USER MOD reduce.3.24.130724 H: found=0, std=0, add=1562, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1590 hydrogens (0 hets) HEADER HYDROLASE INHIBITOR 25-NOV-02 1N9J TITLE SOLUTION STRUCTURE OF THE 3D DOMAIN SWAPPED DIMER OF STEFIN TITLE 2 A COMPND MOL_ID: 1; COMPND 2 MOLECULE: CYSTATIN A; COMPND 3 CHAIN: A, B; COMPND 4 SYNONYM: STEFIN A, CYSTATIN AS; COMPND 5 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_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET3A KEYWDS DOMAIN SWAPPED, STEFIN A, CYSTATINS, AMYLOID, HYDROLASE KEYWDS 2 INHIBITOR EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR R.A.STANIFORTH,S.GIANNINI,L.D.HIGGINS,M.J.CONROY, AUTHOR 2 A.M.HOUNSLOW,R.JERALA,C.J.CRAVEN,J.P.WALTHO REVDAT 2 24-FEB-09 1N9J 1 VERSN REVDAT 1 25-FEB-03 1N9J 0 JRNL AUTH R.A.STANIFORTH,S.GIANNINI,L.D.HIGGINS,M.J.CONROY, JRNL AUTH 2 A.M.HOUNSLOW,R.JERALA,C.J.CRAVEN,J.P.WALTHO JRNL TITL THREE-DIMENSIONAL DOMAIN SWAPPING IN THE FOLDED JRNL TITL 2 AND MOLTEN-GLOBULE STATES OF CYSTATINS, AN JRNL TITL 3 AMYLOID-FORMING STRUCTURAL SUPERFAMILY JRNL REF EMBO J. V. 20 4774 2001 JRNL REFN ISSN 0261-4189 JRNL PMID 11532941 JRNL DOI 10.1093/EMBOJ/20.17.4774 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: DISTANCE RESTRAINTS (NOES AND REMARK 3 HYDROGEN BONDS) WERE TAKEN FROM THE DATA USED FOR THE STEFIN A REMARK 3 MONOMER STRUCTURE (MARTIN ET AL., 1995), EXCEPT THOSE REMARK 3 INVOLVING RESIDUES V48-G50 AND N77-L80 WHERE CHEMICAL SHIFT REMARK 3 PERTURBATION WAS OBSERVED FOLLOWING RESONANCE ASSIGNMENT. THE REMARK 3 NOES WERE SPECIFIED AS INTERMOLECULAR AND INTRAMOLECULAR REMARK 3 ACCORDING TO DOMAIN-SWAPPED TOPOLOGY INFERRED FROM ISOTOPE REMARK 3 FILTERING EXPERIMENTS. AN ADDITIONAL HYDROGEN BOND RESTRAINT REMARK 3 WAS INCLUDED BETWEEN 48 AND 50 BASED ON EVIDENCE FROM REMARK 3 PROTECTION EXPERIMENTS ON THE DIMER (JERALA AND ZEROVNIK, REMARK 3 1999). DIHEDRAL RESTRAINTS (PHI AND PSI) WERE DETERMINED USING REMARK 3 THE 1H-ALPHA, 15N, 13C-ALPHA, 13C-BETA AND 13C' CHEMICAL REMARK 3 SHIFTS AND THE PROGRAM TALOS (CORNILESCU ET AL., 1999). WHERE REMARK 3 TALOS GAVE A `POOR' MATCH, THE EXPERIMENTAL PHI DIHEDRAL ANGLE REMARK 3 WAS TAKEN FROM THE DATA USED FOR THE STEFIN A MONOMER REMARK 3 STRUCTURE CALCULATION. REMARK 4 REMARK 4 1N9J COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 26-NOV-02. REMARK 100 THE RCSB ID CODE IS RCSB017687. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 308 REMARK 210 PH : 5.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1.2MM STEFIN A U-15N; 50MM REMARK 210 PHOSPHATE BUFFER PH 5.5, 100MM REMARK 210 KCL, 5MM AZIDE; 90% H2O, 10% REMARK 210 D2O; 1MM STEFIN A U-15N,13C, REMARK 210 2H; 50MM PHOSPHATE BUFFER PH REMARK 210 5.5, 100MM KCL, 5MM AZIDE; 90% REMARK 210 H2O, 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : HNCA, HNCO, HN(CA)CB, TOCSY- REMARK 210 HSQC, NOESY-HSQC, 15N-ISOTOPE- REMARK 210 FILTERED NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ, 800 MHZ REMARK 210 SPECTROMETER MODEL : DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XWINNMR 2.6, FELIX 2000 REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL 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 LENGTHS 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,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) 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 RES CSSEQI ATM2 DEVIATION REMARK 500 GLU A 8 CD GLU A 8 OE2 0.109 REMARK 500 GLU A 15 CD GLU A 15 OE2 0.110 REMARK 500 GLU A 18 CD GLU A 18 OE2 0.112 REMARK 500 GLU A 28 CD GLU A 28 OE2 0.109 REMARK 500 GLU A 29 CD GLU A 29 OE2 0.111 REMARK 500 GLU A 33 CD GLU A 33 OE2 0.111 REMARK 500 GLU A 39 CD GLU A 39 OE2 0.111 REMARK 500 GLU A 78 CD GLU A 78 OE2 0.109 REMARK 500 GLU A 94 CD GLU A 94 OE2 0.110 REMARK 500 GLU B 8 CD GLU B 8 OE2 0.109 REMARK 500 GLU B 15 CD GLU B 15 OE2 0.111 REMARK 500 GLU B 18 CD GLU B 18 OE2 0.110 REMARK 500 GLU B 28 CD GLU B 28 OE2 0.101 REMARK 500 GLU B 29 CD GLU B 29 OE2 0.111 REMARK 500 GLU B 33 CD GLU B 33 OE2 0.111 REMARK 500 GLU B 39 CD GLU B 39 OE2 0.106 REMARK 500 GLU B 78 CD GLU B 78 OE2 0.110 REMARK 500 GLU B 94 CD GLU B 94 OE2 0.109 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 ASP A 21 CB - CG - OD1 ANGL. DEV. = 5.5 DEGREES REMARK 500 TYR A 35 CB - CG - CD2 ANGL. DEV. = -4.0 DEGREES REMARK 500 TYR A 43 CB - CG - CD1 ANGL. DEV. = -4.0 DEGREES REMARK 500 ASP A 93 CB - CG - OD1 ANGL. DEV. = 5.7 DEGREES REMARK 500 HIS B 66 ND1 - CE1 - NE2 ANGL. DEV. = 7.8 DEGREES REMARK 500 ASP B 79 CB - CG - OD1 ANGL. DEV. = 6.0 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 PRO A 11 9.19 -66.47 REMARK 500 ALA A 12 135.72 148.15 REMARK 500 VAL A 41 -141.72 -131.83 REMARK 500 ASP A 61 -29.33 -34.07 REMARK 500 SER A 72 -80.54 -109.56 REMARK 500 TYR A 85 126.89 -172.84 REMARK 500 ASP A 88 4.15 -38.25 REMARK 500 SER B 7 -174.62 -66.81 REMARK 500 PRO B 11 6.37 -66.06 REMARK 500 ALA B 12 74.81 150.26 REMARK 500 VAL B 41 -146.65 -138.56 REMARK 500 VAL B 57 117.29 -162.60 REMARK 500 SER B 72 -91.61 -86.90 REMARK 500 ASP B 88 -8.86 -24.35 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 ARG A 58 ALA A 59 134.41 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 58 0.31 SIDE_CHAIN REMARK 500 PHE A 98 0.13 SIDE_CHAIN REMARK 500 TYR B 53 0.08 SIDE_CHAIN REMARK 500 TYR B 54 0.08 SIDE_CHAIN REMARK 500 ARG B 58 0.28 SIDE_CHAIN REMARK 500 TYR B 85 0.07 SIDE_CHAIN REMARK 500 PHE B 98 0.10 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1DVC RELATED DB: PDB REMARK 900 SOLUTION NMR STRUCTURE OF MONOMERIC HUMAN STEFIN A AT PH REMARK 900 5.5 AND 308K DBREF 1N9J A 1 98 UNP P01040 CYTA_HUMAN 1 98 DBREF 1N9J B 1 98 UNP P01040 CYTA_HUMAN 1 98 SEQRES 1 A 98 MET ILE PRO GLY GLY LEU SER GLU ALA LYS PRO ALA THR SEQRES 2 A 98 PRO GLU ILE GLN GLU ILE VAL ASP LYS VAL LYS PRO GLN SEQRES 3 A 98 LEU GLU GLU LYS THR ASN GLU THR TYR GLY LYS LEU GLU SEQRES 4 A 98 ALA VAL GLN TYR LYS THR GLN VAL VAL ALA GLY THR ASN SEQRES 5 A 98 TYR TYR ILE LYS VAL ARG ALA GLY ASP ASN LYS TYR MET SEQRES 6 A 98 HIS LEU LYS VAL PHE LYS SER LEU PRO GLY GLN ASN GLU SEQRES 7 A 98 ASP LEU VAL LEU THR GLY TYR GLN VAL ASP LYS ASN LYS SEQRES 8 A 98 ASP ASP GLU LEU THR GLY PHE SEQRES 1 B 98 MET ILE PRO GLY GLY LEU SER GLU ALA LYS PRO ALA THR SEQRES 2 B 98 PRO GLU ILE GLN GLU ILE VAL ASP LYS VAL LYS PRO GLN SEQRES 3 B 98 LEU GLU GLU LYS THR ASN GLU THR TYR GLY LYS LEU GLU SEQRES 4 B 98 ALA VAL GLN TYR LYS THR GLN VAL VAL ALA GLY THR ASN SEQRES 5 B 98 TYR TYR ILE LYS VAL ARG ALA GLY ASP ASN LYS TYR MET SEQRES 6 B 98 HIS LEU LYS VAL PHE LYS SER LEU PRO GLY GLN ASN GLU SEQRES 7 B 98 ASP LEU VAL LEU THR GLY TYR GLN VAL ASP LYS ASN LYS SEQRES 8 B 98 ASP ASP GLU LEU THR GLY PHE HELIX 1 1 THR A 13 ASN A 32 1 20 HELIX 2 2 GLN A 76 LEU A 80 5 5 HELIX 3 3 THR B 13 ASN B 32 1 20 SHEET 1 A 2 LYS A 37 ALA A 40 0 SHEET 2 A 2 VAL B 57 GLY B 60 -1 O ARG B 58 N GLU A 39 SHEET 1 B 6 VAL A 81 GLN A 86 0 SHEET 2 B 6 MET A 65 LYS A 71 -1 N PHE A 70 O VAL A 81 SHEET 3 B 6 LYS A 44 ARG A 58 -1 N ILE A 55 O LEU A 67 SHEET 4 B 6 GLU B 39 TYR B 54 -1 O LYS B 44 N TYR A 54 SHEET 5 B 6 LYS B 68 LYS B 71 -1 O LYS B 71 N THR B 51 SHEET 6 B 6 LEU B 80 GLY B 84 -1 O VAL B 81 N PHE B 70 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: B 68 LYS NZ :NH3+ -156:sc= 0.917 (180deg=0) USER MOD Set 1.2: B 83 THR OG1 : rot -171:sc= 0.785 USER MOD Set 2.1: B 53 TYR OH : rot 180:sc=-0.00119 USER MOD Set 2.2: B 71 LYS NZ :NH3+ 160:sc= 0.0575 (180deg=0.00985) USER MOD Set 3.1: B 52 ASN : amide:sc= -2.25 X(o=-2.5,f=-2.5!) USER MOD Set 3.2: B 54 TYR OH : rot -59:sc= -0.228 USER MOD Set 4.1: B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 86 GLN : amide:sc= 0.00154 X(o=0.0015,f=-0.46) USER MOD Set 5.2: A 89 LYS NZ :NH3+ -150:sc= 0 (180deg=0) USER MOD Set 6.1: A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 83 THR OG1 : rot 160:sc= 0 USER MOD Set 7.1: A 56 LYS NZ :NH3+ -153:sc= 1.15 (180deg=1.09) USER MOD Set 7.2: A 91 LYS NZ :NH3+ -116:sc= 0.566 (180deg=0) USER MOD Set 7.3: B 42 GLN : amide:sc= -0.365 K(o=1.3,f=-4.6!) USER MOD Set 8.1: A 7 SER OG : rot 71:sc= 1.06 USER MOD Set 8.2: A 45 THR OG1 : rot 180:sc= -0.337 USER MOD Single : A 1 MET CE :methyl 172:sc= 0 (180deg=-0.0586) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.653 USER MOD Single : A 17 GLN : amide:sc= -0.311 X(o=-0.31,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ -158:sc= 0.0481 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -0.0374 X(o=-0.037,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0136) USER MOD Single : A 31 THR OG1 : rot -36:sc= 0.0236 USER MOD Single : A 32 ASN : amide:sc= -0.259 X(o=-0.26,f=-0.26) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 14:sc= -1.46 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -1.44 K(o=-1.4,f=-2.4) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -153:sc= -0.0625 (180deg=-1.1) USER MOD Single : A 46 GLN : amide:sc= -0.0515 X(o=-0.051,f=-0.29) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.276 K(o=-0.28,f=-2.5!) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot -137:sc= 0.737 USER MOD Single : A 62 ASN : amide:sc=-0.00402 X(o=-0.004,f=-0.004) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 MET CE :methyl 158:sc= -4.39! (180deg=-5.12!) USER MOD Single : A 66 HIS : no HE2:sc= -2.65! C(o=-2.6!,f=-6.2!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.0169 X(o=-0.017,f=-0.49) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 SER OG : rot 180:sc= 0 USER MOD Single : B 10 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0182) USER MOD Single : B 13 THR OG1 : rot -160:sc= -0.16 USER MOD Single : B 17 GLN : amide:sc= -0.29 X(o=-0.29,f=-0.26) USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 THR OG1 : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.28) USER MOD Single : B 34 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 TYR OH : rot -30:sc= -0.828 USER MOD Single : B 43 TYR OH : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.204 USER MOD Single : B 46 GLN : amide:sc= -3.26! C(o=-3.3!,f=-4.4!) USER MOD Single : B 51 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 LYS NZ :NH3+ 144:sc= 1.63 (180deg=0.103) USER MOD Single : B 62 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 64 TYR OH : rot 180:sc= 0 USER MOD Single : B 65 MET CE :methyl 163:sc= -3.01! (180deg=-4!) USER MOD Single : B 66 HIS : no HD1:sc= -6.25! C(o=-6.3!,f=-6.7!) USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD Single : B 76 GLN : amide:sc= -0.118 K(o=-0.12,f=-1.4) USER MOD Single : B 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 85 TYR OH : rot 180:sc= 0 USER MOD Single : B 86 GLN : amide:sc= -0.0944 X(o=-0.094,f=-0.016) USER MOD Single : B 89 LYS NZ :NH3+ -104:sc= -0.562 (180deg=-2.82!) USER MOD Single : B 90 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 96 THR OG1 : rot -1:sc= 0.222! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.874 -2.565 -9.264 1.00 0.00 N ATOM 2 CA MET A 1 10.342 -2.366 -9.309 1.00 0.00 C ATOM 3 C MET A 1 10.813 -1.601 -8.050 1.00 0.00 C ATOM 4 O MET A 1 11.483 -2.180 -7.190 1.00 0.00 O ATOM 5 CB MET A 1 10.755 -1.692 -10.649 1.00 0.00 C ATOM 6 CG MET A 1 12.187 -1.979 -11.138 1.00 0.00 C ATOM 7 SD MET A 1 12.153 -2.265 -12.926 1.00 0.00 S ATOM 8 CE MET A 1 11.482 -0.714 -13.576 1.00 0.00 C ATOM 0 H1 MET A 1 8.567 -3.080 -10.114 1.00 0.00 H new ATOM 0 H2 MET A 1 8.624 -3.115 -8.417 1.00 0.00 H new ATOM 0 H3 MET A 1 8.399 -1.640 -9.229 1.00 0.00 H new ATOM 0 HA MET A 1 10.852 -3.329 -9.288 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.057 -2.012 -11.423 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.639 -0.614 -10.541 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.840 -1.139 -10.903 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.592 -2.851 -10.625 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.548 -0.717 -14.664 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.439 -0.615 -13.276 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.055 0.125 -13.180 1.00 0.00 H new ATOM 19 N ILE A 2 10.465 -0.300 -7.977 1.00 0.00 N ATOM 20 CA ILE A 2 10.931 0.619 -6.918 1.00 0.00 C ATOM 21 C ILE A 2 9.648 1.120 -6.181 1.00 0.00 C ATOM 22 O ILE A 2 8.902 1.924 -6.755 1.00 0.00 O ATOM 23 CB ILE A 2 11.874 1.748 -7.455 1.00 0.00 C ATOM 24 CG1 ILE A 2 11.235 2.753 -8.478 1.00 0.00 C ATOM 25 CG2 ILE A 2 13.202 1.160 -8.004 1.00 0.00 C ATOM 26 CD1 ILE A 2 10.853 4.125 -7.889 1.00 0.00 C ATOM 0 H ILE A 2 9.848 0.146 -8.656 1.00 0.00 H new ATOM 0 HA ILE A 2 11.579 0.110 -6.205 1.00 0.00 H new ATOM 0 HB ILE A 2 12.078 2.358 -6.575 1.00 0.00 H new ATOM 0 HG12 ILE A 2 11.936 2.909 -9.298 1.00 0.00 H new ATOM 0 HG13 ILE A 2 10.342 2.296 -8.904 1.00 0.00 H new ATOM 0 HG21 ILE A 2 13.835 1.969 -8.369 1.00 0.00 H new ATOM 0 HG22 ILE A 2 13.720 0.626 -7.208 1.00 0.00 H new ATOM 0 HG23 ILE A 2 12.985 0.472 -8.821 1.00 0.00 H new ATOM 0 HD11 ILE A 2 10.420 4.749 -8.671 1.00 0.00 H new ATOM 0 HD12 ILE A 2 10.125 3.988 -7.090 1.00 0.00 H new ATOM 0 HD13 ILE A 2 11.744 4.610 -7.489 1.00 0.00 H new ATOM 38 N PRO A 3 9.338 0.681 -4.928 1.00 0.00 N ATOM 39 CA PRO A 3 8.192 1.211 -4.164 1.00 0.00 C ATOM 40 C PRO A 3 8.551 2.559 -3.487 1.00 0.00 C ATOM 41 O PRO A 3 9.606 2.701 -2.857 1.00 0.00 O ATOM 42 CB PRO A 3 7.949 0.073 -3.176 1.00 0.00 C ATOM 43 CG PRO A 3 9.285 -0.627 -2.938 1.00 0.00 C ATOM 44 CD PRO A 3 10.080 -0.381 -4.217 1.00 0.00 C ATOM 0 HA PRO A 3 7.308 1.456 -4.753 1.00 0.00 H new ATOM 0 HB2 PRO A 3 7.547 0.459 -2.239 1.00 0.00 H new ATOM 0 HB3 PRO A 3 7.215 -0.628 -3.573 1.00 0.00 H new ATOM 0 HG2 PRO A 3 9.798 -0.218 -2.067 1.00 0.00 H new ATOM 0 HG3 PRO A 3 9.147 -1.693 -2.755 1.00 0.00 H new ATOM 0 HD2 PRO A 3 11.100 -0.069 -3.994 1.00 0.00 H new ATOM 0 HD3 PRO A 3 10.148 -1.286 -4.820 1.00 0.00 H new ATOM 52 N GLY A 4 7.669 3.542 -3.661 1.00 0.00 N ATOM 53 CA GLY A 4 7.904 4.912 -3.161 1.00 0.00 C ATOM 54 C GLY A 4 8.479 5.804 -4.263 1.00 0.00 C ATOM 55 O GLY A 4 9.675 6.108 -4.249 1.00 0.00 O ATOM 0 H GLY A 4 6.779 3.423 -4.145 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.968 5.336 -2.796 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.592 4.882 -2.316 1.00 0.00 H new ATOM 59 N GLY A 5 7.608 6.215 -5.194 1.00 0.00 N ATOM 60 CA GLY A 5 7.976 7.139 -6.275 1.00 0.00 C ATOM 61 C GLY A 5 6.880 8.192 -6.428 1.00 0.00 C ATOM 62 O GLY A 5 5.685 7.879 -6.517 1.00 0.00 O ATOM 0 H GLY A 5 6.633 5.918 -5.219 1.00 0.00 H new ATOM 0 HA2 GLY A 5 8.929 7.618 -6.052 1.00 0.00 H new ATOM 0 HA3 GLY A 5 8.105 6.592 -7.209 1.00 0.00 H new ATOM 66 N LEU A 6 7.324 9.453 -6.516 1.00 0.00 N ATOM 67 CA LEU A 6 6.423 10.601 -6.759 1.00 0.00 C ATOM 68 C LEU A 6 5.771 10.519 -8.162 1.00 0.00 C ATOM 69 O LEU A 6 6.392 10.122 -9.155 1.00 0.00 O ATOM 70 CB LEU A 6 7.193 11.931 -6.606 1.00 0.00 C ATOM 71 CG LEU A 6 7.617 12.259 -5.138 1.00 0.00 C ATOM 72 CD1 LEU A 6 9.142 12.280 -4.965 1.00 0.00 C ATOM 73 CD2 LEU A 6 6.971 13.565 -4.679 1.00 0.00 C ATOM 0 H LEU A 6 8.307 9.711 -6.423 1.00 0.00 H new ATOM 0 HA LEU A 6 5.627 10.564 -6.015 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.085 11.895 -7.231 1.00 0.00 H new ATOM 0 HB3 LEU A 6 6.572 12.743 -6.983 1.00 0.00 H new ATOM 0 HG LEU A 6 7.252 11.456 -4.497 1.00 0.00 H new ATOM 0 HD11 LEU A 6 9.387 12.512 -3.929 1.00 0.00 H new ATOM 0 HD12 LEU A 6 9.551 11.304 -5.225 1.00 0.00 H new ATOM 0 HD13 LEU A 6 9.572 13.039 -5.619 1.00 0.00 H new ATOM 0 HD21 LEU A 6 7.275 13.781 -3.655 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.290 14.378 -5.331 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.886 13.469 -4.723 1.00 0.00 H new ATOM 85 N SER A 7 4.495 10.906 -8.196 1.00 0.00 N ATOM 86 CA SER A 7 3.701 10.929 -9.442 1.00 0.00 C ATOM 87 C SER A 7 3.908 12.304 -10.138 1.00 0.00 C ATOM 88 O SER A 7 4.746 13.128 -9.734 1.00 0.00 O ATOM 89 CB SER A 7 2.228 10.592 -9.094 1.00 0.00 C ATOM 90 OG SER A 7 2.120 9.383 -8.343 1.00 0.00 O ATOM 0 H SER A 7 3.979 11.212 -7.371 1.00 0.00 H new ATOM 0 HA SER A 7 4.024 10.175 -10.160 1.00 0.00 H new ATOM 0 HB2 SER A 7 1.793 11.413 -8.524 1.00 0.00 H new ATOM 0 HB3 SER A 7 1.650 10.501 -10.014 1.00 0.00 H new ATOM 0 HG SER A 7 2.473 9.526 -7.440 1.00 0.00 H new ATOM 96 N GLU A 8 3.130 12.569 -11.199 1.00 0.00 N ATOM 97 CA GLU A 8 3.137 13.893 -11.851 1.00 0.00 C ATOM 98 C GLU A 8 2.637 15.015 -10.881 1.00 0.00 C ATOM 99 O GLU A 8 1.740 14.823 -10.048 1.00 0.00 O ATOM 100 CB GLU A 8 2.386 13.790 -13.201 1.00 0.00 C ATOM 101 CG GLU A 8 2.327 15.129 -13.985 1.00 0.00 C ATOM 102 CD GLU A 8 2.317 14.968 -15.502 1.00 0.00 C ATOM 103 OE1 GLU A 8 3.030 14.148 -16.094 1.00 0.00 O ATOM 104 OE2 GLU A 8 1.498 15.844 -16.145 1.00 0.00 O ATOM 0 H GLU A 8 2.493 11.894 -11.622 1.00 0.00 H new ATOM 0 HA GLU A 8 4.154 14.203 -12.089 1.00 0.00 H new ATOM 0 HB2 GLU A 8 2.873 13.037 -13.821 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.370 13.442 -13.016 1.00 0.00 H new ATOM 0 HG2 GLU A 8 1.433 15.674 -13.683 1.00 0.00 H new ATOM 0 HG3 GLU A 8 3.184 15.740 -13.702 1.00 0.00 H new ATOM 112 N ALA A 9 3.285 16.182 -11.029 1.00 0.00 N ATOM 113 CA ALA A 9 2.904 17.406 -10.307 1.00 0.00 C ATOM 114 C ALA A 9 1.811 18.156 -11.090 1.00 0.00 C ATOM 115 O ALA A 9 2.090 18.731 -12.148 1.00 0.00 O ATOM 116 CB ALA A 9 4.102 18.325 -10.021 1.00 0.00 C ATOM 0 H ALA A 9 4.085 16.303 -11.650 1.00 0.00 H new ATOM 0 HA ALA A 9 2.512 17.104 -9.336 1.00 0.00 H new ATOM 0 HB1 ALA A 9 3.761 19.212 -9.487 1.00 0.00 H new ATOM 0 HB2 ALA A 9 4.832 17.792 -9.411 1.00 0.00 H new ATOM 0 HB3 ALA A 9 4.564 18.624 -10.962 1.00 0.00 H new ATOM 122 N LYS A 10 0.577 18.151 -10.569 1.00 0.00 N ATOM 123 CA LYS A 10 -0.554 18.888 -11.215 1.00 0.00 C ATOM 124 C LYS A 10 -0.598 20.287 -10.613 1.00 0.00 C ATOM 125 O LYS A 10 -0.648 20.326 -9.387 1.00 0.00 O ATOM 126 CB LYS A 10 -1.975 18.283 -11.049 1.00 0.00 C ATOM 127 CG LYS A 10 -2.022 16.756 -11.065 1.00 0.00 C ATOM 128 CD LYS A 10 -1.428 16.124 -12.317 1.00 0.00 C ATOM 129 CE LYS A 10 -0.915 14.720 -11.997 1.00 0.00 C ATOM 130 NZ LYS A 10 -1.350 13.784 -13.027 1.00 0.00 N ATOM 0 H LYS A 10 0.323 17.656 -9.714 1.00 0.00 H new ATOM 0 HA LYS A 10 -0.339 18.847 -12.283 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -2.399 18.637 -10.109 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -2.612 18.661 -11.848 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -1.488 16.379 -10.193 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -3.059 16.435 -10.967 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -2.182 16.075 -13.103 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -0.613 16.741 -12.695 1.00 0.00 H new ATOM 0 HE2 LYS A 10 0.173 14.727 -11.936 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -1.287 14.401 -11.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -0.997 12.832 -12.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -2.389 13.768 -13.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -0.974 14.084 -13.949 1.00 0.00 H new ATOM 144 N PRO A 11 -0.658 21.411 -11.373 1.00 0.00 N ATOM 145 CA PRO A 11 -0.669 22.768 -10.787 1.00 0.00 C ATOM 146 C PRO A 11 -1.876 23.227 -9.943 1.00 0.00 C ATOM 147 O PRO A 11 -1.910 24.413 -9.625 1.00 0.00 O ATOM 148 CB PRO A 11 -0.492 23.648 -12.034 1.00 0.00 C ATOM 149 CG PRO A 11 -1.168 22.880 -13.165 1.00 0.00 C ATOM 150 CD PRO A 11 -1.053 21.404 -12.788 1.00 0.00 C ATOM 0 HA PRO A 11 0.100 22.824 -10.017 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -0.951 24.627 -11.894 1.00 0.00 H new ATOM 0 HB3 PRO A 11 0.563 23.818 -12.249 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.211 23.177 -13.271 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -0.681 23.079 -14.120 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -2.000 20.883 -12.932 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -0.312 20.894 -13.404 1.00 0.00 H new ATOM 158 N ALA A 12 -2.816 22.325 -9.596 1.00 0.00 N ATOM 159 CA ALA A 12 -4.040 22.610 -8.825 1.00 0.00 C ATOM 160 C ALA A 12 -5.119 21.648 -9.315 1.00 0.00 C ATOM 161 O ALA A 12 -5.340 21.456 -10.518 1.00 0.00 O ATOM 162 CB ALA A 12 -4.626 24.025 -8.924 1.00 0.00 C ATOM 0 H ALA A 12 -2.739 21.342 -9.855 1.00 0.00 H new ATOM 0 HA ALA A 12 -3.743 22.497 -7.782 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.522 24.092 -8.307 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -3.890 24.749 -8.574 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -4.882 24.241 -9.961 1.00 0.00 H new ATOM 168 N THR A 13 -5.824 21.093 -8.331 1.00 0.00 N ATOM 169 CA THR A 13 -6.986 20.215 -8.577 1.00 0.00 C ATOM 170 C THR A 13 -8.130 20.643 -7.586 1.00 0.00 C ATOM 171 O THR A 13 -7.871 21.346 -6.596 1.00 0.00 O ATOM 172 CB THR A 13 -6.622 18.681 -8.563 1.00 0.00 C ATOM 173 OG1 THR A 13 -7.017 18.038 -7.351 1.00 0.00 O ATOM 174 CG2 THR A 13 -5.190 18.278 -8.897 1.00 0.00 C ATOM 0 H THR A 13 -5.614 21.233 -7.343 1.00 0.00 H new ATOM 0 HA THR A 13 -7.353 20.349 -9.595 1.00 0.00 H new ATOM 0 HB THR A 13 -7.211 18.329 -9.410 1.00 0.00 H new ATOM 0 HG1 THR A 13 -6.773 17.090 -7.389 1.00 0.00 H new ATOM 0 HG21 THR A 13 -5.096 17.193 -8.846 1.00 0.00 H new ATOM 0 HG22 THR A 13 -4.942 18.617 -9.903 1.00 0.00 H new ATOM 0 HG23 THR A 13 -4.507 18.736 -8.181 1.00 0.00 H new ATOM 182 N PRO A 14 -9.409 20.196 -7.769 1.00 0.00 N ATOM 183 CA PRO A 14 -10.456 20.342 -6.723 1.00 0.00 C ATOM 184 C PRO A 14 -10.132 19.662 -5.349 1.00 0.00 C ATOM 185 O PRO A 14 -10.409 20.269 -4.314 1.00 0.00 O ATOM 186 CB PRO A 14 -11.703 19.774 -7.420 1.00 0.00 C ATOM 187 CG PRO A 14 -11.193 18.777 -8.459 1.00 0.00 C ATOM 188 CD PRO A 14 -9.817 19.286 -8.860 1.00 0.00 C ATOM 0 HA PRO A 14 -10.570 21.377 -6.402 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -12.362 19.285 -6.702 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -12.280 20.568 -7.893 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -11.135 17.771 -8.044 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -11.861 18.729 -9.319 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -9.110 18.464 -8.973 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -9.853 19.808 -9.816 1.00 0.00 H new ATOM 196 N GLU A 15 -9.504 18.461 -5.350 1.00 0.00 N ATOM 197 CA GLU A 15 -8.939 17.826 -4.131 1.00 0.00 C ATOM 198 C GLU A 15 -7.809 18.612 -3.407 1.00 0.00 C ATOM 199 O GLU A 15 -7.793 18.652 -2.183 1.00 0.00 O ATOM 200 CB GLU A 15 -8.435 16.394 -4.481 1.00 0.00 C ATOM 201 CG GLU A 15 -8.693 15.355 -3.356 1.00 0.00 C ATOM 202 CD GLU A 15 -9.578 14.182 -3.811 1.00 0.00 C ATOM 203 OE1 GLU A 15 -9.581 13.737 -4.965 1.00 0.00 O ATOM 204 OE2 GLU A 15 -10.360 13.670 -2.821 1.00 0.00 O ATOM 0 H GLU A 15 -9.374 17.904 -6.195 1.00 0.00 H new ATOM 0 HA GLU A 15 -9.763 17.809 -3.418 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -8.925 16.058 -5.395 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -7.366 16.434 -4.689 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -7.738 14.966 -3.002 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -9.167 15.854 -2.511 1.00 0.00 H new ATOM 212 N ILE A 16 -6.884 19.218 -4.157 1.00 0.00 N ATOM 213 CA ILE A 16 -5.736 20.028 -3.616 1.00 0.00 C ATOM 214 C ILE A 16 -6.166 21.330 -2.922 1.00 0.00 C ATOM 215 O ILE A 16 -5.694 21.648 -1.828 1.00 0.00 O ATOM 216 CB ILE A 16 -4.742 20.311 -4.793 1.00 0.00 C ATOM 217 CG1 ILE A 16 -4.349 19.035 -5.561 1.00 0.00 C ATOM 218 CG2 ILE A 16 -3.454 21.036 -4.393 1.00 0.00 C ATOM 219 CD1 ILE A 16 -4.088 17.780 -4.705 1.00 0.00 C ATOM 0 H ILE A 16 -6.892 19.172 -5.176 1.00 0.00 H new ATOM 0 HA ILE A 16 -5.251 19.446 -2.832 1.00 0.00 H new ATOM 0 HB ILE A 16 -5.318 20.979 -5.434 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -5.142 18.806 -6.273 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -3.451 19.247 -6.141 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -2.832 21.186 -5.275 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -3.702 22.003 -3.955 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -2.910 20.436 -3.663 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -3.820 16.946 -5.354 