10.507 1.00 0.14 H new ATOM 0 HD11 ILE A 13 8.306 -6.318 7.628 1.00 0.15 H new ATOM 0 HD12 ILE A 13 9.102 -5.304 8.855 1.00 0.15 H new ATOM 0 HD13 ILE A 13 9.716 -6.940 8.518 1.00 0.15 H new 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 0 H VAL A 14 8.694 -9.128 13.295 1.00 0.13 H new ATOM 0 HA VAL A 14 10.597 -8.030 15.133 1.00 0.13 H new ATOM 0 HB VAL A 14 9.077 -10.672 15.255 1.00 0.14 H new ATOM 0 HG11 VAL A 14 9.154 -10.305 17.707 1.00 0.14 H new ATOM 0 HG12 VAL A 14 10.790 -10.412 17.015 1.00 0.14 H new ATOM 0 HG13 VAL A 14 10.111 -8.826 17.453 1.00 0.14 H new ATOM 0 HG21 VAL A 14 7.286 -9.348 16.376 1.00 0.16 H new ATOM 0 HG22 VAL A 14 8.215 -7.858 16.087 1.00 0.16 H new ATOM 0 HG23 VAL A 14 7.563 -8.781 14.712 1.00 0.16 H new 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 0 H TRP A 15 10.462 -11.265 13.426 1.00 0.13 H new ATOM 0 HA TRP A 15 12.917 -12.231 14.545 1.00 0.13 H new ATOM 0 HB2 TRP A 15 11.274 -13.734 13.539 1.00 0.14 H new ATOM 0 HB3 TRP A 15 11.283 -12.840 12.032 1.00 0.14 H new ATOM 0 HD1 TRP A 15 13.369 -15.322 14.061 1.00 0.17 H new ATOM 0 HE1 TRP A 15 15.165 -16.397 12.541 1.00 0.18 H new ATOM 0 HE3 TRP A 15 12.732 -12.423 9.912 1.00 0.16 H new ATOM 0 HZ2 TRP A 15 16.174 -16.007 9.862 1.00 0.18 H new ATOM 0 HZ3 TRP A 15 14.116 -12.792 7.892 1.00 0.18 H new ATOM 0 HH2 TRP A 15 15.834 -14.579 7.861 1.00 0.19 H new 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 0 H SER A 16 12.289 -9.992 11.779 1.00 0.12 H new ATOM 0 HA SER A 16 15.011 -10.435 10.769 1.00 0.12 H new ATOM 0 HB2 SER A 16 14.293 -8.200 9.521 1.00 0.12 H new ATOM 0 HB3 SER A 16 13.659 -9.758 9.030 1.00 0.12 H new ATOM 0 HG SER A 16 11.748 -9.348 10.034 1.00 1.23 H new 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 0 H ARG A 17 13.304 -8.061 12.960 1.00 0.12 H new ATOM 0 HA ARG A 17 15.243 -6.068 12.999 1.00 0.12 H new ATOM 0 HB2 ARG A 17 13.510 -7.298 15.170 1.00 0.14 H new ATOM 0 HB3 ARG A 17 14.604 -5.982 15.544 1.00 0.14 H new ATOM 0 HG2 ARG A 17 13.532 -4.626 13.678 1.00 0.15 H new ATOM 0 HG3 ARG A 17 12.379 -5.925 13.444 1.00 0.15 H new ATOM 0 HD2 ARG A 17 11.507 -4.119 14.985 1.00 0.35 H new ATOM 0 HD3 ARG A 17 11.550 -5.694 15.752 1.00 0.35 H new ATOM 0 HE ARG A 17 14.092 -4.541 16.329 1.00 0.97 H new ATOM 0 HH11 ARG A 17 10.696 -3.852 16.781 1.00 1.73 H new ATOM 0 HH12 ARG A 17 10.955 -2.929 18.265 1.00 1.73 H new ATOM 0 HH21 ARG A 17 14.424 -3.362 18.222 1.00 2.17 H new ATOM 0 HH22 ARG A 17 13.048 -2.654 19.074 1.00 2.17 H new 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 0 H ASP A 18 15.237 -9.185 14.995 1.00 0.12 H new ATOM 0 HA ASP A 18 17.915 -8.479 15.980 1.00 0.13 H new ATOM 0 HB2 ASP A 18 16.127 -9.726 17.312 1.00 0.14 H new ATOM 0 HB3 ASP A 18 16.332 -11.084 16.224 1.00 0.14 H new 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 0 H GLN A 19 16.504 -10.728 13.456 1.00 0.13 H new ATOM 0 HA GLN A 19 19.055 -12.057 13.049 1.00 0.13 H new ATOM 0 HB2 GLN A 19 16.677 -12.836 12.382 1.00 0.13 H new ATOM 0 HB3 GLN A 19 16.797 -11.718 11.038 1.00 0.13 H new ATOM 0 HG2 GLN A 19 17.621 -13.761 10.127 1.00 0.15 H new ATOM 0 HG3 GLN A 19 19.082 -12.870 10.505 1.00 0.15 H new ATOM 0 HE21 GLN A 19 20.576 -14.385 11.289 1.00 1.15 H new ATOM 0 HE22 GLN A 19 20.205 -15.593 12.525 1.00 1.15 H new 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 0 H ARG A 20 17.342 -9.216 11.515 1.00 0.12 H new ATOM 0 HA ARG A 20 19.155 -8.793 9.393 1.00 0.11 H new ATOM 0 HB2 ARG A 20 16.947 -7.616 9.846 1.00 0.11 H new ATOM 0 HB3 ARG A 20 17.727 -6.719 11.133 1.00 0.11 H new ATOM 0 HG2 ARG A 20 19.457 -5.928 9.385 1.00 0.13 H new ATOM 0 HG3 ARG A 20 18.428 -6.638 8.156 1.00 0.13 H new ATOM 0 HD2 ARG A 20 17.513 -4.548 10.199 1.00 0.20 H new ATOM 0 HD3 ARG A 20 17.928 -4.196 8.533 1.00 0.20 H new ATOM 0 HE ARG A 20 15.384 -5.302 9.444 1.00 0.55 H new ATOM 0 HH11 ARG A 20 17.726 -5.260 6.862 1.00 1.83 H new ATOM 0 HH12 ARG A 20 16.613 -5.955 5.679 1.00 1.83 H new ATOM 0 HH21 ARG A 20 13.979 -6.244 7.960 1.00 1.32 H new ATOM 0 HH22 ARG A 20 14.509 -6.508 6.295 1.00 1.32 H new 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 0 H ARG A 21 19.386 -7.624 12.889 1.00 0.12 H new ATOM 0 HA ARG A 21 21.817 -6.164 12.337 1.00 0.13 H new ATOM 0 HB2 ARG A 21 20.173 -6.005 14.362 1.00 0.13 H new ATOM 0 HB3 ARG A 21 21.024 -7.396 15.004 1.00 0.13 H new ATOM 0 HG2 ARG A 21 22.260 -5.599 15.935 1.00 0.14 H new ATOM 0 HG3 ARG A 21 23.219 -6.001 14.524 1.00 0.14 H new ATOM 0 HD2 ARG A 21 21.726 -4.233 13.261 1.00 0.15 H new ATOM 0 HD3 ARG A 21 21.260 -3.688 14.860 1.00 0.15 H new ATOM 0 HE ARG A 21 23.790 -3.094 13.568 1.00 0.37 H new ATOM 0 HH11 ARG A 21 22.303 -3.862 16.630 1.00 1.92 H new ATOM 0 HH12 ARG A 21 23.668 -3.259 17.575 1.00 1.92 H new ATOM 0 HH21 ARG A 21 25.545 -2.375 14.762 1.00 0.91 H new ATOM 0 HH22 ARG A 21 25.489 -2.424 16.527 1.00 0.91 H new 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 0 H LYS A 22 21.106 -9.615 13.296 1.00 0.14 H new ATOM 0 HA LYS A 22 23.788 -10.315 13.988 1.00 0.15 H new ATOM 0 HB2 LYS A 22 21.593 -11.643 14.245 1.00 0.16 H new ATOM 0 HB3 LYS A 22 21.687 -11.992 12.530 1.00 0.16 H new ATOM 0 HG2 LYS A 22 24.005 -12.991 12.929 1.00 0.18 H new ATOM 0 HG3 LYS A 22 23.752 -12.771 14.649 1.00 0.18 H new ATOM 0 HD2 LYS A 22 21.438 -14.034 14.177 1.00 0.23 H new ATOM 0 HD3 LYS A 22 22.256 -14.598 12.733 1.00 0.23 H new ATOM 0 HE2 LYS A 22 23.771 -14.845 15.328 1.00 1.19 H new ATOM 0 HE3 LYS A 22 22.407 -15.922 15.105 1.00 1.19 H new ATOM 0 HZ1 LYS A 22 24.444 -16.897 14.236 1.00 1.97 H new ATOM 0 HZ2 LYS A 22 23.345 -16.624 12.971 1.00 1.97 H new ATOM 0 HZ3 LYS A 22 24.666 -15.581 13.187 1.00 1.97 H new 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 0 H MET A 23 22.035 -10.373 10.784 1.00 0.14 H new ATOM 0 HA MET A 23 24.312 -11.393 9.362 1.00 0.15 H new ATOM 0 HB2 MET A 23 21.801 -11.335 8.684 1.00 0.14 H new ATOM 0 HB3 MET A 23 22.050 -9.651 8.270 1.00 0.14 H new ATOM 0 HG2 MET A 23 22.422 -10.943 6.238 1.00 0.16 H new ATOM 0 HG3 MET A 23 23.989 -10.368 6.771 1.00 0.16 H new ATOM 0 HE1 MET A 23 22.721 -14.557 5.953 1.00 0.79 H new ATOM 0 HE2 MET A 23 21.534 -13.315 6.416 1.00 0.79 H new ATOM 0 HE3 MET A 23 22.627 -13.032 5.041 1.00 0.79 H new 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 0 H ALA A 24 23.280 -8.029 10.280 1.00 0.14 H new ATOM 0 HA ALA A 24 25.063 -6.811 8.356 1.00 0.15 H new ATOM 0 HB1 ALA A 24 24.670 -4.773 9.708 1.00 0.15 H new ATOM 0 HB2 ALA A 24 23.146 -5.624 9.361 1.00 0.15 H new ATOM 0 HB3 ALA A 24 23.896 -5.762 10.969 1.00 0.15 H new 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 0 H LEU A 25 25.468 -7.927 11.821 1.00 0.17 H new ATOM 0 HA LEU A 25 28.051 -6.635 12.064 1.00 0.19 H new ATOM 0 HB2 LEU A 25 26.868 -9.046 13.503 1.00 0.19 H new ATOM 0 HB3 LEU A 25 28.304 -8.174 14.000 1.00 0.19 H new ATOM 0 HG LEU A 25 25.622 -6.780 13.596 1.00 0.18 H new ATOM 0 HD11 LEU A 25 25.352 -6.941 16.064 1.00 0.21 H new ATOM 0 HD12 LEU A 25 25.391 -8.556 15.319 1.00 0.21 H new ATOM 0 HD13 LEU A 25 26.829 -7.929 16.159 1.00 0.21 H new ATOM 0 HD21 LEU A 25 26.648 -5.046 15.047 1.00 0.22 H new ATOM 0 HD22 LEU A 25 28.139 -6.012 15.150 1.00 0.22 H new ATOM 0 HD23 LEU A 25 27.630 -5.325 13.589 1.00 0.22 H new 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 0 H GLU A 26 26.885 -9.891 10.905 1.00 0.19 H new ATOM 0 HA GLU A 26 29.656 -10.805 10.528 1.00 0.20 H new ATOM 0 HB2 GLU A 26 26.964 -11.921 9.627 1.00 0.20 H new ATOM 0 HB3 GLU A 26 28.501 -12.740 9.437 