USER MOD reduce.3.24.130724 H: found=0, std=0, add=4602, rem=0, adj=149 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER OXYGEN BINDING 17-SEP-07 2RAO TITLE X RAY CRYSTAL STRUCTURE OF RABBIT HEMOGLOBIN (OXY FORM) AT 2.0 TITLE 2 ANGSTROM RESOLUTION COMPND MOL_ID: 1; COMPND 2 MOLECULE: HEMOGLOBIN SUBUNIT ALPHA-1/2; COMPND 3 CHAIN: A, C; COMPND 4 SYNONYM: HEMOGLOBIN ALPHA SUBUNIT, HEMOGLOBIN ALPHA-1/2 CHAIN, ALPHA COMPND 5 1/2-GLOBIN; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: HEMOGLOBIN SUBUNIT BETA-1/2; COMPND 8 CHAIN: B, D; COMPND 9 SYNONYM: HEMOGLOBIN BETA SUBUNIT, HEMOGLOBIN BETA-1/2 CHAIN, BETA- COMPND 0 1/2-GLOBIN SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; SOURCE 3 ORGANISM_COMMON: RABBIT; SOURCE 4 ORGANISM_TAXID: 9986; SOURCE 5 TISSUE: RED BLOOD CELLS; SOURCE 6 MOL_ID: 2; SOURCE 7 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; SOURCE 8 ORGANISM_COMMON: RABBIT; SOURCE 9 ORGANISM_TAXID: 9986; SOURCE 0 TISSUE: RED BLOOD CELLS KEYWDS OXYGEN TRANPORT/STORAGE, HEME, IRON, METAL-BINDING, OXYGEN TRANSPORT, KEYWDS 2 TRANSPORT, OXYGEN BINDING EXPDTA X-RAY DIFFRACTION AUTHOR S.SUNDARESAN,C.PACKIANATHAN,K.NEELAGANDAN,M.N.PONNUSWAMY REVDAT 3 14-OCT-15 2RAO 1 AUTHOR JRNL VERSN REVDAT 2 24-FEB-09 2RAO 1 VERSN REVDAT 1 09-SEP-08 2RAO 0 JRNL AUTH S.SUNDARESAN,C.PACKIANATHAN,K.NEELAGANDAN,M.N.PONNUSWAMY JRNL TITL X-RAY CRYSTAL STRUCTURE DETERMINATION OF HEMOGLOBIN FROM JRNL TITL 2 RABBIT AT 2.0 ANGSTROM RESLOUTION JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 2.00 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.00 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 27.30 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 92.7 REMARK 3 NUMBER OF REFLECTIONS : 34297 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.174 REMARK 3 R VALUE (WORKING SET) : 0.171 REMARK 3 FREE R VALUE : 0.219 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 1796 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.00 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.05 REMARK 3 REFLECTION IN BIN (WORKING SET) : 2516 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 91.77 REMARK 3 BIN R VALUE (WORKING SET) : 0.2360 REMARK 3 BIN FREE R VALUE SET COUNT : 125 REMARK 3 BIN FREE R VALUE : 0.3230 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 4454 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 180 REMARK 3 SOLVENT ATOMS : 199 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 25.31 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.00000 REMARK 3 B22 (A**2) : 0.00000 REMARK 3 B33 (A**2) : 0.00000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.203 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.172 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.111 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 3.929 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.959 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.933 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 4768 ; 0.019 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 6522 ; 1.635 ; 2.055 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 570 ; 5.791 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 192 ;38.272 ;24.062 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 754 ;16.502 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 12 ;13.683 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 700 ; 0.112 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 3600 ; 0.007 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 2031 ; 0.228 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 3195 ; 0.302 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 195 ; 0.152 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): 3 ; 0.186 ; 0.200 REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 27 ; 0.181 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 6 ; 0.174 ; 0.200 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 2916 ; 1.165 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 4574 ; 1.961 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 2100 ; 3.002 ; 3.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1940 ; 4.564 ; 4.500 REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : BABINET MODEL WITH MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 2RAO COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 26-SEP-07. REMARK 100 THE RCSB ID CODE IS RCSB044632. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 03-MAR-07 REMARK 200 TEMPERATURE (KELVIN) : 293 REMARK 200 PH : 7.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RU300 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : AUTOMAR REMARK 200 DATA SCALING SOFTWARE : AUTOMAR REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 35152 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.000 REMARK 200 RESOLUTION RANGE LOW (A) : 46.500 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 92.7 REMARK 200 DATA REDUNDANCY : 2.470 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.07500 REMARK 200 FOR THE DATA SET : 6.9000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.00 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.07 REMARK 200 COMPLETENESS FOR SHELL (%) : 91.5 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.31520 REMARK 200 FOR SHELL : 1.400 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASES REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 47.89 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.36 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 3350, PH 7.0, VAPOR DIFFUSION, REMARK 280 HANGING DROP REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 11860 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 24360 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -101.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: 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 SER A 52 120.77 -32.98 REMARK 500 HIS B 77 37.75 -147.04 REMARK 500 ASN B 80 59.30 -149.78 REMARK 500 ASP C 75 58.86 -150.01 REMARK 500 TYR D 35 77.56 -117.43 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CHIRAL CENTERS REMARK 500 REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY REMARK 500 FOR AMINO ACIDS AND C1'--O4'--N1(N9)--C2' FOR REMARK 500 NUCLEIC ACIDS OR EQUIVALENT ANGLE REMARK 500 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,A1,6X,F5.1,6X,A1,10X,A1,3X,A16) REMARK 500 REMARK 500 M RES CSSEQI IMPROPER EXPECTED FOUND DETAILS REMARK 500 SER D 76 22.8 L L OUTSIDE RANGE REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM A 142 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS A 87 NE2 REMARK 620 2 HEM A 142 NA 88.2 REMARK 620 3 HEM A 142 NB 87.4 91.8 REMARK 620 4 HEM A 142 NC 90.7 178.0 89.9 REMARK 620 5 HEM A 142 ND 91.1 89.9 177.7 88.4 REMARK 620 6 OXY A 143 O2 177.9 89.7 92.2 91.4 89.3 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM B 147 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS B 92 NE2 REMARK 620 2 HEM B 147 NA 86.5 REMARK 620 3 HEM B 147 NB 88.7 92.8 REMARK 620 4 HEM B 147 NC 88.5 174.9 87.9 REMARK 620 5 HEM B 147 ND 87.8 89.3 175.8 89.7 REMARK 620 6 OXY B 148 O2 174.8 90.1 95.4 94.8 88.2 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM C 142 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS C 87 NE2 REMARK 620 2 HEM C 142 NA 88.4 REMARK 620 3 HEM C 142 NB 89.6 87.2 REMARK 620 4 HEM C 142 NC 89.8 177.9 91.8 REMARK 620 5 HEM C 142 ND 90.1 90.5 177.7 90.4 REMARK 620 6 OXY C 143 O2 174.8 96.4 92.6 85.5 87.8 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 HEM D 147 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS D 92 NE2 REMARK 620 2 HEM D 147 NA 86.7 REMARK 620 3 HEM D 147 NB 86.7 92.0 REMARK 620 4 HEM D 147 NC 89.8 176.4 87.1 REMARK 620 5 HEM D 147 ND 90.5 90.4 176.3 90.4 REMARK 620 6 OXY D 148 O2 177.9 95.2 92.3 88.4 90.4 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM A 142 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE OXY A 143 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM B 147 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE OXY B 148 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE OXY C 143 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM C 142 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE OXY D 148 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HEM D 147 DBREF 2RAO A 1 141 UNP P01948 HBA_RABIT 2 142 DBREF 2RAO B 1 146 UNP P02057 HBB_RABIT 2 147 DBREF 2RAO C 1 141 UNP P01948 HBA_RABIT 2 142 DBREF 2RAO D 1 146 UNP P02057 HBB_RABIT 2 147 SEQRES 1 A 141 VAL LEU SER PRO ALA ASP LYS THR ASN ILE LYS THR ALA SEQRES 2 A 141 TRP GLU LYS ILE GLY SER HIS GLY GLY GLU TYR GLY ALA SEQRES 3 A 141 GLU ALA VAL GLU ARG MET PHE LEU GLY PHE PRO THR THR SEQRES 4 A 141 LYS THR TYR PHE PRO HIS PHE ASP PHE THR HIS GLY SER SEQRES 5 A 141 GLU GLN ILE LYS ALA HIS GLY LYS LYS VAL SER GLU ALA SEQRES 6 A 141 LEU THR LYS ALA VAL GLY HIS LEU ASP ASP LEU PRO GLY SEQRES 7 A 141 ALA LEU SER THR LEU SER ASP LEU HIS ALA HIS LYS LEU SEQRES 8 A 141 ARG VAL ASP PRO VAL ASN PHE LYS LEU LEU SER HIS CYS SEQRES 9 A 141 LEU LEU VAL THR LEU ALA ASN HIS HIS PRO SER GLU PHE SEQRES 10 A 141 THR PRO ALA VAL HIS ALA SER LEU ASP LYS PHE LEU ALA SEQRES 11 A 141 ASN VAL SER THR VAL LEU THR SER LYS TYR ARG SEQRES 1 B 146 VAL HIS LEU SER SER GLU GLU LYS SER ALA VAL THR ALA SEQRES 2 B 146 LEU TRP GLY LYS VAL ASN VAL GLU GLU VAL GLY GLY GLU SEQRES 3 B 146 ALA LEU GLY ARG LEU LEU VAL VAL TYR PRO TRP THR GLN SEQRES 4 B 146 ARG PHE PHE GLU SER PHE GLY ASP LEU SER SER ALA ASN SEQRES 5 B 146 ALA VAL MET ASN ASN PRO LYS VAL LYS ALA HIS GLY LYS SEQRES 6 B 146 LYS VAL LEU ALA ALA PHE SER GLU GLY LEU SER HIS LEU SEQRES 7 B 146 ASP ASN LEU LYS GLY THR PHE ALA LYS LEU SER GLU LEU SEQRES 8 B 146 HIS CYS ASP LYS LEU HIS VAL ASP PRO GLU ASN PHE ARG SEQRES 9 B 146 LEU LEU GLY ASN VAL LEU VAL ILE VAL LEU SER HIS HIS SEQRES 10 B 146 PHE GLY LYS GLU PHE THR PRO GLN VAL GLN ALA ALA TYR SEQRES 11 B 146 GLN LYS VAL VAL ALA GLY VAL ALA ASN ALA LEU ALA HIS SEQRES 12 B 146 LYS TYR HIS SEQRES 1 C 141 VAL LEU SER PRO ALA ASP LYS THR ASN ILE LYS THR ALA SEQRES 2 C 141 TRP GLU LYS ILE GLY SER HIS GLY GLY GLU TYR GLY ALA SEQRES 3 C 141 GLU ALA VAL GLU ARG MET PHE LEU GLY PHE PRO THR THR SEQRES 4 C 141 LYS THR TYR PHE PRO HIS PHE ASP PHE THR HIS GLY SER SEQRES 5 C 141 GLU GLN ILE LYS ALA HIS GLY LYS LYS VAL SER GLU ALA SEQRES 6 C 141 LEU THR LYS ALA VAL GLY HIS LEU ASP ASP LEU PRO GLY SEQRES 7 C 141 ALA LEU