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.271 17.977 -4.011 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -4.988 17.528 -4.144 1.00 0.00 H new ATOM 231 N GLN A 17 -7.084 22.041 -3.582 1.00 0.00 N ATOM 232 CA GLN A 17 -7.837 23.150 -2.976 1.00 0.00 C ATOM 233 C GLN A 17 -8.685 22.758 -1.732 1.00 0.00 C ATOM 234 O GLN A 17 -8.815 23.558 -0.808 1.00 0.00 O ATOM 235 CB GLN A 17 -8.733 23.813 -4.070 1.00 0.00 C ATOM 236 CG GLN A 17 -8.601 25.343 -4.107 1.00 0.00 C ATOM 237 CD GLN A 17 -9.026 26.036 -2.808 1.00 0.00 C ATOM 238 OE1 GLN A 17 -10.193 26.049 -2.423 1.00 0.00 O ATOM 239 NE2 GLN A 17 -8.065 26.550 -2.072 1.00 0.00 N ATOM 0 H GLN A 17 -7.329 21.865 -4.556 1.00 0.00 H new ATOM 0 HA GLN A 17 -7.099 23.857 -2.596 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -8.466 23.407 -5.046 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -9.775 23.548 -3.889 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -7.565 25.603 -4.323 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -9.205 25.730 -4.928 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -7.101 26.531 -2.406 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -8.283 26.967 -1.167 1.00 0.00 H new ATOM 248 N GLU A 18 -9.231 21.532 -1.703 1.00 0.00 N ATOM 249 CA GLU A 18 -9.797 20.929 -0.484 1.00 0.00 C ATOM 250 C GLU A 18 -8.790 20.591 0.650 1.00 0.00 C ATOM 251 O GLU A 18 -9.140 20.750 1.820 1.00 0.00 O ATOM 252 CB GLU A 18 -10.569 19.659 -0.912 1.00 0.00 C ATOM 253 CG GLU A 18 -11.764 19.368 0.010 1.00 0.00 C ATOM 254 CD GLU A 18 -12.948 18.662 -0.645 1.00 0.00 C ATOM 255 OE1 GLU A 18 -14.117 18.959 -0.364 1.00 0.00 O ATOM 256 OE2 GLU A 18 -12.621 17.707 -1.562 1.00 0.00 O ATOM 0 H GLU A 18 -9.293 20.930 -2.524 1.00 0.00 H new ATOM 0 HA GLU A 18 -10.439 21.686 -0.033 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.923 19.779 -1.936 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -9.892 18.805 -0.907 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -11.416 18.758 0.843 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.114 20.311 0.430 1.00 0.00 H new ATOM 264 N ILE A 19 -7.564 20.133 0.314 1.00 0.00 N ATOM 265 CA ILE A 19 -6.484 19.900 1.303 1.00 0.00 C ATOM 266 C ILE A 19 -6.098 21.193 2.035 1.00 0.00 C ATOM 267 O ILE A 19 -6.213 21.199 3.259 1.00 0.00 O ATOM 268 CB ILE A 19 -5.262 19.161 0.667 1.00 0.00 C ATOM 269 CG1 ILE A 19 -5.595 17.710 0.216 1.00 0.00 C ATOM 270 CG2 ILE A 19 -4.005 19.160 1.582 1.00 0.00 C ATOM 271 CD1 ILE A 19 -6.172 16.822 1.298 1.00 0.00 C ATOM 0 H ILE A 19 -7.294 19.915 -0.645 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.874 19.227 2.066 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.026 19.743 -0.224 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.303 17.756 -0.612 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -4.686 17.247 -0.167 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -3.192 18.632 1.083 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -3.701 20.187 1.783 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.240 18.660 2.522 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.371 15.832 0.888 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -5.459 16.738 2.119 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -7.101 17.256 1.667 1.00 0.00 H new ATOM 283 N VAL A 20 -5.701 22.264 1.322 1.00 0.00 N ATOM 284 CA VAL A 20 -5.526 23.584 1.971 1.00 0.00 C ATOM 285 C VAL A 20 -6.712 24.073 2.868 1.00 0.00 C ATOM 286 O VAL A 20 -6.498 24.658 3.927 1.00 0.00 O ATOM 287 CB VAL A 20 -5.111 24.713 1.025 1.00 0.00 C ATOM 288 CG1 VAL A 20 -6.265 25.257 0.149 1.00 0.00 C ATOM 289 CG2 VAL A 20 -4.350 25.811 1.838 1.00 0.00 C ATOM 0 H VAL A 20 -5.499 22.248 0.322 1.00 0.00 H new ATOM 0 HA VAL A 20 -4.692 23.365 2.638 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.424 24.304 0.284 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -5.890 26.054 -0.493 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -6.664 24.452 -0.468 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -7.055 25.649 0.790 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -4.052 26.618 1.169 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -5.004 26.207 2.615 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -3.463 25.374 2.297 1.00 0.00 H new ATOM 299 N ASP A 21 -7.947 23.877 2.375 1.00 0.00 N ATOM 300 CA ASP A 21 -9.168 24.253 3.097 1.00 0.00 C ATOM 301 C ASP A 21 -9.360 23.498 4.452 1.00 0.00 C ATOM 302 O ASP A 21 -9.811 24.096 5.429 1.00 0.00 O ATOM 303 CB ASP A 21 -10.374 24.032 2.149 1.00 0.00 C ATOM 304 CG ASP A 21 -11.602 24.858 2.554 1.00 0.00 C ATOM 305 OD1 ASP A 21 -11.685 25.497 3.612 1.00 0.00 O ATOM 306 OD2 ASP A 21 -12.597 24.833 1.629 1.00 0.00 O ATOM 0 H ASP A 21 -8.124 23.453 1.464 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.086 25.303 3.379 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.084 24.294 1.131 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.638 22.974 2.143 1.00 0.00 H new ATOM 312 N LYS A 22 -8.999 22.204 4.494 1.00 0.00 N ATOM 313 CA LYS A 22 -8.848 21.449 5.753 1.00 0.00 C ATOM 314 C LYS A 22 -7.602 21.810 6.633 1.00 0.00 C ATOM 315 O LYS A 22 -7.672 21.655 7.854 1.00 0.00 O ATOM 316 CB LYS A 22 -8.826 19.946 5.376 1.00 0.00 C ATOM 317 CG LYS A 22 -9.056 19.031 6.602 1.00 0.00 C ATOM 318 CD LYS A 22 -10.354 18.197 6.563 1.00 0.00 C ATOM 319 CE LYS A 22 -11.299 18.454 7.762 1.00 0.00 C ATOM 320 NZ LYS A 22 -12.510 19.195 7.369 1.00 0.00 N ATOM 0 H LYS A 22 -8.804 21.652 3.659 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.690 21.720 6.390 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -9.595 19.750 4.629 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.867 19.702 4.918 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -8.209 18.351 6.693 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -9.066 19.649 7.500 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.888 18.416 5.638 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -10.094 17.139 6.538 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -11.587 17.501 8.206 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.765 19.015 8.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.112 19.344 8.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -12.239 20.116 6.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -13.035 18.649 6.656 1.00 0.00 H new ATOM 334 N VAL A 23 -6.474 22.211 6.027 1.00 0.00 N ATOM 335 CA VAL A 23 -5.178 22.434 6.741 1.00 0.00 C ATOM 336 C VAL A 23 -4.962 23.892 7.244 1.00 0.00 C ATOM 337 O VAL A 23 -4.189 24.062 8.178 1.00 0.00 O ATOM 338 CB VAL A 23 -3.968 21.962 5.876 1.00 0.00 C ATOM 339 CG1 VAL A 23 -4.129 20.528 5.304 1.00 0.00 C ATOM 340 CG2 VAL A 23 -3.565 23.012 4.810 1.00 0.00 C ATOM 0 H VAL A 23 -6.420 22.394 5.025 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.239 21.820 7.639 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.124 21.885 6.561 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.249 20.271 4.714 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.236 19.819 6.125 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.015 20.486 4.671 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.719 22.639 4.233 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.407 23.194 4.142 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.285 23.943 5.304 1.00 0.00 H new ATOM 350 N LYS A 24 -5.646 24.900 6.657 1.00 0.00 N ATOM 351 CA LYS A 24 -5.701 26.289 7.158 1.00 0.00 C ATOM 352 C LYS A 24 -5.954 26.479 8.681 1.00 0.00 C ATOM 353 O LYS A 24 -5.252 27.340 9.208 1.00 0.00 O ATOM 354 CB LYS A 24 -6.678 27.129 6.292 1.00 0.00 C ATOM 355 CG LYS A 24 -8.191 26.793 6.277 1.00 0.00 C ATOM 356 CD LYS A 24 -9.046 27.277 7.480 1.00 0.00 C ATOM 357 CE LYS A 24 -9.934 28.500 7.238 1.00 0.00 C ATOM 358 NZ LYS A 24 -9.199 29.744 7.518 1.00 0.00 N ATOM 0 H LYS A 24 -6.187 24.766 5.803 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.683 26.662 7.047 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.580 28.167 6.609 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.325 27.076 5.262 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -8.620 27.215 5.368 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -8.294 25.710 6.205 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -9.682 26.452 7.801 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -8.374 27.502 8.308 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -10.283 28.503 6.205 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -10.818 28.444 7.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.875 30.510 7.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -8.584 29.605 8.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.618 29.997 6.693 1.00 0.00 H new ATOM 372 N PRO A 25 -6.879 25.770 9.431 1.00 0.00 N ATOM 373 CA PRO A 25 -7.041 25.968 10.890 1.00 0.00 C ATOM 374 C PRO A 25 -5.823 25.469 11.741 1.00 0.00 C ATOM 375 O PRO A 25 -5.391 26.151 12.673 1.00 0.00 O ATOM 376 CB PRO A 25 -8.361 25.216 11.174 1.00 0.00 C ATOM 377 CG PRO A 25 -8.510 24.122 10.117 1.00 0.00 C ATOM 378 CD PRO A 25 -7.630 24.578 8.968 1.00 0.00 C ATOM 0 HA PRO A 25 -7.077 27.018 11.179 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -8.346 24.782 12.174 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -9.207 25.902 11.136 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -8.190 23.153 10.501 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -9.548 24.013 9.803 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -6.945 23.784 8.671 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -8.235 24.821 8.094 1.00 0.00 H new ATOM 386 N GLN A 26 -5.286 24.293 11.369 1.00 0.00 N ATOM 387 CA GLN A 26 -4.106 23.642 11.996 1.00 0.00 C ATOM 388 C GLN A 26 -2.764 24.357 11.695 1.00 0.00 C ATOM 389 O GLN A 26 -1.969 24.585 12.608 1.00 0.00 O ATOM 390 CB GLN A 26 -3.993 22.163 11.519 1.00 0.00 C ATOM 391 CG GLN A 26 -5.306 21.346 11.484 1.00 0.00 C ATOM 392 CD GLN A 26 -5.086 19.883 11.098 1.00 0.00 C ATOM 393 OE1 GLN A 26 -4.935 19.015 11.956 1.00 0.00 O ATOM 394 NE2 GLN A 26 -5.062 19.585 9.807 1.00 0.00 N ATOM 0 H GLN A 26 -5.670 23.746 10.598 1.00 0.00 H new ATOM 0 HA GLN A 26 -4.274 23.700 13.071 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -3.562 22.160 10.518 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -3.288 21.647 12.171 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -5.782 21.390 12.464 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -5.994 21.804 10.774 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -5.189 20.320 9.111 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -4.916 18.621 9.509 1.00 0.00 H new ATOM 403 N LEU A 27 -2.544 24.726 10.417 1.00 0.00 N ATOM 404 CA LEU A 27 -1.490 25.666 10.012 1.00 0.00 C ATOM 405 C LEU A 27 -1.585 27.057 10.697 1.00 0.00 C ATOM 406 O LEU A 27 -0.532 27.549 11.078 1.00 0.00 O ATOM 407 CB LEU A 27 -1.459 25.742 8.457 1.00 0.00 C ATOM 408 CG LEU A 27 -0.385 24.856 7.788 1.00 0.00 C ATOM 409 CD1 LEU A 27 -0.615 24.701 6.282 1.00 0.00 C ATOM 410 CD2 LEU A 27 1.024 25.410 8.020 1.00 0.00 C ATOM 0 H LEU A 27 -3.098 24.376 9.636 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.534 25.282 10.367 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.438 25.455 8.073 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -1.292 26.778 8.161 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.472 23.876 8.257 1.00 0.00 H new ATOM 0 HD11 LEU A 27 0.166 24.070 5.858 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.588 24.241 6.108 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.587 25.682 5.807 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.754 24.762 7.536 1.00 0.00 H new ATOM 0 HD22 LEU A 27 1.094 26.413 7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.228 25.450 9.090 1.00 0.00 H new ATOM 422 N GLU A 28 -2.780 27.665 10.898 1.00 0.00 N ATOM 423 CA GLU A 28 -2.936 28.977 11.598 1.00 0.00 C ATOM 424 C GLU A 28 -2.503 29.000 13.086 1.00 0.00 C ATOM 425 O GLU A 28 -1.830 29.939 13.520 1.00 0.00 O ATOM 426 CB GLU A 28 -4.404 29.476 11.450 1.00 0.00 C ATOM 427 CG GLU A 28 -4.601 30.532 10.340 1.00 0.00 C ATOM 428 CD GLU A 28 -5.806 30.483 9.400 1.00 0.00 C ATOM 429 OE1 GLU A 28 -5.840 31.157 8.361 1.00 0.00 O ATOM 430 OE2 GLU A 28 -6.825 29.670 9.790 1.00 0.00 O ATOM 0 H GLU A 28 -3.664 27.266 10.583 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.239 29.653 11.103 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.048 28.621 11.242 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -4.731 29.898 12.400 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -4.619 31.506 10.828 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -3.709 30.505 9.714 1.00 0.00 H new ATOM 438 N GLU A 29 -2.892 27.969 13.849 1.00 0.00 N ATOM 439 CA GLU A 29 -2.359 27.716 15.204 1.00 0.00 C ATOM 440 C GLU A 29 -0.831 27.419 15.275 1.00 0.00 C ATOM 441 O GLU A 29 -0.148 28.000 16.123 1.00 0.00 O ATOM 442 CB GLU A 29 -3.205 26.573 15.830 1.00 0.00 C ATOM 443 CG GLU A 29 -4.320 27.104 16.748 1.00 0.00 C ATOM 444 CD GLU A 29 -4.993 25.964 17.507 1.00 0.00 C ATOM 445 OE1 GLU A 29 -5.648 25.079 16.941 1.00 0.00 O ATOM 446 OE2 GLU A 29 -4.788 25.999 18.854 1.00 0.00 O ATOM 0 H GLU A 29 -3.585 27.284 13.548 1.00 0.00 H new ATOM 0 HA GLU A 29 -2.451 28.639 15.777 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.648 25.974 15.034 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.552 25.912 16.400 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -3.903 27.820 17.456 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -5.062 27.638 16.154 1.00 0.00 H new ATOM 454 N LYS A 30 -0.309 26.538 14.398 1.00 0.00 N ATOM 455 CA LYS A 30 1.146 26.230 14.330 1.00 0.00 C ATOM 456 C LYS A 30 2.075 27.379 13.807 1.00 0.00 C ATOM 457 O LYS A 30 3.210 27.514 14.271 1.00 0.00 O ATOM 458 CB LYS A 30 1.345 24.947 13.480 1.00 0.00 C ATOM 459 CG LYS A 30 2.676 24.221 13.800 1.00 0.00 C ATOM 460 CD LYS A 30 2.494 22.855 14.509 1.00 0.00 C ATOM 461 CE LYS A 30 3.230 22.712 15.855 1.00 0.00 C ATOM 462 NZ LYS A 30 2.766 23.684 16.868 1.00 0.00 N ATOM 0 H LYS A 30 -0.871 26.022 13.721 1.00 0.00 H new ATOM 0 HA LYS A 30 1.463 26.090 15.363 1.00 0.00 H new ATOM 0 HB2 LYS A 30 0.512 24.266 13.656 1.00 0.00 H new ATOM 0 HB3 LYS A 30 1.324 25.209 12.422 1.00 0.00 H new ATOM 0 HG2 LYS A 30 3.226 24.067 12.872 1.00 0.00 H new ATOM 0 HG3 LYS A 30 3.288 24.867 14.430 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.430 22.689 14.676 1.00 0.00 H new ATOM 0 HD3 LYS A 30 2.838 22.067 13.839 1.00 0.00 H new ATOM 0 HE2 LYS A 30 3.087 21.701 16.236 1.00 0.00 H new ATOM 0 HE3 LYS A 30 4.300 22.844 15.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 3.233 23.488 17.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 3.002 24.648 16.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 1.736 23.600 16.983 1.00 0.00 H new ATOM 476 N THR A 31 1.594 28.174 12.842 1.00 0.00 N ATOM 477 CA THR A 31 2.298 29.379 12.325 1.00 0.00 C ATOM 478 C THR A 31 2.186 30.656 13.222 1.00 0.00 C ATOM 479 O THR A 31 2.950 31.595 12.984 1.00 0.00 O ATOM 480 CB THR A 31 1.770 29.644 10.882 1.00 0.00 C ATOM 481 OG1 THR A 31 2.701 30.422 10.140 1.00 0.00 O ATOM 482 CG2 THR A 31 0.388 30.336 10.820 1.00 0.00 C ATOM 0 H THR A 31 0.697 28.006 12.387 1.00 0.00 H new ATOM 0 HA THR A 31 3.367 29.165 12.331 1.00 0.00 H new ATOM 0 HB THR A 31 1.650 28.653 10.445 1.00 0.00 H new ATOM 0 HG1 THR A 31 3.127 31.076 10.733 1.00 0.00 H new ATOM 0 HG21 THR A 31 0.100 30.481 9.779 1.00 0.00 H new ATOM 0 HG22 THR A 31 -0.354 29.712 11.318 1.00 0.00 H new ATOM 0 HG23 THR A 31 0.443 31.303 11.319 1.00 0.00 H new ATOM 490 N ASN A 32 1.189 30.740 14.152 1.00 0.00 N ATOM 491 CA ASN A 32 0.820 32.001 14.867 1.00 0.00 C ATOM 492 C ASN A 32 0.376 33.204 13.932 1.00 0.00 C ATOM 493 O ASN A 32 0.624 34.374 14.238 1.00 0.00 O ATOM 494 CB ASN A 32 1.967 32.312 15.878 1.00 0.00 C ATOM 495 CG ASN A 32 1.764 33.529 16.796 1.00 0.00 C ATOM 496 OD1 ASN A 32 0.677 33.789 17.311 1.00 0.00 O ATOM 497 ND2 ASN A 32 2.807 34.327 16.951 1.00 0.00 N ATOM 0 H ASN A 32 0.621 29.939 14.426 1.00 0.00 H new ATOM 0 HA ASN A 32 -0.107 31.850 15.420 1.00 0.00 H new ATOM 0 HB2 ASN A 32 2.116 31.433 16.505 1.00 0.00 H new ATOM 0 HB3 ASN A 32 2.888 32.461 15.314 1.00 0.00 H new ATOM 0 HD21 ASN A 32 2.720 35.178 17.507 1.00 0.00 H new ATOM 0 HD22 ASN A 32 3.699 34.092 16.515 1.00 0.00 H new ATOM 504 N GLU A 33 -0.278 32.916 12.795 1.00 0.00 N ATOM 505 CA GLU A 33 -0.566 33.908 11.734 1.00 0.00 C ATOM 506 C GLU A 33 -1.777 33.375 10.924 1.00 0.00 C ATOM 507 O GLU A 33 -2.048 32.175 10.814 1.00 0.00 O ATOM 508 CB GLU A 33 0.702 34.219 10.859 1.00 0.00 C ATOM 509 CG GLU A 33 0.459 35.153 9.649 1.00 0.00 C ATOM 510 CD GLU A 33 1.728 35.614 8.942 1.00 0.00 C ATOM 511 OE1 GLU A 33 2.626 36.237 9.522 1.00 0.00 O ATOM 512 OE2 GLU A 33 1.769 35.302 7.616 1.00 0.00 O ATOM 0 H GLU A 33 -0.627 31.982 12.580 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.828 34.875 12.164 1.00 0.00 H new ATOM 0 HB2 GLU A 33 1.462 34.669 11.498 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.110 33.277 10.493 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.176 34.636 8.929 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -0.092 36.030 9.988 1.00 0.00 H new ATOM 520 N THR A 34 -2.478 34.341 10.325 1.00 0.00 N ATOM 521 CA THR A 34 -3.607 34.088 9.409 1.00 0.00 C ATOM 522 C THR A 34 -3.088 34.194 7.954 1.00 0.00 C ATOM 523 O THR A 34 -2.483 35.192 7.546 1.00 0.00 O ATOM 524 CB THR A 34 -4.831 35.030 9.693 1.00 0.00 C ATOM 525 OG1 THR A 34 -4.695 35.788 10.897 1.00 0.00 O ATOM 526 CG2 THR A 34 -6.163 34.261 9.788 1.00 0.00 C ATOM 0 H THR A 34 -2.280 35.333 10.460 1.00 0.00 H new ATOM 0 HA THR A 34 -3.992 33.082 9.575 1.00 0.00 H new ATOM 0 HB THR A 34 -4.843 35.704 8.836 1.00 0.00 H new ATOM 0 HG1 THR A 34 -5.485 36.355 11.018 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.974 34.962 9.985 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.352 33.743 8.848 1.00 0.00 H new ATOM 0 HG23 THR A 34 -6.106 33.534 10.598 1.00 0.00 H new ATOM 534 N TYR A 35 -3.372 33.142 7.177 1.00 0.00 N ATOM 535 CA TYR A 35 -3.041 33.091 5.735 1.00 0.00 C ATOM 536 C TYR A 35 -4.149 33.820 4.943 1.00 0.00 C ATOM 537 O TYR A 35 -5.334 33.748 5.297 1.00 0.00 O ATOM 538 CB TYR A 35 -2.942 31.639 5.220 1.00 0.00 C ATOM 539 CG TYR A 35 -2.027 30.712 6.005 1.00 0.00 C ATOM 540 CD1 TYR A 35 -0.634 30.642 5.790 1.00 0.00 C ATOM 541 CD2 TYR A 35 -2.599 30.008 7.071 1.00 0.00 C ATOM 542 CE1 TYR A 35 0.161 29.848 6.609 1.00 0.00 C ATOM 543 CE2 TYR A 35 -1.794 29.270 7.910 1.00 0.00 C ATOM 544 CZ TYR A 35 -0.420 29.164 7.663 1.00 0.00 C ATOM 545 OH TYR A 35 0.369 28.405 8.466 1.00 0.00 O ATOM 0 H TYR A 35 -3.836 32.302 7.522 1.00 0.00 H new ATOM 0 HA TYR A 35 -2.072 33.571 5.594 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -3.943 31.208 5.214 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -2.599 31.664 4.186 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -0.184 31.207 4.987 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -3.666 30.043 7.235 1.00 0.00 H new ATOM 0 HE1 TYR A 35 1.222 29.766 6.425 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -2.226 28.770 8.764 1.00 0.00 H new ATOM 0 HH TYR A 35 1.310 28.627 8.305 1.00 0.00 H new ATOM 555 N GLY A 36 -3.750 34.495 3.856 1.00 0.00 N ATOM 556 CA GLY A 36 -4.691 35.285 3.036 1.00 0.00 C ATOM 557 C GLY A 36 -5.672 34.415 2.228 1.00 0.00 C ATOM 558 O GLY A 36 -6.546 33.764 2.809 1.00 0.00 O ATOM 0 H GLY A 36 -2.787 34.513 3.522 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -5.258 35.952 3.686 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.124 35.915 2.350 1.00 0.00 H new ATOM 562 N LYS A 37 -5.527 34.413 0.900 1.00 0.00 N ATOM 563 CA LYS A 37 -6.399 33.599 0.010 1.00 0.00 C ATOM 564 C LYS A 37 -5.655 32.332 -0.393 1.00 0.00 C ATOM 565 O LYS A 37 -4.549 32.382 -0.936 1.00 0.00 O ATOM 566 CB LYS A 37 -6.749 34.330 -1.290 1.00 0.00 C ATOM 567 CG LYS A 37 -7.700 35.518 -1.074 1.00 0.00 C ATOM 568 CD LYS A 37 -7.520 36.578 -2.165 1.00 0.00 C ATOM 569 CE LYS A 37 -6.195 37.357 -2.004 1.00 0.00 C ATOM 570 NZ LYS A 37 -6.032 38.327 -3.089 1.00 0.00 N ATOM 0 H LYS A 37 -4.821 34.959 0.407 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.313 33.391 0.567 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.832 34.687 -1.758 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -7.208 33.626 -1.984 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.731 35.166 -1.072 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -7.514 35.963 -0.097 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -7.542 36.098 -3.143 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -8.357 37.276 -2.134 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -6.184 37.872 -1.044 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -5.356 36.661 -2.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -5.136 38.841 -2.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -6.021 37.828 -4.