1.00 0.20 H new ATOM 0 HG2 GLU A 26 28.829 -12.491 11.982 1.00 0.22 H new ATOM 0 HG3 GLU A 26 27.170 -11.932 12.068 1.00 0.22 H new 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 0 H ASN A 27 27.038 -9.173 8.670 1.00 0.18 H new ATOM 0 HA ASN A 27 28.954 -9.040 6.358 1.00 0.18 H new ATOM 0 HB2 ASN A 27 25.922 -9.158 6.124 1.00 0.18 H new ATOM 0 HB3 ASN A 27 27.102 -9.276 4.833 1.00 0.18 H new ATOM 0 HD21 ASN A 27 26.096 -12.807 5.589 1.00 0.54 H new ATOM 0 HD22 ASN A 27 25.346 -11.363 4.900 1.00 0.54 H new 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 0 HA PRO A 28 27.364 -4.888 7.928 1.00 0.19 H new ATOM 0 HB2 PRO A 28 29.855 -3.781 8.496 1.00 0.20 H new ATOM 0 HB3 PRO A 28 28.989 -4.728 9.690 1.00 0.20 H new ATOM 0 HG2 PRO A 28 31.277 -5.531 7.931 1.00 0.33 H new ATOM 0 HG3 PRO A 28 30.935 -5.998 9.585 1.00 0.33 H new ATOM 0 HD2 PRO A 28 30.411 -7.638 7.396 1.00 0.23 H new ATOM 0 HD3 PRO A 28 29.571 -7.785 8.927 1.00 0.23 H new 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 0 H ARG A 29 29.259 -5.984 5.256 1.00 0.19 H new ATOM 0 HA ARG A 29 29.156 -3.175 4.177 1.00 0.20 H new ATOM 0 HB2 ARG A 29 30.713 -5.532 3.055 1.00 0.22 H new ATOM 0 HB3 ARG A 29 30.895 -3.834 2.660 1.00 0.22 H new ATOM 0 HG2 ARG A 29 31.281 -3.653 5.347 1.00 0.27 H new ATOM 0 HG3 ARG A 29 31.783 -5.319 5.136 1.00 0.27 H new ATOM 0 HD2 ARG A 29 33.019 -3.745 3.033 1.00 1.05 H new ATOM 0 HD3 ARG A 29 33.298 -2.928 4.558 1.00 1.05 H new ATOM 0 HE ARG A 29 33.732 -5.811 4.890 1.00 1.72 H new ATOM 0 HH11 ARG A 29 35.076 -2.780 3.816 1.00 2.71 H new ATOM 0 HH12 ARG A 29 36.738 -3.380 3.803 1.00 2.71 H new ATOM 0 HH21 ARG A 29 35.840 -6.603 4.820 1.00 3.35 H new ATOM 0 HH22 ARG A 29 37.167 -5.529 4.368 1.00 3.35 H new 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 0 H MET A 30 27.361 -6.070 4.293 1.00 0.16 H new ATOM 0 HA MET A 30 26.637 -6.121 1.438 1.00 0.15 H new ATOM 0 HB2 MET A 30 26.612 -8.130 2.956 1.00 0.15 H new ATOM 0 HB3 MET A 30 25.317 -7.386 3.873 1.00 0.15 H new ATOM 0 HG2 MET A 30 24.133 -8.730 2.318 1.00 0.15 H new ATOM 0 HG3 MET A 30 24.087 -7.150 1.562 1.00 0.15 H new ATOM 0 HE1 MET A 30 25.782 -10.981 0.000 1.00 0.22 H new ATOM 0 HE2 MET A 30 25.759 -10.625 1.744 1.00 0.22 H new ATOM 0 HE3 MET A 30 24.251 -10.557 0.803 1.00 0.22 H new 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 0 H ARG A 31 24.795 -5.029 0.511 1.00 0.13 H new ATOM 0 HA ARG A 31 23.705 -2.838 2.131 1.00 0.12 H new ATOM 0 HB2 ARG A 31 22.915 -3.908 -0.621 1.00 0.13 H new ATOM 0 HB3 ARG A 31 22.498 -2.339 0.038 1.00 0.13 H new ATOM 0 HG2 ARG A 31 24.966 -1.818 0.278 1.00 0.19 H new ATOM 0 HG3 ARG A 31 25.342 -3.359 -0.468 1.00 0.19 H new ATOM 0 HD2 ARG A 31 23.817 -2.521 -2.455 1.00 0.19 H new ATOM 0 HD3 ARG A 31 24.017 -0.932 -1.742 1.00 0.19 H new ATOM 0 HE ARG A 31 26.649 -2.071 -1.846 1.00 0.39 H new ATOM 0 HH11 ARG A 31 24.055 -0.992 -3.920 1.00 2.02 H new ATOM 0 HH12 ARG A 31 25.116 -0.711 -5.304 1.00 2.02 H new ATOM 0 HH21 ARG A 31 27.996 -1.761 -3.622 1.00 1.02 H new ATOM 0 HH22 ARG A 31 27.330 -1.143 -5.137 1.00 1.02 H new 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 0 H ASN A 32 21.456 -2.606 2.880 1.00 0.11 H new ATOM 0 HA ASN A 32 20.349 -4.994 3.860 1.00 0.10 H new ATOM 0 HB2 ASN A 32 19.159 -2.259 3.313 1.00 0.11 H new ATOM 0 HB3 ASN A 32 18.155 -3.563 3.915 1.00 0.11 H new ATOM 0 HD21 ASN A 32 19.194 -2.714 7.220 1.00 0.12 H new ATOM 0 HD22 ASN A 32 17.856 -2.942 6.089 1.00 0.12 H new 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 0 H SER A 33 20.061 -3.464 0.587 1.00 0.11 H new ATOM 0 HA SER A 33 17.609 -4.723 -0.127 1.00 0.12 H new ATOM 0 HB2 SER A 33 19.967 -4.256 -1.994 1.00 0.13 H new ATOM 0 HB3 SER A 33 18.259 -4.177 -2.376 1.00 0.13 H new ATOM 0 HG SER A 33 18.080 -2.322 -0.999 1.00 0.13 H new 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 0 H GLU A 34 21.063 -5.962 -0.201 1.00 0.11 H new ATOM 0 HA GLU A 34 20.085 -8.429 -1.467 1.00 0.12 H new ATOM 0 HB2 GLU A 34 22.783 -7.644 -0.290 1.00 0.13 H new ATOM 0 HB3 GLU A 34 22.462 -9.149 -1.128 1.00 0.13 H new ATOM 0 HG2 GLU A 34 21.629 -7.758 -3.122 1.00 0.16 H new ATOM 0 HG3 GLU A 34 22.202 -6.329 -2.285 1.00 0.16 H new 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 0 H ILE A 35 21.133 -7.331 1.902 1.00 0.11 H new ATOM 0 HA ILE A 35 21.044 -9.947 2.998 1.00 0.11 H new ATOM 0 HB ILE A 35 20.361 -7.250 4.241 1.00 0.11 H new ATOM 0 HG12 ILE A 35 22.890 -8.951 4.292 1.00 0.13 H new ATOM 0 HG13 ILE A 35 22.676 -7.486 3.354 1.00 0.13 H new ATOM 0 HG21 ILE A 35 20.691 -8.429 6.397 1.00 0.12 H new ATOM 0 HG22 ILE A 35 19.334 -9.134 5.487 1.00 0.12 H new ATOM 0 HG23 ILE A 35 20.907 -9.965 5.525 1.00 0.12 H new ATOM 0 HD11 ILE A 35 23.833 -6.995 5.493 1.00 0.14 H new ATOM 0 HD12 ILE A 35 22.245 -6.193 5.446 1.00 0.14 H new ATOM 0 HD13 ILE A 35 22.463 -7.680 6.399 1.00 0.14 H new 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 0 H SER A 36 18.430 -7.398 2.564 1.00 0.10 H new ATOM 0 HA SER A 36 16.377 -8.784 3.885 1.00 0.10 H new ATOM 0 HB2 SER A 36 16.190 -7.183 1.285 1.00 0.11 H new ATOM 0 HB3 SER A 36 14.887 -7.461 2.423 1.00 0.11 H new ATOM 0 HG SER A 36 17.061 -5.705 2.592 1.00 0.11 H new 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 0 H LYS A 37 17.773 -9.306 0.564 1.00 0.12 H new ATOM 0 HA LYS A 37 15.684 -11.161 -0.161 1.00 0.13 H new ATOM 0 HB2 LYS A 37 18.510 -10.650 -1.201 1.00 0.15 H new ATOM 0 HB3 LYS A 37 17.429 -11.817 -1.937 1.00 0.15 H new ATOM 0 HG2 LYS A 37 15.687 -9.945 -2.143 1.00 0.31 H new ATOM 0 HG3 LYS A 37 16.920 -8.820 -1.609 1.00 0.31 H new ATOM 0 HD2 LYS A 37 18.333 -10.084 -3.568 1.00 0.21 H new ATOM 0 HD3 LYS A 37 16.718 -10.328 -4.204 1.00 0.21 H new ATOM 0 HE2 LYS A 37 16.277 -7.874 -4.044 1.00 1.09 H new ATOM 0 HE3 LYS A 37 17.885 -7.624 -3.391 1.00 1.09 H new ATOM 0 HZ1 LYS A 37 17.843 -7.246 -5.785 1.00 1.86 H new ATOM 0 HZ2 LYS A 37 18.829 -8.580 -5.424 1.00 1.86 H new ATOM 0 HZ3 LYS A 37 17.272 -8.822 -6.056 1.00 1.86 H new 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 0 H GLN A 38 19.039 -11.650 1.318 1.00 0.14 H new ATOM 0 HA GLN A 38 18.749 -14.527 1.080 1.00 0.15 H new ATOM 0 HB2 GLN A 38 20.492 -12.834 2.925 1.00 0.16 H new ATOM 0 HB3 GLN A 38 20.681 -14.554 2.649 1.00 0.16 H new ATOM 0 HG2 GLN A 38 20.756 -13.900 0.088 1.00 0.19 H new ATOM 0 HG3 GLN A 38 21.076 -12.277 0.669 1.00 0.19 H new ATOM 0 HE21 GLN A 38 23.114 -13.423 -0.782 1.00 1.92 H new ATOM 0 HE22 GLN A 38 24.428 -13.933 0.283 1.00 1.92 H new 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 0 H LEU A 39 17.935 -12.094 3.692 1.00 0.14 H new ATOM 0 HA LEU A 39 17.367 -14.049 5.682 1.00 0.14 H new ATOM 0 HB2 LEU A 39 16.093 -11.334 5.124 1.00 0.13 H new ATOM 0 HB3 LEU A 39 15.871 -12.249 6.603 1.00 0.13 H new ATOM 0 HG LEU A 39 18.562 -11.294 5.510 1.00 0.12 H new ATOM 0 HD11 LEU A 39 18.509 -9.778 7.477 1.00 0.14 H new ATOM 0 HD12 LEU A 39 17.125 -9.472 6.400 1.00 0.14 H new ATOM 0 HD13 LEU A 39 16.895 -10.392 7.906 1.00 0.14 H new ATOM 0 HD21 LEU A 39 19.451 -12.091 7.685 1.00 0.15 H new ATOM 0 HD22 LEU A 39 17.837 -12.701 8.123 1.00 0.15 H new ATOM 0 HD23 LEU A 39 18.725 -13.430 6.764 1.00 0.15 H new 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 0 H GLY A 40 15.300 -12.647 2.985 1.00 0.14 H new ATOM 0 HA2 GLY A 40 12.914 -13.988 3.821 1.00 0.15 H new ATOM 0 HA3 GLY A 40 13.277 -13.425 2.201 1.00 0.15 H new 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 0 H TYR A 41 15.730 -15.003 1.724 1.00 0.16 H new ATOM 0 HA