SER THR LEU SER ASP LEU HIS ALA HIS LYS LEU SEQRES 8 C 141 ARG VAL ASP PRO VAL ASN PHE LYS LEU LEU SER HIS CYS SEQRES 9 C 141 LEU LEU VAL THR LEU ALA ASN HIS HIS PRO SER GLU PHE SEQRES 10 C 141 THR PRO ALA VAL HIS ALA SER LEU ASP LYS PHE LEU ALA SEQRES 11 C 141 ASN VAL SER THR VAL LEU THR SER LYS TYR ARG SEQRES 1 D 146 VAL HIS LEU SER SER GLU GLU LYS SER ALA VAL THR ALA SEQRES 2 D 146 LEU TRP GLY LYS VAL ASN VAL GLU GLU VAL GLY GLY GLU SEQRES 3 D 146 ALA LEU GLY ARG LEU LEU VAL VAL TYR PRO TRP THR GLN SEQRES 4 D 146 ARG PHE PHE GLU SER PHE GLY ASP LEU SER SER ALA ASN SEQRES 5 D 146 ALA VAL MET ASN ASN PRO LYS VAL LYS ALA HIS GLY LYS SEQRES 6 D 146 LYS VAL LEU ALA ALA PHE SER GLU GLY LEU SER HIS LEU SEQRES 7 D 146 ASP ASN LEU LYS GLY THR PHE ALA LYS LEU SER GLU LEU SEQRES 8 D 146 HIS CYS ASP LYS LEU HIS VAL ASP PRO GLU ASN PHE ARG SEQRES 9 D 146 LEU LEU GLY ASN VAL LEU VAL ILE VAL LEU SER HIS HIS SEQRES 10 D 146 PHE GLY LYS GLU PHE THR PRO GLN VAL GLN ALA ALA TYR SEQRES 11 D 146 GLN LYS VAL VAL ALA GLY VAL ALA ASN ALA LEU ALA HIS SEQRES 12 D 146 LYS TYR HIS HET HEM A 142 43 HET OXY A 143 2 HET HEM B 147 43 HET OXY B 148 2 HET OXY C 143 2 HET HEM C 142 43 HET OXY D 148 2 HET HEM D 147 43 HETNAM HEM PROTOPORPHYRIN IX CONTAINING FE HETNAM OXY OXYGEN MOLECULE HETSYN HEM HEME FORMUL 5 HEM 4(C34 H32 FE N4 O4) FORMUL 6 OXY 4(O2) FORMUL 13 HOH *199(H2 O) HELIX 1 1 SER A 3 GLY A 18 1 16 HELIX 2 2 HIS A 20 PHE A 36 1 17 HELIX 3 3 PRO A 37 PHE A 43 5 7 HELIX 4 4 SER A 52 GLY A 71 1 20 HELIX 5 5 HIS A 72 ASP A 74 5 3 HELIX 6 6 ASP A 75 LEU A 80 1 6 HELIX 7 7 LEU A 80 HIS A 89 1 10 HELIX 8 8 PRO A 95 HIS A 113 1 19 HELIX 9 9 THR A 118 THR A 137 1 20 HELIX 10 10 SER B 4 GLY B 16 1 13 HELIX 11 11 GLU B 22 TYR B 35 1 14 HELIX 12 12 PRO B 36 GLY B 46 5 11 HELIX 13 13 SER B 50 ASN B 57 1 8 HELIX 14 14 ASN B 57 SER B 76 1 20 HELIX 15 15 HIS B 77 ASP B 79 5 3 HELIX 16 16 ASN B 80 PHE B 85 1 6 HELIX 17 17 PHE B 85 LYS B 95 1 11 HELIX 18 18 PRO B 100 GLY B 119 1 20 HELIX 19 19 LYS B 120 PHE B 122 5 3 HELIX 20 20 THR B 123 ALA B 142 1 20 HELIX 21 21 SER C 3 GLY C 18 1 16 HELIX 22 22 HIS C 20 PHE C 36 1 17 HELIX 23 23 PRO C 37 PHE C 43 5 7 HELIX 24 24 SER C 52 GLY C 71 1 20 HELIX 25 25 HIS C 72 ASP C 74 5 3 HELIX 26 26 ASP C 75 HIS C 89 1 15 HELIX 27 27 PRO C 95 HIS C 113 1 19 HELIX 28 28 THR C 118 THR C 137 1 20 HELIX 29 29 SER D 4 GLY D 16 1 13 HELIX 30 30 ASN D 19 TYR D 35 1 17 HELIX 31 31 PRO D 36 GLY D 46 5 11 HELIX 32 32 SER D 50 ASN D 57 1 8 HELIX 33 33 ASN D 57 SER D 76 1 20 HELIX 34 34 HIS D 77 ASP D 79 5 3 HELIX 35 35 ASN D 80 PHE D 85 1 6 HELIX 36 36 PHE D 85 LYS D 95 1 11 HELIX 37 37 PRO D 100 GLY D 119 1 20 HELIX 38 38 LYS D 120 PHE D 122 5 3 HELIX 39 39 THR D 123 HIS D 143 1 21 HELIX 40 40 LYS D 144 HIS D 146 5 3 LINK NE2 HIS A 87 FE HEM A 142 1555 1555 2.18 LINK NE2 HIS B 92 FE HEM B 147 1555 1555 2.15 LINK NE2 HIS C 87 FE HEM C 142 1555 1555 2.22 LINK NE2 HIS D 92 FE HEM D 147 1555 1555 2.26 LINK FE HEM A 142 O2 OXY A 143 1555 1555 1.67 LINK FE HEM B 147 O2 OXY B 148 1555 1555 1.91 LINK FE HEM C 142 O2 OXY C 143 1555 1555 1.87 LINK FE HEM D 147 O2 OXY D 148 1555 1555 2.00 SITE *** AC1 16 TYR A 42 PHE A 43 HIS A 45 HIS A 58 SITE *** AC1 16 LYS A 61 LEU A 86 HIS A 87 LEU A 91 SITE *** AC1 16 VAL A 93 ASN A 97 PHE A 98 LEU A 136 SITE *** AC1 16 OXY A 143 HOH A 164 HOH A 169 HIS D 2 SITE *** AC2 2 HIS A 58 HEM A 142 SITE *** AC3 11 THR B 38 PHE B 41 PHE B 42 HIS B 63 SITE *** AC3 11 PHE B 71 HIS B 92 LEU B 96 ASN B 102 SITE *** AC3 11 LEU B 106 LEU B 141 OXY B 148 SITE *** AC4 3 HIS B 63 VAL B 67 HEM B 147 SITE *** AC5 2 HIS C 58 HEM C 142 SITE *** AC6 15 TYR C 42 PHE C 43 HIS C 45 PHE C 46 SITE *** AC6 15 HIS C 58 LYS C 61 HIS C 87 LEU C 91 SITE *** AC6 15 VAL C 93 ASN C 97 PHE C 98 LEU C 136 SITE *** AC6 15 OXY C 143 HOH C 159 HOH C 193 SITE *** AC7 4 HIS D 63 VAL D 67 LEU D 106 HEM D 147 SITE *** AC8 11 THR A 8 LYS A 11 PHE D 41 PHE D 42 SITE *** AC8 11 HIS D 63 LEU D 88 HIS D 92 LEU D 96 SITE *** AC8 11 ASN D 102 OXY D 148 HOH D 172 CRYST1 54.608 54.862 64.021 67.23 66.35 60.68 P 1 2 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.018312 -0.010285 -0.005731 0.00000 SCALE2 0.000000 0.020906 -0.005137 0.00000 SCALE3 0.000000 0.000000 0.017559 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 NoAdj-H: A 87 HIS HE2 : A 87 HIS NE2 : A 142 HEMFE :(H bumps) USER MOD NoAdj-H: B 92 HIS HE2 : B 92 HIS NE2 : B 147 HEMFE :(H bumps) USER MOD NoAdj-H: C 87 HIS HE2 : C 87 HIS NE2 : C 142 HEMFE :(H bumps) USER MOD NoAdj-H: D 92 HIS HE2 : D 92 HIS NE2 : D 147 HEMFE :(H bumps) USER MOD Set 1.1: C 103 HIS : no HD1:sc= 1.87 K(o=3,f=-5.9!) USER MOD Set 1.2: C 104 CYS SG : rot 130:sc= -0.0136 USER MOD Set 1.3: D 108 ASN : amide:sc= 0.0935 K(o=3,f=0.95!) USER MOD Set 1.4: D 127 GLN : amide:sc= 0.368 K(o=3,f=-3!) USER MOD Set 1.5: D 131 GLN :FLIP amide:sc= 0.66 F(o=-0.47!,f=3) USER MOD Set 2.1: D 123 THR OG1 : rot -169:sc= 0.633 USER MOD Set 2.2: D 125 GLN : amide:sc= 0.556 K(o=1.2,f=-0.76) USER MOD Set 3.1: C 111 ASN :FLIP amide:sc= 1.36 F(o=0.71,f=2.6) USER MOD Set 3.2: D 115 SER OG : rot -149:sc= 1.27 USER MOD Set 4.1: D 89 SER OG : rot 71:sc= -0.119 USER MOD Set 4.2: D 93 CYS SG : rot -89:sc= 1.5 USER MOD Set 5.1: D 50 SER OG : rot 180:sc= 0.0146 USER MOD Set 5.2: D 52 ASN : amide:sc= 0.152 K(o=0.17,f=-1.3!) USER MOD Set 6.1: C 42 TYR OH : rot 180:sc= 0.892 USER MOD Set 6.2: C 97 ASN : amide:sc= 0.996 K(o=1.9,f=0.67) USER MOD Set 7.1: C 32 MET CE :methyl 161:sc= -0.0352 (180deg=-0.344) USER MOD Set 7.2: C 39 THR OG1 : rot -68:sc= 0.455 USER MOD Set 8.1: C 24 TYR OH : rot -102:sc= 1.31! USER MOD Set 8.2: C 113 HIS : no HD1:sc= 1.99 K(o=3.3,f=-9.9!) USER MOD Set 9.1: C 9 ASN : amide:sc= 0.33 K(o=0.98,f=-0.69) USER MOD Set 9.2: C 124 SER OG : rot -64:sc= 0.648 USER MOD Set10.1: A 103 HIS : no HD1:sc= 1.03 K(o=1.9,f=-7.7!) USER MOD Set10.2: A 104 CYS SG : rot 130:sc= 0 USER MOD Set10.3: B 108 ASN : amide:sc= 0.106 K(o=1.9,f=1.1) USER MOD Set10.4: B 127 GLN : amide:sc= -0.0917 K(o=1.9,f=-4.4!) USER MOD Set10.5: B 131 GLN :FLIP amide:sc= 0.85 F(o=-4.4,f=1.9) USER MOD Set11.1: B 123 THR OG1 : rot -175:sc= 0.923 USER MOD Set11.2: B 125 GLN : amide:sc= 0.957 K(o=1.9,f=-0.21) USER MOD Set12.1: A 111 ASN : amide:sc= 1.56 K(o=3,f=1.2) USER MOD Set12.2: B 115 SER OG : rot -153:sc= 1.4 USER MOD Set13.1: B 89 SER OG : rot 66:sc= 0.0363 USER MOD Set13.2: B 93 CYS SG : rot -87:sc= 1.59 USER MOD Set14.1: A 138 SER OG : rot 88:sc= 1.39 USER MOD Set14.2: C 1 VAL N :NH3+ -165:sc= -0.0756 (180deg=-0.299) USER MOD Set14.3: C 131 ASN : amide:sc= -0.0152 X(o=1.3,f=1.2) USER MOD Set15.1: A 1 VAL N :NH3+ -168:sc= -0.0592 (180deg=-0.295) USER MOD Set15.2: A 131 ASN : amide:sc= 0 X(o=0.77,f=0.76) USER MOD Set15.3: C 138 SER OG : rot 85:sc= 0.824 USER MOD Set16.1: A 9 ASN : amide:sc= 1.86 K(o=2.6,f=-1.4!) USER MOD Set16.2: A 124 SER OG : rot -56:sc= 0.703 USER MOD Set17.1: A 24 TYR OH : rot -114:sc= 0.415 USER MOD Set17.2: A 113 HIS : no HD1:sc= 0.477! C(o=0.89!,f=-11!) USER MOD Set18.1: A 19 SER OG : rot 180:sc= 0 USER MOD Set18.2: A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0.115 USER MOD Single : A 7 LYS NZ :NH3+ -177:sc= 1.6 (180deg=1.59) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 156:sc= -0.0656 (180deg=-0.372) USER MOD Single : A 12 THR OG1 : rot -71:sc= 1.18 USER MOD Single : A 16 LYS NZ :NH3+ -168:sc= 1.23 (180deg=1.03) USER MOD Single : A 32 MET CE :methyl 139:sc= -0.2 (180deg=-0.998) USER MOD Single : A 38 THR OG1 : rot 89:sc= 2.4 USER MOD Single : A 39 THR OG1 : rot -70:sc= 0.846 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot -76:sc= 0.58 USER MOD Single : A 42 TYR OH : rot 180:sc= 0.077 USER MOD Single : A 45 HIS : no HD1:sc= 0.526 K(o=0.53,f=-2.5!) USER MOD Single : A 49 THR OG1 : rot -74:sc= 1.27 USER MOD Single : A 50 HIS : no HD1:sc= -0.302 K(o=-0.3,f=-2.3) USER MOD Single : A 52 SER OG : rot 163:sc= 0.48 USER MOD Single : A 54 GLN :FLIP amide:sc= -0.0592 F(o=-3.6!,f=-0.059) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= 1.84 K(o=1.8,f=-3.2!) USER MOD Single : A 60 LYS NZ :NH3+ 149:sc= 0.128 (180deg=-0.0291) USER MOD Single : A 61 LYS NZ :NH3+ -174:sc= 0.181 (180deg=0.15) USER MOD Single : A 63 SER OG : rot 149:sc= 0.402 USER MOD Single : A 67 THR OG1 : rot 84:sc= 0.215 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HE2:sc= 0.607 K(o=0.61,f=-2!) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 175:sc= 0.59 USER MOD Single : A 89 HIS :FLIP no HE2:sc= 0.193 F(o=-3.1!,f=0.19) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0.906 K(o=0.91,f=0.12) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 79:sc= 1.44 USER MOD Single : A 108 THR OG1 : rot 77:sc= 0.704 USER MOD Single : A 112 HIS : no HD1:sc= 1.04 K(o=1,f=-4.8!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 177:sc= 1.09 USER MOD Single : A 122 HIS : no HD1:sc= 0.141 K(o=0.14,f=-7.2!) USER MOD Single : A 127 LYS NZ :NH3+ -174:sc= 0.693 (180deg=0.659) USER MOD Single : A 133 SER OG : rot 73:sc= 0.272 USER MOD Single : A 134 THR OG1 : rot 81:sc= 0.677 USER MOD Single : A 137 THR OG1 : rot -78:sc= 0.378 USER MOD Single : A 139 LYS NZ :NH3+ 171:sc= 0.42 (180deg=0.393) USER MOD Single : A 140 TYR OH : rot -158:sc= 1 USER MOD Single : A 142 HEM CMA :methyl -30:sc= -0.226 (180deg=-0.475) USER MOD Single : A 142 HEM CMB :methyl 150:sc= -1.98 (180deg=-1.98) USER MOD Single : A 142 HEM CMC :methyl 150:sc= -0.0766 (180deg=-0.0766) USER MOD Single : A 142 HEM CMD :methyl -30:sc= -0.1 (180deg=-0.129) USER MOD Single : B 1 VAL N :NH3+ -167:sc= -0.0237 (180deg=-0.195) USER MOD Single : B 2 HIS : no HD1:sc= 0 X(o=0,f=-0.002) USER MOD Single : B 4 SER OG : rot 180:sc= 0.0521 USER MOD Single : B 5 SER OG : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 SER OG : rot 75:sc= 0.72 USER MOD Single : B 12 THR OG1 : rot -78:sc= 0.127 USER MOD Single : B 17 LYS NZ :NH3+ -155:sc= 1.35 (180deg=0.37) USER MOD Single : B 19 ASN : amide:sc= -1.55 K(o=-1.6,f=-9.4!) USER MOD Single : B 35 TYR OH : rot 40:sc= 1.17 USER MOD Single : B 38 THR OG1 : rot -64:sc= 0.866 USER MOD Single : B 39 GLN :FLIP amide:sc= 0.242 F(o=-1.8,f=0.24) USER MOD Single : B 44 SER OG : rot -75:sc= 0.869 USER MOD Single : B 49 SER OG : rot -101:sc= 0.588 USER MOD Single : B 50 SER OG : rot 180:sc= 0 USER MOD Single : B 52 ASN : amide:sc=-0.00146 X(o=-0.0015,f=0) USER MOD Single : B 55 MET CE :methyl -131:sc= -7.64! (180deg=-9.95!) USER MOD Single : B 56 ASN : amide:sc= -0.886 K(o=-0.89,f=-6.6!) USER MOD Single : B 57 ASN : amide:sc= 0.572 K(o=0.57,f=-6.4!) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -115:sc= 0.652 (180deg=-1.41!) USER MOD Single : B 63 HIS : no HD1:sc= 0.872 K(o=0.87,f=-4.1!) USER MOD Single : B 65 LYS NZ :NH3+ -155:sc= -0.411 (180deg=-1.17) USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 SER OG : rot 46:sc= 0.553 USER MOD Single : B 76 SER OG : rot 180:sc= 0 USER MOD Single : B 77 HIS : no HD1:sc= -0.156 X(o=-0.16,f=-0.17) USER MOD Single : B 80 ASN : amide:sc= -0.15 K(o=-0.15,f=-0.79) USER MOD Single : B 82 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0223) USER MOD Single : B 84 THR OG1 : rot 80:sc= 0.873 USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 102 ASN : amide:sc= 0.806 K(o=0.81,f=-2.6!) USER MOD Single : B 116 HIS :FLIP no HD1:sc= 0.553 F(o=-1.9!,f=0.55) USER MOD Single : B 117 HIS :FLIP no HD1:sc= 0.64 F(o=-0.0089,f=0.64) USER MOD Single : B 120 LYS NZ :NH3+ -127:sc= 0.486 (180deg=-0.504) USER MOD Single : B 130 TYR OH : rot 136:sc= 0.99 USER MOD Single : B 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 139 ASN : amide:sc= -0.0752 K(o=-0.075,f=-1.8!) USER MOD Single : B 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 144 LYS NZ :NH3+ -152:sc= -0.0478 (180deg=-0.167) USER MOD Single : B 145 TYR OH : rot -167:sc= 1.32 USER MOD Single : B 146 HIS : no HD1:sc= -0.115 X(o=-0.12,f=-0.0099) USER MOD Single : B 147 HEM CMA :methyl -30:sc= -0.0754 (180deg=-0.19) USER MOD Single : B 147 HEM CMB :methyl 150:sc= -0.511 (180deg=-0.511) USER MOD Single : B 147 HEM CMC :methyl 150:sc= -2.41 (180deg=-2.41) USER MOD Single : B 147 HEM CMD :methyl -30:sc= -0.693 (180deg=-0.783) USER MOD Single : C 3 SER OG : rot 180:sc= 0.617 USER MOD Single : C 7 LYS NZ :NH3+ -148:sc= 0.825 (180deg=0.076) USER MOD Single : C 8 THR OG1 : rot 180:sc= 0 USER MOD Single : C 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 12 THR OG1 : rot 89:sc= 0.0474 USER MOD Single : C 16 LYS NZ :NH3+ 169:sc= 0.233 (180deg=0.193) USER MOD Single : C 19 SER OG : rot 180:sc= 0 USER MOD Single : C 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 38 THR OG1 : rot -110:sc= 2.37 USER MOD Single : C 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 41 THR OG1 : rot 180:sc= 0 USER MOD Single : C 45 HIS : no HD1:sc= 0.617 K(o=0.62,f=-2.7!) USER MOD Single : C 49 THR OG1 : rot 94:sc= 0.682 USER MOD Single : C 50 HIS : no HD1:sc= 0 X(o=0,f=-0.27) USER MOD Single : C 52 SER OG : rot -171:sc= 0.659 USER MOD Single : C 54 GLN : amide:sc= 0.104 K(o=0.1,f=-1.7) USER MOD Single : C 56 LYS NZ :NH3+ -118:sc= 0.758 (180deg=-0.129) USER MOD Single : C 58 HIS : no HD1:sc= 2.27 K(o=2.3,f=-10!) USER MOD Single : C 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 61 LYS NZ :NH3+ -157:sc= 1.3 (180deg=0.993) USER MOD Single : C 63 SER OG : rot -24:sc= 0.194 USER MOD Single : C 67 THR OG1 : rot 81:sc= 0.803 USER MOD Single : C 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 72 HIS : no HE2:sc= 1.31 K(o=1.3,f=-4.1!) USER MOD Single : C 81 SER OG : rot 180:sc= 0 USER MOD Single : C 82 THR OG1 : rot 180:sc= 0 USER MOD Single : C 84 SER OG : rot 170:sc= 1.46 USER MOD Single : C 89 HIS : no HD1:sc= -0.529 X(o=-0.53,f=-0.52) USER MOD Single : C 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 99 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0523) USER MOD Single : C 102 SER OG : rot 81:sc= 1.33 USER MOD Single : C 108 THR OG1 : rot 81:sc= 0.407 USER MOD Single : C 112 HIS : no HD1:sc= 0.596 K(o=0.6,f=-3.2!) USER MOD Single : C 115 SER OG : rot -54:sc= 2.31 USER MOD Single : C 118 THR OG1 : rot -159:sc= 0.43 USER MOD Single : C 122 HIS : no HD1:sc= 0.203 K(o=0.2,f=-5.8!) USER MOD Single : C 127 LYS NZ :NH3+ -174:sc= 1.38 (180deg=1.3) USER MOD Single : C 133 SER OG : rot 75:sc= 0.979 USER MOD Single : C 134 THR OG1 : rot 78:sc= 0.383 USER MOD Single : C 137 THR OG1 : rot -71:sc= 0.383 USER MOD Single : C 139 LYS NZ :NH3+ 174:sc= 0.00858 (180deg=-0.0425) USER MOD Single : C 140 TYR OH : rot -161:sc= 0.819 USER MOD Single : C 142 HEM CMA :methyl -30:sc= -0.758 (180deg=-1.45) USER MOD Single : C 142 HEM CMB :methyl 150:sc= -0.0107 (180deg=-0.0107) USER MOD Single : C 142 HEM CMC :methyl 150:sc= -0.0199 (180deg=-0.0199) USER MOD Single : C 142 HEM CMD :methyl -30:sc= -0.0296 (180deg=-0.292) USER MOD Single : D 1 VAL N :NH3+ -178:sc= -0.108 (180deg=-0.129) USER MOD Single : D 2 HIS : no HD1:sc= -0.015 X(o=-0.015,f=-0.0017) USER MOD Single : D 4 SER OG : rot 180:sc= 0.123 USER MOD Single : D 5 SER OG : rot 180:sc= 0.0113 USER MOD Single : D 8 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00994) USER MOD Single : D 9 SER OG : rot 83:sc= 0.0177 USER MOD Single : D 12 THR OG1 : rot 96:sc= 0.0735 USER MOD Single : D 17 LYS NZ :NH3+ 178:sc= 1.32 (180deg=1.27) USER MOD Single : D 19 ASN : amide:sc= -1.86 K(o=-1.9,f=-2.6) USER MOD Single : D 35 TYR OH : rot 43:sc= 1.57 USER MOD Single : D 38 THR OG1 : rot -67:sc= 0.705 USER MOD Single : D 39 GLN :FLIP amide:sc= 1.13 F(o=-1!,f=1.1) USER MOD Single : D 44 SER OG : rot -92:sc= 1.34 USER MOD Single : D 49 SER OG : rot -100:sc= 1.21 USER MOD Single : D 55 MET CE :methyl -150:sc= -0.226 (180deg=-1.47) USER MOD Single : D 56 ASN : amide:sc= -0.239 K(o=-0.24,f=-0.78) USER MOD Single : D 57 ASN : amide:sc= -0.197 K(o=-0.2,f=-4!) USER MOD Single : D 59 LYS NZ :NH3+ -158:sc= -0.221 (180deg=-0.871) USER MOD Single : D 61 LYS NZ :NH3+ 166:sc= -0.513 (180deg=-0.655) USER MOD Single : D 63 HIS : no HD1:sc= 0.113 K(o=0.11,f=-1.6!) USER MOD Single : D 65 LYS NZ :NH3+ -167:sc= 0.925 (180deg=0.906) USER MOD Single : D 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 72 SER OG : rot 65:sc= 0.562 USER MOD Single : D 76 SER OG : rot 180:sc= 0 USER MOD Single : D 77 HIS : no HE2:sc= 0.00509 X(o=0.0051,f=-0.085) USER MOD Single : D 80 ASN : amide:sc= -0.715 X(o=-0.72,f=-0.92) USER MOD Single : D 82 LYS NZ :NH3+ 139:sc= -0.131 (180deg=-0.734) USER MOD Single : D 84 THR OG1 : rot 89:sc= 0 USER MOD Single : D 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 97 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : D 102 ASN : amide:sc= 1.13 K(o=1.1,f=-2.9!) USER MOD Single : D 116 HIS :FLIP no HD1:sc= 0.951 F(o=-3.2!,f=0.95) USER MOD Single : D 117 HIS : no HD1:sc= 0.25 X(o=0.25,f=-0.0046) USER MOD Single : D 120 LYS NZ :NH3+ 139:sc= -1.24 (180deg=-1.45) USER MOD Single : D 130 TYR OH : rot 133:sc= 1.31 USER MOD Single : D 132 LYS NZ :NH3+ 160:sc= 0.0561 (180deg=0.0124) USER MOD Single : D 139 ASN : amide:sc= -0.123 K(o=-0.12,f=-1.5!) USER MOD Single : D 143 HIS : no HE2:sc= 1.16 K(o=1.2,f=-4.2!) USER MOD Single : D 144 LYS NZ :NH3+ -128:sc= 0.0201 (180deg=-0.864) USER MOD Single : D 145 TYR OH : rot -176:sc= 1.39 USER MOD Single : D 146 HIS : no HD1:sc= -0.584 K(o=-0.58,f=-1.4) USER MOD Single : D 147 HEM CMA :methyl -30:sc=-0.00572 (180deg=-0.00781) USER MOD Single : D 147 HEM CMB :methyl 150:sc= -0.388 (180deg=-0.388) USER MOD Single : D 147 HEM CMC :methyl -30:sc= -2.63! (180deg=-4.28!) USER MOD Single : D 147 HEM CMD :methyl 150:sc= -0.513 (180deg=-0.513) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 4.612 14.731 4.997 1.00 26.33 N ATOM 2 CA VAL A 1 5.012 16.037 5.603 1.00 25.67 C ATOM 3 C VAL A 1 5.841 16.793 4.582 1.00 24.45 C ATOM 4 O VAL A 1 6.896 16.344 4.102 1.00 24.62 O ATOM 5 CB VAL A 1 5.801 15.879 6.942 1.00 25.78 C ATOM 6 CG1 VAL A 1 5.970 17.227 7.653 1.00 25.86 C ATOM 7 CG2 VAL A 1 5.141 14.831 7.865 1.00 26.18 C ATOM 0 H1 VAL A 1 3.987 14.348 5.502 1.00 26.33 H new ATOM 0 H2 VAL A 1 4.288 14.870 4.180 1.00 26.33 H new ATOM 0 H3 VAL A 1 5.322 14.196 4.948 1.00 26.33 H new ATOM 0 HA VAL A 1 4.206 16.527 5.831 1.00 25.67 H new ATOM 0 HB VAL A 1 6.688 15.553 6.722 1.00 25.78 H new ATOM 0 HG11 VAL A 1 6.462 17.098 8.479 1.00 25.86 H new ATOM 0 HG12 VAL A 1 6.458 17.837 7.078 1.00 25.86 H new ATOM 0 HG13 VAL A 1 5.097 17.600 7.852 1.00 25.86 H new ATOM 0 HG21 VAL A 1 5.652 14.755 8.686 1.00 26.18 H new ATOM 0 HG22 VAL A 1 4.235 15.108 8.073 1.00 26.18 H new ATOM 0 HG23 VAL A 1 5.121 13.971 7.416 1.00 26.18 H new ATOM 8 N LEU A 2 5.358 17.974 4.266 1.00 23.33 N ATOM 9 CA LEU A 2 5.948 18.801 3.233 1.00 21.46 C ATOM 10 C LEU A 2 7.132 19.618 3.764 1.00 21.59 C ATOM 11 O LEU A 2 6.997 20.277 4.785 1.00 20.43 O ATOM 12 CB LEU A 2 4.831 19.693 2.665 1.00 21.14 C ATOM 13 CG LEU A 2 3.634 18.954 2.032 1.00 19.54 C ATOM 14 CD1 LEU A 2 2.472 19.907 1.583 1.00 18.65 C ATOM 15 CD2 LEU A 2 4.139 18.173 0.841 1.00 18.92 C ATOM 0 H LEU A 2 4.671 18.325 4.647 1.00 23.33 H new ATOM 0 HA LEU A 2 6.317 18.247 2.528 1.00 21.46 H new ATOM 0 HB2 LEU A 2 4.498 20.259 3.379 1.00 21.14 H new ATOM 0 HB3 LEU A 2 5.218 20.279 1.996 1.00 21.14 H new ATOM 0 HG LEU A 2 3.257 18.372 2.710 1.00 19.54 H new ATOM 0 HD11 LEU A 2 1.754 19.382 1.195 1.00 18.65 H new ATOM 0 HD12 LEU A 2 2.137 20.394 2.352 1.00 18.65 H new ATOM 0 HD13 LEU A 2 2.805 20.535 0.923 1.00 18.65 H new ATOM 0 HD21 LEU A 2 3.400 17.700 0.427 1.00 18.92 H new ATOM 0 HD22 LEU A 2 4.533 18.783 0.197 1.00 18.92 H new ATOM 0 HD23 LEU A 2 4.809 17.535 1.133 1.00 18.92 H new ATOM 16 N SER A 3 8.287 19.594 3.078 1.00 21.41 N ATOM 17 CA SER A 3 9.403 20.540 3.427 1.00 20.33 C ATOM 18 C SER A 3 9.097 21.983 2.976 1.00 19.98 C ATOM 19 O SER A 3 8.179 22.225 2.145 1.00 18.96 O ATOM 20 CB SER A 3 10.720 20.074 2.808 1.00 20.00 C ATOM 21 OG SER A 3 10.812 20.374 1.408 1.00 20.93 O ATOM 0 H SER A 3 8.455 19.060 2.425 1.00 21.41 H new ATOM 0 HA SER A 3 9.485 20.538 4.394 1.00 20.33 H new ATOM 0 HB2 SER A 3 11.459 20.495 3.274 1.00 20.00 H new ATOM 0 HB3 SER A 3 10.812 19.117 2.936 1.00 20.00 H new ATOM 0 HG SER A 3 11.549 20.102 1.111 1.00 20.93 H new ATOM 22 N PRO A 4 9.833 22.967 3.536 1.00 19.56 N ATOM 23 CA PRO A 4 9.703 24.307 3.029 1.00 18.76 C ATOM 24 C PRO A 4 9.849 24.404 1.495 1.00 18.12 C ATOM 25 O PRO A 4 9.020 25.050 0.841 1.00 16.90 O ATOM 26 CB PRO A 4 10.847 25.067 3.767 1.00 17.95 C ATOM 27 CG PRO A 4 10.929 24.441 5.045 1.00 18.86 C ATOM 28 CD PRO A 4 10.769 22.918 4.693 1.00 19.72 C ATOM 0 HA PRO A 4 8.820 24.674 3.190 1.00 18.76 H new ATOM 0 HB2 PRO A 4 11.686 24.996 3.285 1.00 17.95 H new ATOM 0 HB3 PRO A 4 10.646 26.012 3.850 1.00 17.95 H new ATOM 0 HG2 PRO A 4 11.776 24.623 5.482 1.00 18.86 H new ATOM 0 HG3 PRO A 4 10.229 24.748 5.643 1.00 18.86 H new ATOM 0 HD2 PRO A 4 11.616 22.508 4.458 1.00 19.72 H new ATOM 0 HD3 PRO A 4 10.404 22.410 5.434 1.00 19.72 H new ATOM 29 N ALA A 5 10.889 23.768 0.937 1.00 18.32 N ATOM 30 CA ALA A 5 11.062 23.712 -0.530 1.00 19.05 C ATOM 31 C ALA A 5 9.859 23.080 -1.273 1.00 17.97 C ATOM 32 O ALA A 5 9.492 23.581 -2.327 1.00 17.97 O ATOM 33 CB ALA A 5 12.402 22.994 -0.932 1.00 18.85 C ATOM 0 H ALA A 5 11.503 23.364 1.384 1.00 18.32 H new ATOM 0 HA ALA A 5 11.109 24.637 -0.818 1.00 19.05 H new ATOM 0 HB1 ALA A 5 12.482 22.975 -1.899 1.00 18.85 H new ATOM 0 HB2 ALA A 5 13.154 23.477 -0.555 1.00 18.85 H new ATOM 0 HB3 ALA A 5 12.398 22.086 -0.591 1.00 18.85 H new ATOM 34 N ASP A 6 9.284 21.991 -0.747 1.00 17.53 N ATOM 35 CA ASP A 6 8.072 21.355 -1.358 1.00 17.04 C ATOM 36 C ASP A 6 6.965 22.410 -1.473 1.00 16.23 C ATOM 37 O ASP A 6 6.342 22.576 -2.517 1.00 15.78 O ATOM 38 CB ASP A 6 7.485 20.195 -0.499 1.00 15.07 C ATOM 39 CG ASP A 6 8.380 18.950 -0.443 1.00 17.17 C ATOM 40 OD1 ASP A 6 8.977 18.591 -1.464 1.00 19.44 O ATOM 41 OD2 ASP A 6 8.442 18.306 0.621 1.00 16.96 O ATOM 0 H ASP A 6 9.570 21.596 -0.038 1.00 17.53 H new ATOM 0 HA ASP A 6 8.353 20.998 -2.215 1.00 17.04 H new ATOM 0 HB2 ASP A 6 7.336 20.516 0.404 1.00 15.07 H new ATOM 0 HB3 ASP A 6 6.619 19.945 -0.858 1.00 15.07 H new ATOM 42 N LYS A 7 6.729 23.116 -0.379 1.00 15.99 N ATOM 43 CA LYS A 7 5.703 24.188 -0.333 1.00 17.05 C ATOM 44 C LYS A 7 5.853 25.263 -1.397 1.00 16.90 C ATOM 45 O LYS A 7 4.857 25.653 -2.005 1.00 17.50 O ATOM 46 CB LYS A 7 5.653 24.853 1.056 1.00 16.42 C ATOM 47 CG LYS A 7 5.194 23.948 2.119 1.00 19.06 C ATOM 48 CD LYS A 7 5.166 24.626 3.452 1.00 23.37 C ATOM 49 CE LYS A 7 4.902 23.609 4.542 1.00 27.34 C ATOM 50 NZ LYS A 7 4.778 24.259 5.877 1.00 27.81 N ATOM 0 H LYS A 7 7.149 23.000 0.362 1.00 15.99 H new ATOM 0 HA LYS A 7 4.869 23.729 -0.521 1.00 17.05 H new ATOM 0 HB2 LYS A 7 6.537 25.184 1.281 1.00 16.42 H new ATOM 0 HB3 LYS A 7 5.063 25.622 1.018 1.00 16.42 H new ATOM 0 HG2 LYS A 7 4.307 23.620 1.904 1.00 19.06 H new ATOM 0 HG3 LYS A 7 5.779 23.176 2.161 1.00 19.06 H new ATOM 0 HD2 LYS A 7 6.011 25.073 3.614 1.00 23.37 H new ATOM 0 HD3 LYS A 7 4.477 25.309 3.462 1.00 23.37 H new ATOM 0 HE2 LYS A 7 4.088 23.122 4.341 1.00 27.34 H new ATOM 0 HE3 LYS A 7 5.623 22.960 4.562 1.00 27.34 H new ATOM 0 HZ1 LYS A 7 4.667 23.635 6.502 1.00 27.81 H new ATOM 0 HZ2 LYS A 7 5.517 24.724 6.051 1.00 27.81 H new ATOM 0 HZ3 LYS A 7 4.076 24.806 5.877 1.00 27.81 H new ATOM 51 N THR A 8 7.074 25.805 -1.548 1.00 16.57 N ATOM 52 CA THR A 8 7.421 26.663 -2.656 1.00 18.14 C ATOM 53 C THR A 8 7.250 26.007 -4.063 1.00 17.97 C ATOM 54 O THR A 8 6.714 26.632 -4.997 1.00 18.00 O ATOM 55 CB THR A 8 8.872 27.252 -2.437 1.00 19.43 C ATOM 56 OG1 THR A 8 8.888 27.935 -1.165 1.00 21.56 O ATOM 57 CG2 THR A 8 9.193 28.307 -3.470 1.00 17.54 C ATOM 0 H THR A 8 7.720 25.674 -0.996 1.00 16.57 H new ATOM 0 HA THR A 8 6.778 27.390 -2.662 1.00 18.14 H new ATOM 0 HB THR A 8 9.507 26.521 -2.491 1.00 19.43 H new ATOM 0 HG1 THR A 8 9.653 28.255 -1.028 1.00 21.56 H new ATOM 0 HG21 THR A 8 10.086 28.652 -3.314 1.00 17.54 H new ATOM 0 HG22 THR A 8 9.148 27.916 -4.357 1.00 17.54 H new ATOM 0 HG23 THR A 8 8.551 29.031 -3.403 1.00 17.54 H new ATOM 58 N ASN A 9 7.681 24.762 -4.223 1.00 17.25 N ATOM 59 CA ASN A 9 7.490 24.100 -5.532 1.00 17.63 C ATOM 60 C ASN A 9 6.002 24.045 -5.867 1.00 16.92 C ATOM 61 O ASN A 9 5.656 24.392 -6.954 1.00 16.96 O ATOM 62 CB ASN A 9 8.106 22.696 -5.535 1.00 16.78 C ATOM 63 CG ASN A 9 9.632 22.739 -5.512 1.00 19.59 C ATOM 64 OD1 ASN A 9 10.212 23.748 -5.862 1.00 23.02 O ATOM 65 ND2 ASN A 9 10.279 21.639 -5.121 1.00 21.26 N ATOM 0 H ASN A 9 8.072 24.290 -3.620 1.00 17.25 H new ATOM 0 HA ASN A 9 7.946 24.618 -6.214 1.00 17.63 H new ATOM 0 HB2 ASN A 9 7.786 22.202 -4.764 1.00 16.78 H new ATOM 0 HB3 ASN A 9 7.809 22.215 -6.323 1.00 16.78 H new ATOM 0 HD21 ASN A 9 11.139 21.627 -5.110 1.00 21.26 H new ATOM 0 HD22 ASN A 9 9.836 20.942 -4.880 1.00 21.26 H new ATOM 66 N ILE A 10 5.153 23.648 -4.902 1.00 18.26 N ATOM 67 CA ILE A 10 3.685 23.470 -5.119 1.00 19.20 C ATOM 68 C ILE A 10 3.028 24.835 -5.453 1.00 19.48 C ATOM 69 O ILE A 10 2.325 24.971 -6.460 1.00 17.12 O ATOM 70 CB ILE A 10 2.983 22.813 -3.890 1.00 20.50 C ATOM 71 CG1 ILE A 10 3.469 21.371 -3.671 1.00 20.98 C ATOM 72 CG2 ILE A 10 1.427 22.848 -3.994 1.00 19.48 C ATOM 73 CD1 ILE A 10 3.337 20.926 -2.155 1.00 18.82 C ATOM 0 H ILE A 10 5.405 23.472 -4.099 1.00 18.26 H new ATOM 0 HA ILE A 10 3.571 22.866 -5.869 1.00 19.20 H new ATOM 0 HB ILE A 10 3.233 23.348 -3.120 1.00 20.50 H new ATOM 0 HG12 ILE A 10 2.955 20.768 -4.230 1.00 20.98 H new ATOM 0 HG13 ILE A 10 4.395 21.296 -3.950 1.00 20.98 H new ATOM 0 HG21 ILE A 10 1.041 22.429 -3.209 1.00 19.48 H new ATOM 0 HG22 ILE A 10 1.127 23.769 -4.050 1.00 19.48 H new ATOM 0 HG23 ILE A 10 1.145 22.368 -4.788 1.00 19.48 H new ATOM 0 HD11 ILE A 10 3.652 20.014 -2.057 1.00 18.82 H new ATOM 0 HD12 ILE A 10 3.870 21.514 -1.597 1.00 18.82 H new ATOM 0 HD13 ILE A 10 2.408 20.978 -1.882 1.00 18.82 H new ATOM 74 N LYS A 11 3.286 25.838 -4.616 1.00 19.69 N ATOM 75 CA LYS A 11 2.715 27.156 -4.845 1.00 22.02 C ATOM 76 C LYS A 11 3.089 27.690 -6.205 1.00 21.88 C ATOM 77 O LYS A 11 2.230 28.078 -6.975 1.00 22.01 O ATOM 78 CB LYS A 11 3.212 28.161 -3.796 1.00 22.80 C ATOM 79 CG LYS A 11 2.603 27.981 -2.432 1.00 26.38 C ATOM 80 CD LYS A 11 2.978 29.232 -1.583 1.00 30.60 C ATOM 81 CE LYS A 11 2.838 28.932 -0.142 1.00 34.16 C ATOM 82 NZ LYS A 11 3.939 28.010 0.267 1.00 36.49 N ATOM 0 H LYS A 11 3.784 25.775 -3.918 1.00 19.69 H new ATOM 0 HA LYS A 11 1.752 27.054 -4.784 1.00 22.02 H new ATOM 0 HB2 LYS A 11 4.176 28.085 -3.721 1.00 22.80 H new ATOM 0 HB3 LYS A 11 3.022 29.060 -4.108 1.00 22.80 H new ATOM 0 HG2 LYS A 11 1.640 27.890 -2.498 1.00 26.38 H new ATOM 0 HG3 LYS A 11 2.937 27.172 -2.013 1.00 26.38 H new ATOM 0 HD2 LYS A 11 3.889 29.501 -1.777 1.00 30.60 H new ATOM 0 HD3 LYS A 11 2.405 29.977 -1.822 1.00 30.60 H new ATOM 0 HE2 LYS A 11 2.876 29.751 0.377 1.00 34.16 H new ATOM 0 HE3 LYS A 11 1.976 28.524 0.034 1.00 34.16 H new ATOM 0 HZ1 LYS A 11 4.086 28.092 1.141 1.00 36.49 H new ATOM 0 HZ2 LYS A 11 3.707 27.171 0.083 1.00 36.49 H new ATOM 0 HZ3 LYS A 11 4.681 28.217 -0.179 1.00 36.49 H new ATOM 83 N THR A 12 4.376 27.695 -6.523 1.00 23.38 N ATOM 84 CA THR A 12 4.804 28.300 -7.753 1.00 24.41 C ATOM 85 C THR A 12 4.338 27.529 -8.997 1.00 25.30 C ATOM 86 O THR A 12 3.963 28.154 -9.969 1.00 25.78 O ATOM 87 CB THR A 12 6.317 28.598 -7.779 1.00 25.69 C ATOM 88 OG1 THR A 12 7.053 27.393 -7.576 1.00 28.55 O ATOM 89 CG2 THR A 12 6.697 29.565 -6.651 1.00 23.79 C ATOM 0 H THR A 12 5.003 27.356 -6.042 1.00 23.38 H new ATOM 0 HA THR A 12 4.357 29.160 -7.788 1.00 24.41 H new ATOM 0 HB THR A 12 6.526 28.990 -8.641 1.00 25.69 H new ATOM 0 HG1 THR A 12 6.962 27.139 -6.780 1.00 28.55 H new ATOM 0 HG21 THR A 12 7.650 29.741 -6.683 1.00 23.79 H new ATOM 0 HG22 THR A 12 6.211 30.397 -6.761 1.00 23.79 H new ATOM 0 HG23 THR A 12 6.470 29.169 -5.795 1.00 23.79 H new ATOM 90 N ALA A 13 4.314 26.187 -8.952 1.00 25.47 N ATOM 91 CA ALA A 13 3.726 25.381 -10.014 1.00 26.54 C ATOM 92 C ALA A 13 2.229 25.680 -10.219 1.00 28.05 C ATOM 93 O ALA A 13 1.771 25.767 -11.366 1.00 25.79 O ATOM 94 CB ALA A 13 3.919 23.865 -9.713 1.00 27.00 C ATOM 0 H ALA A 13 4.640 25.727 -8.302 1.00 25.47 H new ATOM 0 HA ALA A 13 4.188 25.616 -10.834 1.00 26.54 H new ATOM 0 HB1 ALA A 13 3.524 23.340 -10.427 1.00 27.00 H new ATOM 0 HB2 ALA A 13 4.866 23.665 -9.652 1.00 27.00 H new ATOM 0 HB3 ALA A 13 3.488 23.644 -8.873 1.00 27.00 H new ATOM 95 N TRP A 14 1.492 25.867 -9.111 1.00 29.15 N ATOM 96 CA TRP A 14 0.042 26.035 -9.171 1.00 32.32 C ATOM 97 C TRP A 14 -0.397 27.381 -9.777 1.00 34.24 C ATOM 98 O TRP A 14 -1.515 27.513 -10.295 1.00 34.30 O ATOM 99 CB TRP A 14 -0.590 25.861 -7.780 1.00 32.54 C ATOM 100 CG TRP A 14 -1.887 25.147 -7.915 1.00 32.07 C ATOM 101 CD1 TRP A 14 -3.142 25.703 -7.929 1.00 31.28 C ATOM 102 CD2 TRP A 14 -2.061 23.740 -8.164 1.00 31.59 C ATOM 103 NE1 TRP A 14 -4.078 24.712 -8.159 1.00 32.44 N ATOM 104 CE2 TRP A 14 -3.442 23.506 -8.298 1.00 31.30 C ATOM 105 CE3 TRP A 14 -1.181 22.658 -8.274 1.00 31.22 C ATOM 106 CZ2 TRP A 14 -3.963 22.228 -8.519 1.00 33.54 C ATOM 107 CZ3 TRP A 14 -1.690 21.406 -8.490 1.00 31.54 C ATOM 108 CH2 TRP A 14 -3.075 21.194 -8.617 1.00 31.48 C ATOM 0 H TRP A 14 1.820 25.899 -8.317 1.00 29.15 H new ATOM 0 HA TRP A 14 -0.278 25.339 -9.766 1.00 32.32 H new ATOM 0 HB2 TRP A 14 0.008 25.361 -7.202 1.00 32.54 H new ATOM 0 HB3 TRP A 14 -0.727 26.727 -7.365 1.00 32.54 H new ATOM 0 HD1 TRP A 14 -3.333 26.605 -7.803 1.00 31.28 H new ATOM 0 HE1 TRP A 14 -4.928 24.833 -8.207 1.00 32.44 H new ATOM 0 HE3 TRP A 14 -0.263 22.788 -8.201 1.00 31.22 H new ATOM 0 HZ2 TRP A 14 -4.879 22.087 -8.596 1.00 33.54 H new ATOM 0 HZ3 TRP A 14 -1.110 20.682 -8.554 1.00 31.54 H new ATOM 0 HH2 TRP A 14 -3.392 20.333 -8.771 1.00 31.48 H new ATOM 109 N GLU A 15 0.491 28.374 -9.685 1.00 36.28 N ATOM 110 CA GLU A 15 0.348 29.647 -10.373 1.00 39.06 C ATOM 111 C GLU A 15 0.310 29.493 -11.897 1.00 39.82 C ATOM 112 O GLU A 15 -0.512 30.106 -12.582 1.00 39.12 O ATOM 113 CB GLU A 15 1.555 30.511 -10.048 1.00 39.52 C ATOM 114 CG GLU A 15 1.423 31.348 -8.817 1.00 43.46 C ATOM 115 CD GLU A 15 2.502 32.396 -8.796 1.00 48.90 C ATOM 116 OE1 GLU A 15 2.694 33.053 -9.853 1.00 51.04 O ATOM 117 OE2 GLU A 15 3.162 32.542 -7.742 1.00 51.15 O ATOM 0 H GLU A 15 1.206 28.320 -9.210 1.00 36.28 H new ATOM 0 HA GLU A 15 -0.488 30.039 -10.077 1.00 39.06 H new ATOM 0 HB2 GLU A 15 2.330 29.936 -9.950 1.00 39.52 H new ATOM 0 HB3 GLU A 15 1.729 31.095 -10.802 1.00 39.52 H new ATOM 0 HG2 GLU A 15 0.550 31.770 -8.795 1.00 43.46 H new ATOM 0 HG3 GLU A 15 1.488 30.789 -8.027 1.00 43.46 H new ATOM 118 N LYS A 16 1.251 28.711 -12.406 1.00 41.52 N ATOM 119 CA LYS A 16 1.337 28.404 -13.822 1.00 43.98 C ATOM 120 C LYS A 16 0.106 27.636 -14.253 1.00 45.37 C ATOM 121 O LYS A 16 -0.417 27.882 -15.326 1.00 46.22 O ATOM 122 CB LYS A 16 2.599 27.594 -14.127 1.00 44.22 C ATOM 123 CG LYS A 16 3.842 28.405 -14.527 1.00 46.30 C ATOM 124 CD LYS A 16 4.221 29.493 -13.512 1.00 49.24 C ATOM 125 CE LYS A 16 5.747 29.643 -13.379 1.00 50.52 C ATOM 126 NZ LYS A 16 6.355 28.545 -12.556 1.00 50.04 N ATOM 0 H LYS A 16 1.865 28.340 -11.932 1.00 41.52 H new ATOM 0 HA LYS A 16 1.385 29.236 -14.318 1.00 43.98 H new ATOM 0 HB2 LYS A 16 2.819 27.064 -13.345 1.00 44.22 H new ATOM 0 HB3 LYS A 16 2.397 26.972 -14.843 1.00 44.22 H new ATOM 0 HG2 LYS A 16 4.592 27.800 -14.636 1.00 46.30 H new ATOM 0 HG3 LYS A 16 3.684 28.819 -15.390 1.00 46.30 H new ATOM 0 HD2 LYS A 16 3.835 30.340 -13.786 1.00 49.24 H new ATOM 0 HD3 LYS A 