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -6.823 39.002 -3.073 1.00 0.00 H new ATOM 584 N LEU A 38 -6.342 31.221 -0.154 1.00 0.00 N ATOM 585 CA LEU A 38 -5.780 29.869 -0.286 1.00 0.00 C ATOM 586 C LEU A 38 -6.266 29.403 -1.660 1.00 0.00 C ATOM 587 O LEU A 38 -7.476 29.307 -1.898 1.00 0.00 O ATOM 588 CB LEU A 38 -6.212 28.918 0.877 1.00 0.00 C ATOM 589 CG LEU A 38 -6.755 29.530 2.207 1.00 0.00 C ATOM 590 CD1 LEU A 38 -7.100 28.436 3.220 1.00 0.00 C ATOM 591 CD2 LEU A 38 -5.875 30.600 2.902 1.00 0.00 C ATOM 0 H LEU A 38 -7.318 31.227 0.141 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.692 29.861 -0.214 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -6.981 28.252 0.486 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.351 28.298 1.130 1.00 0.00 H new ATOM 0 HG LEU A 38 -7.644 30.066 1.874 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.475 28.893 4.136 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.864 27.781 2.802 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.206 27.854 3.445 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.368 30.941 3.812 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.907 30.167 3.154 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -5.731 31.445 2.229 1.00 0.00 H new ATOM 603 N GLU A 39 -5.316 29.191 -2.570 1.00 0.00 N ATOM 604 CA GLU A 39 -5.617 28.777 -3.949 1.00 0.00 C ATOM 605 C GLU A 39 -4.715 27.601 -4.247 1.00 0.00 C ATOM 606 O GLU A 39 -3.502 27.680 -4.052 1.00 0.00 O ATOM 607 CB GLU A 39 -5.342 29.923 -4.958 1.00 0.00 C ATOM 608 CG GLU A 39 -6.643 30.360 -5.650 1.00 0.00 C ATOM 609 CD GLU A 39 -6.578 31.761 -6.226 1.00 0.00 C ATOM 610 OE1 GLU A 39 -6.514 31.979 -7.443 1.00 0.00 O ATOM 611 OE2 GLU A 39 -6.593 32.746 -5.284 1.00 0.00 O ATOM 0 H GLU A 39 -4.320 29.299 -2.378 1.00 0.00 H new ATOM 0 HA GLU A 39 -6.671 28.516 -4.046 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -4.897 30.772 -4.439 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.620 29.592 -5.705 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -6.874 29.657 -6.450 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -7.462 30.308 -4.933 1.00 0.00 H new ATOM 619 N ALA A 40 -5.307 26.538 -4.802 1.00 0.00 N ATOM 620 CA ALA A 40 -4.565 25.323 -5.164 1.00 0.00 C ATOM 621 C ALA A 40 -3.421 25.640 -6.130 1.00 0.00 C ATOM 622 O ALA A 40 -3.498 26.490 -7.027 1.00 0.00 O ATOM 623 CB ALA A 40 -5.496 24.237 -5.682 1.00 0.00 C ATOM 0 H ALA A 40 -6.304 26.494 -5.012 1.00 0.00 H new ATOM 0 HA ALA A 40 -4.104 24.924 -4.260 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -4.914 23.352 -5.941 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.222 23.981 -4.910 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.020 24.598 -6.567 1.00 0.00 H new ATOM 629 N VAL A 41 -2.329 24.977 -5.801 1.00 0.00 N ATOM 630 CA VAL A 41 -1.098 24.998 -6.599 1.00 0.00 C ATOM 631 C VAL A 41 -0.767 23.483 -6.684 1.00 0.00 C ATOM 632 O VAL A 41 -1.638 22.619 -6.846 1.00 0.00 O ATOM 633 CB VAL A 41 0.015 25.956 -6.032 1.00 0.00 C ATOM 634 CG1 VAL A 41 1.126 26.305 -7.050 1.00 0.00 C ATOM 635 CG2 VAL A 41 -0.497 27.275 -5.500 1.00 0.00 C ATOM 0 H VAL A 41 -2.261 24.399 -4.963 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.193 25.443 -7.590 1.00 0.00 H new ATOM 0 HB VAL A 41 0.416 25.356 -5.215 1.00 0.00 H new ATOM 0 HG11 VAL A 41 1.853 26.968 -6.582 1.00 0.00 H new ATOM 0 HG12 VAL A 41 1.624 25.391 -7.373 1.00 0.00 H new ATOM 0 HG13 VAL A 41 0.685 26.802 -7.914 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.340 27.868 -5.131 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.002 27.818 -6.299 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -1.198 27.091 -4.686 1.00 0.00 H new ATOM 645 N GLN A 42 0.511 23.130 -6.609 1.00 0.00 N ATOM 646 CA GLN A 42 1.003 21.916 -7.267 1.00 0.00 C ATOM 647 C GLN A 42 1.410 20.803 -6.325 1.00 0.00 C ATOM 648 O GLN A 42 2.316 20.948 -5.503 1.00 0.00 O ATOM 649 CB GLN A 42 2.101 22.102 -8.318 1.00 0.00 C ATOM 650 CG GLN A 42 2.338 23.519 -8.881 1.00 0.00 C ATOM 651 CD GLN A 42 2.744 23.587 -10.355 1.00 0.00 C ATOM 652 OE1 GLN A 42 2.505 24.599 -11.010 1.00 0.00 O ATOM 653 NE2 GLN A 42 3.370 22.557 -10.907 1.00 0.00 N ATOM 0 H GLN A 42 1.223 23.659 -6.105 1.00 0.00 H new ATOM 0 HA GLN A 42 0.101 21.618 -7.801 1.00 0.00 H new ATOM 0 HB2 GLN A 42 3.039 21.755 -7.885 1.00 0.00 H new ATOM 0 HB3 GLN A 42 1.874 21.444 -9.157 1.00 0.00 H new ATOM 0 HG2 GLN A 42 1.426 24.101 -8.747 1.00 0.00 H new ATOM 0 HG3 GLN A 42 3.114 24.001 -8.287 1.00 0.00 H new ATOM 0 HE21 GLN A 42 3.563 21.722 -10.354 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.658 22.600 -11.884 1.00 0.00 H new ATOM 662 N TYR A 43 0.789 19.653 -6.559 1.00 0.00 N ATOM 663 CA TYR A 43 0.956 18.486 -5.707 1.00 0.00 C ATOM 664 C TYR A 43 1.507 17.302 -6.502 1.00 0.00 C ATOM 665 O TYR A 43 1.152 17.072 -7.657 1.00 0.00 O ATOM 666 CB TYR A 43 -0.429 18.144 -5.097 1.00 0.00 C ATOM 667 CG TYR A 43 -1.305 17.174 -5.870 1.00 0.00 C ATOM 668 CD1 TYR A 43 -1.795 17.607 -7.097 1.00 0.00 C ATOM 669 CD2 TYR A 43 -1.520 15.841 -5.446 1.00 0.00 C ATOM 670 CE1 TYR A 43 -2.548 16.750 -7.860 1.00 0.00 C ATOM 671 CE2 TYR A 43 -2.292 14.987 -6.245 1.00 0.00 C ATOM 672 CZ TYR A 43 -2.804 15.448 -7.461 1.00 0.00 C ATOM 673 OH TYR A 43 -3.588 14.667 -8.263 1.00 0.00 O ATOM 0 H TYR A 43 0.156 19.505 -7.345 1.00 0.00 H new ATOM 0 HA TYR A 43 1.675 18.700 -4.916 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -0.268 17.733 -4.100 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.983 19.075 -4.973 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -1.585 18.607 -7.446 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -1.095 15.487 -4.519 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -2.953 17.100 -8.798 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -2.491 13.976 -5.922 1.00 0.00 H new ATOM 0 HH TYR A 43 -3.683 13.778 -7.862 1.00 0.00 H new ATOM 683 N LYS A 44 2.135 16.428 -5.743 1.00 0.00 N ATOM 684 CA LYS A 44 2.631 15.131 -6.229 1.00 0.00 C ATOM 685 C LYS A 44 2.079 14.044 -5.262 1.00 0.00 C ATOM 686 O LYS A 44 1.457 14.334 -4.228 1.00 0.00 O ATOM 687 CB LYS A 44 4.182 15.209 -6.337 1.00 0.00 C ATOM 688 CG LYS A 44 4.756 16.575 -6.806 1.00 0.00 C ATOM 689 CD LYS A 44 6.014 16.550 -7.648 1.00 0.00 C ATOM 690 CE LYS A 44 7.280 16.839 -6.865 1.00 0.00 C ATOM 691 NZ LYS A 44 8.394 16.582 -7.779 1.00 0.00 N ATOM 0 H LYS A 44 2.324 16.589 -4.754 1.00 0.00 H new ATOM 0 HA LYS A 44 2.286 14.867 -7.229 1.00 0.00 H new ATOM 0 HB2 LYS A 44 4.608 14.972 -5.362 1.00 0.00 H new ATOM 0 HB3 LYS A 44 4.519 14.437 -7.029 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.981 17.089 -7.374 1.00 0.00 H new ATOM 0 HG3 LYS A 44 4.955 17.179 -5.920 1.00 0.00 H new ATOM 0 HD2 LYS A 44 6.105 15.572 -8.120 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.918 17.283 -8.449 1.00 0.00 H new ATOM 0 HE2 LYS A 44 7.294 17.871 -6.515 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.346 16.202 -5.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 9.237 16.315 -7.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 8.141 15.807 -8.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 8.596 17.441 -8.330 1.00 0.00 H new ATOM 705 N THR A 45 2.289 12.767 -5.608 1.00 0.00 N ATOM 706 CA THR A 45 1.764 11.627 -4.792 1.00 0.00 C ATOM 707 C THR A 45 2.792 10.472 -4.781 1.00 0.00 C ATOM 708 O THR A 45 3.209 9.987 -5.831 1.00 0.00 O ATOM 709 CB THR A 45 0.375 11.116 -5.288 1.00 0.00 C ATOM 710 OG1 THR A 45 0.367 10.892 -6.689 1.00 0.00 O ATOM 711 CG2 THR A 45 -0.791 12.051 -4.969 1.00 0.00 C ATOM 0 H THR A 45 2.812 12.483 -6.437 1.00 0.00 H new ATOM 0 HA THR A 45 1.615 11.998 -3.778 1.00 0.00 H new ATOM 0 HB THR A 45 0.231 10.185 -4.739 1.00 0.00 H new ATOM 0 HG1 THR A 45 -0.517 10.571 -6.964 1.00 0.00 H new ATOM 0 HG21 THR A 45 -1.717 11.620 -5.349 1.00 0.00 H new ATOM 0 HG22 THR A 45 -0.867 12.182 -3.890 1.00 0.00 H new ATOM 0 HG23 THR A 45 -0.621 13.019 -5.441 1.00 0.00 H new ATOM 719 N GLN A 46 3.154 9.994 -3.583 1.00 0.00 N ATOM 720 CA GLN A 46 4.121 8.878 -3.406 1.00 0.00 C ATOM 721 C GLN A 46 3.328 7.705 -2.830 1.00 0.00 C ATOM 722 O GLN A 46 2.575 7.828 -1.856 1.00 0.00 O ATOM 723 CB GLN A 46 5.321 9.221 -2.496 1.00 0.00 C ATOM 724 CG GLN A 46 6.332 8.108 -2.179 1.00 0.00 C ATOM 725 CD GLN A 46 7.631 8.617 -1.538 1.00 0.00 C ATOM 726 OE1 GLN A 46 7.715 8.827 -0.328 1.00 0.00 O ATOM 727 NE2 GLN A 46 8.658 8.843 -2.340 1.00 0.00 N ATOM 0 H GLN A 46 2.791 10.363 -2.704 1.00 0.00 H new ATOM 0 HA GLN A 46 4.568 8.644 -4.372 1.00 0.00 H new ATOM 0 HB2 GLN A 46 5.866 10.044 -2.959 1.00 0.00 H new ATOM 0 HB3 GLN A 46 4.926 9.592 -1.550 1.00 0.00 H new ATOM 0 HG2 GLN A 46 5.865 7.386 -1.509 1.00 0.00 H new ATOM 0 HG3 GLN A 46 6.575 7.578 -3.100 1.00 0.00 H new ATOM 0 HE21 GLN A 46 8.573 8.664 -3.341 1.00 0.00 H new ATOM 0 HE22 GLN A 46 9.535 9.196 -1.958 1.00 0.00 H new ATOM 736 N VAL A 47 3.575 6.556 -3.457 1.00 0.00 N ATOM 737 CA VAL A 47 2.871 5.309 -3.120 1.00 0.00 C ATOM 738 C VAL A 47 3.891 4.388 -2.418 1.00 0.00 C ATOM 739 O VAL A 47 4.914 4.026 -2.996 1.00 0.00 O ATOM 740 CB VAL A 47 2.211 4.658 -4.372 1.00 0.00 C ATOM 741 CG1 VAL A 47 1.542 3.309 -4.005 1.00 0.00 C ATOM 742 CG2 VAL A 47 1.169 5.583 -5.052 1.00 0.00 C ATOM 0 H VAL A 47 4.260 6.458 -4.206 1.00 0.00 H new ATOM 0 HA VAL A 47 2.036 5.504 -2.446 1.00 0.00 H new ATOM 0 HB VAL A 47 3.017 4.487 -5.085 1.00 0.00 H new ATOM 0 HG11 VAL A 47 1.088 2.874 -4.895 1.00 0.00 H new ATOM 0 HG12 VAL A 47 2.294 2.626 -3.610 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.773 3.477 -3.251 1.00 0.00 H new ATOM 0 HG21 VAL A 47 0.743 5.076 -5.918 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.375 5.820 -4.343 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.655 6.504 -5.374 1.00 0.00 H new ATOM 752 N VAL A 48 3.541 3.947 -1.209 1.00 0.00 N ATOM 753 CA VAL A 48 4.351 2.968 -0.434 1.00 0.00 C ATOM 754 C VAL A 48 3.861 1.543 -0.815 1.00 0.00 C ATOM 755 O VAL A 48 2.666 1.343 -1.036 1.00 0.00 O ATOM 756 CB VAL A 48 4.256 3.248 1.110 1.00 0.00 C ATOM 757 CG1 VAL A 48 5.269 2.374 1.891 1.00 0.00 C ATOM 758 CG2 VAL A 48 4.421 4.749 1.492 1.00 0.00 C ATOM 0 H VAL A 48 2.693 4.249 -0.729 1.00 0.00 H new ATOM 0 HA VAL A 48 5.408 3.061 -0.683 1.00 0.00 H new ATOM 0 HB VAL A 48 3.241 2.974 1.398 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.185 2.585 2.957 1.00 0.00 H new ATOM 0 HG12 VAL A 48 5.055 1.320 1.711 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.281 2.601 1.555 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.343 4.860 2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 48 5.397 5.104 1.160 1.00 0.00 H new ATOM 0 HG23 VAL A 48 3.639 5.335 1.010 1.00 0.00 H new ATOM 768 N ALA A 49 4.773 0.557 -0.876 1.00 0.00 N ATOM 769 CA ALA A 49 4.387 -0.849 -1.155 1.00 0.00 C ATOM 770 C ALA A 49 4.824 -1.807 -0.020 1.00 0.00 C ATOM 771 O ALA A 49 5.863 -1.651 0.630 1.00 0.00 O ATOM 772 CB ALA A 49 4.917 -1.315 -2.519 1.00 0.00 C ATOM 0 H ALA A 49 5.774 0.699 -0.738 1.00 0.00 H new ATOM 0 HA ALA A 49 3.298 -0.880 -1.195 1.00 0.00 H new ATOM 0 HB1 ALA A 49 4.617 -2.348 -2.692 1.00 0.00 H new ATOM 0 HB2 ALA A 49 4.506 -0.681 -3.305 1.00 0.00 H new ATOM 0 HB3 ALA A 49 6.005 -1.247 -2.529 1.00 0.00 H new ATOM 778 N GLY A 50 3.994 -2.835 0.144 1.00 0.00 N ATOM 779 CA GLY A 50 4.312 -4.041 0.933 1.00 0.00 C ATOM 780 C GLY A 50 4.047 -5.303 0.085 1.00 0.00 C ATOM 781 O GLY A 50 3.523 -5.243 -1.039 1.00 0.00 O ATOM 0 H GLY A 50 3.063 -2.861 -0.272 1.00 0.00 H new ATOM 0 HA2 GLY A 50 5.355 -4.016 1.249 1.00 0.00 H new ATOM 0 HA3 GLY A 50 3.705 -4.065 1.838 1.00 0.00 H new ATOM 785 N THR A 51 4.413 -6.464 0.648 1.00 0.00 N ATOM 786 CA THR A 51 4.364 -7.738 -0.113 1.00 0.00 C ATOM 787 C THR A 51 3.583 -8.803 0.711 1.00 0.00 C ATOM 788 O THR A 51 3.993 -9.268 1.778 1.00 0.00 O ATOM 789 CB THR A 51 5.762 -8.229 -0.589 1.00 0.00 C ATOM 790 OG1 THR A 51 6.614 -7.152 -0.973 1.00 0.00 O ATOM 791 CG2 THR A 51 5.629 -9.134 -1.823 1.00 0.00 C ATOM 0 H THR A 51 4.742 -6.556 1.609 1.00 0.00 H new ATOM 0 HA THR A 51 3.822 -7.559 -1.042 1.00 0.00 H new ATOM 0 HB THR A 51 6.191 -8.762 0.260 1.00 0.00 H new ATOM 0 HG1 THR A 51 7.480 -7.507 -1.263 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.618 -9.466 -2.139 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.018 -10.001 -1.574 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.157 -8.578 -2.633 1.00 0.00 H new ATOM 799 N ASN A 52 2.446 -9.165 0.119 1.00 0.00 N ATOM 800 CA ASN A 52 1.514 -10.224 0.578 1.00 0.00 C ATOM 801 C ASN A 52 1.688 -11.395 -0.451 1.00 0.00 C ATOM 802 O ASN A 52 2.004 -11.180 -1.624 1.00 0.00 O ATOM 803 CB ASN A 52 0.028 -9.695 0.723 1.00 0.00 C ATOM 804 CG ASN A 52 -0.350 -8.222 0.322 1.00 0.00 C ATOM 805 OD1 ASN A 52 0.357 -7.259 0.619 1.00 0.00 O ATOM 806 ND2 ASN A 52 -1.451 -8.012 -0.376 1.00 0.00 N ATOM 0 H ASN A 52 2.123 -8.713 -0.736 1.00 0.00 H new ATOM 0 HA ASN A 52 1.743 -10.571 1.585 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -0.606 -10.359 0.135 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -0.257 -9.825 1.767 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -1.702 -7.065 -0.659 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -2.050 -8.797 -0.632 1.00 0.00 H new ATOM 813 N TYR A 53 1.562 -12.652 -0.012 1.00 0.00 N ATOM 814 CA TYR A 53 1.920 -13.835 -0.857 1.00 0.00 C ATOM 815 C TYR A 53 0.749 -14.792 -0.821 1.00 0.00 C ATOM 816 O TYR A 53 0.173 -15.044 0.230 1.00 0.00 O ATOM 817 CB TYR A 53 3.169 -14.621 -0.387 1.00 0.00 C ATOM 818 CG TYR A 53 4.473 -13.901 -0.697 1.00 0.00 C ATOM 819 CD1 TYR A 53 4.844 -12.752 0.024 1.00 0.00 C ATOM 820 CD2 TYR A 53 5.281 -14.349 -1.756 1.00 0.00 C ATOM 821 CE1 TYR A 53 6.005 -12.065 -0.311 1.00 0.00 C ATOM 822 CE2 TYR A 53 6.457 -13.671 -2.072 1.00 0.00 C ATOM 823 CZ TYR A 53 6.819 -12.528 -1.352 1.00 0.00 C ATOM 824 OH TYR A 53 7.966 -11.857 -1.675 1.00 0.00 O ATOM 0 H TYR A 53 1.218 -12.893 0.917 1.00 0.00 H new ATOM 0 HA TYR A 53 2.150 -13.446 -1.849 1.00 0.00 H new ATOM 0 HB2 TYR A 53 3.101 -14.793 0.687 1.00 0.00 H new ATOM 0 HB3 TYR A 53 3.178 -15.600 -0.866 1.00 0.00 H new ATOM 0 HD1 TYR A 53 4.226 -12.403 0.838 1.00 0.00 H new ATOM 0 HD2 TYR A 53 4.990 -15.219 -2.325 1.00 0.00 H new ATOM 0 HE1 TYR A 53 6.280 -11.173 0.232 1.00 0.00 H new ATOM 0 HE2 TYR A 53 7.088 -14.028 -2.872 1.00 0.00 H new ATOM 0 HH TYR A 53 8.413 -12.312 -2.419 1.00 0.00 H new ATOM 834 N TYR A 54 0.400 -15.291 -1.998 1.00 0.00 N ATOM 835 CA TYR A 54 -0.764 -16.161 -2.189 1.00 0.00 C ATOM 836 C TYR A 54 -0.251 -17.371 -2.939 1.00 0.00 C ATOM 837 O TYR A 54 0.392 -17.212 -3.968 1.00 0.00 O ATOM 838 CB TYR A 54 -1.840 -15.451 -3.022 1.00 0.00 C ATOM 839 CG TYR A 54 -2.782 -14.597 -2.194 1.00 0.00 C ATOM 840 CD1 TYR A 54 -2.307 -13.546 -1.400 1.00 0.00 C ATOM 841 CD2 TYR A 54 -4.148 -14.862 -2.217 1.00 0.00 C ATOM 842 CE1 TYR A 54 -3.188 -12.724 -0.702 1.00 0.00 C ATOM 843 CE2 TYR A 54 -5.017 -14.070 -1.488 1.00 0.00 C ATOM 844 CZ TYR A 54 -4.548 -12.985 -0.749 1.00 0.00 C ATOM 845 OH TYR A 54 -5.404 -12.169 -0.074 1.00 0.00 O ATOM 0 H TYR A 54 0.917 -15.105 -2.857 1.00 0.00 H new ATOM 0 HA TYR A 54 -1.218 -16.430 -1.235 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.354 -14.823 -3.768 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -2.421 -16.198 -3.563 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -1.244 -13.371 -1.328 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.529 -15.685 -2.803 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -2.814 -11.889 -0.128 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.073 -14.295 -1.491 1.00 0.00 H new ATOM 0 HH TYR A 54 -6.077 -12.711 0.389 1.00 0.00 H new ATOM 855 N ILE A 55 -0.567 -18.571 -2.460 1.00 0.00 N ATOM 856 CA ILE A 55 -0.015 -19.817 -3.031 1.00 0.00 C ATOM 857 C ILE A 55 -1.158 -20.779 -3.319 1.00 0.00 C ATOM 858 O ILE A 55 -2.097 -20.906 -2.552 1.00 0.00 O ATOM 859 CB ILE A 55 1.085 -20.423 -2.126 1.00 0.00 C ATOM 860 CG1 ILE A 55 2.302 -19.471 -1.939 1.00 0.00 C ATOM 861 CG2 ILE A 55 1.552 -21.814 -2.573 1.00 0.00 C ATOM 862 CD1 ILE A 55 2.807 -19.492 -0.527 1.00 0.00 C ATOM 0 H ILE A 55 -1.203 -18.717 -1.676 1.00 0.00 H new ATOM 0 HA ILE A 55 0.485 -19.599 -3.975 1.00 0.00 H new ATOM 0 HB ILE A 55 0.603 -20.547 -1.156 1.00 0.00 H new ATOM 0 HG12 ILE A 55 3.103 -19.766 -2.617 1.00 0.00 H new ATOM 0 HG13 ILE A 55 2.014 -18.455 -2.208 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.323 -22.175 -1.892 1.00 0.00 H new ATOM 0 HG22 ILE A 55 0.707 -22.502 -2.562 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.959 -21.754 -3.583 1.00 0.00 H new ATOM 0 HD11 ILE A 55 3.657 -18.816 -0.434 1.00 0.00 H new ATOM 0 HD12 ILE A 55 2.013 -19.172 0.148 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.119 -20.504 -0.267 1.00 0.00 H new ATOM 874 N LYS A 56 -1.001 -21.493 -4.422 1.00 0.00 N ATOM 875 CA LYS A 56 -1.794 -22.682 -4.748 1.00 0.00 C ATOM 876 C LYS A 56 -0.856 -23.876 -4.545 1.00 0.00 C ATOM 877 O LYS A 56 0.353 -23.864 -4.801 1.00 0.00 O ATOM 878 CB LYS A 56 -2.322 -22.552 -6.189 1.00 0.00 C ATOM 879 CG LYS A 56 -3.764 -22.997 -6.481 1.00 0.00 C ATOM 880 CD LYS A 56 -4.458 -22.041 -7.496 1.00 0.00 C ATOM 881 CE LYS A 56 -3.682 -21.727 -8.768 1.00 0.00 C ATOM 882 NZ LYS A 56 -4.410 -21.060 -9.845 1.00 0.00 N ATOM 0 H LYS A 56 -0.307 -21.263 -5.134 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.674 -22.808 -4.117 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.231 -21.506 -6.483 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.660 -23.125 -6.838 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -3.760 -24.012 -6.879 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -4.334 -23.021 -5.552 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -5.415 -22.479 -7.779 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -4.675 -21.102 -6.987 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.830 -21.103 -8.499 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.281 -22.662 -9.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.975 -21.299 -10.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -5.401 -21.375 -9.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -4.373 -20.030 -9.703 1.00 0.00 H new ATOM 896 N VAL A 57 -1.494 -24.904 -4.026 1.00 0.00 N ATOM 897 CA VAL A 57 -0.836 -26.121 -3.543 1.00 0.00 C ATOM 898 C VAL A 57 -1.816 -27.268 -3.829 1.00 0.00 C ATOM 899 O VAL A 57 -3.045 -27.148 -3.793 1.00 0.00 O ATOM 900 CB VAL A 57 -0.367 -26.050 -2.046 1.00 0.00 C ATOM 901 CG1 VAL A 57 1.132 -25.742 -2.018 1.00 0.00 C ATOM 902 CG2 VAL A 57 -1.114 -25.064 -1.114 1.00 0.00 C ATOM 0 H VAL A 57 -2.508 -24.927 -3.922 1.00 0.00 H new ATOM 0 HA VAL A 57 0.108 -26.275 -4.066 1.00 0.00 H new ATOM 0 HB VAL A 57 -0.612 -27.029 -1.634 1.00 0.00 H new ATOM 0 HG11 VAL A 57 1.473 -25.689 -0.984 1.00 0.00 H new ATOM 0 HG12 VAL A 57 1.675 -26.530 -2.540 1.00 0.00 H new ATOM 0 HG13 VAL A 57 1.316 -24.787 -2.510 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -0.689 -25.117 -0.112 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -1.010 -24.050 -1.499 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -2.170 -25.330 -1.074 1.00 0.00 H new ATOM 912 N ARG A 58 -1.199 -28.403 -4.143 1.00 0.00 N ATOM 913 CA ARG A 58 -1.896 -29.628 -4.528 1.00 0.00 C ATOM 914 C ARG A 58 -1.766 -30.477 -3.271 1.00 0.00 C ATOM 915 O ARG A 58 -0.794 -31.194 -3.019 1.00 0.00 O ATOM 916 CB ARG A 58 -1.449 -30.324 -5.841 1.00 0.00 C ATOM 917 CG ARG A 58 0.015 -30.768 -5.953 1.00 0.00 C ATOM 918 CD ARG A 58 0.402 -31.148 -7.386 1.00 0.00 C ATOM 919 NE ARG A 58 1.833 -31.508 -7.395 1.00 0.00 N ATOM 920 CZ ARG A 58 2.489 -31.518 -8.550 1.00 0.00 C ATOM 921 NH1 ARG A 58 2.336 -32.525 -9.393 1.00 0.00 N ATOM 922 NH2 ARG A 58 3.320 -30.530 -8.842 1.00 0.00 N ATOM 0 H ARG A 58 -0.184 -28.500 -4.137 1.00 0.00 H new ATOM 0 HA ARG A 58 -2.926 -29.425 -4.822 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -2.077 -31.203 -5.985 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -1.657 -29.645 -6.668 1.00 0.00 H new ATOM 0 HG2 ARG A 58 0.663 -29.964 -5.606 1.00 0.00 H new ATOM 0 HG3 ARG A 58 0.185 -31.621 -5.295 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -0.203 -31.985 -7.734 1.00 0.00 H new ATOM 0 HD3 ARG A 58 0.215 -30.315 -8.064 1.00 0.00 H new ATOM 0 HE ARG A 58 2.312 -31.746 -6.526 1.00 0.00 H new ATOM 0 HH11 ARG A 58 1.713 -33.297 -9.157 1.00 0.00 H new ATOM 0 HH12 ARG A 58 2.841 -32.530 -10.279 1.00 0.00 H new ATOM 0 HH21 ARG A 58 3.455 -29.765 -8.181 1.00 0.00 H new ATOM 0 HH22 ARG A 58 3.826 -30.534 -9.728 1.00 0.00 H new ATOM 936 N ALA A 59 -2.897 -30.493 -2.580 1.00 0.00 N ATOM 937 CA ALA A 59 -3.402 -31.762 -2.065 1.00 0.00 C ATOM 938 C ALA A 59 -3.765 -32.699 -3.267 1.00 0.00 C ATOM 939 O ALA A 59 -3.851 -32.256 -4.425 1.00 0.00 O ATOM 940 CB ALA A 59 -4.547 -31.383 -1.124 1.00 0.00 C ATOM 0 H ALA A 59 -3.467 -29.674 -2.367 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.684 -32.350 -1.493 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.980 -32.287 -0.695 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -4.166 -30.749 -0.324 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -5.312 -30.843 -1.681 1.00 0.00 H new ATOM 946 N GLY A 60 -3.939 -34.002 -3.006 1.00 0.00 N ATOM 947 CA GLY A 60 -4.297 -34.981 -4.073 1.00 0.00 C ATOM 948 C GLY A 60 -5.492 -34.572 -4.979 1.00 0.00 C ATOM 949 O GLY A 60 -6.175 -33.591 -4.696 1.00 0.00 O ATOM 0 H GLY A 60 -3.841 -34.412 -2.077 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -3.423 -35.141 -4.704 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -4.530 -35.936 -3.603 1.00 0.00 H new ATOM 953 N ASP A 61 -5.762 -35.292 -6.068 1.00 0.00 N ATOM 954 CA ASP A 61 -7.006 -35.100 -6.911 1.00 0.00 C ATOM 955 C ASP A 61 -8.383 -34.682 -6.244 1.00 0.00 C ATOM 956 O ASP A 61 -9.205 -34.013 -6.875 1.00 0.00 O ATOM 957 CB ASP A 61 -7.195 -36.379 -7.782 1.00 0.00 C ATOM 958 CG ASP A 61 -7.197 -37.739 -7.031 1.00 0.00 C ATOM 959 OD1 ASP A 61 -7.503 -37.853 -5.838 1.00 0.00 O ATOM 960 OD2 ASP A 61 -6.785 -38.792 -7.784 1.00 0.00 O ATOM 0 H ASP A 61 -5.146 -36.028 -6.413 1.00 0.00 H new ATOM 0 HA ASP A 61 -6.782 -34.190 -7.468 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -8.137 -36.287 -8.322 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -6.401 -36.403 -8.528 1.00 0.00 H new ATOM 966 N ASN A 62 -8.587 -35.078 -4.980 1.00 0.00 N ATOM 967 CA ASN A 62 -9.777 -34.742 -4.152 1.00 0.00 C ATOM 968 C ASN A 62 -9.704 -33.312 -3.493 1.00 0.00 C ATOM 969 O ASN A 62 -10.742 -32.659 -3.361 1.00 0.00 O ATOM 970 CB ASN A 62 -9.992 -35.865 -3.074 1.00 0.00 C ATOM 971 CG ASN A 62 -9.735 -37.339 -3.488 1.00 0.00 C ATOM 972 OD1 ASN A 62 -10.492 -37.939 -4.249 1.00 0.00 O ATOM 973 ND2 ASN A 62 -8.603 -37.895 -3.068 1.00 0.00 N ATOM 0 H ASN A 62 -7.914 -35.659 -4.481 1.00 0.00 H new ATOM 0 HA ASN A 62 -10.639 -34.702 -4.818 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -9.346 -35.640 -2.226 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -11.020 -35.793 -2.719 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -8.351 -38.834 -3.377 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.987 -37.383 -2.437 1.00 0.00 H new ATOM 980 N LYS A 63 -8.506 -32.858 -3.051 1.00 0.00 N ATOM 981 CA LYS A 63 -8.311 -31.584 -2.308 1.00 0.00 C ATOM 982 C LYS A 63 -7.254 -30.713 -3.037 1.00 0.00 C ATOM 983 O LYS A 63 -6.396 -31.177 -3.788 1.00 0.00 O ATOM 984 CB LYS A 63 -7.905 -31.885 -0.827 1.00 0.00 C ATOM 985 CG LYS A 63 -9.077 -32.237 0.103 1.00 0.00 C ATOM 986 CD LYS A 63 -9.596 -33.674 -0.040 1.00 0.00 C ATOM 987 CE LYS A 63 -9.378 -34.609 1.160 1.00 0.00 C ATOM 988 NZ LYS A 63 -8.702 -35.852 0.741 1.00 0.00 N ATOM 0 H LYS A 63 -7.637 -33.370 -3.201 1.00 0.00 H new ATOM 0 HA LYS A 63 -9.245 -31.022 -2.282 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -7.194 -32.711 -0.821 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -7.387 -31.015 -0.423 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.765 -32.078 1.135 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -9.898 -31.547 -0.091 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -10.665 -33.631 -0.248 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -9.120 -34.123 -0.912 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.780 -34.102 1.917 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -10.337 -34.849 1.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -8.565 -36.468 1.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -9.286 -36.344 0.