TYR A 41 14.539 -17.495 0.905 1.00 0.18 H new ATOM 0 HB2 TYR A 41 16.517 -16.367 -0.152 1.00 0.18 H new ATOM 0 HB3 TYR A 41 17.449 -16.643 1.306 1.00 0.18 H new ATOM 0 HD1 TYR A 41 15.601 -18.382 -1.433 1.00 0.26 H new ATOM 0 HD2 TYR A 41 18.474 -18.746 1.737 1.00 0.25 H new ATOM 0 HE1 TYR A 41 16.216 -20.641 -2.250 1.00 0.31 H new ATOM 0 HE2 TYR A 41 19.085 -21.007 0.925 1.00 0.31 H new ATOM 0 HH TYR A 41 18.733 -22.603 -0.595 1.00 0.40 H new 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 0 H GLN A 42 16.719 -16.570 3.708 1.00 0.18 H new ATOM 0 HA GLN A 42 16.824 -19.276 4.696 1.00 0.18 H new ATOM 0 HB2 GLN A 42 17.213 -16.551 6.034 1.00 0.18 H new ATOM 0 HB3 GLN A 42 17.596 -18.080 6.801 1.00 0.18 H new ATOM 0 HG2 GLN A 42 18.774 -17.235 4.107 1.00 0.21 H new ATOM 0 HG3 GLN A 42 19.569 -16.913 5.635 1.00 0.21 H new ATOM 0 HE21 GLN A 42 20.478 -18.744 3.426 1.00 1.42 H new ATOM 0 HE22 GLN A 42 20.629 -20.336 4.177 1.00 1.42 H new 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 0 H TRP A 43 14.646 -16.419 5.374 1.00 0.17 H new ATOM 0 HA TRP A 43 13.309 -17.592 7.603 1.00 0.17 H new ATOM 0 HB2 TRP A 43 13.133 -15.213 6.977 1.00 0.16 H new ATOM 0 HB3 TRP A 43 12.441 -15.630 5.422 1.00 0.16 H new ATOM 0 HD1 TRP A 43 9.889 -15.870 5.294 1.00 0.20 H new ATOM 0 HE1 TRP A 43 7.936 -15.841 6.985 1.00 0.22 H new ATOM 0 HE3 TRP A 43 12.585 -15.996 9.632 1.00 0.17 H new ATOM 0 HZ2 TRP A 43 7.622 -15.870 9.851 1.00 0.23 H new ATOM 0 HZ3 TRP A 43 11.434 -15.995 11.826 1.00 0.20 H new ATOM 0 HH2 TRP A 43 8.958 -15.931 11.943 1.00 0.22 H new 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 0 H LYS A 44 12.771 -18.026 4.027 1.00 0.19 H new ATOM 0 HA LYS A 44 10.278 -19.411 4.474 1.00 0.20 H new ATOM 0 HB2 LYS A 44 12.265 -19.254 2.170 1.00 0.21 H new ATOM 0 HB3 LYS A 44 10.834 -20.261 2.078 1.00 0.21 H new ATOM 0 HG2 LYS A 44 9.428 -18.217 2.663 1.00 0.21 H new ATOM 0 HG3 LYS A 44 10.883 -17.243 2.586 1.00 0.21 H new ATOM 0 HD2 LYS A 44 11.228 -17.795 0.229 1.00 0.28 H new ATOM 0 HD3 LYS A 44 9.977 -19.022 0.272 1.00 0.28 H new ATOM 0 HE2 LYS A 44 8.231 -17.342 0.620 1.00 1.27 H new ATOM 0 HE3 LYS A 44 9.418 -16.078 0.870 1.00 1.27 H new ATOM 0 HZ1 LYS A 44 8.543 -16.025 -1.388 1.00 1.94 H new ATOM 0 HZ2 LYS A 44 10.200 -16.398 -1.415 1.00 1.94 H new ATOM 0 HZ3 LYS A 44 9.049 -17.623 -1.657 1.00 1.94 H new 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 0 H MET A 45 13.597 -20.365 5.125 1.00 0.20 H new ATOM 0 HA MET A 45 12.927 -23.206 4.568 1.00 0.21 H new ATOM 0 HB2 MET A 45 15.491 -21.875 5.599 1.00 0.22 H new ATOM 0 HB3 MET A 45 15.343 -23.554 5.119 1.00 0.22 H new ATOM 0 HG2 MET A 45 14.511 -21.413 3.144 1.00 0.23 H new ATOM 0 HG3 MET A 45 16.222 -21.705 3.385 1.00 0.23 H new ATOM 0 HE1 MET A 45 14.294 -22.910 0.287 1.00 2.17 H new ATOM 0 HE2 MET A 45 15.405 -21.714 0.995 1.00 2.17 H new ATOM 0 HE3 MET A 45 16.050 -23.193 0.244 1.00 2.17 H new 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 0 H LEU A 46 12.547 -20.995 7.232 1.00 0.21 H new ATOM 0 HA LEU A 46 13.370 -22.858 9.309 1.00 0.22 H new ATOM 0 HB2 LEU A 46 11.369 -20.557 9.428 1.00 0.21 H new ATOM 0 HB3 LEU A 46 12.163 -21.314 10.795 1.00 0.21 H new ATOM 0 HG LEU A 46 13.647 -19.918 8.519 1.00 0.21 H new ATOM 0 HD11 LEU A 46 14.018 -18.097 10.172 1.00 0.22 H new ATOM 0 HD12 LEU A 46 12.282 -18.324 9.851 1.00 0.22 H new ATOM 0 HD13 LEU A 46 13.000 -18.961 11.349 1.00 0.22 H new ATOM 0 HD21 LEU A 46 15.570 -20.046 10.086 1.00 0.22 H new ATOM 0 HD22 LEU A 46 14.551 -20.907 11.264 1.00 0.22 H new ATOM 0 HD23 LEU A 46 14.947 -21.669 9.706 1.00 0.22 H new 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 0 H THR A 47 11.881 -24.217 10.676 1.00 0.24 H new ATOM 0 HA THR A 47 9.595 -25.181 9.068 1.00 0.26 H new ATOM 0 HB THR A 47 9.471 -26.931 10.733 1.00 0.27 H new ATOM 0 HG1 THR A 47 10.869 -26.810 12.597 1.00 0.28 H new ATOM 0 HG21 THR A 47 11.770 -27.847 10.615 1.00 0.30 H new ATOM 0 HG22 THR A 47 11.280 -27.137 9.059 1.00 0.30 H new ATOM 0 HG23 THR A 47 12.383 -26.247 10.134 1.00 0.30 H new 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 0 H GLU A 48 7.396 -25.557 10.384 1.00 0.27 H new ATOM 0 HA GLU A 48 6.550 -22.967 11.298 1.00 0.27 H new ATOM 0 HB2 GLU A 48 5.083 -24.749 10.260 1.00 0.29 H new ATOM 0 HB3 GLU A 48 5.260 -25.706 11.718 1.00 0.29 H new ATOM 0 HG2 GLU A 48 4.334 -23.767 13.064 1.00 0.30 H new ATOM 0 HG3 GLU A 48 4.090 -22.877 11.575 1.00 0.30 H new 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 0 H ALA A 49 7.634 -25.995 13.030 1.00 0.29 H new ATOM 0 HA ALA A 49 6.827 -25.102 15.627 1.00 0.30 H new ATOM 0 HB1 ALA A 49 8.497 -26.741 16.408 1.00 0.33 H new ATOM 0 HB2 ALA A 49 7.519 -27.415 15.083 1.00 0.33 H new ATOM 0 HB3 ALA A 49 9.174 -26.845 14.766 1.00 0.33 H new 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 0 H GLU A 50 9.905 -24.637 13.699 1.00 0.27 H new ATOM 0 HA GLU A 50 11.178 -23.153 15.825 1.00 0.25 H new ATOM 0 HB2 GLU A 50 11.633 -23.311 12.814 1.00 0.27 H new ATOM 0 HB3 GLU A 50 12.685 -22.432 13.905 1.00 0.27 H new ATOM 0 HG2 GLU A 50 12.911 -24.607 15.271 1.00 0.33 H new ATOM 0 HG3 GLU A 50 12.071 -25.427 13.969 1.00 0.33 H new 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 0 H LYS A 51 9.044 -22.233 13.010 1.00 0.23 H new ATOM 0 HA LYS A 51 9.519 -19.394 13.466 1.00 0.23 H new ATOM 0 HB2 LYS A 51 7.379 -20.957 11.939 1.00 0.23 H new ATOM 0 HB3 LYS A 51 7.503 -19.209 11.918 1.00 0.23 H new ATOM 0 HG2 LYS A 51 9.711 -19.287 10.888 1.00 0.23 H new ATOM 0 HG3 LYS A 51 9.851 -21.012 11.163 1.00 0.23 H new ATOM 0 HD2 LYS A 51 9.207 -20.626 8.813 1.00 0.26 H new ATOM 0 HD3 LYS A 51 7.878 -21.407 9.646 1.00 0.26 H new ATOM 0 HE2 LYS A 51 6.632 -19.355 9.829 1.00 0.41 H new ATOM 0 HE3 LYS A 51 8.037 -18.369 9.475 1.00 0.41 H new ATOM 0 HZ1 LYS A 51 6.912 -18.421 7.463 1.00 0.37 H new ATOM 0 HZ2 LYS A 51 8.056 -19.658 7.246 1.00 0.37 H new ATOM 0 HZ3 LYS A 51 6.447 -20.046 7.625 1.00 0.37 H new 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 0 H TRP A 52 7.222 -21.883 14.729 1.00 0.24 H new ATOM 0 HA TRP A 52 5.110 -20.279 15.524 1.00 0.26 H new ATOM 0 HB2 TRP A 52 4.972 -22.621 15.938 1.00 0.30 H new ATOM 0 HB3 TRP A 52 6.490 -22.656 16.813 1.00 0.30 H new ATOM 0 HD1 TRP A 52 6.324 -22.526 19.363 1.00 0.31 H new ATOM 0 HE1 TRP A 52 4.516 -21.906 21.101 1.00 0.33 H new ATOM 0 HE3 TRP A 52 2.695 -20.862 16.178 1.00 0.37 H new ATOM 0 HZ2 TRP A 52 1.841 -20.828 21.073 1.00 0.40 H new ATOM 0 HZ3 TRP A 52 0.527 -20.047 17.059 1.00 0.41 H new ATOM 0 HH2 TRP A 52 0.095 -20.029 19.501 1.00 0.43 H new 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 0 HA PRO A 53 7.333 -18.993 19.677 1.00 0.23 H new ATOM 0 HB2 PRO A 53 10.140 -18.613 19.098 1.00 0.27 H new ATOM 0 HB3 PRO A 53 9.471 -19.777 20.225 1.00 0.27 H new ATOM 0 HG2 PRO A 53 10.488 -20.202 17.493 1.00 0.32 H new ATOM 0 HG3 PRO A 53 10.270 -21.364 18.786 1.00 0.32 H new ATOM 0 HD2 PRO A 53 8.643 -21.274 16.541 1.00 0.24 H new ATOM 0 HD3 PRO A 53 8.118 -21.942 18.074 1.00 0.24 H new 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 0 H PHE A 54 8.452 -17.995 16.380 1.00 0.21 H new ATOM 0 HA PHE A 54 8.665 -15.212 17.321 1.00 0.20 H new ATOM 0 HB2 PHE A 54 8.769 -16.521 14.566 1.00 0.21 H new ATOM 0 HB3 PHE A 54 8.998 -14.806 14.841 1.00 0.21 H new ATOM 0 HD1 PHE A 54 10.904 -14.017 16.306 1.00 0.21 H new ATOM 0 HD2 PHE A 54 10.500 -18.116 15.086 1.00 0.24 H new ATOM 0 HE1 PHE A 54 13.276 -14.428 16.901 1.00 0.22 H new ATOM 0 HE2 PHE A 54 