16 3.841 29.275 -12.647 1.00 49.24 H new ATOM 0 HE2 LYS A 16 6.148 29.643 -14.262 1.00 50.52 H new ATOM 0 HE3 LYS A 16 5.952 30.500 -12.974 1.00 50.52 H new ATOM 0 HZ1 LYS A 16 7.196 28.755 -12.356 1.00 50.04 H new ATOM 0 HZ2 LYS A 16 5.888 28.443 -11.805 1.00 50.04 H new ATOM 0 HZ3 LYS A 16 6.341 27.785 -13.018 1.00 50.04 H new ATOM 127 N ILE A 17 -0.372 26.729 -13.402 1.00 46.83 N ATOM 128 CA ILE A 17 -1.493 25.846 -13.750 1.00 48.71 C ATOM 129 C ILE A 17 -2.804 26.650 -13.791 1.00 49.92 C ATOM 130 O ILE A 17 -3.631 26.439 -14.671 1.00 50.64 O ATOM 131 CB ILE A 17 -1.468 24.559 -12.882 1.00 48.63 C ATOM 132 CG1 ILE A 17 -0.259 23.719 -13.297 1.00 47.19 C ATOM 133 CG2 ILE A 17 -2.769 23.739 -12.972 1.00 49.49 C ATOM 134 CD1 ILE A 17 0.330 22.909 -12.177 1.00 46.08 C ATOM 0 H ILE A 17 -0.060 26.606 -12.610 1.00 46.83 H new ATOM 0 HA ILE A 17 -1.408 25.500 -14.652 1.00 48.71 H new ATOM 0 HB ILE A 17 -1.395 24.823 -11.952 1.00 48.63 H new ATOM 0 HG12 ILE A 17 -0.522 23.121 -14.014 1.00 47.19 H new ATOM 0 HG13 ILE A 17 0.425 24.307 -13.654 1.00 47.19 H new ATOM 0 HG21 ILE A 17 -2.694 22.951 -12.412 1.00 49.49 H new ATOM 0 HG22 ILE A 17 -3.515 24.281 -12.670 1.00 49.49 H new ATOM 0 HG23 ILE A 17 -2.918 23.468 -13.891 1.00 49.49 H new ATOM 0 HD11 ILE A 17 1.089 22.403 -12.508 1.00 46.08 H new ATOM 0 HD12 ILE A 17 0.622 23.502 -11.467 1.00 46.08 H new ATOM 0 HD13 ILE A 17 -0.340 22.298 -11.832 1.00 46.08 H new ATOM 135 N GLY A 18 -2.956 27.592 -12.857 1.00 51.21 N ATOM 136 CA GLY A 18 -3.745 28.824 -13.079 1.00 51.88 C ATOM 137 C GLY A 18 -5.187 28.735 -13.537 1.00 52.24 C ATOM 138 O GLY A 18 -5.994 28.076 -12.890 1.00 52.13 O ATOM 0 H GLY A 18 -2.606 27.540 -12.073 1.00 51.21 H new ATOM 0 HA2 GLY A 18 -3.738 29.324 -12.248 1.00 51.88 H new ATOM 0 HA3 GLY A 18 -3.268 29.357 -13.734 1.00 51.88 H new ATOM 139 N SER A 19 -5.512 29.398 -14.654 1.00 52.87 N ATOM 140 CA SER A 19 -6.924 29.485 -15.117 1.00 53.49 C ATOM 141 C SER A 19 -7.509 28.200 -15.755 1.00 53.41 C ATOM 142 O SER A 19 -8.734 28.077 -15.941 1.00 53.68 O ATOM 143 CB SER A 19 -7.144 30.698 -16.040 1.00 53.81 C ATOM 144 OG SER A 19 -6.798 30.415 -17.389 1.00 54.19 O ATOM 0 H SER A 19 -4.944 29.802 -15.158 1.00 52.87 H new ATOM 0 HA SER A 19 -7.426 29.603 -14.296 1.00 53.49 H new ATOM 0 HB2 SER A 19 -8.074 30.971 -15.997 1.00 53.81 H new ATOM 0 HB3 SER A 19 -6.614 31.445 -15.722 1.00 53.81 H new ATOM 0 HG SER A 19 -6.932 31.096 -17.862 1.00 54.19 H new ATOM 145 N HIS A 20 -6.644 27.239 -16.057 1.00 53.24 N ATOM 146 CA HIS A 20 -7.094 25.990 -16.683 1.00 53.02 C ATOM 147 C HIS A 20 -7.359 24.865 -15.674 1.00 51.71 C ATOM 148 O HIS A 20 -7.650 23.723 -16.074 1.00 51.44 O ATOM 149 CB HIS A 20 -6.087 25.556 -17.747 1.00 53.68 C ATOM 150 CG HIS A 20 -5.599 26.693 -18.585 1.00 57.29 C ATOM 151 ND1 HIS A 20 -4.268 27.053 -18.652 1.00 59.74 N ATOM 152 CD2 HIS A 20 -6.275 27.598 -19.334 1.00 59.04 C ATOM 153 CE1 HIS A 20 -4.142 28.109 -19.434 1.00 60.17 C ATOM 154 NE2 HIS A 20 -5.346 28.462 -19.857 1.00 60.39 N ATOM 0 H HIS A 20 -5.798 27.285 -15.911 1.00 53.24 H new ATOM 0 HA HIS A 20 -7.950 26.170 -17.102 1.00 53.02 H new ATOM 0 HB2 HIS A 20 -5.330 25.131 -17.315 1.00 53.68 H new ATOM 0 HB3 HIS A 20 -6.497 24.890 -18.321 1.00 53.68 H new ATOM 0 HD2 HIS A 20 -7.195 27.628 -19.468 1.00 59.04 H new ATOM 0 HE1 HIS A 20 -3.343 28.533 -19.651 1.00 60.17 H new ATOM 0 HE2 HIS A 20 -5.518 29.126 -20.376 1.00 60.39 H new ATOM 155 N GLY A 21 -7.258 25.190 -14.381 1.00 49.91 N ATOM 156 CA GLY A 21 -7.541 24.234 -13.315 1.00 48.25 C ATOM 157 C GLY A 21 -8.686 23.291 -13.670 1.00 46.84 C ATOM 158 O GLY A 21 -8.503 22.064 -13.760 1.00 46.69 O ATOM 0 H GLY A 21 -7.024 25.969 -14.102 1.00 49.91 H new ATOM 0 HA2 GLY A 21 -6.743 23.715 -13.129 1.00 48.25 H new ATOM 0 HA3 GLY A 21 -7.762 24.715 -12.502 1.00 48.25 H new ATOM 159 N GLY A 22 -9.865 23.864 -13.914 1.00 45.02 N ATOM 160 CA GLY A 22 -11.077 23.075 -14.170 1.00 42.94 C ATOM 161 C GLY A 22 -10.955 22.022 -15.257 1.00 40.92 C ATOM 162 O GLY A 22 -11.514 20.931 -15.120 1.00 41.18 O ATOM 0 H GLY A 22 -9.987 24.715 -13.936 1.00 45.02 H new ATOM 0 HA2 GLY A 22 -11.339 22.637 -13.345 1.00 42.94 H new ATOM 0 HA3 GLY A 22 -11.795 23.682 -14.409 1.00 42.94 H new ATOM 163 N GLU A 23 -10.211 22.349 -16.319 1.00 38.74 N ATOM 164 CA GLU A 23 -10.014 21.482 -17.510 1.00 36.82 C ATOM 165 C GLU A 23 -9.124 20.281 -17.188 1.00 33.61 C ATOM 166 O GLU A 23 -9.435 19.162 -17.611 1.00 30.94 O ATOM 167 CB GLU A 23 -9.399 22.277 -18.662 1.00 36.88 C ATOM 168 CG GLU A 23 -9.877 23.747 -18.642 1.00 43.46 C ATOM 169 CD GLU A 23 -9.013 24.689 -19.463 1.00 50.22 C ATOM 170 OE1 GLU A 23 -7.986 24.220 -20.031 1.00 52.35 O ATOM 171 OE2 GLU A 23 -9.361 25.904 -19.524 1.00 52.44 O ATOM 0 H GLU A 23 -9.793 23.098 -16.376 1.00 38.74 H new ATOM 0 HA GLU A 23 -10.888 21.156 -17.775 1.00 36.82 H new ATOM 0 HB2 GLU A 23 -8.432 22.248 -18.599 1.00 36.88 H new ATOM 0 HB3 GLU A 23 -9.641 21.867 -19.507 1.00 36.88 H new ATOM 0 HG2 GLU A 23 -10.788 23.786 -18.974 1.00 43.46 H new ATOM 0 HG3 GLU A 23 -9.897 24.059 -17.724 1.00 43.46 H new ATOM 172 N TYR A 24 -8.039 20.530 -16.435 1.00 30.16 N ATOM 173 CA TYR A 24 -7.182 19.448 -15.965 1.00 27.87 C ATOM 174 C TYR A 24 -7.946 18.478 -15.062 1.00 25.04 C ATOM 175 O TYR A 24 -7.724 17.248 -15.106 1.00 22.95 O ATOM 176 CB TYR A 24 -5.899 19.980 -15.318 1.00 29.41 C ATOM 177 CG TYR A 24 -5.146 20.927 -16.243 1.00 32.75 C ATOM 178 CD1 TYR A 24 -5.233 20.799 -17.628 1.00 34.74 C ATOM 179 CD2 TYR A 24 -4.319 21.939 -15.740 1.00 35.43 C ATOM 180 CE1 TYR A 24 -4.577 21.668 -18.478 1.00 33.92 C ATOM 181 CE2 TYR A 24 -3.642 22.815 -16.598 1.00 33.04 C ATOM 182 CZ TYR A 24 -3.776 22.666 -17.963 1.00 33.94 C ATOM 183 OH TYR A 24 -3.092 23.505 -18.833 1.00 34.70 O ATOM 0 H TYR A 24 -7.790 21.316 -16.191 1.00 30.16 H new ATOM 0 HA TYR A 24 -6.901 18.937 -16.740 1.00 27.87 H new ATOM 0 HB2 TYR A 24 -6.120 20.441 -14.494 1.00 29.41 H new ATOM 0 HB3 TYR A 24 -5.324 19.235 -15.081 1.00 29.41 H new ATOM 0 HD1 TYR A 24 -5.745 20.112 -17.989 1.00 34.74 H new ATOM 0 HD2 TYR A 24 -4.218 22.031 -14.820 1.00 35.43 H new ATOM 0 HE1 TYR A 24 -4.675 21.580 -19.399 1.00 33.92 H new ATOM 0 HE2 TYR A 24 -3.107 23.491 -16.250 1.00 33.04 H new ATOM 0 HH TYR A 24 -2.265 23.383 -18.749 1.00 34.70 H new ATOM 184 N GLY A 25 -8.849 19.041 -14.250 1.00 22.20 N ATOM 185 CA GLY A 25 -9.686 18.251 -13.348 1.00 18.78 C ATOM 186 C GLY A 25 -10.542 17.252 -14.101 1.00 18.02 C ATOM 187 O GLY A 25 -10.527 16.047 -13.795 1.00 17.64 O ATOM 0 H GLY A 25 -8.990 19.888 -14.209 1.00 22.20 H new ATOM 0 HA2 GLY A 25 -9.123 17.781 -12.714 1.00 18.78 H new ATOM 0 HA3 GLY A 25 -10.257 18.844 -12.835 1.00 18.78 H new ATOM 188 N ALA A 26 -11.246 17.743 -15.120 1.00 15.81 N ATOM 189 CA ALA A 26 -12.142 16.934 -15.891 1.00 16.24 C ATOM 190 C ALA A 26 -11.406 15.783 -16.612 1.00 16.37 C ATOM 191 O ALA A 26 -11.896 14.661 -16.627 1.00 16.38 O ATOM 192 CB ALA A 26 -12.845 17.784 -16.885 1.00 14.59 C ATOM 0 H ALA A 26 -11.207 18.564 -15.374 1.00 15.81 H new ATOM 0 HA ALA A 26 -12.782 16.534 -15.282 1.00 16.24 H new ATOM 0 HB1 ALA A 26 -13.452 17.237 -17.407 1.00 14.59 H new ATOM 0 HB2 ALA A 26 -13.348 18.473 -16.424 1.00 14.59 H new ATOM 0 HB3 ALA A 26 -12.195 18.198 -17.474 1.00 14.59 H new ATOM 193 N GLU A 27 -10.236 16.098 -17.177 1.00 15.98 N ATOM 194 CA GLU A 27 -9.406 15.166 -17.868 1.00 16.98 C ATOM 195 C GLU A 27 -8.791 14.096 -16.933 1.00 15.87 C ATOM 196 O GLU A 27 -8.782 12.905 -17.269 1.00 16.43 O ATOM 197 CB GLU A 27 -8.323 15.897 -18.678 1.00 16.79 C ATOM 198 CG GLU A 27 -7.325 14.881 -19.356 1.00 17.29 C ATOM 199 CD GLU A 27 -6.264 15.563 -20.222 1.00 19.95 C ATOM 200 OE1 GLU A 27 -6.347 16.781 -20.516 1.00 19.85 O ATOM 201 OE2 GLU A 27 -5.306 14.895 -20.569 1.00 20.72 O ATOM 0 H GLU A 27 -9.910 16.893 -17.157 1.00 15.98 H new ATOM 0 HA GLU A 27 -9.978 14.684 -18.486 1.00 16.98 H new ATOM 0 HB2 GLU A 27 -8.742 16.445 -19.360 1.00 16.79 H new ATOM 0 HB3 GLU A 27 -7.831 16.496 -18.095 1.00 16.79 H new ATOM 0 HG2 GLU A 27 -6.885 14.360 -18.666 1.00 17.29 H new ATOM 0 HG3 GLU A 27 -7.829 14.258 -19.903 1.00 17.29 H new ATOM 202 N ALA A 28 -8.331 14.500 -15.754 1.00 14.33 N ATOM 203 CA ALA A 28 -7.815 13.534 -14.790 1.00 13.78 C ATOM 204 C ALA A 28 -8.916 12.543 -14.379 1.00 13.38 C ATOM 205 O ALA A 28 -8.668 11.346 -14.227 1.00 11.58 O ATOM 206 CB ALA A 28 -7.300 14.271 -13.537 1.00 14.29 C ATOM 0 H ALA A 28 -8.308 15.319 -15.494 1.00 14.33 H new ATOM 0 HA ALA A 28 -7.087 13.044 -15.204 1.00 13.78 H new ATOM 0 HB1 ALA A 28 -6.958 13.625 -12.899 1.00 14.29 H new ATOM 0 HB2 ALA A 28 -6.590 14.882 -13.790 1.00 14.29 H new ATOM 0 HB3 ALA A 28 -8.027 14.770 -13.133 1.00 14.29 H new ATOM 207 N VAL A 29 -10.134 13.048 -14.158 1.00 14.31 N ATOM 208 CA VAL A 29 -11.247 12.159 -13.786 1.00 15.17 C ATOM 209 C VAL A 29 -11.570 11.163 -14.912 1.00 15.94 C ATOM 210 O VAL A 29 -11.840 9.987 -14.667 1.00 15.50 O ATOM 211 CB VAL A 29 -12.517 12.943 -13.346 1.00 17.02 C ATOM 212 CG1 VAL A 29 -13.717 11.991 -13.151 1.00 17.79 C ATOM 213 CG2 VAL A 29 -12.239 13.690 -11.980 1.00 14.22 C ATOM 0 H VAL A 29 -10.336 13.882 -14.216 1.00 14.31 H new ATOM 0 HA VAL A 29 -10.950 11.653 -13.014 1.00 15.17 H new ATOM 0 HB VAL A 29 -12.729 13.582 -14.044 1.00 17.02 H new ATOM 0 HG11 VAL A 29 -14.495 12.502 -12.877 1.00 17.79 H new ATOM 0 HG12 VAL A 29 -13.907 11.535 -13.986 1.00 17.79 H new ATOM 0 HG13 VAL A 29 -13.504 11.337 -12.467 1.00 17.79 H new ATOM 0 HG21 VAL A 29 -13.033 14.177 -11.710 1.00 14.22 H new ATOM 0 HG22 VAL A 29 -12.010 13.041 -11.297 1.00 14.22 H new ATOM 0 HG23 VAL A 29 -11.503 14.311 -12.095 1.00 14.22 H new ATOM 214 N GLU A 30 -11.593 11.655 -16.146 1.00 18.04 N ATOM 215 CA GLU A 30 -11.940 10.836 -17.289 1.00 18.84 C ATOM 216 C GLU A 30 -10.872 9.738 -17.489 1.00 18.14 C ATOM 217 O GLU A 30 -11.172 8.550 -17.705 1.00 18.28 O ATOM 218 CB GLU A 30 -12.056 11.749 -18.496 1.00 19.19 C ATOM 219 CG GLU A 30 -12.619 11.119 -19.696 1.00 26.87 C ATOM 220 CD GLU A 30 -12.840 12.146 -20.762 1.00 36.44 C ATOM 221 OE1 GLU A 30 -13.584 13.144 -20.479 1.00 38.05 O ATOM 222 OE2 GLU A 30 -12.219 11.967 -21.843 1.00 36.20 O ATOM 0 H GLU A 30 -11.407 12.472 -16.339 1.00 18.04 H new ATOM 0 HA GLU A 30 -12.787 10.384 -17.155 1.00 18.84 H new ATOM 0 HB2 GLU A 30 -12.608 12.510 -18.257 1.00 19.19 H new ATOM 0 HB3 GLU A 30 -11.175 12.093 -18.711 1.00 19.19 H new ATOM 0 HG2 GLU A 30 -12.018 10.430 -20.020 1.00 26.87 H new ATOM 0 HG3 GLU A 30 -13.458 10.684 -19.478 1.00 26.87 H new ATOM 223 N ARG A 31 -9.619 10.133 -17.365 1.00 17.05 N ATOM 224 CA ARG A 31 -8.497 9.170 -17.347 1.00 15.89 C ATOM 225 C ARG A 31 -8.607 8.127 -16.234 1.00 16.06 C ATOM 226 O ARG A 31 -8.207 6.953 -16.435 1.00 16.04 O ATOM 227 CB ARG A 31 -7.175 9.922 -17.193 1.00 14.05 C ATOM 228 CG ARG A 31 -6.650 10.534 -18.473 1.00 15.00 C ATOM 229 CD ARG A 31 -5.304 11.337 -18.181 1.00 14.88 C ATOM 230 NE ARG A 31 -4.858 12.111 -19.347 1.00 11.59 N ATOM 231 CZ ARG A 31 -4.294 11.600 -20.442 1.00 14.82 C ATOM 232 NH1 ARG A 31 -4.124 10.271 -20.573 1.00 11.12 N ATOM 233 NH2 ARG A 31 -3.952 12.401 -21.441 1.00 12.89 N ATOM 0 H ARG A 31 -9.381 10.956 -17.289 1.00 17.05 H new ATOM 0 HA ARG A 31 -8.532 8.693 -18.191 1.00 15.89 H new ATOM 0 HB2 ARG A 31 -7.291 10.625 -16.535 1.00 14.05 H new ATOM 0 HB3 ARG A 31 -6.508 9.312 -16.842 1.00 14.05 H new ATOM 0 HG2 ARG A 31 -6.485 9.839 -19.129 1.00 15.00 H new ATOM 0 HG3 ARG A 31 -7.315 11.130 -18.852 1.00 15.00 H new ATOM 0 HD2 ARG A 31 -5.442 11.936 -17.431 1.00 14.88 H new ATOM 0 HD3 ARG A 31 -4.607 10.714 -17.922 1.00 14.88 H new ATOM 0 HE ARG A 31 -4.970 12.963 -19.321 1.00 11.59 H new ATOM 0 HH11 ARG A 31 -4.380 9.741 -19.946 1.00 11.12 H new ATOM 0 HH12 ARG A 31 -3.759 9.952 -21.283 1.00 11.12 H new ATOM 0 HH21 ARG A 31 -4.094 13.247 -21.382 1.00 12.89 H new ATOM 0 HH22 ARG A 31 -3.588 12.075 -22.149 1.00 12.89 H new ATOM 234 N MET A 32 -9.107 8.540 -15.048 1.00 14.20 N ATOM 235 CA MET A 32 -9.321 7.580 -13.979 1.00 15.77 C ATOM 236 C MET A 32 -10.435 6.584 -14.336 1.00 15.26 C ATOM 237 O MET A 32 -10.238 5.401 -14.211 1.00 14.29 O ATOM 238 CB MET A 32 -9.664 8.238 -12.645 1.00 14.65 C ATOM 239 CG MET A 32 -9.802 7.246 -11.493 1.00 16.16 C ATOM 240 SD MET A 32 -10.264 8.145 -9.961 1.00 16.41 S ATOM 241 CE MET A 32 -11.861 8.743 -10.426 1.00 16.52 C ATOM 0 H MET A 32 -9.319 9.352 -14.860 1.00 14.20 H new ATOM 0 HA MET A 32 -8.477 7.113 -13.880 1.00 15.77 H new ATOM 0 HB2 MET A 32 -8.975 8.884 -12.425 1.00 14.65 H new ATOM 0 HB3 MET A 32 -10.495 8.730 -12.740 1.00 14.65 H new ATOM 0 HG2 MET A 32 -10.476 6.581 -11.705 1.00 16.16 H new ATOM 0 HG3 MET A 32 -8.967 6.771 -11.361 1.00 16.16 H new ATOM 0 HE1 MET A 32 -12.471 8.655 -9.677 1.00 16.52 H new ATOM 0 HE2 MET A 32 -11.796 9.677 -10.681 1.00 16.52 H new ATOM 0 HE3 MET A 32 -12.195 8.226 -11.176 1.00 16.52 H new ATOM 242 N PHE A 33 -11.581 7.077 -14.790 1.00 15.70 N ATOM 243 CA PHE A 33 -12.720 6.175 -15.123 1.00 16.59 C ATOM 244 C PHE A 33 -12.379 5.198 -16.255 1.00 16.50 C ATOM 245 O PHE A 33 -12.751 4.055 -16.174 1.00 17.85 O ATOM 246 CB PHE A 33 -13.939 6.998 -15.558 1.00 17.05 C ATOM 247 CG PHE A 33 -14.585 7.766 -14.456 1.00 14.98 C ATOM 248 CD1 PHE A 33 -14.540 7.344 -13.123 1.00 16.32 C ATOM 249 CD2 PHE A 33 -15.291 8.908 -14.757 1.00 19.61 C ATOM 250 CE1 PHE A 33 -15.208 8.099 -12.107 1.00 15.87 C ATOM 251 CE2 PHE A 33 -15.940 9.654 -13.743 1.00 16.69 C ATOM 252 CZ PHE A 33 -15.882 9.257 -12.452 1.00 14.78 C ATOM 0 H PHE A 33 -11.734 7.914 -14.916 1.00 15.70 H new ATOM 0 HA PHE A 33 -12.913 5.667 -14.319 1.00 16.59 H new ATOM 0 HB2 PHE A 33 -13.667 7.617 -16.253 1.00 17.05 H new ATOM 0 HB3 PHE A 33 -14.596 6.402 -15.951 1.00 17.05 H new ATOM 0 HD1 PHE A 33 -14.075 6.571 -12.896 1.00 16.32 H new ATOM 0 HD2 PHE A 33 -15.343 9.195 -15.640 1.00 19.61 H new ATOM 0 HE1 PHE A 33 -15.189 7.814 -11.222 1.00 15.87 H new ATOM 0 HE2 PHE A 33 -16.410 10.424 -13.967 1.00 16.69 H new ATOM 0 HZ PHE A 33 -16.297 9.765 -11.793 1.00 14.78 H new ATOM 253 N LEU A 34 -11.624 5.631 -17.269 1.00 16.50 N ATOM 254 CA LEU A 34 -11.167 4.760 -18.350 1.00 17.76 C ATOM 255 C LEU A 34 -10.049 3.788 -17.909 1.00 17.86 C ATOM 256 O LEU A 34 -10.080 2.605 -18.253 1.00 18.59 O ATOM 257 CB LEU A 34 -10.714 5.542 -19.619 1.00 17.02 C ATOM 258 CG LEU A 34 -11.861 6.125 -20.448 1.00 22.04 C ATOM 259 CD1 LEU A 34 -11.457 7.301 -21.336 1.00 21.01 C ATOM 260 CD2 LEU A 34 -12.478 4.941 -21.296 1.00 26.01 C ATOM 0 H LEU A 34 -11.362 6.446 -17.347 1.00 16.50 H new ATOM 0 HA LEU A 34 -11.949 4.237 -18.585 1.00 17.76 H new ATOM 0 HB2 LEU A 34 -10.127 6.265 -19.347 1.00 17.02 H new ATOM 0 HB3 LEU A 34 -10.192 4.949 -20.182 1.00 17.02 H new ATOM 0 HG LEU A 34 -12.517 6.504 -19.842 1.00 22.04 H new ATOM 0 HD11 LEU A 34 -12.231 7.616 -21.828 1.00 21.01 H new ATOM 0 HD12 LEU A 34 -11.111 8.020 -20.784 1.00 21.01 H new ATOM 0 HD13 LEU A 34 -10.772 7.015 -21.960 1.00 21.01 H new ATOM 0 HD21 LEU A 34 -13.211 5.277 -21.836 1.00 26.01 H new ATOM 0 HD22 LEU A 34 -11.795 4.568 -21.875 1.00 26.01 H new ATOM 0 HD23 LEU A 34 -12.807 4.252 -20.698 1.00 26.01 H new ATOM 261 N GLY A 35 -9.064 4.303 -17.200 1.00 18.20 N ATOM 262 CA GLY A 35 -7.884 3.527 -16.810 1.00 18.13 C ATOM 263 C GLY A 35 -8.131 2.494 -15.738 1.00 18.34 C ATOM 264 O GLY A 35 -7.450 1.450 -15.713 1.00 17.55 O ATOM 0 H GLY A 35 -9.053 5.118 -16.925 1.00 18.20 H new ATOM 0 HA2 GLY A 35 -7.532 3.081 -17.596 1.00 18.13 H new ATOM 0 HA3 GLY A 35 -7.198 4.139 -16.500 1.00 18.13 H new ATOM 265 N PHE A 36 -9.102 2.808 -14.861 1.00 16.43 N ATOM 266 CA PHE A 36 -9.381 2.077 -13.631 1.00 16.93 C ATOM 267 C PHE A 36 -10.907 1.978 -13.430 1.00 16.52 C ATOM 268 O PHE A 36 -11.480 2.652 -12.548 1.00 14.68 O ATOM 269 CB PHE A 36 -8.688 2.746 -12.436 1.00 17.20 C ATOM 270 CG PHE A 36 -7.182 2.972 -12.643 1.00 17.44 C ATOM 271 CD1 PHE A 36 -6.259 1.925 -12.443 1.00 18.55 C ATOM 272 CD2 PHE A 36 -6.713 4.220 -13.031 1.00 14.95 C ATOM 273 CE1 PHE A 36 -4.860 2.152 -12.615 1.00 17.56 C ATOM 274 CE2 PHE A 36 -5.337 4.466 -13.186 1.00 17.12 C ATOM 275 CZ PHE A 36 -4.418 3.434 -12.979 1.00 15.17 C ATOM 0 H PHE A 36 -9.629 3.477 -14.979 1.00 16.43 H new ATOM 0 HA PHE A 36 -9.024 1.178 -13.698 1.00 16.93 H new ATOM 0 HB2 PHE A 36 -9.114 3.600 -12.262 1.00 17.20 H new ATOM 0 HB3 PHE A 36 -8.819 2.197 -11.647 1.00 17.20 H new ATOM 0 HD1 PHE A 36 -6.563 1.081 -12.197 1.00 18.55 H new ATOM 0 HD2 PHE A 36 -7.320 4.906 -13.191 1.00 14.95 H new ATOM 0 HE1 PHE A 36 -4.251 1.461 -12.488 1.00 17.56 H new ATOM 0 HE2 PHE A 36 -5.039 5.314 -13.426 1.00 17.12 H new ATOM 0 HZ PHE A 36 -3.508 3.597 -13.083 1.00 15.17 H new ATOM 276 N PRO A 37 -11.567 1.183 -14.300 1.00 17.61 N ATOM 277 CA PRO A 37 -13.054 1.079 -14.374 1.00 18.05 C ATOM 278 C PRO A 37 -13.753 0.808 -13.027 1.00 17.07 C ATOM 279 O PRO A 37 -14.878 1.219 -12.837 1.00 17.24 O ATOM 280 CB PRO A 37 -13.311 -0.096 -15.351 1.00 18.45 C ATOM 281 CG PRO A 37 -11.991 -0.424 -15.986 1.00 20.86 C ATOM 282 CD PRO A 37 -10.879 0.338 -15.292 1.00 18.88 C ATOM 0 HA PRO A 37 -13.424 1.928 -14.662 1.00 18.05 H new ATOM 0 HB2 PRO A 37 -13.667 -0.865 -14.879 1.00 18.45 H new ATOM 0 HB3 PRO A 37 -13.965 0.152 -16.023 1.00 18.45 H new ATOM 0 HG2 PRO A 37 -11.824 -1.378 -15.929 1.00 20.86 H new ATOM 0 HG3 PRO A 37 -12.011 -0.195 -16.928 1.00 20.86 H new ATOM 0 HD2 PRO A 37 -10.251 -0.266 -14.866 1.00 18.88 H new ATOM 0 HD3 PRO A 37 -10.373 0.875 -15.922 1.00 18.88 H new ATOM 283 N THR A 38 -13.101 0.115 -12.105 1.00 17.44 N ATOM 284 CA THR A 38 -13.648 -0.069 -10.756 1.00 18.73 C ATOM 285 C THR A 38 -13.978 1.225 -10.002 1.00 17.65 C ATOM 286 O THR A 38 -14.879 1.222 -9.172 1.00 17.99 O ATOM 287 CB THR A 38 -12.728 -0.883 -9.851 1.00 19.22 C ATOM 288 OG1 THR A 38 -11.458 -0.216 -9.748 1.00 26.52 O ATOM 289 CG2 THR A 38 -12.523 -2.287 -10.460 1.00 22.22 C ATOM 0 H THR A 38 -12.338 -0.260 -12.235 1.00 17.44 H new ATOM 0 HA THR A 38 -14.475 -0.543 -10.936 1.00 18.73 H new ATOM 0 HB THR A 38 -13.125 -0.968 -8.970 1.00 19.22 H new ATOM 0 HG1 THR A 38 -11.478 0.328 -9.108 1.00 26.52 H new ATOM 0 HG21 THR A 38 -11.938 -2.807 -9.886 1.00 22.22 H new ATOM 0 HG22 THR A 38 -13.380 -2.735 -10.538 1.00 22.22 H new ATOM 0 HG23 THR A 38 -12.122 -2.203 -11.339 1.00 22.22 H new ATOM 290 N THR A 39 -13.275 2.323 -10.285 1.00 15.82 N ATOM 291 CA THR A 39 -13.581 3.604 -9.623 1.00 15.53 C ATOM 292 C THR A 39 -15.006 4.141 -9.979 1.00 17.33 C ATOM 293 O THR A 39 -15.574 4.974 -9.261 1.00 18.93 O ATOM 294 CB THR A 39 -12.554 4.714 -10.006 1.00 12.08 C ATOM 295 OG1 THR A 39 -12.568 4.958 -11.419 1.00 13.00 O ATOM 296 CG2 THR A 39 -11.117 4.397 -9.533 1.00 13.52 C ATOM 0 H THR A 39 -12.626 2.353 -10.848 1.00 15.82 H new ATOM 0 HA THR A 39 -13.534 3.413 -8.673 1.00 15.53 H new ATOM 0 HB THR A 39 -12.835 5.517 -9.540 1.00 12.08 H new ATOM 0 HG1 THR A 39 -12.236 4.299 -11.821 1.00 13.00 H new ATOM 0 HG21 THR A 39 -10.523 5.117 -9.797 1.00 13.52 H new ATOM 0 HG22 THR A 39 -11.106 4.307 -8.567 1.00 13.52 H new ATOM 0 HG23 THR A 39 -10.818 3.568 -9.938 1.00 13.52 H new ATOM 297 N LYS A 40 -15.546 3.722 -11.119 1.00 18.15 N ATOM 298 CA LYS A 40 -16.882 4.201 -11.537 1.00 20.76 C ATOM 299 C LYS A 40 -18.009 3.740 -10.578 1.00 19.78 C ATOM 300 O LYS A 40 -19.087 4.323 -10.565 1.00 20.52 O ATOM 301 CB LYS A 40 -17.189 3.757 -12.982 1.00 19.87 C ATOM 302 CG LYS A 40 -16.143 4.248 -14.008 1.00 22.96 C ATOM 303 CD LYS A 40 -16.185 3.373 -15.319 1.00 23.19 C ATOM 304 CE LYS A 40 -17.547 3.483 -15.950 1.00 26.19 C ATOM 305 NZ LYS A 40 -17.690 2.818 -17.306 1.00 31.29 N ATOM 0 H LYS A 40 -15.171 3.171 -11.663 1.00 18.15 H new ATOM 0 HA LYS A 40 -16.857 5.170 -11.499 1.00 20.76 H new ATOM 0 HB2 LYS A 40 -17.234 2.789 -13.013 1.00 19.87 H new ATOM 0 HB3 LYS A 40 -18.064 4.090 -13.237 1.00 19.87 H new ATOM 0 HG2 LYS A 40 -16.313 5.177 -14.229 1.00 22.96 H new ATOM 0 HG3 LYS A 40 -15.257 4.208 -13.616 1.00 22.96 H new ATOM 0 HD2 LYS A 40 -15.504 3.672 -15.942 1.00 23.19 H new ATOM 0 HD3 LYS A 40 -15.989 2.447 -15.108 1.00 23.19 H new ATOM 0 HE2 LYS A 40 -18.199 3.095 -15.346 1.00 26.19 H new ATOM 0 HE3 LYS A 40 -17.769 4.423 -16.042 1.00 26.19 H new ATOM 0 HZ1 LYS A 40 -18.521 2.930 -17.606 1.00 31.29 H new ATOM 0 HZ2 LYS A 40 -17.116 3.185 -17.879 1.00 31.29 H new ATOM 0 HZ3 LYS A 40 -17.517 1.948 -17.230 1.00 31.29 H new ATOM 306 N THR A 41 -17.748 2.716 -9.767 1.00 20.00 N ATOM 307 CA THR A 41 -18.788 2.216 -8.883 1.00 19.76 C ATOM 308 C THR A 41 -19.119 3.218 -7.772 1.00 19.35 C ATOM 309 O THR A 41 -20.112 3.058 -7.066 1.00 18.23 O ATOM 310 CB THR A 41 -18.420 0.895 -8.261 1.00 21.33 C ATOM 311 OG1 THR A 41 -17.221 1.067 -7.501 1.00 24.97 O ATOM 312 CG2 THR A 41 -18.256 -0.208 -9.352 1.00 24.16 C ATOM 0 H THR A 41 -16.993 2.308 -9.716 1.00 20.00 H new ATOM 0 HA THR A 41 -19.571 2.089 -9.441 1.00 19.76 H new ATOM 0 HB THR A 41 -19.131 0.600 -7.671 1.00 21.33 H new ATOM 0 HG1 THR A 41 -16.563 1.106 -8.021 1.00 24.97 H new ATOM 0 HG21 THR A 41 -18.019 -1.049 -8.930 1.00 24.16 H new ATOM 0 HG22 THR A 41 -19.091 -0.313 -9.835 1.00 24.16 H new ATOM 0 HG23 THR A 41 -17.556 0.051 -9.971 1.00 24.16 H new ATOM 313 N TYR A 42 -18.313 4.266 -7.622 1.00 17.19 N ATOM 314 CA TYR A 42 -18.662 5.305 -6.659 1.00 16.65 C ATOM 315 C TYR A 42 -19.563 6.349 -7.270 1.00 16.01 C ATOM 316 O TYR A 42 -20.036 7.269 -6.590 1.00 16.08 O ATOM 317 CB TYR A 42 -17.410 5.986 -6.134 1.00 16.92 C ATOM 318 CG TYR A 42 -16.630 5.106 -5.198 1.00 17.53 C ATOM 319 CD1 TYR A 42 -16.903 5.118 -3.811 1.00 20.59 C ATOM 320 CD2 TYR A 42 -15.614 4.262 -5.681 1.00 17.01 C ATOM 321 CE1 TYR A 42 -16.204 4.269 -2.929 1.00 18.19 C ATOM 322 CE2 TYR A 42 -14.880 3.444 -4.782 1.00 18.49 C ATOM 323 CZ TYR A 42 -15.199 3.456 -3.435 1.00 17.45 C ATOM 324 OH TYR A 42 -14.510 2.664 -2.547 1.00 19.31 O ATOM 0 H TYR A 42 -17.580 4.393 -8.054 1.00 17.19 H new ATOM 0 HA TYR A 42 -19.134 4.871 -5.931 1.00 16.65 H new ATOM 0 HB2 TYR A 42 -16.846 6.240 -6.881 1.00 16.92 H new ATOM 0 HB3 TYR A 42 -17.658 6.804 -5.674 1.00 16.92 H new ATOM 0 HD1 TYR A 42 -17.552 5.694 -3.476 1.00 20.59 H new ATOM 0 HD2 TYR A 42 -15.423 4.240 -6.591 1.00 17.01 H new ATOM 0 HE1 TYR A 42 -16.413 4.254 -2.023 1.00 18.19 H new ATOM 0 HE2 TYR A 42 -14.190 2.904 -5.096 1.00 18.49 H new ATOM 0 HH TYR A 42 -13.931 2.218 -2.960 1.00 19.31 H new ATOM 325 N PHE A 43 -19.781 6.250 -8.571 1.00 15.81 N ATOM 326 CA PHE A 43 -20.516 7.292 -9.264 1.00 17.49 C ATOM 327 C PHE A 43 -21.646 6.662 -10.047 1.00 18.36 C ATOM 328 O PHE A 43 -21.675 6.811 -11.235 1.00 19.33 O ATOM 329 CB PHE A 43 -19.553 8.011 -10.263 1.00 17.04 C ATOM 330 CG PHE A 43 -18.418 8.737 -9.599 1.00 17.05 C ATOM 331 CD1 PHE A 43 -18.514 10.122 -9.350 1.00 18.87 C ATOM 332 CD2 PHE A 43 -17.245 8.058 -9.229 1.00 14.27 C ATOM 333 CE1 PHE A 43 -17.446 10.814 -8.750 1.00 13.89 C ATOM 334 CE2 PHE A 43 -16.154 8.747 -8.599 1.00 15.68 C ATOM 335 CZ PHE A 43 -16.286 10.132 -8.342 1.00 15.19 C ATOM 0 H PHE A 43 -19.516 5.598 -9.065 1.00 15.81 H new ATOM 0 HA PHE A 43 -20.870 7.928 -8.623 1.00 17.49 H new ATOM 0 HB2 PHE A 43 -19.190 7.354 -10.878 1.00 17.04 H new ATOM 0 HB3 PHE A 43 -20.064 8.643 -10.793 1.00 17.04 H new ATOM 0 HD1 PHE A 43 -19.288 10.581 -9.584 1.00 18.87 H new ATOM 0 HD2 PHE A 43 -17.174 7.146 -9.395 1.00 14.27 H new ATOM 0 HE1 PHE A 43 -17.508 11.733 -8.622 1.00 13.89 H new ATOM 0 HE2 PHE A 43 -15.377 8.292 -8.365 1.00 15.68 H new ATOM 0 HZ PHE A 43 -15.606 10.591 -7.904 1.00 15.19 H new ATOM 336 N PRO A 44 -22.592 5.963 -9.389 1.00 20.23 N ATOM 337 CA PRO A 44 -23.577 5.210 -10.200 1.00 20.97 C ATOM 338 C PRO A 44 -24.503 6.141 -11.004 1.00 21.60 C ATOM 339 O PRO A 44 -25.012 5.762 -12.062 1.00 21.42 O ATOM 340 CB PRO A 44 -24.357 4.412 -9.139 1.00 20.59 C ATOM 341 CG PRO A 44 -24.249 5.282 -7.889 1.00 21.91 C ATOM 342 CD PRO A 44 -22.825 5.798 -7.936 1.00 19.73 C ATOM 0 HA PRO A 44 -23.160 4.650 -10.873 1.00 20.97 H new ATOM 0 HB2 PRO A 44 -25.281 4.277 -9.401 1.00 20.59 H new ATOM 0 HB3 PRO A 44 -23.971 3.534 -8.997 1.00 20.59 H new ATOM 0 HG2 PRO A 44 -24.892 6.008 -7.903 1.00 21.91 H new ATOM 0 HG3 PRO A 44 -24.417 4.770 -7.082 1.00 21.91 H new ATOM 0 HD2 PRO A 44 -22.729 6.636 -7.457 1.00 19.73 H new ATOM 0 HD3 PRO A 44 -22.200 5.171 -7.539 1.00 19.73 H new ATOM 343 N HIS A 45 -24.666 7.378 -10.536 1.00 21.79 N ATOM 344 CA HIS A 45 -25.537 8.319 -11.213 1.00 23.01 C ATOM 345 C HIS A 45 -24.903 9.115 -12.359 1.00 24.02 C ATOM 346 O HIS A 45 -25.615 9.917 -12.956 1.00 25.42 O ATOM 347 CB HIS A 45 -26.140 9.298 -10.196 1.00 22.98 C ATOM 348 CG HIS A 45 -25.123 10.101 -9.476 1.00 23.34 C ATOM 349 ND1 HIS A 45 -24.188 9.526 -8.645 1.00 27.57 N ATOM 350 CD2 HIS A 45 -24.875 11.434 -9.468 1.00 23.07 C ATOM 351 CE1 HIS A 45 -23.413 10.474 -8.140 1.00 26.44 C ATOM 352 NE2 HIS A 45 -23.807 11.640 -8.628 1.00 26.33 N ATOM 0 H HIS A 45 -24.281 7.685 -9.831 1.00 21.79 H new ATOM 0 HA HIS A 45 -26.215 7.764 -11.629 1.00 23.01 H new ATOM 0 HB2 HIS A 45 -26.749 9.897 -10.656 1.00 22.98 H new ATOM 0 HB3 HIS A 45 -26.665 8.800 -9.550 1.00 22.98 H new ATOM 0 HD2 HIS A 45 -25.340 12.086 -9.941 1.00 23.07 H new ATOM 0 HE1 HIS A 45 -22.711 10.343 -7.544 1.00 26.44 H new ATOM 0 HE2 HIS A 45 -23.452 12.403 -8.448 1.00 26.33 H new ATOM 353 N PHE A 46 -23.591 8.952 -12.635 1.00 23.79 N ATOM 354 CA PHE A 46 -22.891 9.735 -13.680 1.00 23.61 C ATOM 355 C PHE A 46 -23.192 9.171 -15.085 1.00 26.19 C ATOM 356 O PHE A 46 -23.341 7.962 -15.278 1.00 25.15 O ATOM 357 CB PHE A 46 -21.361 9.731 -13.487 1.00 22.34 C ATOM 358 CG PHE A 46 -20.817 10.884 -12.652 1.00 21.42 C ATOM 359 CD1 PHE A 46 -21.592 11.489 -11.666 1.00 19.23 C ATOM 360 CD2 PHE A 46 -19.518 11.355 -12.861 1.00 19.25 C ATOM 361 CE1 PHE A 46 -21.079 12.560 -10.889 1.00 21.65 C ATOM 362 CE2 PHE A 46 -18.998 12.440 -12.106 1.00 20.40 C ATOM 363 CZ PHE A 46 -19.783 13.039 -11.124 1.00 21.35 C ATOM 0 H PHE A 46 -23.087 8.389 -12.225 1.00 23.79 H new ATOM 0 HA PHE A 46 -23.220 10.644 -13.599 1.00 23.61 H new ATOM 0 HB2 PHE A 46 -21.103 8.895 -13.068 1.00 22.34 H new ATOM 0 HB3 PHE A 46 -20.938 9.753 -14.360 1.00 22.34 H new ATOM 0 HD1 PHE A 46 -22.458 11.187 -11.514 1.00 19.23 H new ATOM 0 HD2 PHE A 46 -18.984 10.951 -13.506 1.00 19.25 H new ATOM 0 HE1 PHE A 46 -21.603 12.944 -10.224 1.00 21.65 H new ATOM 0 HE2 PHE A 46 -18.136 12.749 -12.267 1.00 20.40 H new ATOM 0 HZ PHE A 46 -19.450 13.752 -10.628 1.00 21.35 H new ATOM 364 N ASP A 47 -23.247 10.076 -16.054 1.00 27.60 N ATOM 365 CA ASP A 47 -23.169 9.712 -17.459 1.00 29.09 C ATOM 366 C ASP A 47 -21.688 9.735 -17.860 1.00 28.71 C ATOM 367 O ASP A 47 -20.999 10.749 -17.664 1.00 27.43 O ATOM 368 CB ASP A 47 -24.024 10.704 -18.264 1.00 30.39 C ATOM 369 CG ASP A 47 -23.567 10.836 -19.717 1.00 33.99 C ATOM 370 OD1 ASP A 47 -23.593 9.809 -20.448 1.00 38.35 O ATOM 371 OD2 ASP A 47 -23.176 11.966 -20.110 1.00 37.98 O ATOM 0 H ASP A 47 -23.331 10.920 -15.913 1.00 27.60 H new ATOM 0 HA ASP A 47 -23.516 8.824 -17.636 1.00 29.09 H new ATOM 0 HB2 ASP A 47 -24.950 10.416 -18.245 1.00 30.39 H new ATOM 0 HB3 ASP A 47 -23.989 11.575 -17.838 1.00 30.39 H new ATOM 372 N PHE A 48 -21.189 8.610 -18.380 1.00 29.45 N ATOM 373 CA PHE A 48 -19.739 8.464 -18.609 1.00 31.29 C ATOM 374 C PHE A 48 -19.339 8.701 -20.056 1.00 32.41 C ATOM 375 O PHE A 48 -18.183 8.462 -20.421 1.00 32.12 O ATOM 376 CB PHE A 48 -19.166 7.108 -18.102 1.00 31.10 C ATOM 377 CG PHE A 48 -19.315 6.887 -16.614 1.00 30.64 C ATOM 378 CD1 PHE A 48 -18.447 7.499 -15.701 1.00 30.37 C ATOM 379 CD2 PHE A 48 -20.324 6.054 -16.127 1.00 30.46 C ATOM 380 CE1 PHE A 48 -18.595 7.295 -14.308 1.00 29.69 C ATOM 381 CE2 PHE A 48 -20.498 5.849 -14.741 1.00 32.13 C ATOM 382 CZ PHE A 48 -19.620 6.462 -13.825 1.00 29.77 C ATOM 0 H PHE A 48 -21.661 7.927 -18.605 1.00 29.45 H new ATOM 0 HA PHE A 48 -19.338 9.166 -18.072 1.00 31.29 H new ATOM 0 HB2 PHE A 48 -19.611 6.385 -18.572 1.00 31.10 H new ATOM 0 HB3 PHE A 48 -18.225 7.060 -18.333 1.00 31.10 H new ATOM 0 HD1 PHE A 48 -17.764 8.047 -16.014 1.00 30.37 H new ATOM 0 HD2 PHE A 48 -20.892 5.626 -16.727 1.00 30.46 H new ATOM 0 HE1 PHE A 48 -18.015 7.712 -13.713 1.00 29.69 H new ATOM 0 HE2 PHE A 48 -21.191 5.310 -14.433 1.00 32.13 H new ATOM 0 HZ PHE A 48 -19.717 6.317 -12.911 1.00 29.77 H new ATOM 383 N THR A 49 -20.274 9.170 -20.885 1.00 34.26 N ATOM 384 CA THR A 49 -19.917 9.475 -22.275 1.00 36.59 C ATOM 385 C THR A 49 -18.915 10.645 -22.302 1.00 37.43 C ATOM 386 O THR A 49 -19.021 11.573 -21.501 1.00 36.85 O ATOM 387 CB THR A 49 -21.158 9.592 -23.204 1.00 37.28 C ATOM 388 OG1 THR A 49 -22.232 10.274 -22.546 1.00 38.69 O ATOM 389 CG2 THR A 49 -21.663 8.182 -23.539 1.00 38.36 C ATOM 0 H THR A 49 -21.095 9.315 -20.673 1.00 34.26 H new ATOM 0 HA THR A 49 -19.449 8.725 -22.673 1.00 36.59 H new ATOM 0 HB THR A 49 -20.892 10.082 -23.998 1.00 37.28 H new ATOM 0 HG1 THR A 49 -22.577 9.766 -21.973 1.00 38.69 H new ATOM 0 HG21 THR A 49 -22.438 8.245 -24.119 1.00 38.36 H new ATOM 0 HG22 THR A 49 -20.962 7.686 -23.990 1.00 38.36 H new ATOM 0 HG23 THR A 49 -21.909 7.723 -22.720 1.00 38.36 H new ATOM 390 N HIS A 50 -17.911 10.570 -23.183 1.00 39.53 N ATOM 391 CA HIS A 50 -16.747 11.492 -23.112 1.00 41.05 C ATOM 392 C HIS A 50 -17.026 13.019 -22.982 1.00 40.99 C ATOM 393 O HIS A 50 -16.334 13.730 -22.244 1.00 40.69 O ATOM 394 CB HIS A 50 -15.706 11.203 -24.219 1.00 42.34 C ATOM 395 CG HIS A 50 -14.939 12.419 -24.653 1.00 46.67 C ATOM 396 ND1 HIS A 50 -14.088 13.112 -23.808 1.00 49.98 N ATOM 397 CD2 HIS A 50 -14.925 13.089 -25.832 1.00 50.47 C ATOM 398 CE1 HIS A 50 -13.578 14.149 -24.450 1.00 50.75 C ATOM 399 NE2 HIS A 50 -14.070 14.159 -25.680 1.00 51.45 N ATOM 0 H HIS A 50 -17.877 10.001 -23.827 1.00 39.53 H new ATOM 0 HA HIS A 50 -16.377 11.271 -22.243 1.00 41.05 H new ATOM 0 HB2 HIS A 50 -15.082 10.533 -23.899 1.00 42.34 H new ATOM 0 HB3 HIS A 50 -16.159 10.824 -24.988 1.00 42.34 H new ATOM 0 HD2 HIS A 50 -15.403 12.868 -26.599 1.00 50.47 H new ATOM 0 HE1 HIS A 50 -12.977 14.766 -24.099 1.00 50.75 H new ATOM 0 HE2 HIS A 50 -13.885 14.740 -26.286 1.00 51.45 H new ATOM 400 N GLY A 51 -18.027 13.543 -23.672 1.00 40.42 N ATOM 401 CA GLY A 51 -18.255 14.976 -23.523 1.00 39.61 C ATOM 402 C GLY A 51 -18.870 15.409 -22.192 1.00 39.29 C ATOM 403 O GLY A 51 -18.919 16.594 -21.894 1.00 38.83 O ATOM 0 H GLY A 51 -18.558 13.121 -24.201 1.00 40.42 H new ATOM 0 HA2 GLY A 51 -17.408 15.436 -23.635 1.00 39.61 H new ATOM 0 HA3 GLY A 51 -18.836 15.272 -24.241 1.00 39.61 H new ATOM 404 N SER A 52 -19.327 14.431 -21.403 1.00 38.45 N ATOM 405 CA SER A 52 -20.257 14.629 -20.281 1.00 36.69 C ATOM 406 C SER A 52 -20.177 15.939 -19.482 1.00 36.73 C ATOM 407 O SER A 52 -19.136 16.273 -18.881 1.00 35.71 O ATOM 408 CB SER A 52 -20.226 13.386 -19.368 1.00 36.56 C ATOM 409 OG SER A 52 -20.650 13.636 -18.039 1.00 34.24 O ATOM 0 H SER A 52 -19.098 13.609 -21.508 1.00 38.45 H new ATOM 0 HA SER A 52 -21.121 14.737 -20.709 1.00 36.69 H new ATOM 0 HB2 SER A 52 -20.791 12.698 -19.754 1.00 36.56 H new ATOM 0 HB3 SER A 52 -19.323 13.033 -19.348 1.00 36.56 H new ATOM 0 HG SER A 52 -20.834 12.908 -17.662 1.00 34.24 H new ATOM 410 N GLU A 53 -21.300 16.661 -19.475 1.00 36.01 N ATOM 411 CA GLU A 53 -21.525 17.811 -18.582 1.00 36.54 C ATOM 412 C GLU A 53 -21.200 17.459 -17.111 1.00 33.54 C ATOM 413 O GLU A 53 -20.696 18.289 -16.364 1.00 32.76 O ATOM 414 CB GLU A 53 -22.998 18.243 -18.609 1.00 36.60 C ATOM 415 CG GLU A 53 -23.524 19.063 -19.816 1.00 40.91 C ATOM 416 CD GLU A 53 -25.098 19.252 -19.786 1.00 42.06 