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -7.777 -35.621 0.325 1.00 0.00 H new ATOM 1002 N TYR A 64 -7.303 -29.408 -2.780 1.00 0.00 N ATOM 1003 CA TYR A 64 -6.343 -28.434 -3.353 1.00 0.00 C ATOM 1004 C TYR A 64 -6.378 -27.235 -2.417 1.00 0.00 C ATOM 1005 O TYR A 64 -7.447 -26.687 -2.165 1.00 0.00 O ATOM 1006 CB TYR A 64 -6.805 -27.956 -4.745 1.00 0.00 C ATOM 1007 CG TYR A 64 -6.381 -28.824 -5.922 1.00 0.00 C ATOM 1008 CD1 TYR A 64 -5.044 -28.782 -6.328 1.00 0.00 C ATOM 1009 CD2 TYR A 64 -7.296 -29.638 -6.617 1.00 0.00 C ATOM 1010 CE1 TYR A 64 -4.602 -29.596 -7.367 1.00 0.00 C ATOM 1011 CE2 TYR A 64 -6.855 -30.432 -7.679 1.00 0.00 C ATOM 1012 CZ TYR A 64 -5.500 -30.429 -8.035 1.00 0.00 C ATOM 1013 OH TYR A 64 -5.036 -31.253 -9.024 1.00 0.00 O ATOM 0 H TYR A 64 -8.003 -28.984 -2.171 1.00 0.00 H new ATOM 0 HA TYR A 64 -5.355 -28.883 -3.454 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -7.893 -27.889 -4.742 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -6.424 -26.948 -4.906 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -4.352 -28.116 -5.834 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -8.337 -29.649 -6.330 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -3.562 -29.583 -7.657 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -7.557 -31.046 -8.224 1.00 0.00 H new ATOM 0 HH TYR A 64 -5.781 -31.772 -9.394 1.00 0.00 H new ATOM 1023 N MET A 65 -5.234 -26.779 -1.923 1.00 0.00 N ATOM 1024 CA MET A 65 -5.219 -25.688 -0.930 1.00 0.00 C ATOM 1025 C MET A 65 -4.676 -24.394 -1.525 1.00 0.00 C ATOM 1026 O MET A 65 -3.837 -24.355 -2.425 1.00 0.00 O ATOM 1027 CB MET A 65 -4.557 -26.154 0.388 1.00 0.00 C ATOM 1028 CG MET A 65 -5.618 -26.299 1.496 1.00 0.00 C ATOM 1029 SD MET A 65 -4.955 -27.235 2.853 1.00 0.00 S ATOM 1030 CE MET A 65 -5.118 -28.851 2.107 1.00 0.00 C ATOM 0 H MET A 65 -4.313 -27.134 -2.182 1.00 0.00 H new ATOM 0 HA MET A 65 -6.242 -25.435 -0.651 1.00 0.00 H new ATOM 0 HB2 MET A 65 -4.051 -27.107 0.232 1.00 0.00 H new ATOM 0 HB3 MET A 65 -3.796 -25.436 0.695 1.00 0.00 H new ATOM 0 HG2 MET A 65 -5.932 -25.314 1.842 1.00 0.00 H new ATOM 0 HG3 MET A 65 -6.504 -26.795 1.100 1.00 0.00 H new ATOM 0 HE1 MET A 65 -4.429 -29.545 2.588 1.00 0.00 H new ATOM 0 HE2 MET A 65 -6.140 -29.208 2.233 1.00 0.00 H new ATOM 0 HE3 MET A 65 -4.884 -28.786 1.044 1.00 0.00 H new ATOM 1040 N HIS A 66 -5.203 -23.318 -0.957 1.00 0.00 N ATOM 1041 CA HIS A 66 -4.615 -21.988 -1.077 1.00 0.00 C ATOM 1042 C HIS A 66 -3.955 -21.623 0.262 1.00 0.00 C ATOM 1043 O HIS A 66 -4.316 -22.072 1.358 1.00 0.00 O ATOM 1044 CB HIS A 66 -5.689 -20.958 -1.457 1.00 0.00 C ATOM 1045 CG HIS A 66 -5.986 -20.617 -2.888 1.00 0.00 C ATOM 1046 ND1 HIS A 66 -7.082 -19.857 -3.262 1.00 0.00 N ATOM 1047 CD2 HIS A 66 -5.215 -20.930 -3.991 1.00 0.00 C ATOM 1048 CE1 HIS A 66 -6.858 -19.785 -4.598 1.00 0.00 C ATOM 1049 NE2 HIS A 66 -5.811 -20.454 -5.120 1.00 0.00 N ATOM 0 H HIS A 66 -6.055 -23.342 -0.397 1.00 0.00 H new ATOM 0 HA HIS A 66 -3.863 -21.984 -1.866 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -6.624 -21.299 -1.013 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -5.422 -20.026 -0.959 1.00 0.00 H new ATOM 0 HD1 HIS A 66 -7.837 -19.466 -2.698 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -4.280 -21.471 -3.963 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -7.508 -19.201 -5.233 1.00 0.00 H new ATOM 1058 N LEU A 67 -2.971 -20.751 0.119 1.00 0.00 N ATOM 1059 CA LEU A 67 -2.150 -20.297 1.234 1.00 0.00 C ATOM 1060 C LEU A 67 -1.948 -18.788 1.127 1.00 0.00 C ATOM 1061 O LEU A 67 -1.896 -18.229 0.033 1.00 0.00 O ATOM 1062 CB LEU A 67 -0.797 -21.038 1.178 1.00 0.00 C ATOM 1063 CG LEU A 67 -0.308 -21.376 2.597 1.00 0.00 C ATOM 1064 CD1 LEU A 67 -0.383 -22.893 2.859 1.00 0.00 C ATOM 1065 CD2 LEU A 67 1.062 -20.762 2.838 1.00 0.00 C ATOM 0 H LEU A 67 -2.716 -20.335 -0.777 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.636 -20.512 2.185 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.901 -21.953 0.595 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.057 -20.419 0.670 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.973 -20.927 3.335 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.032 -23.106 3.869 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.415 -23.230 2.755 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.244 -23.418 2.139 1.00 0.00 H new ATOM 0 HD21 LEU A 67 1.399 -21.007 3.845 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.771 -21.159 2.112 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.999 -19.679 2.730 1.00 0.00 H new ATOM 1077 N LYS A 68 -1.790 -18.137 2.280 1.00 0.00 N ATOM 1078 CA LYS A 68 -1.568 -16.682 2.319 1.00 0.00 C ATOM 1079 C LYS A 68 -0.572 -16.337 3.428 1.00 0.00 C ATOM 1080 O LYS A 68 -0.833 -16.563 4.613 1.00 0.00 O ATOM 1081 CB LYS A 68 -2.884 -15.905 2.473 1.00 0.00 C ATOM 1082 CG LYS A 68 -2.932 -14.546 1.826 1.00 0.00 C ATOM 1083 CD LYS A 68 -2.413 -13.360 2.674 1.00 0.00 C ATOM 1084 CE LYS A 68 -3.412 -12.184 2.746 1.00 0.00 C ATOM 1085 NZ LYS A 68 -4.085 -12.076 4.047 1.00 0.00 N ATOM 0 H LYS A 68 -1.811 -18.586 3.196 1.00 0.00 H new ATOM 0 HA LYS A 68 -1.142 -16.375 1.364 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -3.690 -16.511 2.059 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -3.089 -15.786 3.537 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -2.352 -14.586 0.904 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -3.964 -14.338 1.544 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -2.199 -13.709 3.684 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -1.472 -13.005 2.254 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -2.883 -11.253 2.539 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -4.162 -12.305 1.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -4.741 -11.269 4.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -4.615 -12.950 4.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -3.376 -11.932 4.794 1.00 0.00 H new ATOM 1099 N VAL A 69 0.565 -15.771 3.022 1.00 0.00 N ATOM 1100 CA VAL A 69 1.661 -15.449 3.953 1.00 0.00 C ATOM 1101 C VAL A 69 2.028 -13.972 3.703 1.00 0.00 C ATOM 1102 O VAL A 69 2.432 -13.573 2.610 1.00 0.00 O ATOM 1103 CB VAL A 69 2.855 -16.436 3.788 1.00 0.00 C ATOM 1104 CG1 VAL A 69 4.087 -16.068 4.636 1.00 0.00 C ATOM 1105 CG2 VAL A 69 2.449 -17.878 4.142 1.00 0.00 C ATOM 0 H VAL A 69 0.757 -15.523 2.051 1.00 0.00 H new ATOM 0 HA VAL A 69 1.360 -15.571 4.993 1.00 0.00 H new ATOM 0 HB VAL A 69 3.128 -16.360 2.736 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.876 -16.801 4.468 1.00 0.00 H new ATOM 0 HG12 VAL A 69 4.443 -15.079 4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 69 3.814 -16.064 5.691 1.00 0.00 H new ATOM 0 HG21 VAL A 69 3.306 -18.539 4.015 1.00 0.00 H new ATOM 0 HG22 VAL A 69 2.111 -17.917 5.177 1.00 0.00 H new ATOM 0 HG23 VAL A 69 1.642 -18.201 3.484 1.00 0.00 H new ATOM 1115 N PHE A 70 1.970 -13.193 4.784 1.00 0.00 N ATOM 1116 CA PHE A 70 2.538 -11.837 4.807 1.00 0.00 C ATOM 1117 C PHE A 70 4.066 -11.898 5.110 1.00 0.00 C ATOM 1118 O PHE A 70 4.525 -12.571 6.040 1.00 0.00 O ATOM 1119 CB PHE A 70 1.753 -11.006 5.852 1.00 0.00 C ATOM 1120 CG PHE A 70 2.184 -9.536 5.886 1.00 0.00 C ATOM 1121 CD1 PHE A 70 1.800 -8.659 4.855 1.00 0.00 C ATOM 1122 CD2 PHE A 70 3.102 -9.105 6.861 1.00 0.00 C ATOM 1123 CE1 PHE A 70 2.324 -7.365 4.807 1.00 0.00 C ATOM 1124 CE2 PHE A 70 3.622 -7.812 6.809 1.00 0.00 C ATOM 1125 CZ PHE A 70 3.232 -6.940 5.786 1.00 0.00 C ATOM 0 H PHE A 70 1.534 -13.477 5.661 1.00 0.00 H new ATOM 0 HA PHE A 70 2.439 -11.353 3.835 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.688 -11.063 5.629 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.895 -11.445 6.840 1.00 0.00 H new ATOM 0 HD1 PHE A 70 1.100 -8.986 4.101 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.405 -9.776 7.651 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.029 -6.692 4.015 1.00 0.00 H new ATOM 0 HE2 PHE A 70 4.326 -7.483 7.559 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.632 -5.937 5.751 1.00 0.00 H new ATOM 1135 N LYS A 71 4.803 -11.103 4.326 1.00 0.00 N ATOM 1136 CA LYS A 71 6.237 -10.827 4.560 1.00 0.00 C ATOM 1137 C LYS A 71 6.471 -9.299 4.721 1.00 0.00 C ATOM 1138 O LYS A 71 5.864 -8.461 4.044 1.00 0.00 O ATOM 1139 CB LYS A 71 7.073 -11.401 3.387 1.00 0.00 C ATOM 1140 CG LYS A 71 7.628 -12.815 3.662 1.00 0.00 C ATOM 1141 CD LYS A 71 8.990 -13.028 2.984 1.00 0.00 C ATOM 1142 CE LYS A 71 9.419 -14.507 2.932 1.00 0.00 C ATOM 1143 NZ LYS A 71 9.980 -14.831 1.611 1.00 0.00 N ATOM 0 H LYS A 71 4.426 -10.628 3.506 1.00 0.00 H new ATOM 0 HA LYS A 71 6.555 -11.312 5.483 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.454 -11.430 2.490 1.00 0.00 H new ATOM 0 HB3 LYS A 71 7.904 -10.727 3.179 1.00 0.00 H new ATOM 0 HG2 LYS A 71 7.728 -12.965 4.737 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.920 -13.561 3.301 1.00 0.00 H new ATOM 0 HD2 LYS A 71 8.949 -12.633 1.969 1.00 0.00 H new ATOM 0 HD3 LYS A 71 9.748 -12.455 3.519 1.00 0.00 H new ATOM 0 HE2 LYS A 71 10.159 -14.705 3.707 1.00 0.00 H new ATOM 0 HE3 LYS A 71 8.562 -15.148 3.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 10.265 -15.831 1.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.262 -14.660 0.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 10.810 -14.231 1.430 1.00 0.00 H new ATOM 1157 N SER A 72 7.416 -8.981 5.620 1.00 0.00 N ATOM 1158 CA SER A 72 7.875 -7.595 5.892 1.00 0.00 C ATOM 1159 C SER A 72 9.316 -7.447 5.339 1.00 0.00 C ATOM 1160 O SER A 72 9.505 -6.903 4.246 1.00 0.00 O ATOM 1161 CB SER A 72 7.677 -7.290 7.408 1.00 0.00 C ATOM 1162 OG SER A 72 8.492 -6.213 7.863 1.00 0.00 O ATOM 0 H SER A 72 7.893 -9.681 6.188 1.00 0.00 H new ATOM 0 HA SER A 72 7.289 -6.833 5.378 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.630 -7.051 7.593 1.00 0.00 H new ATOM 0 HB3 SER A 72 7.907 -8.184 7.987 1.00 0.00 H new ATOM 0 HG SER A 72 8.330 -6.061 8.817 1.00 0.00 H new ATOM 1168 N LEU A 73 10.313 -7.926 6.105 1.00 0.00 N ATOM 1169 CA LEU A 73 11.742 -7.754 5.782 1.00 0.00 C ATOM 1170 C LEU A 73 12.225 -8.913 4.846 1.00 0.00 C ATOM 1171 O LEU A 73 12.086 -10.083 5.226 1.00 0.00 O ATOM 1172 CB LEU A 73 12.614 -7.617 7.057 1.00 0.00 C ATOM 1173 CG LEU A 73 12.475 -8.736 8.139 1.00 0.00 C ATOM 1174 CD1 LEU A 73 13.814 -9.387 8.547 1.00 0.00 C ATOM 1175 CD2 LEU A 73 11.631 -8.247 9.337 1.00 0.00 C ATOM 0 H LEU A 73 10.150 -8.445 6.968 1.00 0.00 H new ATOM 0 HA LEU A 73 11.862 -6.816 5.240 1.00 0.00 H new ATOM 0 HB2 LEU A 73 13.659 -7.572 6.749 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.379 -6.662 7.526 1.00 0.00 H new ATOM 0 HG LEU A 73 11.926 -9.554 7.674 1.00 0.00 H new ATOM 0 HD11 LEU A 73 13.631 -10.153 9.301 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.279 -9.842 7.672 1.00 0.00 H new ATOM 0 HD13 LEU A 73 14.479 -8.626 8.956 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.550 -9.045 10.075 1.00 0.00 H new ATOM 0 HD22 LEU A 73 12.112 -7.380 9.791 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.635 -7.970 8.991 1.00 0.00 H new ATOM 1187 N PRO A 74 12.807 -8.642 3.639 1.00 0.00 N ATOM 1188 CA PRO A 74 13.410 -9.691 2.786 1.00 0.00 C ATOM 1189 C PRO A 74 14.801 -10.167 3.312 1.00 0.00 C ATOM 1190 O PRO A 74 15.421 -9.536 4.178 1.00 0.00 O ATOM 1191 CB PRO A 74 13.488 -8.971 1.429 1.00 0.00 C ATOM 1192 CG PRO A 74 13.645 -7.479 1.739 1.00 0.00 C ATOM 1193 CD PRO A 74 13.015 -7.279 3.114 1.00 0.00 C ATOM 0 HA PRO A 74 12.841 -10.620 2.753 1.00 0.00 H new ATOM 0 HB2 PRO A 74 14.331 -9.337 0.843 1.00 0.00 H new ATOM 0 HB3 PRO A 74 12.589 -9.153 0.841 1.00 0.00 H new ATOM 0 HG2 PRO A 74 14.695 -7.187 1.743 1.00 0.00 H new ATOM 0 HG3 PRO A 74 13.147 -6.867 0.987 1.00 0.00 H new ATOM 0 HD2 PRO A 74 13.668 -6.700 3.767 1.00 0.00 H new ATOM 0 HD3 PRO A 74 12.073 -6.736 3.042 1.00 0.00 H new ATOM 1201 N GLY A 75 15.257 -11.313 2.786 1.00 0.00 N ATOM 1202 CA GLY A 75 16.464 -11.991 3.329 1.00 0.00 C ATOM 1203 C GLY A 75 16.273 -12.939 4.540 1.00 0.00 C ATOM 1204 O GLY A 75 17.231 -13.626 4.904 1.00 0.00 O ATOM 0 H GLY A 75 14.823 -11.791 1.997 1.00 0.00 H new ATOM 0 HA2 GLY A 75 16.918 -12.565 2.522 1.00 0.00 H new ATOM 0 HA3 GLY A 75 17.181 -11.221 3.615 1.00 0.00 H new ATOM 1208 N GLN A 76 15.075 -12.972 5.156 1.00 0.00 N ATOM 1209 CA GLN A 76 14.764 -13.861 6.288 1.00 0.00 C ATOM 1210 C GLN A 76 13.512 -14.652 5.855 1.00 0.00 C ATOM 1211 O GLN A 76 12.392 -14.124 5.844 1.00 0.00 O ATOM 1212 CB GLN A 76 14.575 -13.001 7.564 1.00 0.00 C ATOM 1213 CG GLN A 76 14.798 -13.757 8.897 1.00 0.00 C ATOM 1214 CD GLN A 76 15.422 -12.856 9.978 1.00 0.00 C ATOM 1215 OE1 GLN A 76 14.729 -12.240 10.787 1.00 0.00 O ATOM 1216 NE2 GLN A 76 16.744 -12.740 9.976 1.00 0.00 N ATOM 0 H GLN A 76 14.293 -12.379 4.879 1.00 0.00 H new ATOM 0 HA GLN A 76 15.555 -14.569 6.536 1.00 0.00 H new ATOM 0 HB2 GLN A 76 15.264 -12.157 7.522 1.00 0.00 H new ATOM 0 HB3 GLN A 76 13.566 -12.589 7.561 1.00 0.00 H new ATOM 0 HG2 GLN A 76 13.845 -14.146 9.256 1.00 0.00 H new ATOM 0 HG3 GLN A 76 15.447 -14.615 8.722 1.00 0.00 H new ATOM 0 HE21 GLN A 76 17.300 -13.259 9.297 1.00 0.00 H new ATOM 0 HE22 GLN A 76 17.204 -12.132 10.654 1.00 0.00 H new ATOM 1225 N ASN A 77 13.722 -15.944 5.520 1.00 0.00 N ATOM 1226 CA ASN A 77 12.606 -16.919 5.363 1.00 0.00 C ATOM 1227 C ASN A 77 11.741 -17.044 6.651 1.00 0.00 C ATOM 1228 O ASN A 77 10.523 -17.012 6.504 1.00 0.00 O ATOM 1229 CB ASN A 77 13.121 -18.303 4.871 1.00 0.00 C ATOM 1230 CG ASN A 77 12.026 -19.398 4.742 1.00 0.00 C ATOM 1231 OD1 ASN A 77 11.273 -19.449 3.770 1.00 0.00 O ATOM 1232 ND2 ASN A 77 11.872 -20.229 5.766 1.00 0.00 N ATOM 0 H ASN A 77 14.647 -16.340 5.353 1.00 0.00 H new ATOM 0 HA ASN A 77 11.948 -16.523 4.589 1.00 0.00 H new ATOM 0 HB2 ASN A 77 13.600 -18.172 3.901 1.00 0.00 H new ATOM 0 HB3 ASN A 77 13.888 -18.656 5.561 1.00 0.00 H new ATOM 0 HD21 ASN A 77 11.122 -20.921 5.753 1.00 0.00 H new ATOM 0 HD22 ASN A 77 12.503 -20.176 6.565 1.00 0.00 H new ATOM 1239 N GLU A 78 12.332 -17.162 7.865 1.00 0.00 N ATOM 1240 CA GLU A 78 11.562 -17.153 9.140 1.00 0.00 C ATOM 1241 C GLU A 78 10.593 -15.951 9.409 1.00 0.00 C ATOM 1242 O GLU A 78 9.664 -16.103 10.208 1.00 0.00 O ATOM 1243 CB GLU A 78 12.544 -17.316 10.342 1.00 0.00 C ATOM 1244 CG GLU A 78 12.121 -18.445 11.312 1.00 0.00 C ATOM 1245 CD GLU A 78 12.686 -19.819 10.904 1.00 0.00 C ATOM 1246 OE1 GLU A 78 12.990 -20.117 9.742 1.00 0.00 O ATOM 1247 OE2 GLU A 78 12.823 -20.682 11.948 1.00 0.00 O ATOM 0 H GLU A 78 13.339 -17.265 7.991 1.00 0.00 H new ATOM 0 HA GLU A 78 10.882 -17.998 9.030 1.00 0.00 H new ATOM 0 HB2 GLU A 78 13.544 -17.525 9.963 1.00 0.00 H new ATOM 0 HB3 GLU A 78 12.601 -16.375 10.889 1.00 0.00 H new ATOM 0 HG2 GLU A 78 12.461 -18.201 12.318 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.033 -18.500 11.348 1.00 0.00 H new ATOM 1255 N ASP A 79 10.787 -14.793 8.738 1.00 0.00 N ATOM 1256 CA ASP A 79 9.792 -13.695 8.706 1.00 0.00 C ATOM 1257 C ASP A 79 8.439 -13.938 7.963 1.00 0.00 C ATOM 1258 O ASP A 79 7.504 -13.152 8.144 1.00 0.00 O ATOM 1259 CB ASP A 79 10.474 -12.453 8.083 1.00 0.00 C ATOM 1260 CG ASP A 79 9.930 -11.184 8.712 1.00 0.00 C ATOM 1261 OD1 ASP A 79 9.074 -10.473 8.168 1.00 0.00 O ATOM 1262 OD2 ASP A 79 10.434 -10.945 9.952 1.00 0.00 O ATOM 0 H ASP A 79 11.634 -14.593 8.205 1.00 0.00 H new ATOM 0 HA ASP A 79 9.493 -13.581 9.748 1.00 0.00 H new ATOM 0 HB2 ASP A 79 11.552 -12.508 8.233 1.00 0.00 H new ATOM 0 HB3 ASP A 79 10.302 -12.436 7.007 1.00 0.00 H new ATOM 1268 N LEU A 80 8.332 -15.013 7.159 1.00 0.00 N ATOM 1269 CA LEU A 80 7.059 -15.496 6.593 1.00 0.00 C ATOM 1270 C LEU A 80 6.073 -15.836 7.761 1.00 0.00 C ATOM 1271 O LEU A 80 6.390 -16.634 8.651 1.00 0.00 O ATOM 1272 CB LEU A 80 7.397 -16.681 5.613 1.00 0.00 C ATOM 1273 CG LEU A 80 7.171 -18.149 6.101 1.00 0.00 C ATOM 1274 CD1 LEU A 80 7.193 -19.170 4.953 1.00 0.00 C ATOM 1275 CD2 LEU A 80 8.123 -18.586 7.239 1.00 0.00 C ATOM 0 H LEU A 80 9.136 -15.576 6.882 1.00 0.00 H new ATOM 0 HA LEU A 80 6.535 -14.746 6.000 1.00 0.00 H new ATOM 0 HB2 LEU A 80 6.807 -16.539 4.708 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.445 -16.585 5.328 1.00 0.00 H new ATOM 0 HG LEU A 80 6.165 -18.139 6.521 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.031 -20.171 5.353 1.00 0.00 H new ATOM 0 HD12 LEU A 80 6.404 -18.932 4.239 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.160 -19.132 4.451 1.00 0.00 H new ATOM 0 HD21 LEU A 80 7.903 -19.616 7.522 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.155 -18.516 6.897 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.982 -17.935 8.102 1.00 0.00 H new ATOM 1287 N VAL A 81 4.917 -15.179 7.783 1.00 0.00 N ATOM 1288 CA VAL A 81 3.863 -15.482 8.781 1.00 0.00 C ATOM 1289 C VAL A 81 2.600 -15.782 7.964 1.00 0.00 C ATOM 1290 O VAL A 81 2.166 -14.976 7.138 1.00 0.00 O ATOM 1291 CB VAL A 81 3.671 -14.340 9.833 1.00 0.00 C ATOM 1292 CG1 VAL A 81 2.458 -14.593 10.772 1.00 0.00 C ATOM 1293 CG2 VAL A 81 4.950 -14.142 10.680 1.00 0.00 C ATOM 0 H VAL A 81 4.675 -14.434 7.130 1.00 0.00 H new ATOM 0 HA VAL A 81 4.136 -16.338 9.399 1.00 0.00 H new ATOM 0 HB VAL A 81 3.470 -13.432 9.264 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.370 -13.771 11.482 1.00 0.00 H new ATOM 0 HG12 VAL A 81 1.546 -14.659 10.179 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.606 -15.527 11.314 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.788 -13.342 11.403 1.00 0.00 H new ATOM 0 HG22 VAL A 81 5.183 -15.066 11.208 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.782 -13.878 10.027 1.00 0.00 H new ATOM 1303 N LEU A 82 1.957 -16.905 8.314 1.00 0.00 N ATOM 1304 CA LEU A 82 0.583 -17.195 7.878 1.00 0.00 C ATOM 1305 C LEU A 82 -0.412 -16.144 8.480 1.00 0.00 C ATOM 1306 O LEU A 82 -0.659 -16.113 9.690 1.00 0.00 O ATOM 1307 CB LEU A 82 0.264 -18.681 8.239 1.00 0.00 C ATOM 1308 CG LEU A 82 -1.239 -19.055 8.217 1.00 0.00 C ATOM 1309 CD1 LEU A 82 -1.805 -18.766 6.830 1.00 0.00 C ATOM 1310 CD2 LEU A 82 -1.602 -20.463 8.708 1.00 0.00 C ATOM 0 H LEU A 82 2.369 -17.631 8.901 1.00 0.00 H new ATOM 0 HA LEU A 82 0.470 -17.096 6.798 1.00 0.00 H new ATOM 0 HB2 LEU A 82 0.794 -19.330 7.542 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.660 -18.890 9.233 1.00 0.00 H new ATOM 0 HG LEU A 82 -1.712 -18.421 8.967 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -2.863 -19.027 6.807 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -1.688 -17.706 6.603 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -1.269 -19.358 6.088 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.681 -20.604 8.644 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.102 -21.205 8.086 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.281 -20.581 9.743 1.00 0.00 H new ATOM 1322 N THR A 83 -0.975 -15.329 7.579 1.00 0.00 N ATOM 1323 CA THR A 83 -2.068 -14.356 7.900 1.00 0.00 C ATOM 1324 C THR A 83 -3.463 -14.713 7.273 1.00 0.00 C ATOM 1325 O THR A 83 -4.490 -14.331 7.840 1.00 0.00 O ATOM 1326 CB THR A 83 -1.631 -12.908 7.533 1.00 0.00 C ATOM 1327 OG1 THR A 83 -1.314 -12.804 6.145 1.00 0.00 O ATOM 1328 CG2 THR A 83 -0.431 -12.409 8.362 1.00 0.00 C ATOM 0 H THR A 83 -0.696 -15.313 6.598 1.00 0.00 H new ATOM 0 HA THR A 83 -2.223 -14.424 8.977 1.00 0.00 H new ATOM 0 HB THR A 83 -2.486 -12.274 7.769 1.00 0.00 H new ATOM 0 HG1 THR A 83 -1.357 -11.865 5.869 1.00 0.00 H new ATOM 0 HG21 THR A 83 -0.176 -11.394 8.058 1.00 0.00 H new ATOM 0 HG22 THR A 83 -0.692 -12.416 9.420 1.00 0.00 H new ATOM 0 HG23 THR A 83 0.424 -13.064 8.195 1.00 0.00 H new ATOM 1336 N GLY A 84 -3.498 -15.418 6.130 1.00 0.00 N ATOM 1337 CA GLY A 84 -4.736 -15.959 5.523 1.00 0.00 C ATOM 1338 C GLY A 84 -4.469 -17.334 4.866 1.00 0.00 C ATOM 1339 O GLY A 84 -3.332 -17.769 4.692 1.00 0.00 O ATOM 0 H GLY A 84 -2.659 -15.634 5.591 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -5.507 -16.059 6.287 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -5.115 -15.261 4.776 1.00 0.00 H new ATOM 1343 N TYR A 85 -5.511 -18.067 4.504 1.00 0.00 N ATOM 1344 CA TYR A 85 -5.364 -19.485 4.058 1.00 0.00 C ATOM 1345 C TYR A 85 -6.752 -19.907 3.562 1.00 0.00 C ATOM 1346 O TYR A 85 -7.756 -19.768 4.272 1.00 0.00 O ATOM 1347 CB TYR A 85 -4.829 -20.494 5.119 1.00 0.00 C ATOM 1348 CG TYR A 85 -5.480 -20.374 6.522 1.00 0.00 C ATOM 1349 CD1 TYR A 85 -5.134 -19.336 7.413 1.00 0.00 C ATOM 1350 CD2 TYR A 85 -6.581 -21.183 6.830 1.00 0.00 C ATOM 1351 CE1 TYR A 85 -5.855 -19.126 8.579 1.00 0.00 C ATOM 1352 CE2 TYR A 85 -7.267 -21.018 8.032 1.00 0.00 C ATOM 1353 CZ TYR A 85 -6.908 -19.981 8.902 1.00 0.00 C ATOM 1354 OH TYR A 85 -7.605 -19.785 10.059 1.00 0.00 O ATOM 0 H TYR A 85 -6.472 -17.725 4.503 1.00 0.00 H new ATOM 0 HA TYR A 85 -4.591 -19.516 3.290 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.986 -21.507 4.747 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -3.753 -20.355 5.221 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -4.295 -18.696 7.184 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.901 -21.941 6.130 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -5.602 -18.305 9.233 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -8.073 -21.688 8.292 1.00 0.00 H new ATOM 0 HH TYR A 85 -8.307 -20.464 10.137 1.00 0.00 H new ATOM 1364 N GLN A 86 -6.788 -20.419 2.332 1.00 0.00 N ATOM 1365 CA GLN A 86 -8.036 -20.933 1.732 1.00 0.00 C ATOM 1366 C GLN A 86 -7.965 -22.469 1.702 1.00 0.00 C ATOM 1367 O GLN A 86 -6.921 -23.117 1.843 1.00 0.00 O ATOM 1368 CB GLN A 86 -8.317 -20.300 0.342 1.00 0.00 C ATOM 1369 CG GLN A 86 -9.518 -19.370 0.229 1.00 0.00 C ATOM 1370 CD GLN A 86 -10.833 -20.082 -0.054 1.00 0.00 C ATOM 1371 OE1 GLN A 86 -11.408 -20.748 0.806 1.00 0.00 O ATOM 1372 NE2 GLN A 86 -11.311 -19.954 -1.276 1.00 0.00 N ATOM 0 H GLN A 86 -5.971 -20.492 1.725 1.00 0.00 H new ATOM 0 HA GLN A 86 -8.890 -20.641 2.343 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -7.430 -19.744 0.039 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -8.448 -21.109 -0.377 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -9.615 -18.806 1.157 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -9.331 -18.647 -0.565 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -10.808 -19.394 -1.964 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -12.184 -20.415 -1.533 1.00 0.00 H new ATOM 1381 N VAL A 87 -9.161 -23.032 1.549 1.00 0.00 N ATOM 1382 CA VAL A 87 -9.403 -24.466 1.780 1.00 0.00 C ATOM 1383 C VAL A 87 -9.079 -25.324 0.511 1.00 0.00 C ATOM 1384 O VAL A 87 -8.518 -24.844 -0.478 1.00 0.00 O ATOM 1385 CB VAL A 87 -10.869 -24.578 2.381 1.00 0.00 C ATOM 1386 CG1 VAL A 87 -11.997 -24.772 1.324 1.00 0.00 C ATOM 1387 CG2 VAL A 87 -10.898 -25.666 3.486 1.00 0.00 C ATOM 0 H VAL A 87 -9.992 -22.514 1.262 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.721 -24.905 2.508 1.00 0.00 H new ATOM 0 HB VAL A 87 -11.100 -23.609 2.823 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -12.961 -24.838 1.829 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -12.003 -23.924 0.639 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -11.817 -25.690 0.764 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -11.905 -25.741 3.897 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -10.608 -26.626 3.059 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -10.201 -25.397 4.280 1.00 0.00 H new ATOM 1397 N ASP A 88 -9.522 -26.585 0.605 1.00 0.00 N ATOM 1398 CA ASP A 88 -9.709 -27.593 -0.482 1.00 0.00 C ATOM 1399 C ASP A 88 -10.248 -27.213 -1.911 1.00 0.00 C ATOM 1400 O ASP A 88 -10.355 -28.099 -2.766 1.00 0.00 O ATOM 1401 CB ASP A 88 -10.639 -28.677 0.146 1.00 0.00 C ATOM 1402 CG ASP A 88 -10.048 -29.416 1.376 1.00 0.00 C ATOM 1403 OD1 ASP A 88 -8.877 -29.285 1.755 1.00 0.00 O ATOM 1404 OD2 ASP A 88 -10.926 -30.265 1.974 1.00 0.00 O ATOM 0 H ASP A 88 -9.784 -26.972 1.512 1.00 0.00 H new ATOM 0 HA ASP A 88 -8.692 -27.870 -0.760 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -11.576 -28.204 0.441 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -10.881 -29.414 -0.620 1.00 0.00 H new ATOM 1410 N LYS A 89 -10.476 -25.920 -2.202 1.00 0.00 N ATOM 1411 CA LYS A 89 -10.747 -25.408 -3.559 1.00 0.00 C ATOM 1412 C LYS A 89 -9.608 -25.620 -4.568 1.00 0.00 C ATOM 1413 O LYS A 89 -8.429 -25.404 -4.275 1.00 0.00 O ATOM 1414 CB LYS A 89 -11.032 -23.882 -3.491 1.00 0.00 C ATOM 1415 CG LYS A 89 -12.395 -23.566 -4.118 1.00 0.00 C ATOM 1416 CD LYS A 89 -12.853 -22.121 -3.853 1.00 0.00 C ATOM 1417 CE LYS A 89 -14.187 -22.036 -3.100 1.00 0.00 C ATOM 1418 NZ LYS A 89 -14.017 -22.375 -1.672 1.00 0.00 N ATOM 0 H LYS A 89 -10.477 -25.189 -1.490 1.00 0.00 H new ATOM 0 HA LYS A 89 -11.603 -25.982 -3.913 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -11.015 -23.548 -2.454 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -10.248 -23.335 -4.015 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -12.343 -23.734 -5.194 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -13.140 -24.257 -3.723 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -12.085 -21.604 -3.278 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -12.946 -21.597 -4.804 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -14.596 -21.030 -3.191 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -14.908 -22.715 -3.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -14.894 -22.800 -1.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -13.235 -23.052 -1.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -13.802 -21.512 -1.133 1.00 0.00 H new ATOM 1432 N ASN A 90 -10.034 -25.961 -5.788 1.00 0.00 N ATOM 1433 CA ASN A 90 -9.144 -26.449 -6.865 1.00 0.00 C ATOM 1434 C ASN A 90 -8.070 -25.417 -7.276 1.00 0.00 C ATOM 1435 O ASN A 90 -8.109 -24.236 -6.904 1.00 0.00 O ATOM 1436 CB ASN A 90 -9.949 -27.052 -8.056 1.00 0.00 C ATOM 1437 CG ASN A 90 -11.115 -27.990 -7.661 1.00 0.00 C ATOM 1438 OD1 ASN A 90 -10.931 -29.016 -7.005 1.00 0.00 O ATOM 1439 ND2 ASN A 90 -12.333 -27.584 -7.971 1.00 0.00 N ATOM 0 H ASN A 90 -11.014 -25.908 -6.066 1.00 0.00 H new ATOM 0 HA ASN A 90 -8.569 -27.279 -6.454 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -10.350 -26.233 -8.653 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -9.261 -27.605 -8.695 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -13.143 -28.123 -7.666 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -12.463 -26.731 -8.515 1.00 0.00 H new ATOM 1446 N LYS A 91 -7.118 -25.878 -8.093 1.00 0.00 N ATOM 1447 CA LYS A 91 -6.250 -24.963 -8.857 1.00 0.00 C ATOM 1448 C LYS A 91 -6.991 -23.915 -9.753 1.00 0.00 C ATOM 1449 O LYS A 91 -6.481 -22.817 -9.932 1.00 0.00 O ATOM 1450 CB LYS A 91 -5.256 -25.785 -9.693 1.00 0.00 C ATOM 1451 CG LYS A 91 -3.919 -25.063 -9.848 1.00 0.00 C ATOM 1452 CD LYS A 91 -2.880 -25.950 -10.521 1.00 0.00 C ATOM 1453 CE LYS A 91 -1.723 -25.144 -11.144 1.00 0.00 C ATOM 1454 NZ LYS A 91 -1.942 -24.930 -12.571 1.00 0.00 N ATOM 0 H LYS A 91 -6.926 -26.868 -8.245 1.00 0.00 H new ATOM 0 HA LYS A 91 -5.733 -24.358 -8.112 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -5.094 -26.753 -9.219 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -5.681 -25.979 -10.678 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -4.060 -24.156 -10.436 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -3.555 -24.754 -8.868 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -2.477 -26.650 -9.789 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -3.363 -26.544 -11.297 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -1.632 -24.183 -10.639 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.783 -25.674 -10.