12.873 -18.527 15.681 1.00 0.25 H new ATOM 0 HZ PHE A 54 14.261 -16.683 16.590 1.00 0.23 H new 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 0 H PHE A 55 6.200 -17.357 15.733 1.00 0.20 H new ATOM 0 HA PHE A 55 4.544 -15.124 14.901 1.00 0.21 H new ATOM 0 HB2 PHE A 55 4.252 -18.107 15.225 1.00 0.23 H new ATOM 0 HB3 PHE A 55 2.788 -17.148 15.125 1.00 0.23 H new ATOM 0 HD1 PHE A 55 6.104 -17.594 13.410 1.00 0.50 H new ATOM 0 HD2 PHE A 55 1.973 -16.490 13.016 1.00 0.56 H new ATOM 0 HE1 PHE A 55 6.384 -17.419 10.954 1.00 0.50 H new ATOM 0 HE2 PHE A 55 2.253 -16.315 10.559 1.00 0.58 H new ATOM 0 HZ PHE A 55 4.459 -16.782 9.527 1.00 0.29 H new 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 0 H GLN A 56 4.647 -17.323 17.843 1.00 0.21 H new ATOM 0 HA GLN A 56 2.330 -16.211 19.049 1.00 0.21 H new ATOM 0 HB2 GLN A 56 3.515 -18.281 19.804 1.00 0.22 H new ATOM 0 HB3 GLN A 56 4.859 -17.305 20.362 1.00 0.22 H new ATOM 0 HG2 GLN A 56 3.600 -16.315 22.110 1.00 0.24 H new ATOM 0 HG3 GLN A 56 2.067 -16.595 21.307 1.00 0.24 H new ATOM 0 HE21 GLN A 56 1.511 -17.560 23.543 1.00 1.90 H new ATOM 0 HE22 GLN A 56 1.911 -19.262 23.797 1.00 1.90 H new 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 0 H GLU A 57 5.847 -15.111 19.160 1.00 0.19 H new ATOM 0 HA GLU A 57 5.331 -13.087 21.122 1.00 0.18 H new ATOM 0 HB2 GLU A 57 7.593 -13.939 20.416 1.00 0.19 H new ATOM 0 HB3 GLU A 57 7.388 -13.142 18.868 1.00 0.19 H new ATOM 0 HG2 GLU A 57 7.558 -10.983 19.790 1.00 0.19 H new ATOM 0 HG3 GLU A 57 6.943 -11.482 21.353 1.00 0.19 H new 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 0 H ALA A 58 5.193 -13.013 17.433 1.00 0.17 H new ATOM 0 HA ALA A 58 4.611 -10.213 17.297 1.00 0.17 H new ATOM 0 HB1 ALA A 58 3.674 -10.776 15.098 1.00 0.18 H new ATOM 0 HB2 ALA A 58 5.220 -11.617 15.359 1.00 0.18 H new ATOM 0 HB3 ALA A 58 3.686 -12.504 15.521 1.00 0.18 H new 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 0 H GLN A 59 2.584 -13.172 17.856 1.00 0.19 H new ATOM 0 HA GLN A 59 0.066 -11.816 17.715 1.00 0.20 H new ATOM 0 HB2 GLN A 59 0.461 -14.313 17.669 1.00 0.21 H new ATOM 0 HB3 GLN A 59 0.909 -14.248 19.362 1.00 0.21 H new ATOM 0 HG2 GLN A 59 -1.326 -13.280 19.926 1.00 0.25 H new ATOM 0 HG3 GLN A 59 -1.775 -13.313 18.232 1.00 0.25 H new ATOM 0 HE21 GLN A 59 -2.405 -15.336 17.277 1.00 1.65 H new ATOM 0 HE22 GLN A 59 -2.521 -16.826 18.220 1.00 1.65 H new 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 0 H LYS A 60 2.426 -12.409 20.446 1.00 0.20 H new ATOM 0 HA LYS A 60 0.682 -11.269 22.449 1.00 0.20 H new ATOM 0 HB2 LYS A 60 2.601 -12.772 22.941 1.00 0.20 H new ATOM 0 HB3 LYS A 60 3.715 -11.575 22.312 1.00 0.20 H new ATOM 0 HG2 LYS A 60 3.124 -9.978 24.061 1.00 0.22 H new ATOM 0 HG3 LYS A 60 1.767 -10.956 24.583 1.00 0.22 H new ATOM 0 HD2 LYS A 60 3.212 -12.701 25.438 1.00 1.08 H new ATOM 0 HD3 LYS A 60 4.613 -12.058 24.604 1.00 1.08 H new ATOM 0 HE2 LYS A 60 5.115 -10.757 26.410 1.00 1.57 H new ATOM 0 HE3 LYS A 60 3.568 -9.943 26.276 1.00 1.57 H new ATOM 0 HZ1 LYS A 60 3.798 -11.040 28.422 1.00 2.24 H new ATOM 0 HZ2 LYS A 60 2.537 -11.754 27.536 1.00 2.24 H new ATOM 0 HZ3 LYS A 60 4.036 -12.542 27.666 1.00 2.24 H new 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 0 H LEU A 61 3.324 -9.901 20.315 1.00 0.19 H new ATOM 0 HA LEU A 61 3.273 -7.304 21.500 1.00 0.19 H new ATOM 0 HB2 LEU A 61 3.822 -8.149 18.618 1.00 0.20 H new ATOM 0 HB3 LEU A 61 4.232 -6.592 19.309 1.00 0.20 H new ATOM 0 HG LEU A 61 5.210 -9.146 20.625 1.00 0.21 H new ATOM 0 HD11 LEU A 61 7.295 -8.940 19.262 1.00 0.25 H new ATOM 0 HD12 LEU A 61 5.882 -9.247 18.224 1.00 0.25 H new ATOM 0 HD13 LEU A 61 6.557 -7.605 18.344 1.00 0.25 H new ATOM 0 HD21 LEU A 61 7.045 -7.642 21.369 1.00 0.26 H new ATOM 0 HD22 LEU A 61 6.318 -6.303 20.450 1.00 0.26 H new ATOM 0 HD23 LEU A 61 5.456 -6.997 21.844 1.00 0.26 H new 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 0 H GLN A 62 1.202 -8.937 18.979 1.00 0.20 H new ATOM 0 HA GLN A 62 -0.118 -6.484 18.202 1.00 0.21 H new ATOM 0 HB2 GLN A 62 -0.047 -8.605 16.853 1.00 0.22 H new ATOM 0 HB3 GLN A 62 -1.027 -9.400 18.070 1.00 0.22 H new ATOM 0 HG2 GLN A 62 -2.808 -7.606 17.717 1.00 0.26 H new ATOM 0 HG3 GLN A 62 -1.846 -6.972 16.396 1.00 0.26 H new ATOM 0 HE21 GLN A 62 -2.505 -7.759 14.388 1.00 0.94 H new ATOM 0 HE22 GLN A 62 -3.184 -9.367 14.117 1.00 0.94 H new 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 0 H ALA A 63 -0.868 -9.092 20.684 1.00 0.22 H new ATOM 0 HA ALA A 63 -3.409 -7.892 21.361 1.00 0.23 H new ATOM 0 HB1 ALA A 63 -3.239 -9.334 23.356 1.00 0.24 H new ATOM 0 HB2 ALA A 63 -2.821 -10.233 21.879 1.00 0.24 H new ATOM 0 HB3 ALA A 63 -1.534 -9.671 22.972 1.00 0.24 H new 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 0 H MET A 64 -0.017 -7.606 22.735 1.00 0.22 H new ATOM 0 HA MET A 64 -0.825 -5.819 24.856 1.00 0.23 H new ATOM 0 HB2 MET A 64 1.509 -7.141 24.008 1.00 0.24 H new ATOM 0 HB3 MET A 64 1.885 -5.441 23.806 1.00 0.24 H new ATOM 0 HG2 MET A 64 1.419 -4.944 26.128 1.00 1.10 H new ATOM 0 HG3 MET A 64 0.575 -6.460 26.370 1.00 1.10 H new ATOM 0 HE1 MET A 64 5.040 -5.815 25.633 1.00 1.47 H new ATOM 0 HE2 MET A 64 4.028 -6.287 24.247 1.00 1.47 H new ATOM 0 HE3 MET A 64 3.650 -4.808 25.162 1.00 1.47 H new 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 0 H HIS A 65 0.200 -5.324 21.383 1.00 0.22 H new ATOM 0 HA HIS A 65 0.359 -2.472 21.566 1.00 0.22 H new ATOM 0 HB2 HIS A 65 1.158 -3.887 19.649 1.00 0.22 H new ATOM 0 HB3 HIS A 65 -0.507 -4.248 19.239 1.00 0.22 H new ATOM 0 HD2 HIS A 65 -1.664 -2.341 17.575 1.00 0.27 H new ATOM 0 HE1 HIS A 65 1.128 0.768 18.190 1.00 0.26 H new ATOM 0 HE2 HIS A 65 -0.942 0.084 16.849 1.00 0.28 H new 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 0 H ARG A 66 -2.401 -4.796 21.022 1.00 0.22 H new ATOM 0 HA ARG A 66 -4.305 -2.738 20.418 1.00 0.22 H new ATOM 0 HB2 ARG A 66 -4.533 -5.240 19.951 1.00 0.23 H new ATOM 0 HB3 ARG A 66 -4.790 -5.488 21.667 1.00 0.23 H new ATOM 0 HG2 ARG A 66 -6.632 -3.597 21.416 1.00 0.26 H new ATOM 0 HG3 ARG A 66 -6.534 -3.951 19.703 1.00 0.26 H new ATOM 0 HD2 ARG A 66 -6.767 -6.410 21.342 1.00 0.28 H new ATOM 0 HD3 ARG A 66 -8.125 -5.325 21.567 1.00 0.28 H new ATOM 0 HE ARG A 66 -7.483 -5.516 18.711 1.00 1.33 H new ATOM 0 HH11 ARG A 66 -9.049 -7.029 21.435 1.00 2.29 H new ATOM 0 HH12 ARG A 66 -10.051 -8.082 20.431 1.00 2.29 H new ATOM 0 HH21 ARG A 66 -8.726 -6.884 17.423 1.00 3.11 H new ATOM 0 HH22 ARG A 66 -9.870 -8.001 18.176 1.00 3.11 H new 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 0 H GLU A 67 -2.933 -4.012 23.506 1.00 0.22 H new ATOM 0 HA GLU A 67 -5.165 -3.041 25.088 1.00 0.22 H new ATOM 0 HB2 GLU A 67 -3.559 -4.813 25.832 1.00 0.22 H new ATOM 0 HB3 GLU A 67 -2.280 -3.615 25.882 1.00 0.22 H new ATOM 0 HG2 GLU A 67 -3.278 -2.424 27.685 1.00 0.23 H new ATOM 0 HG3 GLU A 67 -4.876 -3.062 27.355 1.00 0.23 H new 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 0 H LYS A 68 -2.046 -1.640 23.875 1.00 0.22 H new ATOM 0 HA LYS A 68 -2.226 0.723 25.545 1.00 0.22 H new ATOM 0 HB2 LYS A 68 -0.207 -0.272 24.249 1.00 0.22 H new ATOM 0 HB3 LYS A 68 -0.907 0.459 22.819 1.00 0.22 H new ATOM 0 HG2 LYS A 68 -0.876 2.697 23.917 1.00 0.23 H new ATOM 0 HG3 LYS A 68 -0.248 1.985 25.390 1.00 0.23 H new ATOM 0 HD2 LYS A 68 1.711 1.070 23.944 1.00 0.25 H new ATOM 0 HD3 LYS A 68 1.134 2.125 22.668 1.00 0.25 H new ATOM 0 HE2 LYS A 68 2.171 3.916 23.636 1.00 1.08 H new ATOM 0 HE3 LYS A 68 1.258 3.682 25.113 1.00 1.08 H new ATOM 0 HZ1 LYS A 68 3.639 3.473 25.513 1.00 1.85 H new ATOM 0 HZ2 LYS A 68 2.868 1.989 25.808 1.00 1.85 H new ATOM 0 HZ3 LYS A 68 3.753 2.217 24.376 1.00 1.85 H new 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 0 H TYR A 69 -3.350 -0.130 22.142 1.00 0.22 H new ATOM 0 HA TYR A 69 -5.061 2.338 22.340 1.00 0.22 H new ATOM 0 HB2 TYR A 69 -3.801 1.220 19.799 1.00 0.23 H new ATOM 0 HB3 TYR A 69 -4.662 2.736 19.980 1.00 0.23 H new ATOM 0 HD1 TYR A 69 -3.662 4.255 22.037 1.00 0.27 H new ATOM 0 HD2 TYR A 69 -1.481 1.347 19.751 1.00 0.26 H new ATOM 0 HE1 TYR A 69 -1.534 5.384 22.630 1.00 0.29 H new ATOM 0 HE2 TYR A 69 0.646 2.472 20.344 1.00 0.28 H new ATOM 0 HH TYR A 69 1.627 4.151 21.441 1.00 0.31 H new 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 0 HA PRO A 70 -7.539 -1.579 21.693 1.00 0.23 H new ATOM 0 HB2 PRO A 70 -9.588 -0.142 23.303 1.00 0.24 H new ATOM 0 HB3 PRO A 70 -8.833 -1.682 23.665 1.00 0.24 H new ATOM 0 HG2 PRO A 70 -8.338 0.650 25.052 1.00 0.47 H new ATOM 0 HG3 PRO A 70 -7.250 -0.723 25.014 1.00 0.47 H new ATOM 0 HD2 PRO A 70 -6.984 1.912 23.634 1.00 0.25 H new ATOM 0 HD3 PRO A 70 -5.729 0.778 24.091 1.00 0.25 H new 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 0 H ASN A 71 -8.034 1.820 20.954 1.00 0.24 H new ATOM 0 HA ASN A 71 -10.401 0.993 19.307 1.00 0.24 H new ATOM 0 HB2 ASN A 71 -10.514 2.969 20.978 1.00 0.25 H new ATOM 0 HB3 ASN A 71 -9.385 3.806 19.932 1.00 0.25 H new ATOM 0 HD21 ASN A 71 -12.831 4.749 18.739 1.00 1.04 H new ATOM 0 HD22 ASN A 71 -11.869 4.995 20.201 1.00 1.04 H new 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 0 H TYR A 72 -7.093 1.010 18.935 1.00 0.23 H new ATOM 0 HA TYR A 72 -6.754 2.709 16.674 1.00 0.23 H new ATOM 0 HB2 TYR A 72 -4.872 1.748 17.977 1.00 0.23 H new ATOM 0 HB3 TYR A 72 -5.345 0.126 17.513 1.00 0.23 H new ATOM 0 HD1 TYR A 72 -4.070 3.371 16.232 1.00 0.28 H new ATOM 0 HD2 TYR A 72 -4.865 -0.746 15.315 1.00 0.27 H new ATOM 0 HE1 TYR A 72 -2.790 3.595 14.122 1.00 0.32 H new ATOM 0 HE2 TYR A 72 -3.581 -0.527 13.208 1.00 0.30 H new ATOM 0 HH TYR A 72 -2.390 0.816 11.877 1.00 0.36 H new 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 0 H LYS A 73 -6.936 2.356 14.417 1.00 0.24 H new ATOM 0 HA LYS A 73 -8.000 -0.328 13.650 1.00 0.25 H new ATOM 0 HB2 LYS A 73 -9.906 1.281 13.767 1.00 0.27 H new ATOM 0 HB3 LYS A 73 -9.051 2.385 12.706 1.00 0.27 H new ATOM 0 HG2 LYS A 73 -8.955 0.588 10.935 1.00 0.32 H new ATOM 0 HG3 LYS A 73 -9.841 -0.492 11.994 1.00 0.32 H new ATOM 0 HD2 LYS A 73 -11.789 1.032 11.998 1.00 0.85 H new ATOM 0 HD3 LYS A 73 -10.901 2.227 11.074 1.00 0.85 H new ATOM 0 HE2 LYS A 73 -11.146 1.066 9.077 1.00 0.74 H new ATOM 0 HE3 LYS A 73 -10.937 -0.498 9.839 1.00 0.74 H new ATOM 0 HZ1 LYS A 73 -13.210 -0.202 9.056 1.00 1.50 H new ATOM 0 HZ2 LYS A 73 -13.190 -0.325 10.749 1.00 1.50 H new ATOM 0 HZ3 LYS A 73 -13.393 1.191 10.011 1.00 1.50 H new 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 0 H TYR A 74 -7.093 -1.111 11.643 1.00 0.25 H new ATOM 0 HA TYR A 74 -4.834 0.448 10.594 1.00 0.26 H new ATOM 0 HB2 TYR A 74 -4.710 -1.982 10.697 1.00 0.27 H new ATOM 0 HB3 TYR A 74 -6.191 -2.148 9.775 1.00 0.27 H new ATOM 0 HD1 TYR A 74 -3.174 0.089 9.278 1.00 0.49 H new ATOM 0 HD2 TYR A 74 -5.676 -3.019 7.681 1.00 0.20 H new ATOM 0 HE1 TYR A 74 -1.888 0.134 7.159 1.00 0.56 H new ATOM 0 HE2 TYR A 74 -4.385 -2.971 5.567 1.00 0.25 H new ATOM 0 HH TYR A 74 -2.437 -2.249 4.587 1.00 0.50 H new 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 0 H ARG A 75 -5.184 2.169 9.142 1.00 0.26 H new ATOM 0 HA ARG A 75 -7.515 1.865 7.252 1.00 0.27 H new ATOM 0 HB2 ARG A 75 -6.598 4.372 8.756 1.00 0.28 H new ATOM 0 HB3 ARG A 75 -7.934 4.280 7.626 1.00 0.28 H new ATOM 0 HG2 ARG A 75 -8.944 2.437 9.115 1.00 0.40 H new ATOM 0 HG3 ARG A 75 -7.689 2.784 10.288 1.00 0.40 H new ATOM 0 HD2 ARG A 75 -10.037 4.491 9.459 1.00 0.49 H new ATOM 0 HD3 ARG A 75 -9.438 4.146 11.069 1.00 0.49 H new ATOM 0 HE ARG A 75 -7.338 5.606 9.819 1.00 1.42 H new ATOM 0 HH11 ARG A 75 -10.722 5.921 10.630 1.00 2.33 H new ATOM 0 HH12 ARG A 75 -10.657 7.681 10.770 1.00 2.33 H new ATOM 0 HH21 ARG A 75 -7.254 7.864 9.985 1.00 3.23 H new ATOM 0 HH22 ARG A 75 -8.709 8.772 10.408 1.00 3.23 H new 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 0 HA PRO A 76 -3.543 2.636 5.018 1.00 0.25 H new ATOM 0 HB2 PRO A 76 -4.248 1.091 2.795 1.00 0.25 H new ATOM 0 HB3 PRO A 76 -3.451 0.404 4.197 1.00 0.25 H new ATOM 0 HG2 PRO A 76 -6.328 0.287 3.409 1.00 0.25 H new ATOM 0 HG3 PRO A 76 -5.356 -0.908 4.246 1.00 0.25 H new ATOM 0 HD2 PRO A 76 -7.190 0.743 5.532 1.00 0.25 H new ATOM 0 HD3 PRO A 76 -5.825 0.005 6.348 1.00 0.25 H new 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 0 H ARG A 77 -2.998 3.947 3.204 1.00 0.26 H new ATOM 0 HA ARG A 77 -5.324 5.589 2.440 1.00 0.27 H new ATOM 0 HB2 ARG A 77 -3.093 6.600 3.114 1.00 0.30 H new ATOM 0 HB3 ARG A 77 -2.387 5.906 1.668 1.00 0.30 H new ATOM 0 HG2 ARG A 77 -4.323 7.064 0.357 1.00 0.35 H new ATOM 0 HG3 ARG A 77 -4.650 7.954 1.830 1.00 0.35 H new ATOM 0 HD2 ARG A 77 -1.777 8.011 1.108 1.00 0.92 H new ATOM 0 HD3 ARG A 77 -2.793 8.690 -0.148 1.00 0.92 H new ATOM 0 HE ARG A 77 -3.716 9.695 2.428 1.00 1.64 H new ATOM 0 HH11 ARG A 77 -1.206 9.936 0.013 1.00 2.56 H new ATOM 0 HH12 ARG A 77 -0.693 11.546 0.532 1.00 2.56 H new ATOM 0 HH21 ARG A 77 -3.046 11.732 3.113 1.00 3.30 H new ATOM 0 HH22 ARG A 77 -1.727 12.554 2.273 1.00 3.30 H new 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 0 H ARG A 78 -6.414 5.294 0.483 1.00 0.29 H new ATOM 0 HA ARG A 78 -5.293 3.319 -1.394 1.00 0.29 H new ATOM 0 HB2 ARG A 78 -7.862 4.975 -1.316 1.00 0.33 H new ATOM 0 HB3 ARG A 78 -7.497 3.803 -2.566 1.00 0.33 H new ATOM 0 HG2 ARG A 78 -7.397 3.011 0.371 1.00 0.32 H new ATOM 0 HG3 ARG A 78 -8.923 3.034 -0.490 1.00 0.32 H new ATOM 0 HD2 ARG A 78 -6.456 1.373 -1.220 1.00 0.35 H new ATOM 0 HD3 ARG A 78 -7.983 0.762 -0.615 1.00 0.35 H new ATOM 0 HE ARG A 78 -8.064 2.392 -3.164 1.00 0.47 H new ATOM 0 HH11 ARG A 78 -8.491 -0.613 -1.448 1.00 2.03 H new ATOM 0 HH12 ARG A 78 -9.123 -1.459 -2.864 1.00 2.03 H new ATOM 0 HH21 ARG A 78 -8.806 1.314 -4.968 1.00 1.11 H new ATOM 0 HH22 ARG A 78 -9.300 -0.377 -4.840 1.00 1.11 H new 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 0 H LYS A 79 -4.482 3.799 -3.477 1.00 0.32 H new ATOM 0 HA LYS A 79 -3.901 6.671 -3.988 1.00 0.38 H new ATOM 0 HB2 LYS A 79 -3.041 4.062 -5.318 1.00 0.43 H new ATOM 0 HB3 LYS A 79 -2.502 5.653 -5.819 1.00 0.43 H new ATOM 0 HG2 LYS A 79 -1.589 6.068 -3.515 1.00 0.46 H new ATOM 0 HG3 LYS A 79 -2.126 4.476 -3.016 1.00 0.46 H new ATOM 0 HD2 LYS A 79 -0.684 3.436 -4.788 1.00 0.58 H new ATOM 0 HD3 LYS A 79 -0.145 5.028 -5.282 1.00 0.58 H new ATOM 0 HE2 LYS A 79 0.608 5.386 -2.826 1.00 1.16 H new ATOM 0 HE3 LYS A 79 0.327 3.673 -2.587 1.00 1.16 H new ATOM 0 HZ1 LYS A 79 2.628 4.105 -3.206 1.00 2.03 H new ATOM 0 HZ2 LYS A 79 1.861 3.193 -4.417 1.00 2.03 H new ATOM 0 HZ3 LYS A 79 2.134 4.853 -4.648 1.00 2.03 H new 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 0 H ALA A 80 -4.258 7.443 -6.385 1.00 0.52 H new ATOM 0 HA ALA A 80 -7.060 7.006 -6.944 1.00 0.65 H new ATOM 0 HB1 ALA A 80 -6.601 8.346 -8.954 1.00 0.65 H new ATOM 0 HB2 ALA A 80 -5.868 9.087 -7.511 1.00 0.65 H new ATOM 0 HB3 ALA A 80 -4.851 8.193 -8.666 1.00 0.65 H new 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 0 H LYS A 81 -7.819 4.984 -7.696 1.00 1.03 H new ATOM 0 HA LYS A 81 -6.276 3.824 -9.976 1.00 1.25 H new ATOM 0 HB2 LYS A 81 -5.626 2.703 -7.773 1.00 1.30 H new ATOM 0 HB3 LYS