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -1.197 -25.413 -13.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -2.870 -25.313 -12.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -1.915 -23.911 -12.777 1.00 0.00 H new ATOM 1468 N ASP A 92 -8.207 -24.189 -10.265 1.00 0.00 N ATOM 1469 CA ASP A 92 -9.075 -23.144 -10.864 1.00 0.00 C ATOM 1470 C ASP A 92 -9.407 -21.892 -9.998 1.00 0.00 C ATOM 1471 O ASP A 92 -9.606 -20.819 -10.579 1.00 0.00 O ATOM 1472 CB ASP A 92 -10.391 -23.796 -11.367 1.00 0.00 C ATOM 1473 CG ASP A 92 -10.762 -23.326 -12.782 1.00 0.00 C ATOM 1474 OD1 ASP A 92 -9.924 -23.127 -13.671 1.00 0.00 O ATOM 1475 OD2 ASP A 92 -12.098 -23.160 -12.974 1.00 0.00 O ATOM 0 H ASP A 92 -8.615 -25.124 -10.278 1.00 0.00 H new ATOM 0 HA ASP A 92 -8.469 -22.736 -11.673 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -10.283 -24.881 -11.362 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -11.202 -23.553 -10.680 1.00 0.00 H new ATOM 1481 N ASP A 93 -9.424 -22.013 -8.644 1.00 0.00 N ATOM 1482 CA ASP A 93 -9.504 -20.862 -7.725 1.00 0.00 C ATOM 1483 C ASP A 93 -8.346 -19.870 -8.003 1.00 0.00 C ATOM 1484 O ASP A 93 -7.166 -20.191 -7.820 1.00 0.00 O ATOM 1485 CB ASP A 93 -9.492 -21.349 -6.247 1.00 0.00 C ATOM 1486 CG ASP A 93 -10.110 -20.329 -5.267 1.00 0.00 C ATOM 1487 OD1 ASP A 93 -10.697 -19.298 -5.620 1.00 0.00 O ATOM 1488 OD2 ASP A 93 -9.933 -20.660 -3.962 1.00 0.00 O ATOM 0 H ASP A 93 -9.382 -22.913 -8.166 1.00 0.00 H new ATOM 0 HA ASP A 93 -10.443 -20.336 -7.896 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -10.039 -22.289 -6.176 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -8.464 -21.555 -5.947 1.00 0.00 H new ATOM 1494 N GLU A 94 -8.721 -18.685 -8.508 1.00 0.00 N ATOM 1495 CA GLU A 94 -7.751 -17.620 -8.798 1.00 0.00 C ATOM 1496 C GLU A 94 -7.436 -16.905 -7.464 1.00 0.00 C ATOM 1497 O GLU A 94 -8.324 -16.569 -6.670 1.00 0.00 O ATOM 1498 CB GLU A 94 -8.320 -16.635 -9.850 1.00 0.00 C ATOM 1499 CG GLU A 94 -7.199 -15.876 -10.600 1.00 0.00 C ATOM 1500 CD GLU A 94 -7.631 -14.551 -11.217 1.00 0.00 C ATOM 1501 OE1 GLU A 94 -7.693 -14.371 -12.440 1.00 0.00 O ATOM 1502 OE2 GLU A 94 -7.919 -13.582 -10.304 1.00 0.00 O ATOM 0 H GLU A 94 -9.688 -18.441 -8.723 1.00 0.00 H new ATOM 0 HA GLU A 94 -6.836 -18.035 -9.221 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.929 -17.184 -10.568 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -8.976 -15.918 -9.357 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -6.379 -15.688 -9.907 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -6.809 -16.519 -11.389 1.00 0.00 H new ATOM 1510 N LEU A 95 -6.141 -16.687 -7.250 1.00 0.00 N ATOM 1511 CA LEU A 95 -5.635 -16.048 -6.017 1.00 0.00 C ATOM 1512 C LEU A 95 -5.808 -14.521 -6.188 1.00 0.00 C ATOM 1513 O LEU A 95 -5.070 -13.914 -6.964 1.00 0.00 O ATOM 1514 CB LEU A 95 -4.150 -16.415 -5.776 1.00 0.00 C ATOM 1515 CG LEU A 95 -3.749 -17.904 -5.965 1.00 0.00 C ATOM 1516 CD1 LEU A 95 -2.850 -18.134 -7.184 1.00 0.00 C ATOM 1517 CD2 LEU A 95 -3.113 -18.520 -4.732 1.00 0.00 C ATOM 0 H LEU A 95 -5.410 -16.942 -7.914 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.191 -16.399 -5.148 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.539 -15.812 -6.448 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.890 -16.121 -4.759 1.00 0.00 H new ATOM 0 HG LEU A 95 -4.696 -18.414 -6.140 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -2.605 -19.193 -7.261 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -3.372 -17.816 -8.086 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.932 -17.557 -7.073 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.858 -19.560 -4.935 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.209 -17.969 -4.475 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -3.815 -18.474 -3.899 1.00 0.00 H new ATOM 1529 N THR A 96 -6.842 -13.950 -5.557 1.00 0.00 N ATOM 1530 CA THR A 96 -7.334 -12.577 -5.892 1.00 0.00 C ATOM 1531 C THR A 96 -7.696 -11.844 -4.586 1.00 0.00 C ATOM 1532 O THR A 96 -8.878 -11.806 -4.222 1.00 0.00 O ATOM 1533 CB THR A 96 -8.521 -12.579 -6.916 1.00 0.00 C ATOM 1534 OG1 THR A 96 -9.085 -11.267 -6.989 1.00 0.00 O ATOM 1535 CG2 THR A 96 -9.648 -13.606 -6.643 1.00 0.00 C ATOM 0 H THR A 96 -7.365 -14.406 -4.809 1.00 0.00 H new ATOM 0 HA THR A 96 -6.531 -12.041 -6.398 1.00 0.00 H new ATOM 0 HB THR A 96 -8.078 -12.890 -7.862 1.00 0.00 H new ATOM 0 HG1 THR A 96 -9.827 -11.265 -7.630 1.00 0.00 H new ATOM 0 HG21 THR A 96 -10.415 -13.518 -7.413 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.233 -14.614 -6.657 1.00 0.00 H new ATOM 0 HG23 THR A 96 -10.090 -13.410 -5.666 1.00 0.00 H new ATOM 1543 N GLY A 97 -6.703 -11.278 -3.868 1.00 0.00 N ATOM 1544 CA GLY A 97 -6.940 -10.696 -2.514 1.00 0.00 C ATOM 1545 C GLY A 97 -7.894 -11.452 -1.524 1.00 0.00 C ATOM 1546 O GLY A 97 -8.559 -10.818 -0.704 1.00 0.00 O ATOM 0 H GLY A 97 -5.738 -11.208 -4.191 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -5.971 -10.592 -2.025 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -7.337 -9.690 -2.652 1.00 0.00 H new ATOM 1550 N PHE A 98 -7.928 -12.803 -1.628 1.00 0.00 N ATOM 1551 CA PHE A 98 -8.737 -13.731 -0.808 1.00 0.00 C ATOM 1552 C PHE A 98 -8.416 -13.504 0.710 1.00 0.00 C ATOM 1553 O PHE A 98 -9.327 -13.096 1.459 1.00 0.00 O ATOM 1554 CB PHE A 98 -8.613 -15.217 -1.410 1.00 0.00 C ATOM 1555 CG PHE A 98 -7.826 -16.284 -0.607 1.00 0.00 C ATOM 1556 CD1 PHE A 98 -8.207 -16.531 0.722 1.00 0.00 C ATOM 1557 CD2 PHE A 98 -6.625 -16.852 -1.082 1.00 0.00 C ATOM 1558 CE1 PHE A 98 -7.317 -17.119 1.610 1.00 0.00 C ATOM 1559 CE2 PHE A 98 -5.719 -17.424 -0.185 1.00 0.00 C ATOM 1560 CZ PHE A 98 -6.060 -17.530 1.157 1.00 0.00 C ATOM 1561 OXT PHE A 98 -7.263 -13.736 1.147 1.00 0.00 O ATOM 0 H PHE A 98 -7.364 -13.296 -2.320 1.00 0.00 H new ATOM 0 HA PHE A 98 -9.808 -13.535 -0.859 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -9.623 -15.597 -1.562 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -8.151 -15.137 -2.394 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -9.198 -16.262 1.055 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -6.406 -16.845 -2.139 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -7.594 -17.258 2.645 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -4.761 -17.781 -0.533 1.00 0.00 H new ATOM 0 HZ PHE A 98 -5.346 -17.935 1.859 1.00 0.00 H new TER 1571 PHE A 98 ATOM 1572 N MET B 1 3.230 3.834 -13.479 1.00 0.00 N ATOM 1573 CA MET B 1 3.373 3.257 -14.840 1.00 0.00 C ATOM 1574 C MET B 1 2.530 1.966 -15.033 1.00 0.00 C ATOM 1575 O MET B 1 1.773 1.852 -16.002 1.00 0.00 O ATOM 1576 CB MET B 1 4.867 2.997 -15.191 1.00 0.00 C ATOM 1577 CG MET B 1 5.161 3.183 -16.684 1.00 0.00 C ATOM 1578 SD MET B 1 6.547 2.124 -17.146 1.00 0.00 S ATOM 1579 CE MET B 1 7.505 3.214 -18.212 1.00 0.00 C ATOM 0 H1 MET B 1 3.812 4.693 -13.403 1.00 0.00 H new ATOM 0 H2 MET B 1 2.233 4.075 -13.307 1.00 0.00 H new ATOM 0 H3 MET B 1 3.545 3.139 -12.772 1.00 0.00 H new ATOM 0 HA MET B 1 2.981 4.002 -15.533 1.00 0.00 H new ATOM 0 HB2 MET B 1 5.496 3.674 -14.613 1.00 0.00 H new ATOM 0 HB3 MET B 1 5.135 1.983 -14.895 1.00 0.00 H new ATOM 0 HG2 MET B 1 4.281 2.931 -17.275 1.00 0.00 H new ATOM 0 HG3 MET B 1 5.398 4.226 -16.894 1.00 0.00 H new ATOM 0 HE1 MET B 1 8.390 2.688 -18.569 1.00 0.00 H new ATOM 0 HE2 MET B 1 6.896 3.518 -19.063 1.00 0.00 H new ATOM 0 HE3 MET B 1 7.809 4.097 -17.650 1.00 0.00 H new ATOM 1590 N ILE B 2 2.725 0.993 -14.123 1.00 0.00 N ATOM 1591 CA ILE B 2 2.010 -0.299 -14.115 1.00 0.00 C ATOM 1592 C ILE B 2 0.796 -0.176 -13.130 1.00 0.00 C ATOM 1593 O ILE B 2 0.989 0.312 -12.007 1.00 0.00 O ATOM 1594 CB ILE B 2 3.010 -1.464 -13.759 1.00 0.00 C ATOM 1595 CG1 ILE B 2 2.380 -2.859 -14.054 1.00 0.00 C ATOM 1596 CG2 ILE B 2 3.614 -1.386 -12.326 1.00 0.00 C ATOM 1597 CD1 ILE B 2 3.256 -4.091 -13.791 1.00 0.00 C ATOM 0 H ILE B 2 3.395 1.083 -13.359 1.00 0.00 H new ATOM 0 HA ILE B 2 1.611 -0.547 -15.098 1.00 0.00 H new ATOM 0 HB ILE B 2 3.864 -1.325 -14.422 1.00 0.00 H new ATOM 0 HG12 ILE B 2 1.474 -2.954 -13.456 1.00 0.00 H new ATOM 0 HG13 ILE B 2 2.075 -2.878 -15.100 1.00 0.00 H new ATOM 0 HG21 ILE B 2 4.290 -2.227 -12.170 1.00 0.00 H new ATOM 0 HG22 ILE B 2 4.165 -0.452 -12.214 1.00 0.00 H new ATOM 0 HG23 ILE B 2 2.811 -1.424 -11.590 1.00 0.00 H new ATOM 0 HD11 ILE B 2 2.697 -4.994 -14.037 1.00 0.00 H new ATOM 0 HD12 ILE B 2 4.152 -4.039 -14.409 1.00 0.00 H new ATOM 0 HD13 ILE B 2 3.542 -4.116 -12.739 1.00 0.00 H new ATOM 1609 N PRO B 3 -0.440 -0.661 -13.457 1.00 0.00 N ATOM 1610 CA PRO B 3 -1.501 -0.842 -12.440 1.00 0.00 C ATOM 1611 C PRO B 3 -1.129 -1.953 -11.411 1.00 0.00 C ATOM 1612 O PRO B 3 -0.340 -2.862 -11.703 1.00 0.00 O ATOM 1613 CB PRO B 3 -2.726 -1.173 -13.316 1.00 0.00 C ATOM 1614 CG PRO B 3 -2.202 -1.780 -14.621 1.00 0.00 C ATOM 1615 CD PRO B 3 -0.766 -1.284 -14.757 1.00 0.00 C ATOM 0 HA PRO B 3 -1.674 0.023 -11.800 1.00 0.00 H new ATOM 0 HB2 PRO B 3 -3.386 -1.873 -12.804 1.00 0.00 H new ATOM 0 HB3 PRO B 3 -3.309 -0.274 -13.517 1.00 0.00 H new ATOM 0 HG2 PRO B 3 -2.239 -2.869 -14.589 1.00 0.00 H new ATOM 0 HG3 PRO B 3 -2.808 -1.465 -15.471 1.00 0.00 H new ATOM 0 HD2 PRO B 3 -0.086 -2.106 -14.980 1.00 0.00 H new ATOM 0 HD3 PRO B 3 -0.674 -0.565 -15.571 1.00 0.00 H new ATOM 1623 N GLY B 4 -1.753 -1.905 -10.219 1.00 0.00 N ATOM 1624 CA GLY B 4 -1.722 -3.050 -9.280 1.00 0.00 C ATOM 1625 C GLY B 4 -2.290 -4.358 -9.882 1.00 0.00 C ATOM 1626 O GLY B 4 -2.753 -4.418 -11.030 1.00 0.00 O ATOM 0 H GLY B 4 -2.279 -1.098 -9.883 1.00 0.00 H new ATOM 0 HA2 GLY B 4 -0.693 -3.222 -8.963 1.00 0.00 H new ATOM 0 HA3 GLY B 4 -2.292 -2.793 -8.387 1.00 0.00 H new ATOM 1630 N GLY B 5 -2.182 -5.422 -9.103 1.00 0.00 N ATOM 1631 CA GLY B 5 -2.374 -6.771 -9.646 1.00 0.00 C ATOM 1632 C GLY B 5 -1.284 -7.679 -9.121 1.00 0.00 C ATOM 1633 O GLY B 5 -0.148 -7.289 -8.811 1.00 0.00 O ATOM 0 H GLY B 5 -1.966 -5.388 -8.107 1.00 0.00 H new ATOM 0 HA2 GLY B 5 -3.353 -7.155 -9.360 1.00 0.00 H new ATOM 0 HA3 GLY B 5 -2.348 -6.744 -10.735 1.00 0.00 H new ATOM 1637 N LEU B 6 -1.661 -8.950 -9.106 1.00 0.00 N ATOM 1638 CA LEU B 6 -0.756 -10.005 -8.655 1.00 0.00 C ATOM 1639 C LEU B 6 0.408 -10.235 -9.646 1.00 0.00 C ATOM 1640 O LEU B 6 0.243 -10.123 -10.868 1.00 0.00 O ATOM 1641 CB LEU B 6 -1.566 -11.293 -8.447 1.00 0.00 C ATOM 1642 CG LEU B 6 -2.491 -11.328 -7.206 1.00 0.00 C ATOM 1643 CD1 LEU B 6 -3.969 -11.271 -7.601 1.00 0.00 C ATOM 1644 CD2 LEU B 6 -2.206 -12.542 -6.297 1.00 0.00 C ATOM 0 H LEU B 6 -2.582 -9.277 -9.399 1.00 0.00 H new ATOM 0 HA LEU B 6 -0.301 -9.698 -7.713 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -2.177 -11.460 -9.334 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -0.869 -12.128 -8.378 1.00 0.00 H new ATOM 0 HG LEU B 6 -2.265 -10.433 -6.627 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -4.587 -11.298 -6.703 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -4.164 -10.349 -8.148 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -4.210 -12.126 -8.233 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -2.880 -12.522 -5.441 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -2.362 -13.462 -6.860 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -1.174 -12.501 -5.948 1.00 0.00 H new ATOM 1656 N SER B 7 1.581 -10.593 -9.094 1.00 0.00 N ATOM 1657 CA SER B 7 2.770 -10.921 -9.918 1.00 0.00 C ATOM 1658 C SER B 7 2.552 -12.228 -10.744 1.00 0.00 C ATOM 1659 O SER B 7 1.463 -12.824 -10.751 1.00 0.00 O ATOM 1660 CB SER B 7 4.013 -10.984 -8.996 1.00 0.00 C ATOM 1661 OG SER B 7 5.166 -10.483 -9.657 1.00 0.00 O ATOM 0 H SER B 7 1.736 -10.664 -8.088 1.00 0.00 H new ATOM 0 HA SER B 7 2.935 -10.139 -10.659 1.00 0.00 H new ATOM 0 HB2 SER B 7 3.828 -10.405 -8.091 1.00 0.00 H new ATOM 0 HB3 SER B 7 4.187 -12.014 -8.685 1.00 0.00 H new ATOM 0 HG SER B 7 5.936 -10.532 -9.053 1.00 0.00 H new ATOM 1667 N GLU B 8 3.606 -12.682 -11.442 1.00 0.00 N ATOM 1668 CA GLU B 8 3.556 -13.943 -12.202 1.00 0.00 C ATOM 1669 C GLU B 8 3.296 -15.171 -11.288 1.00 0.00 C ATOM 1670 O GLU B 8 3.817 -15.294 -10.170 1.00 0.00 O ATOM 1671 CB GLU B 8 4.849 -14.082 -13.039 1.00 0.00 C ATOM 1672 CG GLU B 8 4.847 -15.350 -13.932 1.00 0.00 C ATOM 1673 CD GLU B 8 5.672 -15.386 -15.210 1.00 0.00 C ATOM 1674 OE1 GLU B 8 5.486 -16.262 -16.068 1.00 0.00 O ATOM 1675 OE2 GLU B 8 6.602 -14.401 -15.340 1.00 0.00 O ATOM 0 H GLU B 8 4.501 -12.196 -11.496 1.00 0.00 H new ATOM 0 HA GLU B 8 2.706 -13.913 -12.884 1.00 0.00 H new ATOM 0 HB2 GLU B 8 4.967 -13.199 -13.668 1.00 0.00 H new ATOM 0 HB3 GLU B 8 5.709 -14.114 -12.370 1.00 0.00 H new ATOM 0 HG2 GLU B 8 5.176 -16.183 -13.311 1.00 0.00 H new ATOM 0 HG3 GLU B 8 3.812 -15.548 -14.210 1.00 0.00 H new ATOM 1683 N ALA B 9 2.468 -16.068 -11.850 1.00 0.00 N ATOM 1684 CA ALA B 9 2.154 -17.346 -11.217 1.00 0.00 C ATOM 1685 C ALA B 9 3.225 -18.394 -11.547 1.00 0.00 C ATOM 1686 O ALA B 9 3.292 -18.873 -12.685 1.00 0.00 O ATOM 1687 CB ALA B 9 0.747 -17.847 -11.536 1.00 0.00 C ATOM 0 H ALA B 9 2.005 -15.923 -12.747 1.00 0.00 H new ATOM 0 HA ALA B 9 2.164 -17.175 -10.140 1.00 0.00 H new ATOM 0 HB1 ALA B 9 0.578 -18.800 -11.035 1.00 0.00 H new ATOM 0 HB2 ALA B 9 0.014 -17.119 -11.188 1.00 0.00 H new ATOM 0 HB3 ALA B 9 0.643 -17.980 -12.613 1.00 0.00 H new ATOM 1693 N LYS B 10 4.057 -18.742 -10.558 1.00 0.00 N ATOM 1694 CA LYS B 10 5.099 -19.772 -10.763 1.00 0.00 C ATOM 1695 C LYS B 10 4.549 -21.143 -10.343 1.00 0.00 C ATOM 1696 O LYS B 10 4.216 -21.241 -9.166 1.00 0.00 O ATOM 1697 CB LYS B 10 6.357 -19.541 -9.930 1.00 0.00 C ATOM 1698 CG LYS B 10 7.102 -18.242 -10.178 1.00 0.00 C ATOM 1699 CD LYS B 10 7.868 -18.247 -11.508 1.00 0.00 C ATOM 1700 CE LYS B 10 8.023 -16.826 -12.049 1.00 0.00 C ATOM 1701 NZ LYS B 10 8.854 -15.999 -11.158 1.00 0.00 N ATOM 0 H LYS B 10 4.036 -18.338 -9.622 1.00 0.00 H new ATOM 0 HA LYS B 10 5.362 -19.722 -11.820 1.00 0.00 H new ATOM 0 HB2 LYS B 10 6.081 -19.581 -8.876 1.00 0.00 H new ATOM 0 HB3 LYS B 10 7.043 -20.368 -10.111 1.00 0.00 H new ATOM 0 HG2 LYS B 10 6.393 -17.414 -10.174 1.00 0.00 H new ATOM 0 HG3 LYS B 10 7.801 -18.066 -9.361 1.00 0.00 H new ATOM 0 HD2 LYS B 10 8.851 -18.696 -11.365 1.00 0.00 H new ATOM 0 HD3 LYS B 10 7.339 -18.862 -12.236 1.00 0.00 H new ATOM 0 HE2 LYS B 10 8.473 -16.860 -13.041 1.00 0.00 H new ATOM 0 HE3 LYS B 10 7.040 -16.368 -12.161 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 8.996 -15.062 -11.586 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 8.378 -15.891 -10.240 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 9.776 -16.459 -11.018 1.00 0.00 H new ATOM 1715 N PRO B 11 4.496 -22.198 -11.203 1.00 0.00 N ATOM 1716 CA PRO B 11 3.793 -23.473 -10.905 1.00 0.00 C ATOM 1717 C PRO B 11 4.285 -24.412 -9.780 1.00 0.00 C ATOM 1718 O PRO B 11 3.713 -25.496 -9.681 1.00 0.00 O ATOM 1719 CB PRO B 11 3.825 -24.186 -12.266 1.00 0.00 C ATOM 1720 CG PRO B 11 5.087 -23.673 -12.951 1.00 0.00 C ATOM 1721 CD PRO B 11 5.265 -22.245 -12.451 1.00 0.00 C ATOM 0 HA PRO B 11 2.823 -23.218 -10.477 1.00 0.00 H new ATOM 0 HB2 PRO B 11 3.855 -25.269 -12.144 1.00 0.00 H new ATOM 0 HB3 PRO B 11 2.936 -23.956 -12.853 1.00 0.00 H new ATOM 0 HG2 PRO B 11 5.950 -24.289 -12.697 1.00 0.00 H new ATOM 0 HG3 PRO B 11 4.984 -23.700 -14.036 1.00 0.00 H new ATOM 0 HD2 PRO B 11 6.316 -22.012 -12.279 1.00 0.00 H new ATOM 0 HD3 PRO B 11 4.892 -21.521 -13.175 1.00 0.00 H new ATOM 1729 N ALA B 12 5.286 -24.009 -8.977 1.00 0.00 N ATOM 1730 CA ALA B 12 5.832 -24.753 -7.812 1.00 0.00 C ATOM 1731 C ALA B 12 7.318 -24.359 -7.690 1.00 0.00 C ATOM 1732 O ALA B 12 8.212 -25.153 -8.001 1.00 0.00 O ATOM 1733 CB ALA B 12 5.665 -26.281 -7.786 1.00 0.00 C ATOM 0 H ALA B 12 5.762 -23.119 -9.123 1.00 0.00 H new ATOM 0 HA ALA B 12 5.225 -24.457 -6.956 1.00 0.00 H new ATOM 0 HB1 ALA B 12 6.113 -26.681 -6.876 1.00 0.00 H new ATOM 0 HB2 ALA B 12 4.604 -26.532 -7.809 1.00 0.00 H new ATOM 0 HB3 ALA B 12 6.159 -26.716 -8.655 1.00 0.00 H new ATOM 1739 N THR B 13 7.594 -23.134 -7.194 1.00 0.00 N ATOM 1740 CA THR B 13 8.981 -22.695 -6.877 1.00 0.00 C ATOM 1741 C THR B 13 9.516 -23.517 -5.651 1.00 0.00 C ATOM 1742 O THR B 13 8.707 -24.029 -4.862 1.00 0.00 O ATOM 1743 CB THR B 13 9.195 -21.137 -6.714 1.00 0.00 C ATOM 1744 OG1 THR B 13 9.217 -20.706 -5.360 1.00 0.00 O ATOM 1745 CG2 THR B 13 8.276 -20.213 -7.478 1.00 0.00 C ATOM 0 H THR B 13 6.881 -22.430 -7.003 1.00 0.00 H new ATOM 0 HA THR B 13 9.580 -22.915 -7.760 1.00 0.00 H new ATOM 0 HB THR B 13 10.177 -21.042 -7.178 1.00 0.00 H new ATOM 0 HG1 THR B 13 9.033 -19.744 -5.320 1.00 0.00 H new ATOM 0 HG21 THR B 13 8.543 -19.178 -7.267 1.00 0.00 H new ATOM 0 HG22 THR B 13 8.376 -20.403 -8.547 1.00 0.00 H new ATOM 0 HG23 THR B 13 7.245 -20.391 -7.173 1.00 0.00 H new ATOM 1753 N PRO B 14 10.850 -23.637 -5.411 1.00 0.00 N ATOM 1754 CA PRO B 14 11.366 -24.172 -4.126 1.00 0.00 C ATOM 1755 C PRO B 14 10.913 -23.390 -2.842 1.00 0.00 C ATOM 1756 O PRO B 14 10.610 -24.036 -1.838 1.00 0.00 O ATOM 1757 CB PRO B 14 12.882 -24.179 -4.361 1.00 0.00 C ATOM 1758 CG PRO B 14 13.157 -23.082 -5.388 1.00 0.00 C ATOM 1759 CD PRO B 14 11.897 -22.999 -6.235 1.00 0.00 C ATOM 0 HA PRO B 14 10.960 -25.157 -3.894 1.00 0.00 H new ATOM 0 HB2 PRO B 14 13.421 -23.988 -3.433 1.00 0.00 H new ATOM 0 HB3 PRO B 14 13.215 -25.150 -4.729 1.00 0.00 H new ATOM 0 HG2 PRO B 14 13.366 -22.130 -4.900 1.00 0.00 H new ATOM 0 HG3 PRO B 14 14.026 -23.325 -5.999 1.00 0.00 H new ATOM 0 HD2 PRO B 14 11.643 -21.965 -6.467 1.00 0.00 H new ATOM 0 HD3 PRO B 14 12.024 -23.517 -7.186 1.00 0.00 H new ATOM 1767 N GLU B 15 10.785 -22.041 -2.910 1.00 0.00 N ATOM 1768 CA GLU B 15 10.036 -21.228 -1.918 1.00 0.00 C ATOM 1769 C GLU B 15 8.556 -21.624 -1.723 1.00 0.00 C ATOM 1770 O GLU B 15 8.180 -21.828 -0.576 1.00 0.00 O ATOM 1771 CB GLU B 15 10.165 -19.720 -2.275 1.00 0.00 C ATOM 1772 CG GLU B 15 11.430 -19.084 -1.670 1.00 0.00 C ATOM 1773 CD GLU B 15 11.903 -17.830 -2.398 1.00 0.00 C ATOM 1774 OE1 GLU B 15 12.940 -17.811 -3.073 1.00 0.00 O ATOM 1775 OE2 GLU B 15 11.087 -16.748 -2.248 1.00 0.00 O ATOM 0 H GLU B 15 11.200 -21.484 -3.657 1.00 0.00 H new ATOM 0 HA GLU B 15 10.500 -21.436 -0.954 1.00 0.00 H new ATOM 0 HB2 GLU B 15 10.186 -19.606 -3.359 1.00 0.00 H new ATOM 0 HB3 GLU B 15 9.285 -19.187 -1.915 1.00 0.00 H new ATOM 0 HG2 GLU B 15 11.235 -18.834 -0.627 1.00 0.00 H new ATOM 0 HG3 GLU B 15 12.233 -19.821 -1.677 1.00 0.00 H new ATOM 1783 N ILE B 16 7.741 -21.787 -2.783 1.00 0.00 N ATOM 1784 CA ILE B 16 6.332 -22.300 -2.675 1.00 0.00 C ATOM 1785 C ILE B 16 6.215 -23.605 -1.840 1.00 0.00 C ATOM 1786 O ILE B 16 5.383 -23.669 -0.930 1.00 0.00 O ATOM 1787 CB ILE B 16 5.672 -22.505 -4.078 1.00 0.00 C ATOM 1788 CG1 ILE B 16 5.781 -21.242 -4.957 1.00 0.00 C ATOM 1789 CG2 ILE B 16 4.196 -22.962 -3.995 1.00 0.00 C ATOM 1790 CD1 ILE B 16 5.089 -21.359 -6.311 1.00 0.00 C ATOM 0 H ILE B 16 8.024 -21.573 -3.739 1.00 0.00 H new ATOM 0 HA ILE B 16 5.788 -21.521 -2.141 1.00 0.00 H new ATOM 0 HB ILE B 16 6.239 -23.310 -4.546 1.00 0.00 H new ATOM 0 HG12 ILE B 16 5.354 -20.398 -4.415 1.00 0.00 H new ATOM 0 HG13 ILE B 16 6.835 -21.016 -5.119 1.00 0.00 H new ATOM 0 HG21 ILE B 16 3.796 -23.086 -5.001 1.00 0.00 H new ATOM 0 HG22 ILE B 16 4.138 -23.911 -3.462 1.00 0.00 H new ATOM 0 HG23 ILE B 16 3.612 -22.211 -3.463 1.00 0.00 H new ATOM 0 HD11 ILE B 16 5.214 -20.429 -6.865 1.00 0.00 H new ATOM 0 HD12 ILE B 16 5.531 -22.180 -6.876 1.00 0.00 H new ATOM 0 HD13 ILE B 16 4.027 -21.552 -6.161 1.00 0.00 H new ATOM 1802 N GLN B 17 7.045 -24.617 -2.167 1.00 0.00 N ATOM 1803 CA GLN B 17 7.032 -25.916 -1.449 1.00 0.00 C ATOM 1804 C GLN B 17 7.464 -25.778 0.030 1.00 0.00 C ATOM 1805 O GLN B 17 6.842 -26.369 0.908 1.00 0.00 O ATOM 1806 CB GLN B 17 7.856 -27.003 -2.203 1.00 0.00 C ATOM 1807 CG GLN B 17 7.310 -28.453 -2.096 1.00 0.00 C ATOM 1808 CD GLN B 17 6.979 -28.947 -0.673 1.00 0.00 C ATOM 1809 OE1 GLN B 17 7.856 -29.113 0.174 1.00 0.00 O ATOM 1810 NE2 GLN B 17 5.705 -29.085 -0.354 1.00 0.00 N ATOM 0 H GLN B 17 7.731 -24.564 -2.920 1.00 0.00 H new ATOM 0 HA GLN B 17 5.996 -26.255 -1.434 1.00 0.00 H new ATOM 0 HB2 GLN B 17 7.906 -26.729 -3.257 1.00 0.00 H new ATOM 0 HB3 GLN B 17 8.877 -26.989 -1.821 1.00 0.00 H new ATOM 0 HG2 GLN B 17 6.408 -28.526 -2.704 1.00 0.00 H new ATOM 0 HG3 GLN B 17 8.044 -29.130 -2.533 1.00 0.00 H new ATOM 0 HE21 GLN B 17 4.984 -28.946 -1.062 1.00 0.00 H new ATOM 0 HE22 GLN B 17 5.442 -29.331 0.600 1.00 0.00 H new ATOM 1819 N GLU B 18 8.486 -24.963 0.310 1.00 0.00 N ATOM 1820 CA GLU B 18 8.847 -24.578 1.683 1.00 0.00 C ATOM 1821 C GLU B 18 7.782 -23.803 2.504 1.00 0.00 C ATOM 1822 O GLU B 18 7.632 -24.069 3.698 1.00 0.00 O ATOM 1823 CB GLU B 18 10.163 -23.775 1.590 1.00 0.00 C ATOM 1824 CG GLU B 18 11.109 -24.137 2.742 1.00 0.00 C ATOM 1825 CD GLU B 18 12.541 -23.766 2.390 1.00 0.00 C ATOM 1826 OE1 GLU B 18 12.934 -22.594 2.342 1.00 0.00 O ATOM 1827 OE2 GLU B 18 13.326 -24.837 2.085 1.00 0.00 O ATOM 0 H GLU B 18 9.086 -24.551 -0.405 1.00 0.00 H new ATOM 0 HA GLU B 18 8.944 -25.503 2.251 1.00 0.00 H new ATOM 0 HB2 GLU B 18 10.651 -23.978 0.637 1.00 0.00 H new ATOM 0 HB3 GLU B 18 9.945 -22.707 1.616 1.00 0.00 H new ATOM 0 HG2 GLU B 18 10.804 -23.615 3.649 1.00 0.00 H new ATOM 0 HG3 GLU B 18 11.045 -25.205 2.952 1.00 0.00 H new ATOM 1835 N ILE B 19 7.051 -22.871 1.861 1.00 0.00 N ATOM 1836 CA ILE B 19 5.939 -22.118 2.482 1.00 0.00 C ATOM 1837 C ILE B 19 4.800 -23.105 2.874 1.00 0.00 C ATOM 1838 O ILE B 19 4.528 -23.210 4.067 1.00 0.00 O ATOM 1839 CB ILE B 19 5.471 -20.942 1.561 1.00 0.00 C ATOM 1840 CG1 ILE B 19 6.554 -19.906 1.133 1.00 0.00 C ATOM 1841 CG2 ILE B 19 4.318 -20.165 2.215 1.00 0.00 C ATOM 1842 CD1 ILE B 19 6.279 -19.251 -0.235 1.00 0.00 C ATOM 0 H ILE B 19 7.216 -22.616 0.887 1.00 0.00 H new ATOM 0 HA ILE B 19 6.278 -21.642 3.402 1.00 0.00 H new ATOM 0 HB ILE B 19 5.171 -21.459 0.649 1.00 0.00 H new ATOM 0 HG12 ILE B 19 6.619 -19.127 1.892 1.00 0.00 H new ATOM 0 HG13 ILE B 19 7.525 -20.401 1.100 1.00 0.00 H new ATOM 0 HG21 ILE B 19 4.008 -19.352 1.558 1.00 0.00 H new ATOM 0 HG22 ILE B 19 3.476 -20.837 2.383 1.00 0.00 H new ATOM 0 HG23 ILE B 19 4.651 -19.754 3.168 1.00 0.00 H new ATOM 0 HD11 ILE B 19 7.074 -18.542 -0.466 1.00 0.00 H new ATOM 0 HD12 ILE B 19 6.244 -20.020 -1.006 1.00 0.00 H new ATOM 0 HD13 ILE B 19 5.324 -18.727 -0.202 1.00 0.00 H new ATOM 1854 N VAL B 20 4.217 -23.873 1.925 1.00 0.00 N ATOM 1855 CA VAL B 20 3.263 -24.965 2.259 1.00 0.00 C ATOM 1856 C VAL B 20 3.752 -26.012 3.282 1.00 0.00 C ATOM 1857 O VAL B 20 2.933 -26.440 4.074 1.00 0.00 O ATOM 1858 CB VAL B 20 2.710 -25.695 1.004 1.00 0.00 C ATOM 1859 CG1 VAL B 20 3.566 -26.844 0.421 1.00 0.00 C ATOM 1860 CG2 VAL B 20 1.291 -26.228 1.293 1.00 0.00 C ATOM 0 H VAL B 20 4.387 -23.761 0.926 1.00 0.00 H new ATOM 0 HA VAL B 20 2.462 -24.413 2.751 1.00 0.00 H new ATOM 0 HB VAL B 20 2.723 -24.924 0.233 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.065 -27.265 -0.450 1.00 0.00 H new ATOM 0 HG12 VAL B 20 4.542 -26.458 0.127 1.00 0.00 H new ATOM 0 HG13 VAL B 20 3.696 -27.620 1.175 1.00 0.00 H new ATOM 0 HG21 VAL B 20 0.907 -26.739 0.410 1.00 0.00 H new ATOM 0 HG22 VAL B 20 1.328 -26.926 2.129 1.00 0.00 H new ATOM 0 HG23 VAL B 20 0.634 -25.396 1.544 1.00 0.00 H new ATOM 1870 N ASP B 21 5.015 -26.471 3.221 1.00 0.00 N ATOM 1871 CA ASP B 21 5.580 -27.420 4.210 1.00 0.00 C ATOM 1872 C ASP B 21 5.521 -26.867 5.663 1.00 0.00 C ATOM 1873 O ASP B 21 4.976 -27.536 6.542 1.00 0.00 O ATOM 1874 CB ASP B 21 7.022 -27.772 3.750 1.00 0.00 C ATOM 1875 CG ASP B 21 7.894 -28.663 4.645 1.00 0.00 C ATOM 1876 OD1 ASP B 21 9.130 -28.598 4.620 1.00 0.00 O ATOM 1877 OD2 ASP B 21 7.208 -29.505 5.470 1.00 0.00 O ATOM 0 H ASP B 21 5.673 -26.199 2.491 1.00 0.00 H new ATOM 0 HA ASP B 21 4.979 -28.329 4.244 1.00 0.00 H new ATOM 0 HB2 ASP B 21 6.947 -28.257 2.777 1.00 0.00 H new ATOM 0 HB3 ASP B 21 7.557 -26.834 3.599 1.00 0.00 H new ATOM 1883 N LYS B 22 6.038 -25.644 5.871 1.00 0.00 N ATOM 1884 CA LYS B 22 5.865 -24.895 7.137 1.00 0.00 C ATOM 1885 C LYS B 22 4.432 -24.521 7.569 1.00 0.00 C ATOM 1886 O LYS B 22 4.190 -24.417 8.773 1.00 0.00 O ATOM 1887 CB LYS B 22 6.719 -23.603 7.056 1.00 0.00 C ATOM 1888 CG LYS B 22 8.125 -23.855 7.607 1.00 0.00 C ATOM 1889 CD LYS B 22 8.897 -22.557 7.893 1.00 0.00 C ATOM 1890 CE LYS B 22 9.880 -22.720 9.066 1.00 0.00 C ATOM 1891 NZ LYS B 22 9.191 -22.575 10.365 1.00 0.00 N ATOM 0 H LYS B 22 6.587 -25.144 5.171 1.00 0.00 H new ATOM 0 HA LYS B 22 6.186 -25.596 7.908 1.00 0.00 H new ATOM 0 HB2 LYS B 22 6.782 -23.266 6.021 1.00 0.00 H new ATOM 0 HB3 LYS B 22 6.238 -22.806 7.622 1.00 0.00 H new ATOM 0 HG2 LYS B 22 8.051 -24.437 8.525 1.00 0.00 H new ATOM 0 HG3 LYS B 22 8.687 -24.456 6.893 1.00 0.00 H new ATOM 0 HD2 LYS B 22 9.444 -22.256 7.000 1.00 0.00 H new ATOM 0 HD3 LYS B 22 8.192 -21.757 8.119 1.00 0.00 H new ATOM 0 HE2 LYS B 22 10.356 -23.699 9.011 1.00 0.00 H new ATOM 0 HE3 LYS B 22 10.672 -21.975 8.986 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 9.878 -22.690 11.137 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 8.757 -21.632 10.425 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 8.452 -23.302 10.449 1.00 0.00 H new ATOM 1905 N VAL B 23 3.528 -24.297 6.611 1.00 0.00 N ATOM 1906 CA VAL B 23 2.110 -23.962 6.883 1.00 0.00 C ATOM 1907 C VAL B 23 1.196 -25.234 6.889 1.00 0.00 C ATOM 1908 O VAL B 23 0.103 -25.136 7.417 1.00 0.00 O ATOM 1909 CB VAL B 23 1.599 -22.840 5.927 1.00 0.00 C ATOM 1910 CG1 VAL B 23 0.217 -22.278 6.360 1.00 0.00 C ATOM 1911 CG2 VAL B 23 2.591 -21.659 5.687 1.00 0.00 C ATOM 0 H VAL B 23 3.751 -24.341 5.617 1.00 0.00 H new ATOM 0 HA VAL B 23 2.052 -23.556 7.893 1.00 0.00 H new ATOM 0 HB VAL B 23 1.504 -23.357 4.972 1.00 0.00 H new ATOM 0 HG11 VAL B 23 -0.094 -21.500 5.663 1.00 0.00 H new ATOM 0 HG12 VAL B 23 -0.519 -23.082 6.359 1.00 0.00 H new ATOM 0 HG13 VAL B 23 0.293 -21.857 7.362 1.00 0.00 H new ATOM 0 HG21 VAL B 23 2.138 -20.936 5.009 1.00 0.00 H new ATOM 0 HG22 VAL B 23 2.816 -21.174 6.637 1.00 0.00 H new ATOM 0 HG23 VAL B 23 3.512 -22.041 5.247 1.00 0.00 H new ATOM 1921 N LYS B 24 1.619 -26.422 6.413 1.00 0.00 N ATOM 1922 CA LYS B 24 0.916 -27.713 6.581 1.00 0.00 C ATOM 1923 C LYS B 24 0.498 -28.018 8.059 1.00 0.00 C ATOM 1924 O LYS B 24 -0.705 -28.203 8.246 1.00 0.00 O ATOM 1925 CB LYS B 24 1.797 -28.849 5.984 1.00 0.00 C ATOM 1926 CG LYS B 24 1.004 -30.117 5.655 1.00 0.00 C ATOM 1927 CD LYS B 24 1.823 -31.206 4.951 1.00 0.00 C ATOM 1928 CE LYS B 24 2.334 -32.252 5.951 1.00 0.00 C ATOM 1929 NZ LYS B 24 2.956 -33.372 5.237 1.00 0.00 N ATOM 0 H LYS B 24 2.486 -26.514 5.884 1.00 0.00 H new ATOM 0 HA LYS B 24 -0.026 -27.650 6.037 1.00 0.00 H new ATOM 0 HB2 LYS B 24 2.282 -28.486 5.078 1.00 0.00 H new ATOM 0 HB3 LYS B 24 2.588 -29.096 6.692 1.00 0.00 H new ATOM 0 HG2 LYS B 24 0.595 -30.526 6.579 1.00 0.00 H new ATOM 0 HG3 LYS B 24 0.158 -29.849 5.023 1.00 0.00 H new ATOM 0 HD2 LYS B 24 1.209 -31.693 4.193 1.00 0.00 H new ATOM 0 HD3 LYS B 24 2.668 -30.751 4.433 1.00 0.00 H new ATOM 0 HE2 LYS B 24 3.057 -31.796 6.628 1.00 0.00 H new ATOM 0 HE3 LYS B 24 1.508 -32.615 6.563 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 3.298 -34.074 5.924 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 2.256 -33.815 4.609 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 3.756 -33.022 4.672 1.00 0.00 H new ATOM 1943 N PRO B 25 1.383 -28.032 9.119 1.00 0.00 N ATOM 1944 CA PRO B 25 0.939 -28.176 10.527 1.00 0.00 C ATOM 1945 C PRO B 25 0.013 -27.032 11.063 1.00 0.00 C ATOM 1946 O PRO B 25 -0.959 -27.315 11.760 1.00 0.00 O ATOM 1947 CB PRO B 25 2.282 -28.287 11.280 1.00 0.00 C ATOM 1948 CG PRO B 25 3.326 -27.533 10.456 1.00 0.00 C ATOM 1949 CD PRO B 25 2.778 -27.542 9.039 1.00 0.00 C ATOM 0 HA PRO B 25 0.282 -29.035 10.663 1.00 0.00 H new ATOM 0 HB2 PRO B 25 2.199 -27.860 12.279 1.00 0.00 H new ATOM 0 HB3 PRO B 25 2.569 -29.331 11.402 1.00 0.00 H new ATOM 0 HG2 PRO B 25 3.460 -26.515 10.822 1.00 0.00 H new ATOM 0 HG3 PRO B 25 4.299 -28.021 10.507 1.00 0.00 H new ATOM 0 HD2 PRO B 25 2.812 -26.542 8.606 1.00 0.00 H new ATOM 0 HD3 PRO B 25 3.378 -28.188 8.397 1.00 0.00 H new ATOM 1957 N GLN B 26 0.310 -25.771 10.699 1.00 0.00 N ATOM 1958 CA GLN B 26 -0.474 -24.560 11.089 1.00 0.00 C ATOM 1959 C GLN B 26 -1.886 -24.473 10.445 1.00 0.00 C ATOM 1960 O GLN B 26 -2.836 -24.064 11.107 1.00 0.00 O ATOM 1961 CB GLN B 26 0.293 -23.237 10.774 1.00 0.00 C ATOM 1962 CG GLN B 26 1.837 -23.293 10.827 1.00 0.00 C ATOM 1963 CD GLN B 26 2.546 -21.939 10.846 1.00 0.00 C ATOM 1964 OE1 GLN B 26 3.067 -21.522 11.879 1.00 0.00 O ATOM 1965 NE2 GLN B 26 2.601 -21.233 9.727 1.00 0.00 N ATOM 0 H GLN B 26 1.116 -25.549 10.114 1.00 0.00 H new ATOM 0 HA GLN B 26 -0.606 -24.674 12.165 1.00 0.00 H new ATOM 0 HB2 GLN B 26 -0.000 -22.904 9.778 1.00 0.00 H new ATOM 0 HB3 GLN B 26 -0.043 -22.475 11.477 1.00 0.00 H new ATOM 0 HG2 GLN B 26 2.132 -23.850 11.716 1.00 0.00 H new ATOM 0 HG3 GLN B 26 2.192 -23.857 9.965 1.00 0.00 H new ATOM 0 HE21 GLN B 26 2.165 -21.590 8.877 1.00 0.00 H new ATOM 0 HE22 GLN B 26 3.080 -20.332 9.715 1.00 0.00 H new ATOM 1974 N LEU B 27 -2.017 -24.870 9.167 1.00 0.00 N ATOM 1975 CA LEU B 27 -3.312 -25.081 8.493 1.00 0.00 C ATOM 1976 C LEU B 27 -4.197 -26.158 9.200 1.00 0.00 C ATOM 1977 O LEU B 27 -5.376 -25.900 9.440 1.00 0.00 O ATOM 1978 CB LEU B 27 -3.079 -25.411 6.973 1.00 0.00 C ATOM 1979 CG LEU B 27 -3.857 -24.539 5.964 1.00 0.00 C ATOM 1980 CD1 LEU B 27 -3.568 -24.969 4.513 1.00 0.00 C ATOM 1981 CD2 LEU B 27 -5.369 -24.498 6.261 1.00 0.00 C ATOM 0 H LEU B 27 -1.216 -25.056 8.564 1.00 0.00 H new ATOM 0 HA LEU B 27 -3.877 -24.152 8.563 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -2.014 -25.316 6.760 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -3.346 -26.454 6.803 1.00 0.00 H new ATOM 0 HG LEU B 27 -3.495 -23.518 6.083 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -4.131 -24.336 3.827 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -2.502 -24.868 4.309 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -3.867 -26.008 4.375 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -5.868 -23.871 5.522 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -5.776 -25.508 6.215 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -5.533 -24.086 7.257 1.00 0.00 H new ATOM 1993 N GLU B 28 -3.625 -27.337 9.537 1.00 0.00 N ATOM 1994 CA GLU B 28 -4.360 -28.443 10.210 1.00 0.00 C ATOM 1995 C GLU B 28 -4.775 -28.145 11.672 1.00 0.00 C ATOM 1996 O GLU B 28 -5.850 -28.566 12.087 1.00 0.00 O ATOM 1997 CB GLU B 28 -3.503 -29.736 10.229 1.00 0.00 C ATOM 1998 CG GLU B 28 -3.075 -30.300 8.862 1.00 0.00 C ATOM 1999 CD GLU B 28 -1.986 -31.353 8.991 1.00 0.00 C ATOM 2000 OE1 GLU B 28 -2.110 -32.372 9.689 1.00 0.00 O ATOM 2001 OE2 GLU B 28 -0.866 -31.074 8.286 1.00 0.00 O ATOM 0 H GLU B 28 -2.645 -27.552 9.353 1.00 0.00 H new ATOM 0 HA GLU B 28 -5.269 -28.562 9.621 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -2.604 -29.540 10.813 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -4.063 -30.508 10.756 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -3.941 -30.735 8.363 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -2.718 -29.486 8.231 1.00 0.00 H new ATOM 2009 N GLU B 29 -3.923 -27.446 12.440 1.00 0.00 N ATOM 2010 CA GLU B 29 -4.269 -26.883 13.762 1.00 0.00 C ATOM 2011 C GLU B 29 -5.375 -25.780 13.740 1.00 0.00 C ATOM 2012 O GLU B 29 -6.281 -25.823 14.576 1.00 0.00 O ATOM 2013 CB GLU B 29 -2.942 -26.371 14.386 1.00 0.00 C ATOM 2014 CG GLU B 29 -2.005 -27.505 14.886 1.00 0.00 C ATOM 2015 CD GLU B 29 -1.408 -27.248 16.263 1.00 0.00 C ATOM 2016 OE1 GLU B 29 -0.235 -26.891 16.427 1.00 0.00 O ATOM 2017 OE2 GLU B 29 -2.287 -27.438 17.287 1.00 0.00 O ATOM 0 H GLU B 29 -2.962 -27.252 12.159 1.00 0.00 H new ATOM 0 HA GLU B 29 -4.724 -27.666 14.368 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -2.410 -25.773 13.646 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -3.175 -25.711 15.221 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -2.564 -28.440 14.912 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -1.195 -27.637 14.168 1.00 0.00 H new ATOM 2025 N LYS B 30 -5.306 -24.822 12.795 1.00 0.00 N ATOM 2026 CA LYS B 30 -6.318 -23.729 12.641 1.00 0.00 C ATOM 2027 C LYS B 30 -7.695 -24.174 12.103 1.00 0.00 C ATOM 2028 O LYS B 30 -8.725 -23.719 12.608 1.00 0.00 O ATOM 2029 CB LYS B 30 -5.714 -22.582 11.774 1.00 0.00 C ATOM 2030 CG LYS B 30 -4.907 -21.519 12.554 1.00 0.00 C ATOM 2031 CD LYS B 30 -3.829 -22.046 13.536 1.00 0.00 C ATOM 2032 CE LYS B 30 -4.339 -22.265 14.983 1.00 0.00 C ATOM 2033 NZ LYS B 30 -3.657 -21.372 15.924 1.00 0.00 N ATOM 0 H LYS B 30 -4.551 -24.774 12.111 1.00 0.00 H new ATOM 0 HA LYS B 30 -6.533 -23.374 13.649 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -5.065 -23.024 11.018 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -6.526 -22.082 11.245 1.00 0.00 H new ATOM 0 HG2 LYS B 30 -4.419 -20.865 11.832 1.00 0.00 H new ATOM 0 HG3 LYS B 30 -5.609 -20.904 13.117 1.00 0.00 H new ATOM 0 HD2 LYS B 30 -3.436 -22.989 13.155 1.00 0.00 H new ATOM 0 HD3 LYS B 30 -2.998 -21.341 13.559 1.00 0.00 H new ATOM 0 HE2 LYS B 30 -5.414 -22.089 15.024 1.00 0.00 H new ATOM 0 HE3 LYS B 30 -4.175 -23.302 15.277 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 -4.017 -21.540 16.885 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 -2.634 -21.559 15.900 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 -3.835 -20.383 15.655 1.00 0.00 H new ATOM 2047 N THR B 31 -7.698 -25.059 11.104 1.00 0.00 N ATOM 2048 CA THR B 31 -8.931 -25.713 10.615 1.00 0.00 C ATOM 2049 C THR B 31 -9.363 -26.975 11.456 1.00 0.00 C ATOM 2050 O THR B 31 -10.452 -27.493 11.195 1.00 0.00 O ATOM 2051 CB THR B 31 -8.700 -26.007 9.102 1.00 0.00 C ATOM 2052 OG1 THR B 31 -8.293 -24.831 8.397 1.00 0.00 O ATOM 2053 CG2 THR B 31 -9.934 -26.548 8.367 1.00 0.00 C ATOM 0 H THR B 31 -6.854 -25.347 10.608 1.00 0.00 H new ATOM 0 HA THR B 31 -9.788 -25.051 10.744 1.00 0.00 H new ATOM 0 HB THR B 31 -7.924 -26.772 9.103 1.00 0.00 H new ATOM 0 HG1 THR B 31 -8.154 -25.048 7.451 1.00 0.00 H new ATOM 0 HG21 THR B 31 -9.686 -26.725 7.321 1.00 0.00 H new ATOM 0 HG22 THR B 31 -10.251 -27.483 8.828 1.00 0.00 H new ATOM 0 HG23 THR B 31 -10.743 -25.820 8.430 1.00 0.00 H new ATOM 2061 N ASN B 32 -8.551 -27.505 12.418 1.00 0.00 N ATOM 2062 CA ASN B 32 -8.767 -28.858 13.039 1.00 0.00 C ATOM 2063 C ASN B 32 -8.897 -30.075 12.023 1.00 0.00 C ATOM 2064 O ASN B 32 -9.437 -31.128 12.376 1.00 0.00 O ATOM 2065 CB ASN B 32 -9.908 -28.725 14.093 1.00 0.00 C ATOM 2066 CG ASN B 32 -10.178 -29.974 14.954 1.00 0.00 C ATOM 2067 OD1 ASN B 32 -9.294 -30.504 15.627 1.00 0.00 O ATOM 2068 ND2 ASN B 32 -11.392 -30.495 14.883 1.00 0.00 N ATOM 0 H ASN B 32 -7.735 -27.016 12.785 1.00 0.00 H new ATOM 0 HA ASN B 32 -7.853 -29.158 13.551 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -9.668 -27.895 14.757 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -10.828 -28.461 13.572 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -11.610 -31.352 15.392 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -12.110 -30.040 14.320 1.00 0.00 H new ATOM 2075 N GLU B 33 -8.397 -29.932 10.779 1.00 0.00 N ATOM 2076 CA GLU B 33 -8.592 -30.919 9.697 1.00 0.00 C ATOM 2077 C GLU B 33 -7.223 -31.491 9.309 1.00 0.00 C ATOM 2078 O GLU B 33 -6.188 -30.827 9.372 1.00 0.00 O ATOM 2079 CB GLU B 33 -9.299 -30.240 8.502 1.00 0.00 C ATOM 2080 CG GLU B 33 -9.671 -31.200 7.346 1.00 0.00 C ATOM 2081 CD GLU B 33 -10.780 -30.666 6.438 1.00 0.00 C ATOM 2082 OE1 GLU B 33 -10.975 -29.461 6.232 1.00 0.00 O ATOM 2083 OE2 GLU B 33 -11.536 -31.649 5.873 1.00 0.00 O ATOM 0 H GLU B 33 -7.843 -29.124 10.495 1.00 0.00 H new ATOM 0 HA GLU B 33 -9.227 -31.741 10.026 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -10.207 -29.755 8.861 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -8.651 -29.455 8.111 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -8.782 -31.393 6.745 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -9.985 -32.156 7.766 1.00 0.00 H new ATOM 2091 N THR B 34 -7.260 -32.744 8.862 1.00 0.00 N ATOM 2092 CA THR B 34 -6.053 -33.483 8.447 1.00 0.00 C ATOM 2093 C THR B 34 -6.032 -33.484 6.905 1.00 0.00 C ATOM 2094 O THR B 34 -6.993 -33.889 6.239 1.00 0.00 O ATOM 2095 CB THR B 34 -5.996 -34.930 9.043 1.00 0.00 C ATOM 2096 OG1 THR B 34 -6.931 -35.144 10.102 1.00 0.00 O ATOM 2097 CG2 THR B 34 -4.599 -35.236 9.602 1.00 0.00 C ATOM 0 H THR B 34 -8.122 -33.282 8.774 1.00 0.00 H new ATOM 0 HA THR B 34 -5.162 -32.992 8.839 1.00 0.00 H new ATOM 0 HB THR B 34 -6.247 -35.589 8.212 1.00 0.00 H new ATOM 0 HG1 THR B 34 -6.848 -36.064 10.430 1.00 0.00 H new ATOM 0 HG21 THR B 34 -4.584 -36.246 10.011 1.00 0.00 H new ATOM 0 HG22 THR B 34 -3.862 -35.157 8.803 1.00 0.00 H new ATOM 0 HG23 THR B 34 -4.358 -34.522 10.390 1.00 0.00 H new ATOM 2105 N TYR B 35 -4.901 -33.029 6.365 1.00 0.00 N ATOM 2106 CA TYR B 35 -4.673 -32.980 4.903 1.00 0.00 C ATOM 2107 C TYR B 35 -3.642 -34.072 4.575 1.00 0.00 C ATOM 2108 O TYR B 35 -2.734 -34.354 5.371 1.00 0.00 O ATOM 2109 CB TYR B 35 -4.187 -31.586 4.440 1.00 0.00 C ATOM 2110 CG TYR B 35 -4.986 -30.403 5.016 1.00 0.00 C ATOM 2111 CD1 TYR B 35 -6.374 -30.244 4.792 1.00 0.00 C ATOM 2112 CD2 TYR B 35 -4.321 -29.519 5.865 1.00 0.00 C ATOM 2113 CE1 TYR B 35 -7.067 -29.203 5.421 1.00 0.00 C ATOM 2114 CE2 TYR B 35 -5.034 -28.536 6.531 1.00 0.00 C ATOM 2115 CZ TYR B 35 -6.389 -28.351 6.293 1.00 0.00 C ATOM 2116 OH TYR B 35 -7.024 -27.311 6.898 1.00 0.00 O ATOM 0 H TYR B 35 -4.116 -32.684 6.917 1.00 0.00 H new ATOM 0 HA TYR B 35 -5.607 -33.157 4.369 1.00 0.00 H new ATOM 0 HB2 TYR B 35 -3.140 -31.470 4.719 1.00 0.00 H new ATOM 0 HB3 TYR B 35 -4.233 -31.543 3.352 1.00 0.00 H new ATOM 0 HD1 TYR B 35 -6.898 -30.924 4.137 1.00 0.00 H new ATOM 0 HD2 TYR B 35 -3.253 -29.601 6.003 1.00 0.00 H new ATOM 0 HE1 TYR B 35 -8.121 -29.060 5.232 1.00 0.00 H new ATOM 0 HE2 TYR B 35 -4.528 -27.904 7.246 1.00 0.00 H new ATOM 0 HH TYR B 35 -7.745 -26.987 6.319 1.00 0.00 H new ATOM 2126 N GLY B 36 -3.774 -34.665 3.378 1.00 0.00 N ATOM 2127 CA GLY B 36 -2.845 -35.720 2.920 1.00 0.00 C ATOM 2128 C GLY B 36 -1.407 -35.202 2.700 1.00 0.00 C ATOM 2129 O GLY B 36 -0.737 -34.780 3.650 1.00 0.00 O ATOM 0 H GLY B 36 -4.510 -34.436 2.710 1.00 0.00 H new ATOM 0 HA2 GLY B 36 -2.827 -36.525 3.655 1.00 0.00 H new ATOM 0 HA3 GLY B 36 -3.218 -36.146 1.989 1.00 0.00 H new ATOM 2133 N LYS B 37 -0.947 -35.220 1.447 1.00 0.00 N ATOM 2134 CA LYS B 37 0.356 -34.618 1.084 1.00 0.00 C ATOM 2135 C LYS B 37 0.090 -33.272 0.377 1.00 0.00 C ATOM 2136 O LYS B 37 -0.618 -33.211 -0.632 1.00 0.00 O ATOM 2137 CB LYS B 37 1.164 -35.589 0.192 1.00 0.00 C ATOM 2138 CG LYS B 37 2.578 -35.063 -0.160 1.00 0.00 C ATOM 2139 CD LYS B 37 3.645 -35.369 0.913 1.00 0.00 C ATOM 2140 CE LYS B 37 4.788 -34.327 0.960 1.00 0.00 C ATOM 2141 NZ LYS B 37 4.776 -33.553 2.214 1.00 0.00 N ATOM 0 H LYS B 37 -1.448 -35.640 0.664 1.00 0.00 H new ATOM 0 HA LYS B 37 0.955 -34.434 1.976 1.00 0.00 H new ATOM 0 HB2 LYS B 37 1.257 -36.548 0.702 1.00 0.00 H new ATOM 0 HB3 LYS B 37 0.611 -35.770 -0.730 1.00 0.00 H new ATOM 0 HG2 LYS B 37 2.893 -35.502 -1.107 1.00 0.00 H new ATOM 0 HG3 LYS B 37 2.527 -33.985 -0.310 1.00 0.00 H new ATOM 0 HD2 LYS B 37 3.164 -35.414 1.890 1.00 0.00 H new ATOM 0 HD3 LYS B 37 4.070 -36.354 0.721 1.00 0.00 H new ATOM 0 HE2 LYS B 37 5.747 -34.835 0.856 1.00 0.00 H new ATOM 0 HE3 LYS B 37 4.694 -33.647 0.113 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 5.557 -32.866 2.206 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 3.871 -33.047 2.301 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 4.891 -34.198 3.021 1.00 0.00 H new ATOM 2155 N LEU B 38 0.751 -32.225 0.890 1.00 0.00 N ATOM 2156 CA LEU B 38 0.715 -30.885 0.271 1.00 0.00 C ATOM 2157 C LEU B 38 2.022 -30.683 -0.500 1.00 0.00 C ATOM 2158 O LEU B 38 3.113 -30.659 0.079 1.00 0.00 O ATOM 2159 CB LEU B 38 0.479 -29.771 1.316 1.00 0.00 C ATOM 2160 CG LEU B 38 -0.766 -29.937 2.224 1.00 0.00 C ATOM 2161 CD1 LEU B 38 -1.013 -28.668 3.057 1.00 0.00 C ATOM 2162 CD2 LEU B 38 -2.030 -30.310 1.435 1.00 0.00 C ATOM 0 H LEU B 38 1.320 -32.277 1.735 1.00 0.00 H new ATOM 0 HA LEU B 38 -0.128 -30.821 -0.417 1.00 0.00 H new ATOM 0 HB2 LEU B 38 1.361 -29.706 1.953 1.00 0.00 H new ATOM 0 HB3 LEU B 38 0.395 -28.820 0.790 1.00 0.00 H new ATOM 0 HG LEU B 38 -0.549 -30.767 2.896 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -1.892 -28.811 3.685 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -0.145 -28.471 3.686 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -1.177 -27.821 2.390 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.870 -30.413 2.122 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -2.249 -29.528 0.708 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -1.869 -31.254 0.915 1.00 0.00 H new ATOM 2174 N GLU B 39 1.869 -30.564 -1.821 1.00 0.00 N ATOM 2175 CA GLU B 39 2.982 -30.281 -2.737 1.00 0.00 C ATOM 2176 C GLU B 39 2.762 -28.874 -3.287 1.00 0.00 C ATOM 2177 O GLU B 39 1.634 -28.457 -3.566 1.00 0.00 O ATOM 2178 CB GLU B 39 3.020 -31.338 -3.874 1.00 0.00 C ATOM 2179 CG GLU B 39 4.446 -31.692 -4.350 1.00 0.00 C ATOM 2180 CD GLU B 39 4.957 -30.930 -5.575 1.00 0.00 C ATOM 2181 OE1 GLU B 39 5.292 -29.739 -5.548 1.00 0.00 O ATOM 2182 OE2 GLU B 39 5.056 -31.695 -6.693 1.00 0.00 O ATOM 0 H GLU B 39 0.968 -30.661 -2.289 1.00 0.00 H new ATOM 0 HA GLU B 39 3.942 -30.334 -2.224 1.00 0.00 H new ATOM 0 HB2 GLU B 39 2.526 -32.247 -3.529 1.00 0.00 H new ATOM 0 HB3 GLU B 39 2.446 -30.966 -4.723 1.00 0.00 H new ATOM 0 HG2 GLU B 39 5.136 -31.517 -3.525 1.00 0.00 H new ATOM 0 HG3 GLU B 39 4.478 -32.759 -4.572 1.00 0.00 H new ATOM 2190 N ALA B 40 3.870 -28.166 -3.520 1.00 0.00 N ATOM 2191 CA ALA B 40 3.824 -26.879 -4.222 1.00 0.00 C ATOM 2192 C ALA B 40 3.174 -26.952 -5.598 1.00 0.00 C ATOM 2193 O ALA B 40 3.311 -27.912 -6.367 1.00 0.00 O ATOM 2194 CB ALA B 40 5.191 -26.242 -4.335 1.00 0.00 C ATOM 0 H ALA B 40 4.805 -28.459 -3.235 1.00 0.00 H new ATOM 0 HA ALA B 40 3.189 -26.250 -3.599 1.00 0.00 H new ATOM 0 HB1 ALA B 40 5.107 -25.292 -4.862 1.00 0.00 H new ATOM 0 HB2 ALA B 40 5.596 -26.070 -3.338 1.00 0.00 H new ATOM 0 HB3 ALA B 40 5.857 -26.905 -4.887 1.00 0.00 H new ATOM 2200 N VAL B 41 2.413 -25.893 -5.820 1.00 0.00 N ATOM 2201 CA VAL B 41 1.783 -25.620 -7.112 1.00 0.00 C ATOM 2202 C VAL B 41 1.960 -24.096 -7.313 1.00 0.00 C ATOM 2203 O VAL B 41 2.984 -23.520 -6.938 1.00 0.00 O ATOM 2204 CB VAL B 41 0.338 -26.180 -7.185 1.00 0.00 C ATOM 2205 CG1 VAL B 41 -0.197 -26.168 -8.607 1.00 0.00 C ATOM 2206 CG2 VAL B 41 0.186 -27.604 -6.724 1.00 0.00 C ATOM 0 H VAL B 41 2.211 -25.191 -5.108 1.00 0.00 H new ATOM 0 HA VAL B 41 2.243 -26.140 -7.952 1.00 0.00 H new ATOM 0 HB VAL B 41 -0.211 -25.517 -6.516 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -1.211 -26.567 -8.618 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -0.206 -25.145 -8.984 1.00 0.00 H new ATOM 0 HG13 VAL B 41 0.442 -26.783 -9.241 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -0.858 -27.905 -6.812 1.00 0.00 H new ATOM 0 HG22 VAL B 41 0.805 -28.255 -7.342 1.00 0.00 H new ATOM 0 HG23 VAL B 41 0.501 -27.685 -5.684 1.00 0.00 H new ATOM 2216 N GLN B 42 1.006 -23.416 -7.961 1.00 0.00 N ATOM 2217 CA GLN B 42 1.269 -22.085 -8.516 1.00 0.00 C ATOM 2218 C GLN B 42 0.964 -20.983 -7.496 1.00 0.00 C ATOM 2219 O GLN B 42 -0.168 -20.868 -7.046 1.00 0.00 O ATOM 2220 CB GLN B 42 0.695 -21.881 -9.930 1.00 0.00 C ATOM 2221 CG GLN B 42 -0.761 -21.482 -9.934 1.00 0.00 C ATOM 2222 CD GLN B 42 -1.373 -21.182 -11.292 1.00 0.00 C ATOM 2223 OE1 GLN B 42 -1.694 -22.059 -12.085 1.00 0.00 O ATOM 2224 NE2 GLN B 42 -1.597 -19.915 -11.556 1.00 0.00 N ATOM 0 H GLN B 42 0.058 -23.760 -8.112 1.00 0.00 H new ATOM 0 HA GLN B 42 2.341 -22.005 -8.696 1.00 0.00 H new ATOM 0 HB2 GLN B 42 1.276 -21.114 -10.443 1.00 0.00 H new ATOM 0 HB3 GLN B 42 0.813 -22.803 -10.499 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -1.336 -22.282 -9.469 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -0.876 -20.600 -9.305 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -1.323 -19.198 -10.884 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -2.045 -19.648 -12.433 1.00 0.00 H new ATOM 2233 N TYR B 43 1.925 -20.130 -7.184 1.00 0.00 N ATOM 2234 CA TYR B 43 1.686 -18.972 -6.307 1.00 0.00 C ATOM 2235 C TYR B 43 1.700 -17.691 -7.115 1.00 0.00 C ATOM 2236 O TYR B 43 2.408 -17.574 -8.105 1.00 0.00 O ATOM 2237 CB TYR B 43 2.736 -18.957 -5.161 1.00 0.00 C ATOM 2238 CG TYR B 43 4.110 -18.279 -5.332 1.00 0.00 C ATOM 2239 CD1 TYR B 43 4.742 -18.263 -6.584 1.00 0.00 C ATOM 2240 CD2 TYR B 43 4.764 -17.694 -4.231 1.00 0.00 C ATOM 2241 CE1 TYR B 43 5.955 -17.640 -6.757 1.00 0.00 C ATOM 2242 CE2 TYR B 43 6.034 -17.126 -4.397 1.00 0.00 C ATOM 2243 CZ TYR B 43 6.624 -17.101 -5.671 1.00 0.00 C ATOM 2244 OH TYR B 43 7.868 -16.582 -5.887 1.00 0.00 O ATOM 0 H TYR B 43 2.884 -20.209 -7.521 1.00 0.00 H new ATOM 0 HA TYR B 43 0.699 -19.052 -5.851 1.00 0.00 H new ATOM 0 HB2 TYR B 43 2.258 -18.490 -4.300 1.00 0.00 H new ATOM 0 HB3 TYR B 43 2.927 -19.996 -4.894 1.00 0.00 H new ATOM 0 HD1 TYR B 43 4.268 -18.748 -7.425 1.00 0.00 H new ATOM 0 HD2 TYR B 43 4.288 -17.683 -3.262 1.00 0.00 H new ATOM 0 HE1 TYR B 43 6.388 -17.571 -7.744 1.00 0.00 H new ATOM 0 HE2 TYR B 43 6.557 -16.709 -3.549 1.00 0.00 H new ATOM 0 HH TYR B 43 8.228 -16.235 -5.044 1.00 0.00 H new ATOM 2254 N LYS B 44 1.053 -16.678 -6.586 1.00 0.00 N ATOM 2255 CA LYS B 44 1.196 -15.311 -7.087 1.00 0.00 C ATOM 2256 C LYS B 44 1.543 -14.391 -5.903 1.00 0.00 C ATOM 2257 O LYS B 44 1.255 -14.649 -4.730 1.00 0.00 O ATOM 2258 CB LYS B 44 -0.127 -14.984 -7.780 1.00 0.00 C ATOM 2259 CG LYS B 44 -0.350 -15.705 -9.124 1.00 0.00 C ATOM 2260 CD LYS B 44 -1.801 -15.634 -9.608 1.00 0.00 C ATOM 2261 CE LYS B 44 -2.115 -14.357 -10.382 1.00 0.00 C ATOM 2262 NZ LYS B 44 -3.569 -14.140 -10.439 1.00 0.00 N ATOM 0 H LYS B 44 0.412 -16.767 -5.798 1.00 0.00 H new ATOM 0 HA LYS B 44 2.003 -15.177 -7.807 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -0.946 -15.239 -7.107 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -0.176 -13.908 -7.949 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.301 -15.264 -9.879 1.00 0.00 H new ATOM 0 HG3 LYS B 44 -0.058 -16.750 -9.022 1.00 0.00 H new ATOM 0 HD2 LYS B 44 -2.008 -16.496 -10.242 1.00 0.00 H new ATOM 0 HD3 LYS B 44 -2.468 -15.703 -8.748 1.00 0.00 H new ATOM 0 HE2 LYS B 44 -1.632 -13.505 -9.903 1.00 0.00 H new ATOM 0 HE3 LYS B 44 -1.711 -14.427 -11.392 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 -3.769 -13.268 -10.969 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 -4.022 -14.946 -10.915 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 -3.945 -14.053 -9.473 1.00 0.00 H new ATOM 2276 N THR B 45 2.196 -13.287 -6.255 1.00 0.00 N ATOM 2277 CA THR B 45 2.569 -12.237 -5.277 1.00 0.00 C ATOM 2278 C THR B 45 1.469 -11.147 -5.296 1.00 0.00 C ATOM 2279 O THR B 45 0.674 -11.042 -6.225 1.00 0.00 O ATOM 2280 CB THR B 45 3.987 -11.642 -5.561 1.00 0.00 C ATOM 2281 OG1 THR B 45 4.796 -12.476 -6.391 1.00 0.00 O ATOM 2282 CG2 THR B 45 4.795 -11.403 -4.293 1.00 0.00 C ATOM 0 H THR B 45 2.485 -13.084 -7.212 1.00 0.00 H new ATOM 