A 81 -7.306 2.252 -7.559 1.00 1.30 H new ATOM 0 HG2 LYS A 81 -7.272 1.006 -9.719 1.00 1.57 H new ATOM 0 HG3 LYS A 81 -5.616 1.504 -10.000 1.00 1.57 H new ATOM 0 HD2 LYS A 81 -4.956 0.362 -7.823 1.00 1.80 H new ATOM 0 HD3 LYS A 81 -6.602 -0.221 -7.670 1.00 1.80 H new ATOM 0 HE2 LYS A 81 -6.421 -1.650 -9.556 1.00 2.22 H new ATOM 0 HE3 LYS A 81 -5.119 -0.718 -10.269 1.00 2.22 H new ATOM 0 HZ1 LYS A 81 -3.964 -2.479 -9.401 1.00 2.52 H new ATOM 0 HZ2 LYS A 81 -3.879 -1.419 -8.078 1.00 2.52 H new ATOM 0 HZ3 LYS A 81 -5.011 -2.685 -8.081 1.00 2.52 H new 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 0 H MET A 82 -7.686 3.491 -11.671 1.00 1.69 H new ATOM 0 HA MET A 82 -10.517 2.793 -10.940 1.00 1.95 H new ATOM 0 HB2 MET A 82 -10.103 5.260 -11.652 1.00 2.17 H new ATOM 0 HB3 MET A 82 -9.698 4.620 -13.232 1.00 2.17 H new ATOM 0 HG2 MET A 82 -11.898 3.729 -13.575 1.00 2.44 H new ATOM 0 HG3 MET A 82 -12.291 3.796 -11.868 1.00 2.44 H new ATOM 0 HE1 MET A 82 -13.612 6.659 -14.874 1.00 3.50 H new ATOM 0 HE2 MET A 82 -12.340 5.467 -15.235 1.00 3.50 H new ATOM 0 HE3 MET A 82 -13.876 4.938 -14.509 1.00 3.50 H new 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 0 H LEU A 83 -10.824 0.684 -11.764 1.00 2.25 H new ATOM 0 HA LEU A 83 -9.093 -0.107 -14.042 1.00 2.53 H new ATOM 0 HB2 LEU A 83 -11.190 -1.687 -12.474 1.00 2.66 H new ATOM 0 HB3 LEU A 83 -9.981 -2.351 -13.555 1.00 2.66 H new ATOM 0 HG LEU A 83 -9.335 -0.749 -11.030 1.00 2.60 H new ATOM 0 HD11 LEU A 83 -8.655 -2.929 -10.063 1.00 2.93 H new ATOM 0 HD12 LEU A 83 -10.385 -2.923 -10.481 1.00 2.93 H new ATOM 0 HD13 LEU A 83 -9.218 -3.758 -11.533 1.00 2.93 H new ATOM 0 HD21 LEU A 83 -7.025 -1.578 -11.427 1.00 2.75 H new ATOM 0 HD22 LEU A 83 -7.572 -2.384 -12.917 1.00 2.75 H new ATOM 0 HD23 LEU A 83 -7.604 -0.608 -12.802 1.00 2.75 H new 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 0 HA PRO A 84 -12.357 0.712 -16.997 1.00 3.41 H new ATOM 0 HB2 PRO A 84 -11.588 -1.150 -18.947 1.00 3.83 H new ATOM 0 HB3 PRO A 84 -10.816 0.414 -18.774 1.00 3.83 H new ATOM 0 HG2 PRO A 84 -9.882 -2.271 -17.851 1.00 3.81 H new ATOM 0 HG3 PRO A 84 -8.945 -0.914 -18.444 1.00 3.81 H new ATOM 0 HD2 PRO A 84 -9.105 -1.540 -15.761 1.00 3.32 H new ATOM 0 HD3 PRO A 84 -8.822 0.095 -16.325 1.00 3.32 H new 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 0 H LYS A 85 -14.334 -0.167 -17.893 1.00 3.67 H new ATOM 0 HA LYS A 85 -14.898 -2.934 -16.870 1.00 3.89 H new ATOM 0 HB2 LYS A 85 -16.696 -0.465 -16.665 1.00 3.97 H new ATOM 0 HB3 LYS A 85 -17.144 -2.089 -16.184 1.00 3.97 H new ATOM 0 HG2 LYS A 85 -15.371 -2.142 -14.474 1.00 4.14 H new ATOM 0 HG3 LYS A 85 -14.721 -0.614 -15.036 1.00 4.14 H new ATOM 0 HD2 LYS A 85 -16.042 0.027 -13.170 1.00 4.45 H new ATOM 0 HD3 LYS A 85 -17.087 0.378 -14.531 1.00 4.45 H new ATOM 0 HE2 LYS A 85 -18.033 -0.979 -12.449 1.00 5.03 H new ATOM 0 HE3 LYS A 85 -18.536 -1.408 -14.072 1.00 5.03 H new ATOM 0 HZ1 LYS A 85 -17.743 -3.271 -12.552 1.00 5.55 H new ATOM 0 HZ2 LYS A 85 -17.100 -3.237 -14.123 1.00 5.55 H new ATOM 0 HZ3 LYS A 85 -16.172 -2.684 -12.813 1.00 5.55 H new 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 0 H5' DC B 101 -18.993 -18.239 1.524 1.00 0.51 H new ATOM 0 H5'' DC B 101 -17.770 -19.308 2.182 1.00 0.51 H new ATOM 0 H4' DC B 101 -17.421 -19.083 -0.160 1.00 0.47 H new ATOM 0 H3' DC B 101 -15.346 -18.724 1.577 1.00 0.44 H new ATOM 0 H2' DC B 101 -15.081 -16.364 1.526 1.00 0.40 H new ATOM 0 H2'' DC B 101 -14.206 -16.728 0.051 1.00 0.40 H new ATOM 0 HO5' DC B 101 -18.070 -17.406 3.492 1.00 0.49 H new ATOM 0 H1' DC B 101 -15.894 -16.048 -1.293 1.00 0.41 H new ATOM 0 H41 DC B 101 -17.809 -10.821 2.311 1.00 0.40 H new ATOM 0 H42 DC B 101 -17.643 -10.276 0.639 1.00 0.40 H new ATOM 0 H5 DC B 101 -17.452 -13.107 2.975 1.00 0.41 H new ATOM 0 H6 DC B 101 -16.869 -15.353 2.228 1.00 0.41 H new 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 0 H5' DC B 102 -14.450 -17.892 -2.759 1.00 0.37 H new ATOM 0 H5'' DC B 102 -13.157 -18.976 -3.234 1.00 0.37 H new ATOM 0 H4' DC B 102 -13.008 -17.104 -4.619 1.00 0.34 H new ATOM 0 H3' DC B 102 -10.789 -17.753 -3.080 1.00 0.32 H new ATOM 0 H2' DC B 102 -10.674 -15.807 -1.695 1.00 0.29 H new ATOM 0 H2'' DC B 102 -9.990 -15.087 -3.139 1.00 0.29 H new ATOM 0 H1' DC B 102 -11.930 -14.082 -3.758 1.00 0.29 H new ATOM 0 H41 DC B 102 -13.648 -11.715 2.183 1.00 0.27 H new ATOM 0 H42 DC B 102 -13.865 -10.418 1.003 1.00 0.27 H new ATOM 0 H5 DC B 102 -12.911 -13.929 1.560 1.00 0.29 H new ATOM 0 H6 DC B 102 -12.240 -15.383 -0.285 1.00 0.29 H new 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 0 H5' DT B 103 -10.470 -14.388 -6.125 1.00 0.26 H new ATOM 0 H5'' DT B 103 -9.164 -14.849 -7.198 1.00 0.26 H new ATOM 0 H4' DT B 103 -9.277 -12.538 -7.308 1.00 0.24 H new ATOM 0 H3' DT B 103 -6.884 -13.635 -6.383 1.00 0.24 H new ATOM 0 H2' DT B 103 -6.816 -12.689 -4.192 1.00 0.22 H new ATOM 0 H2'' DT B 103 -6.387 -11.224 -5.051 1.00 0.22 H new ATOM 0 H1' DT B 103 -8.475 -10.348 -4.934 1.00 0.21 H new ATOM 0 H3 DT B 103 -9.943 -9.325 -0.868 1.00 0.20 H new ATOM 0 H71 DT B 103 -8.790 -14.595 -0.812 1.00 0.23 H new ATOM 0 H72 DT B 103 -7.611 -13.666 0.144 1.00 0.23 H new ATOM 0 H73 DT B 103 -9.318 -13.716 0.643 1.00 0.23 H new ATOM 0 H6 DT B 103 -8.297 -13.386 -2.842 1.00 0.21 H new 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 0 H5' DG B 104 -7.165 -9.253 -7.097 1.00 0.20 H new ATOM 0 H5'' DG B 104 -5.948 -8.826 -8.283 1.00 0.20 H new ATOM 0 H4' DG B 104 -6.330 -6.906 -7.055 1.00 0.19 H new ATOM 0 H3' DG B 104 -3.721 -7.944 -6.971 1.00 0.20 H new ATOM 0 H2' DG B 104 -3.548 -8.347 -4.630 1.00 0.19 H new ATOM 0 H2'' DG B 104 -3.365 -6.605 -4.555 1.00 0.19 H new ATOM 0 H1' DG B 104 -5.539 -6.240 -3.943 1.00 0.17 H new ATOM 0 H8 DG B 104 -4.583 -9.935 -3.402 1.00 0.17 H new ATOM 0 H1 DG B 104 -7.831 -7.200 1.399 1.00 0.15 H new ATOM 0 H21 DG B 104 -8.012 -4.430 -0.705 1.00 0.15 H new ATOM 0 H22 DG B 104 -8.409 -5.146 0.861 1.00 0.15 H new 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 0 H5' DC B 105 -4.904 -3.793 -5.793 1.00 0.20 H new ATOM 0 H5'' DC B 105 -3.789 -2.619 -6.463 1.00 0.20 H new ATOM 0 H4' DC B 105 -4.863 -1.684 -4.557 1.00 0.19 H new ATOM 0 H3' DC B 105 -2.064 -1.729 -4.732 1.00 0.20 H new ATOM 0 H2' DC B 105 -1.513 -2.894 -2.754 1.00 0.19 H new ATOM 0 H2'' DC B 105 -2.109 -1.472 -1.921 1.00 0.19 H new ATOM 0 H1' DC B 105 -4.077 -2.429 -1.386 1.00 0.18 H new ATOM 0 H41 DC B 105 -2.009 -8.617 -0.179 1.00 0.15 H new ATOM 0 H42 DC B 105 -2.941 -8.086 1.225 1.00 0.15 H new ATOM 0 H5 DC B 105 -1.675 -7.230 -2.121 1.00 0.16 H new ATOM 0 H6 DC B 105 -2.122 -5.057 -3.149 1.00 0.17 H new 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 0 H5' DA B 106 -3.746 0.686 -1.394 1.00 0.20 H new ATOM 0 H5'' DA B 106 -3.119 2.320 -1.470 1.00 0.20 H new ATOM 0 H4' DA B 106 -3.332 1.779 0.790 1.00 0.19 H new ATOM 0 H3' DA B 106 -0.848 2.564 -0.141 1.00 0.20 H new ATOM 0 H2' DA B 106 0.285 0.440 0.053 1.00 0.19 H new ATOM 0 H2'' DA B 106 0.465 1.000 1.704 1.00 0.19 H new ATOM 0 H1' DA B 106 -1.329 -0.243 2.491 1.00 0.18 H new ATOM 0 H8 DA B 106 0.145 -1.651 -0.787 1.00 0.17 H new ATOM 0 H61 DA B 106 0.255 -7.020 2.264 1.00 0.14 H new ATOM 0 H62 DA B 106 0.707 -6.186 0.773 1.00 0.14 H new ATOM 0 H2 DA B 106 -1.825 -3.988 4.847 1.00 0.15 H new 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 0 H5' DC B 107 -1.124 1.659 4.294 1.00 0.20 H new ATOM 0 H5'' DC B 107 -0.554 3.086 5.137 1.00 0.20 H new ATOM 0 H4' DC B 107 -0.041 1.298 6.522 1.00 0.18 H new ATOM 0 H3' DC B 107 2.129 2.815 5.533 1.00 0.19 H new ATOM 0 H2' DC B 107 3.243 1.027 4.364 1.00 0.18 H new ATOM 0 H2'' DC B 107 3.769 0.614 5.984 1.00 0.18 H new ATOM 0 H1' DC B 107 2.117 -0.988 6.290 1.00 0.17 H new ATOM 0 H41 DC B 107 3.632 -4.268 0.765 1.00 0.15 H new ATOM 0 H42 DC B 107 3.496 -5.450 2.072 1.00 0.15 H new ATOM 0 H5 DC B 107 3.207 -1.924 1.082 1.00 0.17 H new ATOM 0 H6 DC B 107 2.550 -0.176 2.685 1.00 0.17 H new 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 0 H5' DA B 108 2.479 0.729 9.885 1.00 0.19 H new ATOM 0 H5'' DA B 108 3.652 1.690 10.763 1.00 0.19 H new ATOM 0 H4' DA B 108 3.779 -0.521 11.536 1.00 0.17 H new ATOM 0 H3' DA B 108 6.185 0.397 9.998 1.00 0.16 H new ATOM 0 H2' DA B 108 7.132 -1.776 9.968 1.00 0.15 H new ATOM 0 H2'' DA B 108 6.271 -2.272 11.412 1.00 0.15 H new ATOM 0 H1' DA B 108 4.883 -3.339 9.977 1.00 0.15 H new ATOM 0 H8 DA B 108 5.051 -0.421 7.451 1.00 0.15 H new ATOM 0 H61 DA B 108 6.837 -4.798 3.440 1.00 0.14 H new ATOM 0 H62 DA B 108 6.386 -3.098 3.606 1.00 0.14 H new ATOM 0 H2 DA B 108 6.497 -6.632 7.520 1.00 0.14 H new 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 0 H5' DA B 109 7.915 -1.747 12.863 1.00 0.14 H new ATOM 0 H5'' DA B 109 8.690 -0.678 14.015 1.00 0.14 H new ATOM 0 H4' DA B 109 10.212 -2.446 13.563 1.00 0.13 H new ATOM 0 H3' DA B 109 10.979 0.203 13.154 1.00 0.13 H new ATOM 0 H2' DA B 109 11.229 0.227 10.790 1.00 0.13 H new ATOM 0 H2'' DA B 109 12.725 -0.616 11.143 1.00 0.13 H new ATOM 0 H1' DA B 109 11.906 -2.634 10.549 1.00 0.12 H new ATOM 0 H8 DA B 109 9.427 0.097 9.374 1.00 0.13 H new ATOM 0 H61 DA B 109 9.365 -3.066 4.047 1.00 0.13 H new ATOM 0 H62 DA B 109 8.814 -1.602 4.869 1.00 0.13 H new ATOM 0 H2 DA B 109 11.828 -5.359 7.039 1.00 0.12 H new 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 0 H5' DA B 110 14.330 -2.799 12.572 1.00 0.11 H new ATOM 0 H5'' DA B 110 15.606 -2.301 13.665 1.00 0.11 H new ATOM 0 H4' DA B 110 16.693 -3.242 11.831 1.00 0.10 H new ATOM 0 H3' DA B 110 17.155 -0.523 12.377 1.00 0.10 H new ATOM 0 H2' DA B 110 16.415 0.411 10.304 1.00 0.10 H new ATOM 0 H2'' DA B 110 17.912 -0.256 9.683 1.00 0.10 H new ATOM 0 H1' DA B 110 16.900 -2.097 8.773 1.00 0.09 H new ATOM 0 H8 DA B 110 14.180 0.511 9.650 1.00 0.11 H new ATOM 0 H61 DA B 110 12.374 -0.335 3.770 1.00 0.12 H new ATOM 0 H62 DA B 110 12.083 0.590 5.247 1.00 0.12 H new ATOM 0 H2 DA B 110 15.747 -3.145 4.630 1.00 0.10 H new 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 0 H5' DC B 111 19.972 -2.419 9.352 1.00 0.11 H new ATOM 0 H5'' DC B 111 21.586 -2.096 9.955 1.00 0.11 H new ATOM 0 H4' DC B 111 21.794 -2.154 7.649 1.00 0.11 H new ATOM 0 H3' DC B 111 22.383 0.323 8.907 1.00 0.13 H new ATOM 0 H2' DC B 111 20.798 1.678 7.739 1.00 0.13 H new ATOM 0 H2'' DC B 111 21.936 1.509 6.417 1.00 0.13 H new ATOM 0 H1' DC B 111 20.749 -0.152 5.385 1.00 0.11 H new ATOM 0 H41 DC B 111 14.769 2.696 5.664 1.00 0.14 H new ATOM 0 H42 DC B 111 15.028 2.113 4.016 1.00 0.14 H new ATOM 0 H5 DC B 111 16.407 2.353 7.441 1.00 0.12 H new ATOM 0 H6 DC B 111 18.609 1.422 8.003 1.00 0.12 H new 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 0 H5' DA B 112 24.476 -1.365 5.209 1.00 0.15 H new ATOM 0 H5'' DA B 112 26.163 -0.889 5.211 1.00 0.15 H new ATOM 0 H4' DA B 112 25.465 -1.396 2.993 1.00 0.16 H new ATOM 0 H3' DA B 112 26.886 0.861 3.479 1.00 0.17 H new ATOM 0 H2' DA B 112 25.162 2.508 3.453 1.00 0.18 H new ATOM 0 H2'' DA B 112 25.467 2.414 1.730 1.00 0.18 H new ATOM 0 H1' DA B 112 23.619 1.162 1.312 1.00 0.16 H new ATOM 0 H8 DA B 112 23.418 2.676 4.856 1.00 0.17 H new ATOM 0 H61 DA B 112 17.636 4.204 3.171 1.00 0.18 H new ATOM 0 H62 DA B 112 18.854 4.390 4.437 1.00 0.18 H new ATOM 0 H2 DA B 112 19.437 1.689 -0.045 1.00 0.16 H new 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 0 H5' DC B 113 25.246 0.589 -0.635 1.00 0.20 H new ATOM 0 H5'' DC B 113 26.564 0.671 -1.788 1.00 0.20 H new ATOM 0 H4' DC B 113 24.730 1.623 -2.849 1.00 0.21 H new ATOM 0 H3' DC B 113 26.990 3.254 -2.436 1.00 0.24 H new ATOM 0 H2' DC B 113 25.950 4.918 -1.045 1.00 0.25 H new ATOM 0 H2'' DC B 113 25.335 5.487 -2.584 1.00 0.25 H new ATOM 0 H1' DC B 113 23.296 4.466 -2.338 1.00 0.23 H new ATOM 0 H41 DC B 113 21.994 6.475 3.840 1.00 0.22 H new ATOM 0 H42 DC B 113 20.577 6.814 2.841 1.00 0.22 H new ATOM 0 H5 DC B 113 23.997 5.422 2.942 1.00 0.22 H new ATOM 0 H6 DC B 113 25.048 4.467 0.949 1.00 0.22 H new 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 0 H5' DC B 114 23.822 4.985 -5.318 1.00 0.31 H new ATOM 0 H5'' DC B 114 24.702 5.350 -6.789 1.00 0.31 H new ATOM 0 H4' DC B 114 23.029 6.953 -6.668 1.00 0.33 H new ATOM 0 H3' DC B 114 25.675 7.884 -6.568 1.00 0.37 H new ATOM 0 H2' DC B 114 25.603 8.966 -4.438 1.00 0.36 H new ATOM 0 H2'' DC B 114 24.687 10.182 -5.305 1.00 0.36 H new ATOM 0 HO3' DC B 114 24.762 9.686 -7.618 1.00 0.41 H new ATOM 0 H1' DC B 114 22.675 9.424 -4.581 1.00 0.33 H new ATOM 0 H41 DC B 114 24.253 8.441 1.770 1.00 0.28 H new ATOM 0 H42 DC B 114 22.720 9.317 1.725 1.00 0.28 H new ATOM 0 H5 DC B 114 25.419 7.751 -0.239 1.00 0.29 H new ATOM 0 H6 DC B 114 25.375 7.726 -2.684 1.00 0.30 H new 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 0 H5' DG C 115 15.643 14.996 4.784 1.00 0.37 H new ATOM 0 H5'' DG C 115 14.057 14.442 5.285 1.00 0.37 H new ATOM 0 H4' DG C 115 14.023 14.881 2.945 1.00 0.36 H new ATOM 0 H3' DG C 115 13.057 12.516 3.914 1.00 0.35 H new ATOM 0 H2' DG C 115 14.724 10.963 3.293 1.00 0.33 H new ATOM 0 H2'' DG C 115 14.003 11.113 1.703 1.00 0.33 H new ATOM 0 HO5' DG C 115 16.193 12.631 4.630 1.00 0.35 H new ATOM 0 H1' DG C 115 15.720 12.322 0.912 1.00 0.33 H new ATOM 0 H8 DG C 115 16.744 11.552 4.578 1.00 0.31 H new ATOM 0 H1 DG C 115 21.110 10.237 0.077 1.00 0.30 H new ATOM 0 H21 DG C 115 18.787 11.616 -2.113 1.00 0.33 H new ATOM 0 H22 DG C 115 20.373 10.869 -1.891 1.00 0.33 H new 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 0 H5' DG C 116 13.109 12.751 -0.492 1.00 0.35 H new ATOM 0 H5'' DG C 116 11.611 12.273 -1.267 1.00 0.35 H new ATOM 0 H4' DG C 116 13.420 11.537 -2.593 1.00 0.33 H new ATOM 0 H3' DG C 116 11.472 9.719 -1.863 1.00 0.32 H new ATOM 0 H2' DG C 116 12.768 8.379 -0.343 1.00 0.30 H new ATOM 0 H2'' DG C 116 13.265 7.636 -1.851 1.00 0.30 H new ATOM 0 H1' DG C 116 15.223 8.854 -1.996 1.00 0.29 H new ATOM 0 H8 DG C 116 14.029 8.956 1.700 1.00 0.27 H new ATOM 0 H1 DG C 116 19.959 6.811 0.561 1.00 0.24 H new ATOM 0 H21 DG C 116 19.213 7.490 -2.770 1.00 0.25 H new ATOM 0 H22 DG C 116 20.381 6.872 -1.597 1.00 0.25 H new 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 0 H5' DT C 117 14.892 8.256 -4.578 1.00 0.28 H new ATOM 0 H5'' DT C 117 14.138 7.557 -5.997 1.00 0.28 H new ATOM 0 H4' DT C 117 16.201 6.467 -5.695 1.00 0.26 H new ATOM 0 H3' DT C 117 13.855 4.946 -5.740 1.00 0.25 H new ATOM 0 H2' DT C 117 13.987 4.064 -3.490 1.00 0.23 H new ATOM 0 H2'' DT C 117 15.150 2.984 -4.232 1.00 0.23 H new ATOM 0 H1' DT C 117 16.974 4.205 -3.547 1.00 0.22 H new ATOM 0 H3 DT C 117 17.779 3.783 0.762 1.00 0.20 H new ATOM 0 H71 DT C 117 13.045 6.314 0.329 1.00 0.23 H new ATOM 0 H72 DT C 117 12.830 4.701 1.049 1.00 0.23 H new ATOM 0 H73 DT C 117 13.781 5.938 1.905 1.00 0.23 H new ATOM 0 H6 DT C 117 14.012 5.466 -1.696 1.00 0.22 H new 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 0 H5' DG C 118 17.351 1.880 -5.639 1.00 0.19 H new ATOM 0 H5'' DG C 118 17.065 0.872 -7.043 1.00 0.19 H new ATOM 0 H4' DG C 118 17.607 -0.679 -5.419 1.00 0.17 H new ATOM 0 H3' DG C 118 