0 HA THR B 45 2.633 -12.676 -4.281 1.00 0.00 H new ATOM 0 HB THR B 45 3.765 -10.702 -6.065 1.00 0.00 H new ATOM 0 HG1 THR B 45 5.667 -12.050 -6.533 1.00 0.00 H new ATOM 0 HG21 THR B 45 5.769 -10.990 -4.555 1.00 0.00 H new ATOM 0 HG22 THR B 45 4.264 -10.701 -3.650 1.00 0.00 H new ATOM 0 HG23 THR B 45 4.931 -12.347 -3.765 1.00 0.00 H new ATOM 2290 N GLN B 46 1.425 -10.339 -4.247 1.00 0.00 N ATOM 2291 CA GLN B 46 0.371 -9.323 -4.051 1.00 0.00 C ATOM 2292 C GLN B 46 1.064 -8.032 -3.604 1.00 0.00 C ATOM 2293 O GLN B 46 1.911 -8.020 -2.701 1.00 0.00 O ATOM 2294 CB GLN B 46 -0.588 -9.716 -2.928 1.00 0.00 C ATOM 2295 CG GLN B 46 -1.395 -11.000 -3.083 1.00 0.00 C ATOM 2296 CD GLN B 46 -2.852 -10.917 -3.601 1.00 0.00 C ATOM 2297 OE1 GLN B 46 -3.646 -11.839 -3.454 1.00 0.00 O ATOM 2298 NE2 GLN B 46 -3.260 -9.883 -4.299 1.00 0.00 N ATOM 0 H GLN B 46 2.117 -10.360 -3.498 1.00 0.00 H new ATOM 0 HA GLN B 46 -0.189 -9.217 -4.980 1.00 0.00 H new ATOM 0 HB2 GLN B 46 -0.008 -9.797 -2.009 1.00 0.00 H new ATOM 0 HB3 GLN B 46 -1.292 -8.895 -2.790 1.00 0.00 H new ATOM 0 HG2 GLN B 46 -0.844 -11.655 -3.757 1.00 0.00 H new ATOM 0 HG3 GLN B 46 -1.420 -11.492 -2.111 1.00 0.00 H new ATOM 0 HE21 GLN B 46 -2.636 -9.091 -4.449 1.00 0.00 H new ATOM 0 HE22 GLN B 46 -4.201 -9.872 -4.691 1.00 0.00 H new ATOM 2307 N VAL B 47 0.630 -6.937 -4.220 1.00 0.00 N ATOM 2308 CA VAL B 47 1.170 -5.597 -3.920 1.00 0.00 C ATOM 2309 C VAL B 47 0.033 -4.858 -3.164 1.00 0.00 C ATOM 2310 O VAL B 47 -1.046 -4.598 -3.709 1.00 0.00 O ATOM 2311 CB VAL B 47 1.671 -4.915 -5.235 1.00 0.00 C ATOM 2312 CG1 VAL B 47 2.097 -3.450 -4.995 1.00 0.00 C ATOM 2313 CG2 VAL B 47 2.867 -5.675 -5.874 1.00 0.00 C ATOM 0 H VAL B 47 -0.098 -6.942 -4.935 1.00 0.00 H new ATOM 0 HA VAL B 47 2.056 -5.602 -3.285 1.00 0.00 H new ATOM 0 HB VAL B 47 0.823 -4.943 -5.920 1.00 0.00 H new ATOM 0 HG11 VAL B 47 2.439 -3.012 -5.933 1.00 0.00 H new ATOM 0 HG12 VAL B 47 1.247 -2.881 -4.617 1.00 0.00 H new ATOM 0 HG13 VAL B 47 2.906 -3.421 -4.265 1.00 0.00 H new ATOM 0 HG21 VAL B 47 3.179 -5.163 -6.784 1.00 0.00 H new ATOM 0 HG22 VAL B 47 3.699 -5.702 -5.170 1.00 0.00 H new ATOM 0 HG23 VAL B 47 2.563 -6.693 -6.116 1.00 0.00 H new ATOM 2323 N VAL B 48 0.340 -4.483 -1.914 1.00 0.00 N ATOM 2324 CA VAL B 48 -0.444 -3.462 -1.165 1.00 0.00 C ATOM 2325 C VAL B 48 0.089 -2.044 -1.558 1.00 0.00 C ATOM 2326 O VAL B 48 1.266 -1.871 -1.892 1.00 0.00 O ATOM 2327 CB VAL B 48 -0.416 -3.777 0.375 1.00 0.00 C ATOM 2328 CG1 VAL B 48 0.954 -3.580 1.040 1.00 0.00 C ATOM 2329 CG2 VAL B 48 -1.468 -2.996 1.181 1.00 0.00 C ATOM 0 H VAL B 48 1.126 -4.867 -1.390 1.00 0.00 H new ATOM 0 HA VAL B 48 -1.500 -3.486 -1.434 1.00 0.00 H new ATOM 0 HB VAL B 48 -0.658 -4.839 0.404 1.00 0.00 H new ATOM 0 HG11 VAL B 48 0.881 -3.820 2.101 1.00 0.00 H new ATOM 0 HG12 VAL B 48 1.685 -4.237 0.569 1.00 0.00 H new ATOM 0 HG13 VAL B 48 1.270 -2.543 0.923 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -1.391 -3.263 2.235 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -1.295 -1.926 1.064 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -2.464 -3.245 0.816 1.00 0.00 H new ATOM 2339 N ALA B 49 -0.798 -1.042 -1.495 1.00 0.00 N ATOM 2340 CA ALA B 49 -0.421 0.379 -1.681 1.00 0.00 C ATOM 2341 C ALA B 49 -0.921 1.250 -0.489 1.00 0.00 C ATOM 2342 O ALA B 49 -2.015 1.061 0.052 1.00 0.00 O ATOM 2343 CB ALA B 49 -0.875 0.885 -3.067 1.00 0.00 C ATOM 0 H ALA B 49 -1.792 -1.184 -1.315 1.00 0.00 H new ATOM 0 HA ALA B 49 0.665 0.469 -1.672 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -0.589 1.930 -3.184 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -0.399 0.289 -3.846 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -1.958 0.794 -3.151 1.00 0.00 H new ATOM 2349 N GLY B 50 -0.081 2.226 -0.119 1.00 0.00 N ATOM 2350 CA GLY B 50 -0.455 3.348 0.775 1.00 0.00 C ATOM 2351 C GLY B 50 -0.186 4.676 0.055 1.00 0.00 C ATOM 2352 O GLY B 50 0.696 4.743 -0.799 1.00 0.00 O ATOM 0 H GLY B 50 0.889 2.266 -0.431 1.00 0.00 H new ATOM 0 HA2 GLY B 50 -1.508 3.275 1.049 1.00 0.00 H new ATOM 0 HA3 GLY B 50 0.119 3.299 1.700 1.00 0.00 H new ATOM 2356 N THR B 51 -0.936 5.741 0.376 1.00 0.00 N ATOM 2357 CA THR B 51 -0.843 7.008 -0.401 1.00 0.00 C ATOM 2358 C THR B 51 -0.503 8.162 0.577 1.00 0.00 C ATOM 2359 O THR B 51 -1.326 8.586 1.394 1.00 0.00 O ATOM 2360 CB THR B 51 -2.100 7.277 -1.285 1.00 0.00 C ATOM 2361 OG1 THR B 51 -2.668 6.081 -1.811 1.00 0.00 O ATOM 2362 CG2 THR B 51 -1.737 8.162 -2.496 1.00 0.00 C ATOM 0 H THR B 51 -1.602 5.762 1.148 1.00 0.00 H new ATOM 0 HA THR B 51 -0.036 6.926 -1.129 1.00 0.00 H new ATOM 0 HB THR B 51 -2.818 7.767 -0.628 1.00 0.00 H new ATOM 0 HG1 THR B 51 -3.452 6.303 -2.355 1.00 0.00 H new ATOM 0 HG21 THR B 51 -2.628 8.337 -3.099 1.00 0.00 H new ATOM 0 HG22 THR B 51 -1.343 9.116 -2.145 1.00 0.00 H new ATOM 0 HG23 THR B 51 -0.983 7.659 -3.101 1.00 0.00 H new ATOM 2370 N ASN B 52 0.727 8.677 0.431 1.00 0.00 N ATOM 2371 CA ASN B 52 1.127 10.000 0.964 1.00 0.00 C ATOM 2372 C ASN B 52 0.909 11.052 -0.179 1.00 0.00 C ATOM 2373 O ASN B 52 0.911 10.750 -1.380 1.00 0.00 O ATOM 2374 CB ASN B 52 2.554 9.894 1.634 1.00 0.00 C ATOM 2375 CG ASN B 52 3.644 10.813 1.070 1.00 0.00 C ATOM 2376 OD1 ASN B 52 3.755 10.901 -0.141 1.00 0.00 O ATOM 2377 ND2 ASN B 52 4.417 11.547 1.847 1.00 0.00 N ATOM 0 H ASN B 52 1.478 8.192 -0.060 1.00 0.00 H new ATOM 0 HA ASN B 52 0.513 10.360 1.790 1.00 0.00 H new ATOM 0 HB2 ASN B 52 2.448 10.104 2.698 1.00 0.00 H new ATOM 0 HB3 ASN B 52 2.897 8.863 1.545 1.00 0.00 H new ATOM 0 HD21 ASN B 52 5.100 12.181 1.434 1.00 0.00 H new ATOM 0 HD22 ASN B 52 4.331 11.480 2.861 1.00 0.00 H new ATOM 2384 N TYR B 53 0.740 12.309 0.244 1.00 0.00 N ATOM 2385 CA TYR B 53 0.427 13.439 -0.669 1.00 0.00 C ATOM 2386 C TYR B 53 1.431 14.521 -0.337 1.00 0.00 C ATOM 2387 O TYR B 53 1.810 14.719 0.810 1.00 0.00 O ATOM 2388 CB TYR B 53 -1.015 14.032 -0.539 1.00 0.00 C ATOM 2389 CG TYR B 53 -2.092 13.068 -1.026 1.00 0.00 C ATOM 2390 CD1 TYR B 53 -2.231 11.828 -0.388 1.00 0.00 C ATOM 2391 CD2 TYR B 53 -2.805 13.317 -2.213 1.00 0.00 C ATOM 2392 CE1 TYR B 53 -2.909 10.806 -1.013 1.00 0.00 C ATOM 2393 CE2 TYR B 53 -3.607 12.309 -2.768 1.00 0.00 C ATOM 2394 CZ TYR B 53 -3.643 11.044 -2.171 1.00 0.00 C ATOM 2395 OH TYR B 53 -4.469 10.054 -2.633 1.00 0.00 O ATOM 0 H TYR B 53 0.814 12.582 1.224 1.00 0.00 H new ATOM 0 HA TYR B 53 0.480 13.067 -1.692 1.00 0.00 H new ATOM 0 HB2 TYR B 53 -1.206 14.288 0.503 1.00 0.00 H new ATOM 0 HB3 TYR B 53 -1.076 14.958 -1.111 1.00 0.00 H new ATOM 0 HD1 TYR B 53 -1.807 11.674 0.593 1.00 0.00 H new ATOM 0 HD2 TYR B 53 -2.735 14.281 -2.695 1.00 0.00 H new ATOM 0 HE1 TYR B 53 -2.871 9.809 -0.600 1.00 0.00 H new ATOM 0 HE2 TYR B 53 -4.194 12.508 -3.652 1.00 0.00 H new ATOM 0 HH TYR B 53 -4.920 10.358 -3.448 1.00 0.00 H new ATOM 2405 N TYR B 54 1.816 15.229 -1.379 1.00 0.00 N ATOM 2406 CA TYR B 54 2.727 16.376 -1.297 1.00 0.00 C ATOM 2407 C TYR B 54 1.927 17.453 -1.975 1.00 0.00 C ATOM 2408 O TYR B 54 1.677 17.286 -3.156 1.00 0.00 O ATOM 2409 CB TYR B 54 4.050 16.198 -2.071 1.00 0.00 C ATOM 2410 CG TYR B 54 4.790 14.907 -1.833 1.00 0.00 C ATOM 2411 CD1 TYR B 54 4.363 13.736 -2.448 1.00 0.00 C ATOM 2412 CD2 TYR B 54 5.831 14.861 -0.922 1.00 0.00 C ATOM 2413 CE1 TYR B 54 4.973 12.540 -2.143 1.00 0.00 C ATOM 2414 CE2 TYR B 54 6.456 13.648 -0.619 1.00 0.00 C ATOM 2415 CZ TYR B 54 6.018 12.487 -1.216 1.00 0.00 C ATOM 2416 OH TYR B 54 6.501 11.311 -0.730 1.00 0.00 O ATOM 0 H TYR B 54 1.504 15.028 -2.329 1.00 0.00 H new ATOM 0 HA TYR B 54 3.029 16.561 -0.266 1.00 0.00 H new ATOM 0 HB2 TYR B 54 3.837 16.280 -3.137 1.00 0.00 H new ATOM 0 HB3 TYR B 54 4.712 17.025 -1.814 1.00 0.00 H new ATOM 0 HD1 TYR B 54 3.555 13.764 -3.164 1.00 0.00 H new ATOM 0 HD2 TYR B 54 6.163 15.769 -0.441 1.00 0.00 H new ATOM 0 HE1 TYR B 54 4.640 11.633 -2.625 1.00 0.00 H new ATOM 0 HE2 TYR B 54 7.279 13.621 0.080 1.00 0.00 H new ATOM 0 HH TYR B 54 5.779 10.820 -0.286 1.00 0.00 H new ATOM 2426 N ILE B 55 1.557 18.544 -1.313 1.00 0.00 N ATOM 2427 CA ILE B 55 0.751 19.615 -1.961 1.00 0.00 C ATOM 2428 C ILE B 55 1.490 20.942 -1.896 1.00 0.00 C ATOM 2429 O ILE B 55 2.163 21.270 -0.930 1.00 0.00 O ATOM 2430 CB ILE B 55 -0.704 19.672 -1.401 1.00 0.00 C ATOM 2431 CG1 ILE B 55 -1.403 18.367 -1.834 1.00 0.00 C ATOM 2432 CG2 ILE B 55 -1.483 20.928 -1.867 1.00 0.00 C ATOM 2433 CD1 ILE B 55 -2.674 18.062 -1.132 1.00 0.00 C ATOM 0 H ILE B 55 1.791 18.725 -0.337 1.00 0.00 H new ATOM 0 HA ILE B 55 0.631 19.375 -3.018 1.00 0.00 H new ATOM 0 HB ILE B 55 -0.677 19.755 -0.315 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -1.603 18.420 -2.904 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -0.714 17.537 -1.679 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.488 20.910 -1.445 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.963 21.825 -1.529 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.547 20.934 -2.955 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -3.083 17.125 -1.510 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -2.486 17.970 -0.062 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.388 18.866 -1.307 1.00 0.00 H new ATOM 2445 N LYS B 56 1.281 21.728 -2.943 1.00 0.00 N ATOM 2446 CA LYS B 56 1.484 23.172 -2.898 1.00 0.00 C ATOM 2447 C LYS B 56 0.143 23.867 -3.079 1.00 0.00 C ATOM 2448 O LYS B 56 -0.770 23.422 -3.779 1.00 0.00 O ATOM 2449 CB LYS B 56 2.588 23.514 -3.883 1.00 0.00 C ATOM 2450 CG LYS B 56 3.240 24.907 -3.833 1.00 0.00 C ATOM 2451 CD LYS B 56 4.754 24.781 -4.093 1.00 0.00 C ATOM 2452 CE LYS B 56 5.078 23.961 -5.367 1.00 0.00 C ATOM 2453 NZ LYS B 56 6.507 23.747 -5.543 1.00 0.00 N ATOM 0 H LYS B 56 0.965 21.383 -3.850 1.00 0.00 H new ATOM 0 HA LYS B 56 1.838 23.543 -1.936 1.00 0.00 H new ATOM 0 HB2 LYS B 56 3.381 22.777 -3.755 1.00 0.00 H new ATOM 0 HB3 LYS B 56 2.185 23.377 -4.886 1.00 0.00 H new ATOM 0 HG2 LYS B 56 2.786 25.559 -4.579 1.00 0.00 H new ATOM 0 HG3 LYS B 56 3.065 25.366 -2.860 1.00 0.00 H new ATOM 0 HD2 LYS B 56 5.186 25.777 -4.188 1.00 0.00 H new ATOM 0 HD3 LYS B 56 5.228 24.309 -3.232 1.00 0.00 H new ATOM 0 HE2 LYS B 56 4.573 22.996 -5.313 1.00 0.00 H new ATOM 0 HE3 LYS B 56 4.681 24.480 -6.240 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 6.669 22.802 -5.946 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 6.889 24.469 -6.187 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 6.985 23.817 -4.622 1.00 0.00 H new ATOM 2467 N VAL B 57 0.042 24.966 -2.353 1.00 0.00 N ATOM 2468 CA VAL B 57 -1.178 25.757 -2.270 1.00 0.00 C ATOM 2469 C VAL B 57 -0.792 27.146 -1.718 1.00 0.00 C ATOM 2470 O VAL B 57 -0.466 27.311 -0.541 1.00 0.00 O ATOM 2471 CB VAL B 57 -2.257 25.088 -1.392 1.00 0.00 C ATOM 2472 CG1 VAL B 57 -1.816 24.913 0.090 1.00 0.00 C ATOM 2473 CG2 VAL B 57 -3.521 25.942 -1.590 1.00 0.00 C ATOM 0 H VAL B 57 0.811 25.340 -1.798 1.00 0.00 H new ATOM 0 HA VAL B 57 -1.621 25.845 -3.262 1.00 0.00 H new ATOM 0 HB VAL B 57 -2.446 24.057 -1.692 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -2.618 24.437 0.654 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -0.923 24.290 0.133 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -1.598 25.889 0.522 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -4.336 25.529 -0.996 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -3.322 26.965 -1.271 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -3.802 25.938 -2.643 1.00 0.00 H new ATOM 2483 N ARG B 58 -1.004 28.177 -2.511 1.00 0.00 N ATOM 2484 CA ARG B 58 -0.689 29.543 -2.091 1.00 0.00 C ATOM 2485 C ARG B 58 -1.777 30.143 -1.215 1.00 0.00 C ATOM 2486 O ARG B 58 -2.786 30.647 -1.701 1.00 0.00 O ATOM 2487 CB ARG B 58 -0.310 30.491 -3.226 1.00 0.00 C ATOM 2488 CG ARG B 58 -1.157 30.356 -4.482 1.00 0.00 C ATOM 2489 CD ARG B 58 -1.251 31.587 -5.339 1.00 0.00 C ATOM 2490 NE ARG B 58 -2.446 31.435 -6.174 1.00 0.00 N ATOM 2491 CZ ARG B 58 -2.603 32.227 -7.216 1.00 0.00 C ATOM 2492 NH1 ARG B 58 -1.750 32.214 -8.232 1.00 0.00 N ATOM 2493 NH2 ARG B 58 -3.629 33.045 -7.213 1.00 0.00 N ATOM 0 H ARG B 58 -1.393 28.103 -3.451 1.00 0.00 H new ATOM 0 HA ARG B 58 0.214 29.434 -1.490 1.00 0.00 H new ATOM 0 HB2 ARG B 58 -0.384 31.516 -2.864 1.00 0.00 H new ATOM 0 HB3 ARG B 58 0.734 30.321 -3.489 1.00 0.00 H new ATOM 0 HG2 ARG B 58 -0.751 29.545 -5.086 1.00 0.00 H new ATOM 0 HG3 ARG B 58 -2.165 30.062 -4.189 1.00 0.00 H new ATOM 0 HD2 ARG B 58 -1.323 32.483 -4.722 1.00 0.00 H new ATOM 0 HD3 ARG B 58 -0.360 31.696 -5.957 1.00 0.00 H new ATOM 0 HE ARG B 58 -3.146 30.727 -5.952 1.00 0.00 H new ATOM 0 HH11 ARG B 58 -0.950 31.581 -8.218 1.00 0.00 H new ATOM 0 HH12 ARG B 58 -1.894 32.837 -9.027 1.00 0.00 H new ATOM 0 HH21 ARG B 58 -4.272 33.053 -6.422 1.00 0.00 H new ATOM 0 HH22 ARG B 58 -3.783 33.673 -8.002 1.00 0.00 H new ATOM 2507 N ALA B 59 -1.471 30.088 0.074 1.00 0.00 N ATOM 2508 CA ALA B 59 -2.176 30.835 1.103 1.00 0.00 C ATOM 2509 C ALA B 59 -1.107 31.679 1.794 1.00 0.00 C ATOM 2510 O ALA B 59 -0.485 31.295 2.781 1.00 0.00 O ATOM 2511 CB ALA B 59 -2.822 29.803 2.007 1.00 0.00 C ATOM 0 H ALA B 59 -0.712 29.512 0.439 1.00 0.00 H new ATOM 0 HA ALA B 59 -2.963 31.501 0.749 1.00 0.00 H new ATOM 0 HB1 ALA B 59 -3.369 30.308 2.803 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -3.511 29.191 1.426 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -2.051 29.168 2.443 1.00 0.00 H new ATOM 2517 N GLY B 60 -0.910 32.848 1.218 1.00 0.00 N ATOM 2518 CA GLY B 60 -0.278 33.976 1.891 1.00 0.00 C ATOM 2519 C GLY B 60 -1.132 35.214 1.635 1.00 0.00 C ATOM 2520 O GLY B 60 -1.975 35.267 0.723 1.00 0.00 O ATOM 0 H GLY B 60 -1.186 33.049 0.257 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -0.195 33.784 2.961 1.00 0.00 H new ATOM 0 HA3 GLY B 60 0.734 34.126 1.515 1.00 0.00 H new ATOM 2524 N ASP B 61 -0.824 36.286 2.376 1.00 0.00 N ATOM 2525 CA ASP B 61 -1.268 37.643 1.965 1.00 0.00 C ATOM 2526 C ASP B 61 -0.698 38.030 0.552 1.00 0.00 C ATOM 2527 O ASP B 61 -1.470 38.244 -0.386 1.00 0.00 O ATOM 2528 CB ASP B 61 -0.958 38.693 3.065 1.00 0.00 C ATOM 2529 CG ASP B 61 -2.012 39.802 3.065 1.00 0.00 C ATOM 2530 OD1 ASP B 61 -2.036 40.697 2.212 1.00 0.00 O ATOM 2531 OD2 ASP B 61 -2.946 39.678 4.049 1.00 0.00 O ATOM 0 H ASP B 61 -0.285 36.254 3.241 1.00 0.00 H new ATOM 0 HA ASP B 61 -2.352 37.631 1.856 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -0.933 38.208 4.041 1.00 0.00 H new ATOM 0 HB3 ASP B 61 0.030 39.123 2.897 1.00 0.00 H new ATOM 2537 N ASN B 62 0.641 37.989 0.424 1.00 0.00 N ATOM 2538 CA ASN B 62 1.343 37.923 -0.887 1.00 0.00 C ATOM 2539 C ASN B 62 2.192 36.620 -1.136 1.00 0.00 C ATOM 2540 O ASN B 62 3.065 36.614 -2.011 1.00 0.00 O ATOM 2541 CB ASN B 62 2.244 39.193 -0.955 1.00 0.00 C ATOM 2542 CG ASN B 62 2.388 39.792 -2.366 1.00 0.00 C ATOM 2543 OD1 ASN B 62 2.000 39.221 -3.386 1.00 0.00 O ATOM 2544 ND2 ASN B 62 2.945 40.984 -2.438 1.00 0.00 N ATOM 0 H ASN B 62 1.275 38.000 1.223 1.00 0.00 H new ATOM 0 HA ASN B 62 0.592 37.886 -1.677 1.00 0.00 H new ATOM 0 HB2 ASN B 62 1.832 39.953 -0.291 1.00 0.00 H new ATOM 0 HB3 ASN B 62 3.235 38.942 -0.577 1.00 0.00 H new ATOM 0 HD21 ASN B 62 3.057 41.441 -3.343 1.00 0.00 H new ATOM 0 HD22 ASN B 62 3.264 41.450 -1.589 1.00 0.00 H new ATOM 2551 N LYS B 63 1.954 35.535 -0.379 1.00 0.00 N ATOM 2552 CA LYS B 63 2.897 34.396 -0.271 1.00 0.00 C ATOM 2553 C LYS B 63 2.230 33.065 -0.693 1.00 0.00 C ATOM 2554 O LYS B 63 1.043 32.989 -1.034 1.00 0.00 O ATOM 2555 CB LYS B 63 3.457 34.324 1.172 1.00 0.00 C ATOM 2556 CG LYS B 63 4.224 35.549 1.690 1.00 0.00 C ATOM 2557 CD LYS B 63 3.362 36.486 2.556 1.00 0.00 C ATOM 2558 CE LYS B 63 4.211 37.422 3.426 1.00 0.00 C ATOM 2559 NZ LYS B 63 4.868 38.452 2.604 1.00 0.00 N ATOM 0 H LYS B 63 1.106 35.418 0.176 1.00 0.00 H new ATOM 0 HA LYS B 63 3.726 34.559 -0.959 1.00 0.00 H new ATOM 0 HB2 LYS B 63 2.623 34.137 1.849 1.00 0.00 H new ATOM 0 HB3 LYS B 63 4.119 33.460 1.235 1.00 0.00 H new ATOM 0 HG2 LYS B 63 5.081 35.212 2.274 1.00 0.00 H new ATOM 0 HG3 LYS B 63 4.616 36.109 0.841 1.00 0.00 H new ATOM 0 HD2 LYS B 63 2.716 37.081 1.911 1.00 0.00 H new ATOM 0 HD3 LYS B 63 2.712 35.889 3.196 1.00 0.00 H new ATOM 0 HE2 LYS B 63 3.581 37.898 4.177 1.00 0.00 H new ATOM 0 HE3 LYS B 63 4.964 36.844 3.962 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 5.436 39.073 3.215 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 5.486 37.995 1.904 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 4.146 39.017 2.112 1.00 0.00 H new ATOM 2573 N TYR B 64 3.072 32.019 -0.733 1.00 0.00 N ATOM 2574 CA TYR B 64 2.694 30.691 -1.237 1.00 0.00 C ATOM 2575 C TYR B 64 3.013 29.680 -0.125 1.00 0.00 C ATOM 2576 O TYR B 64 4.106 29.704 0.419 1.00 0.00 O ATOM 2577 CB TYR B 64 3.464 30.317 -2.530 1.00 0.00 C ATOM 2578 CG TYR B 64 3.122 31.042 -3.853 1.00 0.00 C ATOM 2579 CD1 TYR B 64 3.056 32.448 -3.921 1.00 0.00 C ATOM 2580 CD2 TYR B 64 2.779 30.289 -4.997 1.00 0.00 C ATOM 2581 CE1 TYR B 64 2.562 33.083 -5.051 1.00 0.00 C ATOM 2582 CE2 TYR B 64 2.325 30.935 -6.153 1.00 0.00 C ATOM 2583 CZ TYR B 64 2.217 32.335 -6.174 1.00 0.00 C ATOM 2584 OH TYR B 64 1.733 32.990 -7.274 1.00 0.00 O ATOM 0 H TYR B 64 4.039 32.073 -0.414 1.00 0.00 H new ATOM 0 HA TYR B 64 1.635 30.686 -1.494 1.00 0.00 H new ATOM 0 HB2 TYR B 64 4.525 30.474 -2.336 1.00 0.00 H new ATOM 0 HB3 TYR B 64 3.325 29.249 -2.697 1.00 0.00 H new ATOM 0 HD1 TYR B 64 3.394 33.039 -3.083 1.00 0.00 H new ATOM 0 HD2 TYR B 64 2.867 29.213 -4.980 1.00 0.00 H new ATOM 0 HE1 TYR B 64 2.445 34.157 -5.060 1.00 0.00 H new ATOM 0 HE2 TYR B 64 2.059 30.358 -7.026 1.00 0.00 H new ATOM 0 HH TYR B 64 1.536 32.341 -7.981 1.00 0.00 H new ATOM 2594 N MET B 65 2.113 28.761 0.196 1.00 0.00 N ATOM 2595 CA MET B 65 2.367 27.719 1.229 1.00 0.00 C ATOM 2596 C MET B 65 2.437 26.358 0.522 1.00 0.00 C ATOM 2597 O MET B 65 1.749 26.125 -0.465 1.00 0.00 O ATOM 2598 CB MET B 65 1.278 27.858 2.308 1.00 0.00 C ATOM 2599 CG MET B 65 1.212 26.749 3.372 1.00 0.00 C ATOM 2600 SD MET B 65 -0.477 26.160 3.439 1.00 0.00 S ATOM 2601 CE MET B 65 -1.174 27.516 4.363 1.00 0.00 C ATOM 0 H MET B 65 1.191 28.701 -0.236 1.00 0.00 H new ATOM 0 HA MET B 65 3.319 27.829 1.748 1.00 0.00 H new ATOM 0 HB2 MET B 65 1.424 28.810 2.818 1.00 0.00 H new ATOM 0 HB3 MET B 65 0.310 27.909 1.809 1.00 0.00 H new ATOM 0 HG2 MET B 65 1.891 25.935 3.119 1.00 0.00 H new ATOM 0 HG3 MET B 65 1.522 27.132 4.344 1.00 0.00 H new ATOM 0 HE1 MET B 65 -2.259 27.506 4.261 1.00 0.00 H new ATOM 0 HE2 MET B 65 -0.907 27.415 5.415 1.00 0.00 H new ATOM 0 HE3 MET B 65 -0.782 28.458 3.979 1.00 0.00 H new ATOM 2611 N HIS B 66 3.263 25.423 1.003 1.00 0.00 N ATOM 2612 CA HIS B 66 3.273 24.078 0.400 1.00 0.00 C ATOM 2613 C HIS B 66 3.313 22.990 1.460 1.00 0.00 C ATOM 2614 O HIS B 66 4.323 22.806 2.098 1.00 0.00 O ATOM 2615 CB HIS B 66 4.330 24.023 -0.733 1.00 0.00 C ATOM 2616 CG HIS B 66 5.627 23.281 -0.545 1.00 0.00 C ATOM 2617 ND1 HIS B 66 6.845 23.819 -0.795 1.00 0.00 N ATOM 2618 CD2 HIS B 66 5.759 21.929 -0.254 1.00 0.00 C ATOM 2619 CE1 HIS B 66 7.636 22.714 -0.647 1.00 0.00 C ATOM 2620 NE2 HIS B 66 7.068 21.532 -0.344 1.00 0.00 N ATOM 0 H HIS B 66 3.912 25.559 1.778 1.00 0.00 H new ATOM 0 HA HIS B 66 2.331 23.862 -0.105 1.00 0.00 H new ATOM 0 HB2 HIS B 66 3.840 23.594 -1.607 1.00 0.00 H new ATOM 0 HB3 HIS B 66 4.584 25.053 -0.984 1.00 0.00 H new ATOM 0 HD2 HIS B 66 4.939 21.277 0.008 1.00 0.00 H new ATOM 0 HE1 HIS B 66 8.706 22.789 -0.772 1.00 0.00 H new ATOM 0 HE2 HIS B 66 7.488 20.611 -0.218 1.00 0.00 H new ATOM 2629 N LEU B 67 2.279 22.176 1.582 1.00 0.00 N ATOM 2630 CA LEU B 67 2.263 21.094 2.571 1.00 0.00 C ATOM 2631 C LEU B 67 1.887 19.721 2.005 1.00 0.00 C ATOM 2632 O LEU B 67 0.956 19.561 1.228 1.00 0.00 O ATOM 2633 CB LEU B 67 1.310 21.556 3.683 1.00 0.00 C ATOM 2634 CG LEU B 67 -0.168 21.685 3.244 1.00 0.00 C ATOM 2635 CD1 LEU B 67 -1.049 20.957 4.237 1.00 0.00 C ATOM 2636 CD2 LEU B 67 -0.565 23.125 2.910 1.00 0.00 C ATOM 0 H LEU B 67 1.436 22.238 1.012 1.00 0.00 H new ATOM 0 HA LEU B 67 3.272 20.926 2.948 1.00 0.00 H new ATOM 0 HB2 LEU B 67 1.370 20.851 4.512 1.00 0.00 H new ATOM 0 HB3 LEU B 67 1.650 22.521 4.059 1.00 0.00 H new ATOM 0 HG LEU B 67 -0.319 21.185 2.287 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -2.092 21.045 3.932 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -0.768 19.904 4.269 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -0.922 21.397 5.226 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -1.612 23.153 2.609 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -0.423 23.755 3.788 1.00 0.00 H new ATOM 0 HD23 LEU B 67 0.057 23.494 2.095 1.00 0.00 H new ATOM 2648 N LYS B 68 2.566 18.718 2.527 1.00 0.00 N ATOM 2649 CA LYS B 68 2.236 17.303 2.319 1.00 0.00 C ATOM 2650 C LYS B 68 1.248 16.755 3.386 1.00 0.00 C ATOM 2651 O LYS B 68 1.351 17.065 4.574 1.00 0.00 O ATOM 2652 CB LYS B 68 3.599 16.562 2.305 1.00 0.00 C ATOM 2653 CG LYS B 68 4.486 16.668 3.559 1.00 0.00 C ATOM 2654 CD LYS B 68 4.855 15.315 4.176 1.00 0.00 C ATOM 2655 CE LYS B 68 3.969 14.820 5.304 1.00 0.00 C ATOM 2656 NZ LYS B 68 3.764 13.373 5.212 1.00 0.00 N ATOM 0 H LYS B 68 3.382 18.857 3.122 1.00 0.00 H new ATOM 0 HA LYS B 68 1.701 17.150 1.382 1.00 0.00 H new ATOM 0 HB2 LYS B 68 3.404 15.506 2.121 1.00 0.00 H new ATOM 0 HB3 LYS B 68 4.173 16.933 1.456 1.00 0.00 H new ATOM 0 HG2 LYS B 68 5.402 17.200 3.300 1.00 0.00 H new ATOM 0 HG3 LYS B 68 3.969 17.269 4.308 1.00 0.00 H new ATOM 0 HD2 LYS B 68 4.849 14.566 3.384 1.00 0.00 H new ATOM 0 HD3 LYS B 68 5.878 15.377 4.548 1.00 0.00 H new ATOM 0 HE2 LYS B 68 4.424 15.066 6.264 1.00 0.00 H new ATOM 0 HE3 LYS B 68 3.007 15.331 5.267 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 2.881 13.116 5.698 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 3.703 13.094 4.212 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 4.562 12.880 5.661 1.00 0.00 H new ATOM 2670 N VAL B 69 0.297 15.920 2.943 1.00 0.00 N ATOM 2671 CA VAL B 69 -0.728 15.308 3.831 1.00 0.00 C ATOM 2672 C VAL B 69 -0.663 13.778 3.597 1.00 0.00 C ATOM 2673 O VAL B 69 -0.960 13.288 2.507 1.00 0.00 O ATOM 2674 CB VAL B 69 -2.142 15.918 3.534 1.00 0.00 C ATOM 2675 CG1 VAL B 69 -3.319 15.249 4.286 1.00 0.00 C ATOM 2676 CG2 VAL B 69 -2.182 17.427 3.863 1.00 0.00 C ATOM 0 H VAL B 69 0.208 15.645 1.965 1.00 0.00 H new ATOM 0 HA VAL B 69 -0.536 15.518 4.883 1.00 0.00 H new ATOM 0 HB VAL B 69 -2.281 15.731 2.469 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -4.252 15.742 4.013 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -3.372 14.195 4.014 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -3.162 15.339 5.361 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -3.175 17.820 3.646 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -1.955 17.575 4.919 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -1.444 17.951 3.256 1.00 0.00 H new ATOM 2686 N PHE B 70 -0.373 13.014 4.659 1.00 0.00 N ATOM 2687 CA PHE B 70 -0.540 11.544 4.630 1.00 0.00 C ATOM 2688 C PHE B 70 -2.018 11.140 4.919 1.00 0.00 C ATOM 2689 O PHE B 70 -2.637 11.590 5.886 1.00 0.00 O ATOM 2690 CB PHE B 70 0.460 10.865 5.605 1.00 0.00 C ATOM 2691 CG PHE B 70 0.423 9.313 5.624 1.00 0.00 C ATOM 2692 CD1 PHE B 70 0.340 8.567 4.428 1.00 0.00 C ATOM 2693 CD2 PHE B 70 0.332 8.635 6.851 1.00 0.00 C ATOM 2694 CE1 PHE B 70 0.123 7.194 4.457 1.00 0.00 C ATOM 2695 CE2 PHE B 70 0.135 7.249 6.879 1.00 0.00 C ATOM 2696 CZ PHE B 70 0.018 6.534 5.681 1.00 0.00 C ATOM 0 H PHE B 70 -0.024 13.380 5.545 1.00 0.00 H new ATOM 0 HA PHE B 70 -0.310 11.186 3.627 1.00 0.00 H new ATOM 0 HB2 PHE B 70 1.469 11.184 5.344 1.00 0.00 H new ATOM 0 HB3 PHE B 70 0.262 11.229 6.613 1.00 0.00 H new ATOM 0 HD1 PHE B 70 0.446 9.070 3.478 1.00 0.00 H new ATOM 0 HD2 PHE B 70 0.414 9.185 7.777 1.00 0.00 H new ATOM 0 HE1 PHE B 70 0.036 6.640 3.534 1.00 0.00 H new ATOM 0 HE2 PHE B 70 0.073 6.731 7.825 1.00 0.00 H new ATOM 0 HZ PHE B 70 -0.154 5.468 5.705 1.00 0.00 H new ATOM 2706 N LYS B 71 -2.518 10.221 4.083 1.00 0.00 N ATOM 2707 CA LYS B 71 -3.823 9.544 4.281 1.00 0.00 C ATOM 2708 C LYS B 71 -3.637 8.001 4.313 1.00 0.00 C ATOM 2709 O LYS B 71 -2.820 7.428 3.583 1.00 0.00 O ATOM 