14.980 -0.778 -6.321 1.00 0.16 H new ATOM 0 H2' DG C 118 13.899 -0.081 -4.251 1.00 0.16 H new ATOM 0 H2'' DG C 118 14.127 -1.774 -3.861 1.00 0.16 H new ATOM 0 H1' DG C 118 16.059 -1.402 -2.632 1.00 0.15 H new ATOM 0 H8 DG C 118 13.775 1.646 -2.910 1.00 0.17 H new ATOM 0 H1 DG C 118 16.378 0.640 2.871 1.00 0.13 H new ATOM 0 H21 DG C 118 18.274 -1.784 1.228 1.00 0.11 H new ATOM 0 H22 DG C 118 17.925 -0.935 2.737 1.00 0.11 H new 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 0 H5' DT C 119 16.388 -4.729 -4.159 1.00 0.14 H new ATOM 0 H5'' DT C 119 15.372 -6.028 -4.750 1.00 0.14 H new ATOM 0 H4' DT C 119 15.955 -6.434 -2.551 1.00 0.13 H new ATOM 0 H3' DT C 119 13.010 -5.783 -2.815 1.00 0.13 H new ATOM 0 H2' DT C 119 12.792 -5.914 -0.424 1.00 0.12 H new ATOM 0 H2'' DT C 119 14.113 -7.057 -0.286 1.00 0.12 H new ATOM 0 H1' DT C 119 15.512 -5.347 0.224 1.00 0.12 H new ATOM 0 H3 DT C 119 13.575 -2.422 3.022 1.00 0.12 H new ATOM 0 H71 DT C 119 12.774 -0.840 -2.084 1.00 0.15 H new ATOM 0 H72 DT C 119 11.200 -1.078 -1.288 1.00 0.15 H new ATOM 0 H73 DT C 119 12.305 0.193 -0.712 1.00 0.15 H new ATOM 0 H6 DT C 119 13.505 -3.050 -1.734 1.00 0.13 H new 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 0 H5' DT C 120 14.086 -9.339 -0.951 1.00 0.15 H new ATOM 0 H5'' DT C 120 12.995 -10.669 -1.281 1.00 0.15 H new ATOM 0 H4' DT C 120 13.684 -10.775 0.906 1.00 0.14 H new ATOM 0 H3' DT C 120 10.750 -10.172 0.669 1.00 0.14 H new ATOM 0 H2' DT C 120 10.597 -9.917 3.047 1.00 0.14 H new ATOM 0 H2'' DT C 120 12.053 -10.849 3.333 1.00 0.14 H new ATOM 0 H1' DT C 120 13.014 -8.791 3.599 1.00 0.13 H new ATOM 0 H3 DT C 120 10.230 -5.374 4.596 1.00 0.13 H new ATOM 0 H71 DT C 120 9.011 -5.027 0.126 1.00 0.15 H new ATOM 0 H72 DT C 120 10.685 -4.721 -0.397 1.00 0.15 H new ATOM 0 H73 DT C 120 9.942 -6.314 -0.678 1.00 0.15 H new ATOM 0 H6 DT C 120 11.590 -7.519 0.518 1.00 0.13 H new 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 0 H5' DT C 121 10.993 -12.996 3.493 1.00 0.15 H new ATOM 0 H5'' DT C 121 10.081 -14.457 3.167 1.00 0.15 H new ATOM 0 H4' DT C 121 9.562 -13.629 5.364 1.00 0.14 H new ATOM 0 H3' DT C 121 7.489 -14.241 3.592 1.00 0.15 H new ATOM 0 H2' DT C 121 6.290 -12.206 3.555 1.00 0.14 H new ATOM 0 H2'' DT C 121 5.971 -12.496 5.254 1.00 0.14 H new ATOM 0 H1' DT C 121 7.533 -11.040 5.943 1.00 0.13 H new ATOM 0 H3 DT C 121 7.176 -6.791 4.809 1.00 0.14 H new ATOM 0 H71 DT C 121 7.181 -9.618 0.218 1.00 0.14 H new ATOM 0 H72 DT C 121 5.562 -8.966 0.567 1.00 0.14 H new ATOM 0 H73 DT C 121 6.915 -7.859 0.232 1.00 0.14 H new ATOM 0 H6 DT C 121 7.235 -10.844 2.232 1.00 0.14 H new 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 0 H5' DG C 122 6.319 -13.293 7.887 1.00 0.15 H new ATOM 0 H5'' DG C 122 5.301 -14.551 8.560 1.00 0.15 H new ATOM 0 H4' DG C 122 4.537 -12.488 9.379 1.00 0.14 H new ATOM 0 H3' DG C 122 2.715 -14.145 8.072 1.00 0.14 H new ATOM 0 H2' DG C 122 2.343 -12.790 6.130 1.00 0.14 H new ATOM 0 H2'' DG C 122 1.234 -12.002 7.235 1.00 0.14 H new ATOM 0 H1' DG C 122 2.732 -10.306 7.782 1.00 0.14 H new ATOM 0 H8 DG C 122 3.653 -11.956 4.419 1.00 0.14 H new ATOM 0 H1 DG C 122 3.041 -5.577 4.395 1.00 0.14 H new ATOM 0 H21 DG C 122 2.588 -5.910 7.827 1.00 0.15 H new ATOM 0 H22 DG C 122 2.674 -4.835 6.428 1.00 0.15 H new 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 0 H5' DT C 123 1.376 -10.318 10.382 1.00 0.14 H new ATOM 0 H5'' DT C 123 0.271 -11.015 11.550 1.00 0.14 H new ATOM 0 H4' DT C 123 -0.326 -8.768 11.374 1.00 0.14 H new ATOM 0 H3' DT C 123 -2.230 -10.708 10.660 1.00 0.15 H new ATOM 0 H2' DT C 123 -2.601 -10.122 8.393 1.00 0.16 H new ATOM 0 H2'' DT C 123 -3.467 -8.760 9.076 1.00 0.16 H new ATOM 0 H1' DT C 123 -1.785 -7.300 8.691 1.00 0.15 H new ATOM 0 H3 DT C 123 -0.704 -6.575 4.434 1.00 0.13 H new ATOM 0 H71 DT C 123 -0.447 -11.173 3.601 1.00 0.15 H new ATOM 0 H72 DT C 123 0.913 -11.346 4.736 1.00 0.15 H new ATOM 0 H73 DT C 123 -0.711 -11.905 5.202 1.00 0.15 H new ATOM 0 H6 DT C 123 -0.797 -10.543 7.157 1.00 0.13 H new 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 0 H5' DG C 124 -3.641 -6.470 10.957 1.00 0.17 H new ATOM 0 H5'' DG C 124 -4.973 -6.443 12.095 1.00 0.17 H new ATOM 0 H4' DG C 124 -5.389 -4.746 10.555 1.00 0.17 H new ATOM 0 H3' DG C 124 -7.305 -6.762 10.829 1.00 0.17 H new ATOM 0 H2' DG C 124 -7.062 -7.790 8.688 1.00 0.16 H new ATOM 0 H2'' DG C 124 -8.099 -6.458 8.220 1.00 0.16 H new ATOM 0 H1' DG C 124 -6.376 -5.196 7.380 1.00 0.15 H new ATOM 0 H8 DG C 124 -5.271 -8.881 7.720 1.00 0.14 H new ATOM 0 H1 DG C 124 -4.073 -6.102 2.068 1.00 0.14 H new ATOM 0 H21 DG C 124 -5.293 -3.216 3.572 1.00 0.16 H new ATOM 0 H22 DG C 124 -4.626 -3.982 2.126 1.00 0.16 H new 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 0 H5' DC C 125 -7.968 -3.013 8.539 1.00 0.19 H new ATOM 0 H5'' DC C 125 -9.460 -2.278 9.090 1.00 0.19 H new ATOM 0 H4' DC C 125 -8.970 -1.461 6.937 1.00 0.19 H new ATOM 0 H3' DC C 125 -11.450 -2.622 7.446 1.00 0.20 H new ATOM 0 H2' DC C 125 -11.374 -4.497 6.013 1.00 0.20 H new ATOM 0 H2'' DC C 125 -11.652 -3.301 4.762 1.00 0.20 H new ATOM 0 H1' DC C 125 -9.497 -3.270 4.090 1.00 0.18 H new ATOM 0 H41 DC C 125 -8.144 -9.751 4.341 1.00 0.16 H new ATOM 0 H42 DC C 125 -7.712 -9.179 2.726 1.00 0.16 H new ATOM 0 H5 DC C 125 -9.016 -8.303 6.038 1.00 0.16 H new ATOM 0 H6 DC C 125 -9.650 -6.026 6.620 1.00 0.17 H new 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 0 H5' DA C 126 -10.552 -0.843 3.470 1.00 0.24 H new ATOM 0 H5'' DA C 126 -11.667 0.492 3.258 1.00 0.24 H new ATOM 0 H4' DA C 126 -11.100 -0.219 1.115 1.00 0.24 H new ATOM 0 H3' DA C 126 -13.784 -0.263 1.833 1.00 0.27 H new ATOM 0 H2' DA C 126 -14.074 -2.648 1.967 1.00 0.25 H new ATOM 0 H2'' DA C 126 -14.315 -2.434 0.245 1.00 0.25 H new ATOM 0 H1' DA C 126 -12.185 -3.083 -0.303 1.00 0.23 H new ATOM 0 H8 DA C 126 -13.157 -4.318 3.224 1.00 0.21 H new ATOM 0 H61 DA C 126 -10.886 -9.753 1.314 1.00 0.20 H new ATOM 0 H62 DA C 126 -11.709 -8.914 2.633 1.00 0.20 H new ATOM 0 H2 DA C 126 -10.159 -6.714 -1.900 1.00 0.19 H new 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 0 H5' DG C 127 -12.602 -1.388 -2.373 1.00 0.32 H new ATOM 0 H5'' DG C 127 -13.474 -0.271 -3.404 1.00 0.32 H new ATOM 0 H4' DG C 127 -13.027 -2.147 -4.706 1.00 0.33 H new ATOM 0 H3' DG C 127 -15.689 -1.413 -4.369 1.00 0.37 H new ATOM 0 H2' DG C 127 -16.417 -3.286 -3.052 1.00 0.36 H new ATOM 0 H2'' DG C 127 -16.516 -4.030 -4.635 1.00 0.36 H new ATOM 0 H1' DG C 127 -14.522 -5.130 -4.428 1.00 0.32 H new ATOM 0 H8 DG C 127 -15.890 -4.071 -0.977 1.00 0.30 H new ATOM 0 H1 DG C 127 -13.589 -10.036 -1.380 1.00 0.25 H new ATOM 0 H21 DG C 127 -12.637 -9.099 -4.592 1.00 0.26 H new ATOM 0 H22 DG C 127 -12.679 -10.359 -3.355 1.00 0.26 H new 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 0 H5' DG C 128 -14.859 -4.888 -7.135 1.00 0.45 H new ATOM 0 H5'' DG C 128 -15.535 -4.471 -8.697 1.00 0.45 H new ATOM 0 H4' DG C 128 -15.647 -6.783 -8.564 1.00 0.47 H new ATOM 0 H3' DG C 128 -18.036 -5.461 -8.959 1.00 0.53 H new ATOM 0 H2' DG C 128 -18.908 -5.790 -6.693 1.00 0.52 H new ATOM 0 H2'' DG C 128 -19.479 -7.254 -7.469 1.00 0.52 H new ATOM 0 HO3' DG C 128 -18.756 -7.443 -9.764 1.00 0.56 H new ATOM 0 H1' DG C 128 -17.705 -8.543 -6.720 1.00 0.46 H new ATOM 0 H8 DG C 128 -18.580 -5.599 -4.411 1.00 0.44 H new ATOM 0 H1 DG C 128 -17.154 -11.150 -1.548 1.00 0.38 H new ATOM 0 H21 DG C 128 -16.357 -12.225 -4.763 1.00 0.39 H new ATOM 0 H22 DG C 128 -16.467 -12.613 -3.043 1.00 0.39 H new TER 2402 DG C 128 END