2710 CB LYS B 71 -4.824 9.976 3.183 1.00 0.00 C ATOM 2711 CG LYS B 71 -4.418 9.596 1.745 1.00 0.00 C ATOM 2712 CD LYS B 71 -5.503 9.833 0.690 1.00 0.00 C ATOM 2713 CE LYS B 71 -5.808 11.326 0.475 1.00 0.00 C ATOM 2714 NZ LYS B 71 -6.703 11.539 -0.664 1.00 0.00 N ATOM 0 H LYS B 71 -2.030 9.918 3.240 1.00 0.00 H new ATOM 0 HA LYS B 71 -4.236 9.845 5.244 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -5.794 9.529 3.401 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -4.952 11.057 3.235 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -3.531 10.167 1.469 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -4.137 8.543 1.727 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -5.187 9.391 -0.255 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -6.416 9.320 0.992 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -6.262 11.738 1.376 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -4.876 11.868 0.312 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -7.152 12.474 -0.583 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -6.157 11.493 -1.548 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -7.437 10.802 -0.672 1.00 0.00 H new ATOM 2728 N SER B 72 -4.482 7.331 5.109 1.00 0.00 N ATOM 2729 CA SER B 72 -4.555 5.849 5.128 1.00 0.00 C ATOM 2730 C SER B 72 -5.545 5.379 4.025 1.00 0.00 C ATOM 2731 O SER B 72 -5.140 5.186 2.873 1.00 0.00 O ATOM 2732 CB SER B 72 -4.871 5.382 6.575 1.00 0.00 C ATOM 2733 OG SER B 72 -3.726 5.486 7.410 1.00 0.00 O ATOM 0 H SER B 72 -5.129 7.786 5.753 1.00 0.00 H new ATOM 0 HA SER B 72 -3.606 5.374 4.877 1.00 0.00 H new ATOM 0 HB2 SER B 72 -5.680 5.985 6.986 1.00 0.00 H new ATOM 0 HB3 SER B 72 -5.220 4.349 6.559 1.00 0.00 H new ATOM 0 HG SER B 72 -3.953 5.187 8.315 1.00 0.00 H new ATOM 2739 N LEU B 73 -6.826 5.217 4.384 1.00 0.00 N ATOM 2740 CA LEU B 73 -7.865 4.665 3.497 1.00 0.00 C ATOM 2741 C LEU B 73 -8.635 5.815 2.770 1.00 0.00 C ATOM 2742 O LEU B 73 -8.973 6.821 3.408 1.00 0.00 O ATOM 2743 CB LEU B 73 -8.829 3.738 4.291 1.00 0.00 C ATOM 2744 CG LEU B 73 -8.174 2.432 4.831 1.00 0.00 C ATOM 2745 CD1 LEU B 73 -9.079 1.737 5.861 1.00 0.00 C ATOM 2746 CD2 LEU B 73 -7.770 1.475 3.685 1.00 0.00 C ATOM 0 H LEU B 73 -7.176 5.468 5.309 1.00 0.00 H new ATOM 0 HA LEU B 73 -7.383 4.057 2.731 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -9.240 4.297 5.132 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -9.666 3.470 3.647 1.00 0.00 H new ATOM 0 HG LEU B 73 -7.255 2.717 5.344 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -8.593 0.829 6.218 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -9.256 2.408 6.701 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -10.030 1.480 5.395 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -7.317 0.576 4.104 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -8.655 1.201 3.111 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -7.053 1.972 3.032 1.00 0.00 H new ATOM 2758 N PRO B 74 -8.959 5.698 1.448 1.00 0.00 N ATOM 2759 CA PRO B 74 -9.790 6.696 0.735 1.00 0.00 C ATOM 2760 C PRO B 74 -11.303 6.602 1.112 1.00 0.00 C ATOM 2761 O PRO B 74 -11.768 5.621 1.706 1.00 0.00 O ATOM 2762 CB PRO B 74 -9.501 6.334 -0.733 1.00 0.00 C ATOM 2763 CG PRO B 74 -9.194 4.834 -0.758 1.00 0.00 C ATOM 2764 CD PRO B 74 -8.654 4.507 0.630 1.00 0.00 C ATOM 0 HA PRO B 74 -9.555 7.731 0.982 1.00 0.00 H new ATOM 0 HB2 PRO B 74 -10.358 6.565 -1.366 1.00 0.00 H new ATOM 0 HB3 PRO B 74 -8.658 6.909 -1.116 1.00 0.00 H new ATOM 0 HG2 PRO B 74 -10.090 4.253 -0.978 1.00 0.00 H new ATOM 0 HG3 PRO B 74 -8.463 4.596 -1.530 1.00 0.00 H new ATOM 0 HD2 PRO B 74 -9.129 3.615 1.039 1.00 0.00 H new ATOM 0 HD3 PRO B 74 -7.582 4.312 0.601 1.00 0.00 H new ATOM 2772 N GLY B 75 -12.048 7.666 0.779 1.00 0.00 N ATOM 2773 CA GLY B 75 -13.460 7.805 1.232 1.00 0.00 C ATOM 2774 C GLY B 75 -13.715 8.261 2.696 1.00 0.00 C ATOM 2775 O GLY B 75 -14.857 8.180 3.156 1.00 0.00 O ATOM 0 H GLY B 75 -11.712 8.439 0.205 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -13.955 8.516 0.570 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -13.952 6.843 1.091 1.00 0.00 H new ATOM 2779 N GLN B 76 -12.675 8.725 3.409 1.00 0.00 N ATOM 2780 CA GLN B 76 -12.760 9.163 4.816 1.00 0.00 C ATOM 2781 C GLN B 76 -12.090 10.553 4.838 1.00 0.00 C ATOM 2782 O GLN B 76 -10.880 10.671 4.644 1.00 0.00 O ATOM 2783 CB GLN B 76 -12.032 8.142 5.735 1.00 0.00 C ATOM 2784 CG GLN B 76 -12.869 6.896 6.094 1.00 0.00 C ATOM 2785 CD GLN B 76 -12.135 5.858 6.966 1.00 0.00 C ATOM 2786 OE1 GLN B 76 -11.214 6.154 7.724 1.00 0.00 O ATOM 2787 NE2 GLN B 76 -12.554 4.608 6.917 1.00 0.00 N ATOM 0 H GLN B 76 -11.736 8.808 3.019 1.00 0.00 H new ATOM 0 HA GLN B 76 -13.783 9.219 5.187 1.00 0.00 H new ATOM 0 HB2 GLN B 76 -11.115 7.819 5.243 1.00 0.00 H new ATOM 0 HB3 GLN B 76 -11.739 8.646 6.656 1.00 0.00 H new ATOM 0 HG2 GLN B 76 -13.770 7.218 6.617 1.00 0.00 H new ATOM 0 HG3 GLN B 76 -13.191 6.413 5.171 1.00 0.00 H new ATOM 0 HE21 GLN B 76 -13.318 4.350 6.292 1.00 0.00 H new ATOM 0 HE22 GLN B 76 -12.114 3.899 7.504 1.00 0.00 H new ATOM 2796 N ASN B 77 -12.894 11.598 5.090 1.00 0.00 N ATOM 2797 CA ASN B 77 -12.390 12.996 5.292 1.00 0.00 C ATOM 2798 C ASN B 77 -11.471 13.173 6.543 1.00 0.00 C ATOM 2799 O ASN B 77 -10.441 13.847 6.448 1.00 0.00 O ATOM 2800 CB ASN B 77 -13.586 13.986 5.362 1.00 0.00 C ATOM 2801 CG ASN B 77 -14.379 14.124 4.046 1.00 0.00 C ATOM 2802 OD1 ASN B 77 -15.299 13.354 3.771 1.00 0.00 O ATOM 2803 ND2 ASN B 77 -14.017 15.079 3.206 1.00 0.00 N ATOM 0 H ASN B 77 -13.908 11.515 5.162 1.00 0.00 H new ATOM 0 HA ASN B 77 -11.762 13.217 4.429 1.00 0.00 H new ATOM 0 HB2 ASN B 77 -14.266 13.660 6.149 1.00 0.00 H new ATOM 0 HB3 ASN B 77 -13.212 14.968 5.651 1.00 0.00 H new ATOM 0 HD21 ASN B 77 -14.502 15.186 2.315 1.00 0.00 H new ATOM 0 HD22 ASN B 77 -13.252 15.709 3.449 1.00 0.00 H new ATOM 2810 N GLU B 78 -11.825 12.536 7.682 1.00 0.00 N ATOM 2811 CA GLU B 78 -10.934 12.408 8.861 1.00 0.00 C ATOM 2812 C GLU B 78 -9.628 11.555 8.692 1.00 0.00 C ATOM 2813 O GLU B 78 -8.697 11.755 9.478 1.00 0.00 O ATOM 2814 CB GLU B 78 -11.778 11.865 10.051 1.00 0.00 C ATOM 2815 CG GLU B 78 -11.554 12.679 11.338 1.00 0.00 C ATOM 2816 CD GLU B 78 -12.189 12.012 12.554 1.00 0.00 C ATOM 2817 OE1 GLU B 78 -11.661 11.055 13.135 1.00 0.00 O ATOM 2818 OE2 GLU B 78 -13.382 12.552 12.930 1.00 0.00 O ATOM 0 H GLU B 78 -12.736 12.096 7.811 1.00 0.00 H new ATOM 0 HA GLU B 78 -10.547 13.412 9.033 1.00 0.00 H new ATOM 0 HB2 GLU B 78 -12.835 11.890 9.786 1.00 0.00 H new ATOM 0 HB3 GLU B 78 -11.519 10.822 10.233 1.00 0.00 H new ATOM 0 HG2 GLU B 78 -10.484 12.800 11.509 1.00 0.00 H new ATOM 0 HG3 GLU B 78 -11.972 13.678 11.213 1.00 0.00 H new ATOM 2826 N ASP B 79 -9.533 10.640 7.696 1.00 0.00 N ATOM 2827 CA ASP B 79 -8.237 10.005 7.304 1.00 0.00 C ATOM 2828 C ASP B 79 -7.112 10.917 6.760 1.00 0.00 C ATOM 2829 O ASP B 79 -5.944 10.528 6.838 1.00 0.00 O ATOM 2830 CB ASP B 79 -8.504 8.844 6.302 1.00 0.00 C ATOM 2831 CG ASP B 79 -8.626 7.488 7.008 1.00 0.00 C ATOM 2832 OD1 ASP B 79 -8.667 7.343 8.239 1.00 0.00 O ATOM 2833 OD2 ASP B 79 -8.715 6.446 6.158 1.00 0.00 O ATOM 0 H ASP B 79 -10.332 10.322 7.147 1.00 0.00 H new ATOM 0 HA ASP B 79 -7.834 9.657 8.255 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -9.421 9.047 5.748 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -7.694 8.801 5.574 1.00 0.00 H new ATOM 2839 N LEU B 80 -7.454 12.101 6.234 1.00 0.00 N ATOM 2840 CA LEU B 80 -6.486 13.053 5.660 1.00 0.00 C ATOM 2841 C LEU B 80 -5.849 13.822 6.833 1.00 0.00 C ATOM 2842 O LEU B 80 -6.513 14.582 7.549 1.00 0.00 O ATOM 2843 CB LEU B 80 -7.219 14.014 4.695 1.00 0.00 C ATOM 2844 CG LEU B 80 -7.671 13.408 3.338 1.00 0.00 C ATOM 2845 CD1 LEU B 80 -8.678 12.251 3.428 1.00 0.00 C ATOM 2846 CD2 LEU B 80 -8.309 14.488 2.467 1.00 0.00 C ATOM 0 H LEU B 80 -8.419 12.430 6.193 1.00 0.00 H new ATOM 0 HA LEU B 80 -5.711 12.540 5.091 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -8.099 14.407 5.205 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -6.564 14.861 4.491 1.00 0.00 H new ATOM 0 HG LEU B 80 -6.752 13.004 2.913 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -8.924 11.904 2.424 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -8.240 11.431 3.998 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -9.585 12.596 3.926 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -8.622 14.052 1.518 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.177 14.903 2.980 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -7.584 15.280 2.281 1.00 0.00 H new ATOM 2858 N VAL B 81 -4.561 13.535 7.036 1.00 0.00 N ATOM 2859 CA VAL B 81 -3.793 14.046 8.190 1.00 0.00 C ATOM 2860 C VAL B 81 -2.606 14.817 7.598 1.00 0.00 C ATOM 2861 O VAL B 81 -1.764 14.258 6.889 1.00 0.00 O ATOM 2862 CB VAL B 81 -3.309 12.925 9.173 1.00 0.00 C ATOM 2863 CG1 VAL B 81 -2.475 13.522 10.343 1.00 0.00 C ATOM 2864 CG2 VAL B 81 -4.485 12.077 9.709 1.00 0.00 C ATOM 0 H VAL B 81 -4.015 12.943 6.410 1.00 0.00 H new ATOM 0 HA VAL B 81 -4.432 14.681 8.804 1.00 0.00 H new ATOM 0 HB VAL B 81 -2.663 12.259 8.602 1.00 0.00 H new ATOM 0 HG11 VAL B 81 -2.154 12.720 11.007 1.00 0.00 H new ATOM 0 HG12 VAL B 81 -1.600 14.033 9.942 1.00 0.00 H new ATOM 0 HG13 VAL B 81 -3.086 14.232 10.900 1.00 0.00 H new ATOM 0 HG21 VAL B 81 -4.104 11.313 10.386 1.00 0.00 H new ATOM 0 HG22 VAL B 81 -5.183 12.720 10.244 1.00 0.00 H new ATOM 0 HG23 VAL B 81 -4.999 11.599 8.875 1.00 0.00 H new ATOM 2874 N LEU B 82 -2.509 16.090 7.997 1.00 0.00 N ATOM 2875 CA LEU B 82 -1.299 16.889 7.766 1.00 0.00 C ATOM 2876 C LEU B 82 -0.160 16.367 8.691 1.00 0.00 C ATOM 2877 O LEU B 82 -0.208 16.504 9.917 1.00 0.00 O ATOM 2878 CB LEU B 82 -1.645 18.398 7.943 1.00 0.00 C ATOM 2879 CG LEU B 82 -0.434 19.345 8.132 1.00 0.00 C ATOM 2880 CD1 LEU B 82 0.535 19.267 6.952 1.00 0.00 C ATOM 2881 CD2 LEU B 82 -0.811 20.797 8.432 1.00 0.00 C ATOM 0 H LEU B 82 -3.254 16.590 8.482 1.00 0.00 H new ATOM 0 HA LEU B 82 -0.928 16.784 6.746 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -2.208 18.728 7.070 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -2.303 18.503 8.806 1.00 0.00 H new ATOM 0 HG LEU B 82 0.071 18.978 9.025 1.00 0.00 H new ATOM 0 HD11 LEU B 82 1.371 19.946 7.122 1.00 0.00 H new ATOM 0 HD12 LEU B 82 0.909 18.248 6.855 1.00 0.00 H new ATOM 0 HD13 LEU B 82 0.017 19.552 6.036 1.00 0.00 H new ATOM 0 HD21 LEU B 82 0.095 21.391 8.550 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -1.403 21.197 7.608 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -1.395 20.839 9.352 1.00 0.00 H new ATOM 2893 N THR B 83 0.856 15.799 8.041 1.00 0.00 N ATOM 2894 CA THR B 83 2.129 15.383 8.698 1.00 0.00 C ATOM 2895 C THR B 83 3.349 16.331 8.424 1.00 0.00 C ATOM 2896 O THR B 83 4.314 16.302 9.194 1.00 0.00 O ATOM 2897 CB THR B 83 2.432 13.870 8.401 1.00 0.00 C ATOM 2898 OG1 THR B 83 1.830 13.401 7.196 1.00 0.00 O ATOM 2899 CG2 THR B 83 1.935 12.925 9.499 1.00 0.00 C ATOM 0 H THR B 83 0.835 15.607 7.039 1.00 0.00 H new ATOM 0 HA THR B 83 1.973 15.490 9.771 1.00 0.00 H new ATOM 0 HB THR B 83 3.520 13.850 8.330 1.00 0.00 H new ATOM 0 HG1 THR B 83 1.932 12.428 7.136 1.00 0.00 H new ATOM 0 HG21 THR B 83 2.176 11.897 9.231 1.00 0.00 H new ATOM 0 HG22 THR B 83 2.419 13.177 10.443 1.00 0.00 H new ATOM 0 HG23 THR B 83 0.855 13.028 9.606 1.00 0.00 H new ATOM 2907 N GLY B 84 3.313 17.150 7.362 1.00 0.00 N ATOM 2908 CA GLY B 84 4.429 18.009 6.954 1.00 0.00 C ATOM 2909 C GLY B 84 3.899 19.219 6.172 1.00 0.00 C ATOM 2910 O GLY B 84 2.982 19.125 5.358 1.00 0.00 O ATOM 0 H GLY B 84 2.496 17.234 6.756 1.00 0.00 H new ATOM 0 HA2 GLY B 84 4.980 18.346 7.832 1.00 0.00 H new ATOM 0 HA3 GLY B 84 5.127 17.444 6.337 1.00 0.00 H new ATOM 2914 N TYR B 85 4.510 20.373 6.418 1.00 0.00 N ATOM 2915 CA TYR B 85 4.075 21.657 5.842 1.00 0.00 C ATOM 2916 C TYR B 85 5.296 22.565 5.545 1.00 0.00 C ATOM 2917 O TYR B 85 6.378 22.468 6.134 1.00 0.00 O ATOM 2918 CB TYR B 85 2.969 22.314 6.712 1.00 0.00 C ATOM 2919 CG TYR B 85 3.475 22.714 8.097 1.00 0.00 C ATOM 2920 CD1 TYR B 85 3.675 21.730 9.084 1.00 0.00 C ATOM 2921 CD2 TYR B 85 3.995 24.003 8.285 1.00 0.00 C ATOM 2922 CE1 TYR B 85 4.400 22.035 10.230 1.00 0.00 C ATOM 2923 CE2 TYR B 85 4.646 24.328 9.467 1.00 0.00 C ATOM 2924 CZ TYR B 85 4.861 23.341 10.436 1.00 0.00 C ATOM 2925 OH TYR B 85 5.527 23.644 11.587 1.00 0.00 O ATOM 0 H TYR B 85 5.326 20.453 7.025 1.00 0.00 H new ATOM 0 HA TYR B 85 3.603 21.483 4.875 1.00 0.00 H new ATOM 0 HB2 TYR B 85 2.585 23.196 6.200 1.00 0.00 H new ATOM 0 HB3 TYR B 85 2.136 21.620 6.820 1.00 0.00 H new ATOM 0 HD1 TYR B 85 3.266 20.740 8.951 1.00 0.00 H new ATOM 0 HD2 TYR B 85 3.889 24.745 7.508 1.00 0.00 H new ATOM 0 HE1 TYR B 85 4.607 21.266 10.960 1.00 0.00 H new ATOM 0 HE2 TYR B 85 4.985 25.339 9.638 1.00 0.00 H new ATOM 0 HH TYR B 85 5.782 24.590 11.578 1.00 0.00 H new ATOM 2935 N GLN B 86 5.050 23.459 4.598 1.00 0.00 N ATOM 2936 CA GLN B 86 5.986 24.514 4.176 1.00 0.00 C ATOM 2937 C GLN B 86 5.192 25.825 4.230 1.00 0.00 C ATOM 2938 O GLN B 86 3.963 25.900 4.138 1.00 0.00 O ATOM 2939 CB GLN B 86 6.582 24.294 2.749 1.00 0.00 C ATOM 2940 CG GLN B 86 8.046 24.733 2.571 1.00 0.00 C ATOM 2941 CD GLN B 86 9.050 23.783 3.250 1.00 0.00 C ATOM 2942 OE1 GLN B 86 9.808 24.178 4.132 1.00 0.00 O ATOM 2943 NE2 GLN B 86 9.050 22.512 2.879 1.00 0.00 N ATOM 0 H GLN B 86 4.171 23.479 4.082 1.00 0.00 H new ATOM 0 HA GLN B 86 6.851 24.517 4.839 1.00 0.00 H new ATOM 0 HB2 GLN B 86 6.505 23.235 2.501 1.00 0.00 H new ATOM 0 HB3 GLN B 86 5.968 24.836 2.030 1.00 0.00 H new ATOM 0 HG2 GLN B 86 8.274 24.792 1.507 1.00 0.00 H new ATOM 0 HG3 GLN B 86 8.170 25.736 2.980 1.00 0.00 H new ATOM 0 HE21 GLN B 86 8.416 22.195 2.145 1.00 0.00 H new ATOM 0 HE22 GLN B 86 9.684 21.850 3.327 1.00 0.00 H new ATOM 2952 N VAL B 87 5.970 26.879 4.375 1.00 0.00 N ATOM 2953 CA VAL B 87 5.456 28.238 4.622 1.00 0.00 C ATOM 2954 C VAL B 87 5.406 29.010 3.280 1.00 0.00 C ATOM 2955 O VAL B 87 5.564 28.443 2.194 1.00 0.00 O ATOM 2956 CB VAL B 87 6.279 28.933 5.805 1.00 0.00 C ATOM 2957 CG1 VAL B 87 5.312 29.527 6.861 1.00 0.00 C ATOM 2958 CG2 VAL B 87 7.458 28.154 6.454 1.00 0.00 C ATOM 0 H VAL B 87 6.988 26.830 4.327 1.00 0.00 H new ATOM 0 HA VAL B 87 4.429 28.225 4.986 1.00 0.00 H new ATOM 0 HB VAL B 87 6.824 29.724 5.290 1.00 0.00 H new ATOM 0 HG11 VAL B 87 5.888 29.996 7.659 1.00 0.00 H new ATOM 0 HG12 VAL B 87 4.672 30.272 6.389 1.00 0.00 H new ATOM 0 HG13 VAL B 87 4.696 28.731 7.278 1.00 0.00 H new ATOM 0 HG21 VAL B 87 7.909 28.763 7.237 1.00 0.00 H new ATOM 0 HG22 VAL B 87 7.086 27.225 6.886 1.00 0.00 H new ATOM 0 HG23 VAL B 87 8.206 27.927 5.694 1.00 0.00 H new ATOM 2968 N ASP B 88 5.161 30.315 3.437 1.00 0.00 N ATOM 2969 CA ASP B 88 5.327 31.419 2.455 1.00 0.00 C ATOM 2970 C ASP B 88 6.309 31.390 1.227 1.00 0.00 C ATOM 2971 O ASP B 88 6.205 32.242 0.338 1.00 0.00 O ATOM 2972 CB ASP B 88 5.613 32.652 3.363 1.00 0.00 C ATOM 2973 CG ASP B 88 4.376 33.152 4.171 1.00 0.00 C ATOM 2974 OD1 ASP B 88 3.263 32.612 4.124 1.00 0.00 O ATOM 2975 OD2 ASP B 88 4.622 34.260 4.918 1.00 0.00 O ATOM 0 H ASP B 88 4.811 30.668 4.328 1.00 0.00 H new ATOM 0 HA ASP B 88 4.420 31.379 1.852 1.00 0.00 H new ATOM 0 HB2 ASP B 88 6.410 32.398 4.061 1.00 0.00 H new ATOM 0 HB3 ASP B 88 5.982 33.469 2.742 1.00 0.00 H new ATOM 2981 N LYS B 89 7.178 30.383 1.145 1.00 0.00 N ATOM 2982 CA LYS B 89 7.960 30.046 -0.054 1.00 0.00 C ATOM 2983 C LYS B 89 7.124 29.642 -1.296 1.00 0.00 C ATOM 2984 O LYS B 89 6.086 28.981 -1.227 1.00 0.00 O ATOM 2985 CB LYS B 89 8.911 28.877 0.325 1.00 0.00 C ATOM 2986 CG LYS B 89 10.380 29.185 -0.016 1.00 0.00 C ATOM 2987 CD LYS B 89 10.770 28.943 -1.491 1.00 0.00 C ATOM 2988 CE LYS B 89 12.227 28.466 -1.637 1.00 0.00 C ATOM 2989 NZ LYS B 89 12.405 27.556 -2.772 1.00 0.00 N ATOM 0 H LYS B 89 7.366 29.759 1.930 1.00 0.00 H new ATOM 0 HA LYS B 89 8.490 30.951 -0.352 1.00 0.00 H new ATOM 0 HB2 LYS B 89 8.823 28.672 1.392 1.00 0.00 H new ATOM 0 HB3 LYS B 89 8.600 27.974 -0.200 1.00 0.00 H new ATOM 0 HG2 LYS B 89 10.585 30.226 0.233 1.00 0.00 H new ATOM 0 HG3 LYS B 89 11.021 28.574 0.619 1.00 0.00 H new ATOM 0 HD2 LYS B 89 10.101 28.200 -1.925 1.00 0.00 H new ATOM 0 HD3 LYS B 89 10.633 29.864 -2.057 1.00 0.00 H new ATOM 0 HE2 LYS B 89 12.879 29.331 -1.762 1.00 0.00 H new ATOM 0 HE3 LYS B 89 12.536 27.964 -0.720 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 12.492 26.580 -2.424 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 11.583 27.626 -3.405 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 13.267 27.815 -3.293 1.00 0.00 H new ATOM 3003 N ASN B 90 7.690 30.023 -2.438 1.00 0.00 N ATOM 3004 CA ASN B 90 7.034 29.965 -3.763 1.00 0.00 C ATOM 3005 C ASN B 90 7.031 28.519 -4.327 1.00 0.00 C ATOM 3006 O ASN B 90 7.507 27.557 -3.709 1.00 0.00 O ATOM 3007 CB ASN B 90 7.717 31.021 -4.698 1.00 0.00 C ATOM 3008 CG ASN B 90 7.854 32.454 -4.127 1.00 0.00 C ATOM 3009 OD1 ASN B 90 6.897 33.226 -4.079 1.00 0.00 O ATOM 3010 ND2 ASN B 90 9.031 32.778 -3.610 1.00 0.00 N ATOM 0 H ASN B 90 8.640 30.391 -2.480 1.00 0.00 H new ATOM 0 HA ASN B 90 5.979 30.228 -3.685 1.00 0.00 H new ATOM 0 HB2 ASN B 90 8.712 30.658 -4.955 1.00 0.00 H new ATOM 0 HB3 ASN B 90 7.148 31.075 -5.626 1.00 0.00 H new ATOM 0 HD21 ASN B 90 9.158 33.684 -3.160 1.00 0.00 H new ATOM 0 HD22 ASN B 90 9.809 32.121 -3.662 1.00 0.00 H new ATOM 3017 N LYS B 91 6.512 28.399 -5.554 1.00 0.00 N ATOM 3018 CA LYS B 91 6.681 27.185 -6.383 1.00 0.00 C ATOM 3019 C LYS B 91 8.124 26.635 -6.657 1.00 0.00 C ATOM 3020 O LYS B 91 8.276 25.460 -7.004 1.00 0.00 O ATOM 3021 CB LYS B 91 5.963 27.395 -7.731 1.00 0.00 C ATOM 3022 CG LYS B 91 5.279 26.103 -8.188 1.00 0.00 C ATOM 3023 CD LYS B 91 5.188 25.949 -9.705 1.00 0.00 C ATOM 3024 CE LYS B 91 5.755 24.603 -10.203 1.00 0.00 C ATOM 3025 NZ LYS B 91 7.209 24.594 -10.381 1.00 0.00 N ATOM 0 H LYS B 91 5.965 29.132 -6.005 1.00 0.00 H new ATOM 0 HA LYS B 91 6.245 26.408 -5.756 1.00 0.00 H new ATOM 0 HB2 LYS B 91 5.223 28.189 -7.634 1.00 0.00 H new ATOM 0 HB3 LYS B 91 6.681 27.718 -8.485 1.00 0.00 H new ATOM 0 HG2 LYS B 91 5.824 25.252 -7.779 1.00 0.00 H new ATOM 0 HG3 LYS B 91 4.273 26.069 -7.769 1.00 0.00 H new ATOM 0 HD2 LYS B 91 4.146 26.036 -10.013 1.00 0.00 H new ATOM 0 HD3 LYS B 91 5.730 26.766 -10.182 1.00 0.00 H new ATOM 0 HE2 LYS B 91 5.482 23.822 -9.494 1.00 0.00 H new ATOM 0 HE3 LYS B 91 5.282 24.351 -11.152 1.00 0.00 H new ATOM 0 HZ1 LYS B 91 7.512 23.657 -10.717 1.00 0.00 H new ATOM 0 HZ2 LYS B 91 7.478 25.316 -11.080 1.00 0.00 H new ATOM 0 HZ3 LYS B 91 7.671 24.803 -9.473 1.00 0.00 H new ATOM 3039 N ASP B 92 9.177 27.453 -6.490 1.00 0.00 N ATOM 3040 CA ASP B 92 10.568 26.955 -6.411 1.00 0.00 C ATOM 3041 C ASP B 92 10.847 25.879 -5.302 1.00 0.00 C ATOM 3042 O ASP B 92 11.705 25.018 -5.523 1.00 0.00 O ATOM 3043 CB ASP B 92 11.500 28.185 -6.257 1.00 0.00 C ATOM 3044 CG ASP B 92 12.914 27.896 -6.769 1.00 0.00 C ATOM 3045 OD1 ASP B 92 13.719 27.190 -6.148 1.00 0.00 O ATOM 3046 OD2 ASP B 92 13.186 28.453 -7.981 1.00 0.00 O ATOM 0 H ASP B 92 9.094 28.466 -6.406 1.00 0.00 H new ATOM 0 HA ASP B 92 10.766 26.410 -7.334 1.00 0.00 H new ATOM 0 HB2 ASP B 92 11.081 29.029 -6.805 1.00 0.00 H new ATOM 0 HB3 ASP B 92 11.546 28.477 -5.208 1.00 0.00 H new ATOM 3052 N ASP B 93 10.134 25.918 -4.143 1.00 0.00 N ATOM 3053 CA ASP B 93 10.307 24.940 -3.053 1.00 0.00 C ATOM 3054 C ASP B 93 9.646 23.625 -3.489 1.00 0.00 C ATOM 3055 O ASP B 93 8.419 23.495 -3.490 1.00 0.00 O ATOM 3056 CB ASP B 93 9.686 25.456 -1.727 1.00 0.00 C ATOM 3057 CG ASP B 93 10.507 25.163 -0.468 1.00 0.00 C ATOM 3058 OD1 ASP B 93 11.160 24.120 -0.319 1.00 0.00 O ATOM 3059 OD2 ASP B 93 10.419 26.119 0.489 1.00 0.00 O ATOM 0 H ASP B 93 9.428 26.628 -3.947 1.00 0.00 H new ATOM 0 HA ASP B 93 11.369 24.784 -2.864 1.00 0.00 H new ATOM 0 HB2 ASP B 93 9.543 26.534 -1.806 1.00 0.00 H new ATOM 0 HB3 ASP B 93 8.698 25.011 -1.609 1.00 0.00 H new ATOM 3065 N GLU B 94 10.480 22.663 -3.875 1.00 0.00 N ATOM 3066 CA GLU B 94 9.995 21.365 -4.352 1.00 0.00 C ATOM 3067 C GLU B 94 9.765 20.467 -3.111 1.00 0.00 C ATOM 3068 O GLU B 94 10.515 20.484 -2.127 1.00 0.00 O ATOM 3069 CB GLU B 94 11.020 20.829 -5.387 1.00 0.00 C ATOM 3070 CG GLU B 94 10.368 20.111 -6.588 1.00 0.00 C ATOM 3071 CD GLU B 94 10.484 18.601 -6.489 1.00 0.00 C ATOM 3072 OE1 GLU B 94 11.229 17.939 -7.224 1.00 0.00 O ATOM 3073 OE2 GLU B 94 9.708 18.046 -5.519 1.00 0.00 O ATOM 0 H GLU B 94 11.496 22.755 -3.868 1.00 0.00 H new ATOM 0 HA GLU B 94 9.039 21.410 -4.874 1.00 0.00 H new ATOM 0 HB2 GLU B 94 11.621 21.661 -5.754 1.00 0.00 H new ATOM 0 HB3 GLU B 94 11.701 20.139 -4.888 1.00 0.00 H new ATOM 0 HG2 GLU B 94 9.316 20.389 -6.647 1.00 0.00 H new ATOM 0 HG3 GLU B 94 10.840 20.450 -7.511 1.00 0.00 H new ATOM 3081 N LEU B 95 8.679 19.704 -3.177 1.00 0.00 N ATOM 3082 CA LEU B 95 8.250 18.810 -2.076 1.00 0.00 C ATOM 3083 C LEU B 95 9.033 17.481 -2.207 1.00 0.00 C ATOM 3084 O LEU B 95 8.703 16.638 -3.049 1.00 0.00 O ATOM 3085 CB LEU B 95 6.719 18.572 -2.087 1.00 0.00 C ATOM 3086 CG LEU B 95 5.799 19.640 -2.758 1.00 0.00 C ATOM 3087 CD1 LEU B 95 5.591 19.440 -4.272 1.00 0.00 C ATOM 3088 CD2 LEU B 95 4.459 19.716 -2.070 1.00 0.00 C ATOM 0 H LEU B 95 8.063 19.679 -3.990 1.00 0.00 H new ATOM 0 HA LEU B 95 8.471 19.279 -1.117 1.00 0.00 H new ATOM 0 HB2 LEU B 95 6.536 17.619 -2.584 1.00 0.00 H new ATOM 0 HB3 LEU B 95 6.395 18.459 -1.053 1.00 0.00 H new ATOM 0 HG LEU B 95 6.335 20.582 -2.639 1.00 0.00 H new ATOM 0 HD11 LEU B 95 4.940 20.225 -4.657 1.00 0.00 H new ATOM 0 HD12 LEU B 95 6.554 19.486 -4.781 1.00 0.00 H new ATOM 0 HD13 LEU B 95 5.132 18.468 -4.451 1.00 0.00 H new ATOM 0 HD21 LEU B 95 3.841 20.468 -2.560 1.00 0.00 H new ATOM 0 HD22 LEU B 95 3.965 18.746 -2.128 1.00 0.00 H new ATOM 0 HD23 LEU B 95 4.602 19.988 -1.024 1.00 0.00 H new ATOM 3100 N THR B 96 10.129 17.370 -1.436 1.00 0.00 N ATOM 3101 CA THR B 96 11.202 16.369 -1.718 1.00 0.00 C ATOM 3102 C THR B 96 11.454 15.569 -0.427 1.00 0.00 C ATOM 3103 O THR B 96 11.823 16.164 0.593 1.00 0.00 O ATOM 3104 CB THR B 96 12.548 16.963 -2.271 1.00 0.00 C ATOM 3105 OG1 THR B 96 13.470 17.339 -1.249 1.00 0.00 O ATOM 3106 CG2 THR B 96 12.441 18.177 -3.195 1.00 0.00 C ATOM 0 H THR B 96 10.305 17.951 -0.616 1.00 0.00 H new ATOM 0 HA THR B 96 10.840 15.736 -2.528 1.00 0.00 H new ATOM 0 HB THR B 96 12.899 16.111 -2.853 1.00 0.00 H new ATOM 0 HG1 THR B 96 13.073 17.165 -0.370 1.00 0.00 H new ATOM 0 HG21 THR B 96 13.439 18.487 -3.505 1.00 0.00 H new ATOM 0 HG22 THR B 96 11.853 17.914 -4.074 1.00 0.00 H new ATOM 0 HG23 THR B 96 11.955 18.996 -2.665 1.00 0.00 H new ATOM 3114 N GLY B 97 11.239 14.240 -0.452 1.00 0.00 N ATOM 3115 CA GLY B 97 11.238 13.417 0.799 1.00 0.00 C ATOM 3116 C GLY B 97 10.438 13.956 2.028 1.00 0.00 C ATOM 3117 O GLY B 97 10.859 13.807 3.177 1.00 0.00 O ATOM 0 H GLY B 97 11.065 13.708 -1.305 1.00 0.00 H new ATOM 0 HA2 GLY B 97 10.845 12.431 0.550 1.00 0.00 H new ATOM 0 HA3 GLY B 97 12.274 13.278 1.109 1.00 0.00 H new ATOM 3121 N PHE B 98 9.338 14.656 1.735 1.00 0.00 N ATOM 3122 CA PHE B 98 8.661 15.581 2.657 1.00 0.00 C ATOM 3123 C PHE B 98 7.326 15.731 1.936 1.00 0.00 C ATOM 3124 O PHE B 98 6.533 14.778 2.010 1.00 0.00 O ATOM 3125 CB PHE B 98 9.467 16.908 2.904 1.00 0.00 C ATOM 3126 CG PHE B 98 8.629 18.127 3.302 1.00 0.00 C ATOM 3127 CD1 PHE B 98 7.973 18.112 4.539 1.00 0.00 C ATOM 3128 CD2 PHE B 98 8.263 19.093 2.331 1.00 0.00 C ATOM 3129 CE1 PHE B 98 6.980 19.039 4.799 1.00 0.00 C ATOM 3130 CE2 PHE B 98 7.181 19.937 2.585 1.00 0.00 C ATOM 3131 CZ PHE B 98 6.539 19.909 3.801 1.00 0.00 C ATOM 3132 OXT PHE B 98 7.053 16.759 1.281 1.00 0.00 O ATOM 0 H PHE B 98 8.879 14.595 0.826 1.00 0.00 H new ATOM 0 HA PHE B 98 8.555 15.238 3.686 1.00 0.00 H new ATOM 0 HB2 PHE B 98 10.203 16.724 3.687 1.00 0.00 H new ATOM 0 HB3 PHE B 98 10.020 17.150 1.997 1.00 0.00 H new ATOM 0 HD1 PHE B 98 8.241 17.380 5.287 1.00 0.00 H new ATOM 0 HD2 PHE B 98 8.815 19.175 1.406 1.00 0.00 H new ATOM 0 HE1 PHE B 98 6.541 19.090 5.785 1.00 0.00 H new ATOM 0 HE2 PHE B 98 6.844 20.619 1.819 1.00 0.00 H new ATOM 0 HZ PHE B 98 5.696 20.559 3.983 1.00 0.00 H new TER 3142 PHE B 98 END