C ATOM 417 OE1 GLU A 53 -25.632 19.964 -18.878 1.00 45.63 O ATOM 418 OE2 GLU A 53 -25.794 18.677 -20.687 1.00 48.04 O ATOM 0 H GLU A 53 -21.965 16.497 -19.996 1.00 36.01 H new ATOM 0 HA GLU A 53 -20.944 18.519 -18.901 1.00 36.54 H new ATOM 0 HB2 GLU A 53 -23.539 17.440 -18.543 1.00 36.60 H new ATOM 0 HB3 GLU A 53 -23.164 18.764 -17.808 1.00 36.60 H new ATOM 0 HG2 GLU A 53 -23.097 19.934 -19.821 1.00 40.91 H new ATOM 0 HG3 GLU A 53 -23.271 18.618 -20.640 1.00 40.91 H new ATOM 419 N GLN A 54 -21.530 16.243 -16.692 1.00 30.86 N ATOM 420 CA GLN A 54 -21.401 15.871 -15.281 1.00 29.16 C ATOM 421 C GLN A 54 -19.943 15.753 -14.885 1.00 26.93 C ATOM 422 O GLN A 54 -19.500 16.253 -13.851 1.00 25.84 O ATOM 423 CB GLN A 54 -22.079 14.548 -15.027 1.00 28.38 C ATOM 424 CG GLN A 54 -22.951 14.567 -13.850 1.00 29.87 C ATOM 425 CD GLN A 54 -23.991 13.452 -13.912 1.00 30.62 C ATOM 426 OE1 GLN A 54 -24.118 12.818 -15.076 1.00 34.38 O flip ATOM 427 NE2 GLN A 54 -24.657 13.152 -12.908 1.00 30.59 N flip ATOM 0 H GLN A 54 -21.829 15.619 -17.203 1.00 30.86 H new ATOM 0 HA GLN A 54 -21.822 16.566 -14.752 1.00 29.16 H new ATOM 0 HB2 GLN A 54 -22.602 14.304 -15.807 1.00 28.38 H new ATOM 0 HB3 GLN A 54 -21.404 13.861 -14.912 1.00 28.38 H new ATOM 0 HG2 GLN A 54 -22.416 14.469 -13.047 1.00 29.87 H new ATOM 0 HG3 GLN A 54 -23.398 15.426 -13.790 1.00 29.87 H new ATOM 0 HE21 GLN A 54 -24.546 13.585 -12.173 1.00 30.59 H new ATOM 0 HE22 GLN A 54 -25.229 12.511 -12.947 1.00 30.59 H new ATOM 428 N ILE A 55 -19.214 15.086 -15.759 1.00 25.82 N ATOM 429 CA ILE A 55 -17.777 14.948 -15.622 1.00 24.92 C ATOM 430 C ILE A 55 -17.046 16.315 -15.628 1.00 24.81 C ATOM 431 O ILE A 55 -16.163 16.540 -14.801 1.00 22.73 O ATOM 432 CB ILE A 55 -17.239 13.954 -16.640 1.00 23.67 C ATOM 433 CG1 ILE A 55 -17.805 12.559 -16.310 1.00 23.63 C ATOM 434 CG2 ILE A 55 -15.709 13.936 -16.619 1.00 25.20 C ATOM 435 CD1 ILE A 55 -17.278 11.478 -17.175 1.00 20.62 C ATOM 0 H ILE A 55 -19.540 14.697 -16.454 1.00 25.82 H new ATOM 0 HA ILE A 55 -17.588 14.578 -14.745 1.00 24.92 H new ATOM 0 HB ILE A 55 -17.516 14.216 -17.532 1.00 23.67 H new ATOM 0 HG12 ILE A 55 -17.603 12.348 -15.385 1.00 23.63 H new ATOM 0 HG13 ILE A 55 -18.771 12.584 -16.391 1.00 23.63 H new ATOM 0 HG21 ILE A 55 -15.384 13.298 -17.273 1.00 25.20 H new ATOM 0 HG22 ILE A 55 -15.372 14.820 -16.835 1.00 25.20 H new ATOM 0 HG23 ILE A 55 -15.400 13.679 -15.736 1.00 25.20 H new ATOM 0 HD11 ILE A 55 -17.674 10.632 -16.914 1.00 20.62 H new ATOM 0 HD12 ILE A 55 -17.500 11.666 -18.100 1.00 20.62 H new ATOM 0 HD13 ILE A 55 -16.314 11.427 -17.078 1.00 20.62 H new ATOM 436 N LYS A 56 -17.454 17.224 -16.521 1.00 24.22 N ATOM 437 CA LYS A 56 -16.819 18.547 -16.598 1.00 25.78 C ATOM 438 C LYS A 56 -17.099 19.377 -15.356 1.00 23.90 C ATOM 439 O LYS A 56 -16.202 20.056 -14.852 1.00 24.42 O ATOM 440 CB LYS A 56 -17.171 19.299 -17.929 1.00 26.38 C ATOM 441 CG LYS A 56 -16.702 18.498 -19.150 1.00 28.50 C ATOM 442 CD LYS A 56 -16.503 19.210 -20.480 1.00 30.58 C ATOM 443 CE LYS A 56 -15.791 18.172 -21.404 1.00 34.44 C ATOM 444 NZ LYS A 56 -15.210 18.636 -22.726 1.00 40.84 N ATOM 0 H LYS A 56 -18.090 17.097 -17.086 1.00 24.22 H new ATOM 0 HA LYS A 56 -15.860 18.404 -16.622 1.00 25.78 H new ATOM 0 HB2 LYS A 56 -18.129 19.443 -17.980 1.00 26.38 H new ATOM 0 HB3 LYS A 56 -16.752 20.174 -17.931 1.00 26.38 H new ATOM 0 HG2 LYS A 56 -15.860 18.078 -18.916 1.00 28.50 H new ATOM 0 HG3 LYS A 56 -17.344 17.785 -19.295 1.00 28.50 H new ATOM 0 HD2 LYS A 56 -17.352 19.489 -20.857 1.00 30.58 H new ATOM 0 HD3 LYS A 56 -15.964 20.009 -20.372 1.00 30.58 H new ATOM 0 HE2 LYS A 56 -15.071 17.772 -20.893 1.00 34.44 H new ATOM 0 HE3 LYS A 56 -16.428 17.467 -21.596 1.00 34.44 H new ATOM 0 HZ1 LYS A 56 -14.837 17.945 -23.146 1.00 40.84 H new ATOM 0 HZ2 LYS A 56 -15.858 18.976 -23.232 1.00 40.84 H new ATOM 0 HZ3 LYS A 56 -14.593 19.260 -22.577 1.00 40.84 H new ATOM 445 N ALA A 57 -18.347 19.329 -14.873 1.00 23.28 N ATOM 446 CA ALA A 57 -18.750 20.002 -13.636 1.00 22.59 C ATOM 447 C ALA A 57 -17.980 19.455 -12.430 1.00 21.94 C ATOM 448 O ALA A 57 -17.539 20.220 -11.586 1.00 21.88 O ATOM 449 CB ALA A 57 -20.239 19.795 -13.421 1.00 23.22 C ATOM 0 H ALA A 57 -18.986 18.901 -15.259 1.00 23.28 H new ATOM 0 HA ALA A 57 -18.549 20.947 -13.720 1.00 22.59 H new ATOM 0 HB1 ALA A 57 -20.513 20.238 -12.603 1.00 23.22 H new ATOM 0 HB2 ALA A 57 -20.729 20.168 -14.170 1.00 23.22 H new ATOM 0 HB3 ALA A 57 -20.427 18.846 -13.352 1.00 23.22 H new ATOM 450 N HIS A 58 -17.849 18.122 -12.347 1.00 20.74 N ATOM 451 CA HIS A 58 -17.137 17.450 -11.257 1.00 19.77 C ATOM 452 C HIS A 58 -15.631 17.749 -11.306 1.00 19.13 C ATOM 453 O HIS A 58 -15.042 18.092 -10.295 1.00 19.83 O ATOM 454 CB HIS A 58 -17.379 15.920 -11.264 1.00 19.34 C ATOM 455 CG HIS A 58 -16.732 15.206 -10.108 1.00 20.03 C ATOM 456 ND1 HIS A 58 -17.149 15.375 -8.805 1.00 23.85 N ATOM 457 CD2 HIS A 58 -15.686 14.349 -10.052 1.00 21.19 C ATOM 458 CE1 HIS A 58 -16.394 14.643 -7.997 1.00 21.91 C ATOM 459 NE2 HIS A 58 -15.504 14.008 -8.730 1.00 20.11 N ATOM 0 H HIS A 58 -18.176 17.581 -12.930 1.00 20.74 H new ATOM 0 HA HIS A 58 -17.496 17.805 -10.429 1.00 19.77 H new ATOM 0 HB2 HIS A 58 -18.334 15.750 -11.246 1.00 19.34 H new ATOM 0 HB3 HIS A 58 -17.041 15.550 -12.094 1.00 19.34 H new ATOM 0 HD2 HIS A 58 -15.183 14.046 -10.773 1.00 21.19 H new ATOM 0 HE1 HIS A 58 -16.479 14.588 -7.073 1.00 21.91 H new ATOM 0 HE2 HIS A 58 -14.905 13.467 -8.432 1.00 20.11 H new ATOM 460 N GLY A 59 -15.025 17.625 -12.494 1.00 18.87 N ATOM 461 CA GLY A 59 -13.626 18.036 -12.714 1.00 19.96 C ATOM 462 C GLY A 59 -13.277 19.413 -12.179 1.00 21.07 C ATOM 463 O GLY A 59 -12.242 19.594 -11.543 1.00 19.84 O ATOM 0 H GLY A 59 -15.409 17.302 -13.192 1.00 18.87 H new ATOM 0 HA2 GLY A 59 -13.041 17.383 -12.298 1.00 19.96 H new ATOM 0 HA3 GLY A 59 -13.442 18.016 -13.666 1.00 19.96 H new ATOM 464 N LYS A 60 -14.156 20.377 -12.456 1.00 21.96 N ATOM 465 CA LYS A 60 -14.026 21.747 -11.986 1.00 23.72 C ATOM 466 C LYS A 60 -14.049 21.835 -10.469 1.00 23.30 C ATOM 467 O LYS A 60 -13.223 22.559 -9.869 1.00 23.91 O ATOM 468 CB LYS A 60 -15.150 22.604 -12.592 1.00 25.12 C ATOM 469 CG LYS A 60 -15.155 24.078 -12.164 1.00 29.61 C ATOM 470 CD LYS A 60 -13.996 24.874 -12.795 1.00 33.72 C ATOM 471 CE LYS A 60 -14.051 26.394 -12.447 1.00 34.98 C ATOM 472 NZ LYS A 60 -13.046 26.835 -11.375 1.00 37.58 N ATOM 0 H LYS A 60 -14.859 20.245 -12.934 1.00 21.96 H new ATOM 0 HA LYS A 60 -13.164 22.084 -12.276 1.00 23.72 H new ATOM 0 HB2 LYS A 60 -15.082 22.564 -13.559 1.00 25.12 H new ATOM 0 HB3 LYS A 60 -16.003 22.210 -12.351 1.00 25.12 H new ATOM 0 HG2 LYS A 60 -15.999 24.483 -12.418 1.00 29.61 H new ATOM 0 HG3 LYS A 60 -15.093 24.132 -11.197 1.00 29.61 H new ATOM 0 HD2 LYS A 60 -13.152 24.506 -12.490 1.00 33.72 H new ATOM 0 HD3 LYS A 60 -14.021 24.765 -13.759 1.00 33.72 H new ATOM 0 HE2 LYS A 60 -13.891 26.906 -13.255 1.00 34.98 H new ATOM 0 HE3 LYS A 60 -14.946 26.613 -12.145 1.00 34.98 H new ATOM 0 HZ1 LYS A 60 -12.800 27.677 -11.527 1.00 37.58 H new ATOM 0 HZ2 LYS A 60 -13.424 26.777 -10.571 1.00 37.58 H new ATOM 0 HZ3 LYS A 60 -12.330 26.307 -11.404 1.00 37.58 H new ATOM 473 N LYS A 61 -14.982 21.131 -9.820 1.00 21.77 N ATOM 474 CA LYS A 61 -15.030 21.164 -8.362 1.00 22.10 C ATOM 475 C LYS A 61 -13.751 20.566 -7.724 1.00 20.28 C ATOM 476 O LYS A 61 -13.256 21.058 -6.719 1.00 18.78 O ATOM 477 CB LYS A 61 -16.241 20.401 -7.808 1.00 21.66 C ATOM 478 CG LYS A 61 -17.605 20.926 -8.199 1.00 24.39 C ATOM 479 CD LYS A 61 -18.697 20.181 -7.388 1.00 25.63 C ATOM 480 CE LYS A 61 -20.021 20.121 -8.131 1.00 35.14 C ATOM 481 NZ LYS A 61 -20.540 18.686 -8.085 1.00 38.71 N ATOM 0 H LYS A 61 -15.580 20.641 -10.197 1.00 21.77 H new ATOM 0 HA LYS A 61 -15.102 22.102 -8.127 1.00 22.10 H new ATOM 0 HB2 LYS A 61 -16.177 19.477 -8.098 1.00 21.66 H new ATOM 0 HB3 LYS A 61 -16.182 20.400 -6.840 1.00 21.66 H new ATOM 0 HG2 LYS A 61 -17.656 21.880 -8.029 1.00 24.39 H new ATOM 0 HG3 LYS A 61 -17.751 20.799 -9.149 1.00 24.39 H new ATOM 0 HD2 LYS A 61 -18.395 19.280 -7.194 1.00 25.63 H new ATOM 0 HD3 LYS A 61 -18.826 20.627 -6.536 1.00 25.63 H new ATOM 0 HE2 LYS A 61 -20.663 20.724 -7.725 1.00 35.14 H new ATOM 0 HE3 LYS A 61 -19.905 20.408 -9.050 1.00 35.14 H new ATOM 0 HZ1 LYS A 61 -21.270 18.618 -8.590 1.00 38.71 H new ATOM 0 HZ2 LYS A 61 -19.914 18.134 -8.393 1.00 38.71 H new ATOM 0 HZ3 LYS A 61 -20.739 18.469 -7.245 1.00 38.71 H new ATOM 482 N VAL A 62 -13.242 19.477 -8.298 1.00 19.64 N ATOM 483 CA VAL A 62 -12.059 18.819 -7.735 1.00 18.87 C ATOM 484 C VAL A 62 -10.881 19.816 -7.885 1.00 19.34 C ATOM 485 O VAL A 62 -10.059 19.983 -6.988 1.00 19.45 O ATOM 486 CB VAL A 62 -11.708 17.497 -8.512 1.00 20.18 C ATOM 487 CG1 VAL A 62 -10.330 16.925 -8.026 1.00 17.94 C ATOM 488 CG2 VAL A 62 -12.889 16.459 -8.418 1.00 17.74 C ATOM 0 H VAL A 62 -13.561 19.106 -9.005 1.00 19.64 H new ATOM 0 HA VAL A 62 -12.226 18.580 -6.810 1.00 18.87 H new ATOM 0 HB VAL A 62 -11.604 17.697 -9.455 1.00 20.18 H new ATOM 0 HG11 VAL A 62 -10.127 16.111 -8.513 1.00 17.94 H new ATOM 0 HG12 VAL A 62 -9.633 17.580 -8.187 1.00 17.94 H new ATOM 0 HG13 VAL A 62 -10.377 16.730 -7.077 1.00 17.94 H new ATOM 0 HG21 VAL A 62 -12.651 15.653 -8.903 1.00 17.74 H new ATOM 0 HG22 VAL A 62 -13.054 16.239 -7.488 1.00 17.74 H new ATOM 0 HG23 VAL A 62 -13.690 16.844 -8.805 1.00 17.74 H new ATOM 489 N SER A 63 -10.840 20.510 -9.006 1.00 19.49 N ATOM 490 CA SER A 63 -9.858 21.567 -9.194 1.00 21.15 C ATOM 491 C SER A 63 -9.954 22.704 -8.200 1.00 21.27 C ATOM 492 O SER A 63 -8.932 23.137 -7.676 1.00 20.76 O ATOM 493 CB SER A 63 -9.913 22.121 -10.601 1.00 21.21 C ATOM 494 OG SER A 63 -8.754 21.641 -11.255 1.00 31.34 O ATOM 0 H SER A 63 -11.370 20.388 -9.672 1.00 19.49 H new ATOM 0 HA SER A 63 -9.004 21.136 -9.035 1.00 21.15 H new ATOM 0 HB2 SER A 63 -10.716 21.828 -11.058 1.00 21.21 H new ATOM 0 HB3 SER A 63 -9.930 23.091 -10.592 1.00 21.21 H new ATOM 0 HG SER A 63 -8.916 21.536 -12.072 1.00 31.34 H new ATOM 495 N GLU A 64 -11.156 23.189 -7.924 1.00 21.87 N ATOM 496 CA GLU A 64 -11.329 24.249 -6.878 1.00 23.39 C ATOM 497 C GLU A 64 -10.840 23.810 -5.500 1.00 21.39 C ATOM 498 O GLU A 64 -10.209 24.566 -4.766 1.00 19.43 O ATOM 499 CB GLU A 64 -12.788 24.750 -6.809 1.00 22.72 C ATOM 500 CG GLU A 64 -13.221 25.423 -8.107 1.00 27.59 C ATOM 501 CD GLU A 64 -14.759 25.535 -8.306 1.00 29.26 C ATOM 502 OE1 GLU A 64 -15.538 24.874 -7.581 1.00 37.95 O ATOM 503 OE2 GLU A 64 -15.184 26.266 -9.245 1.00 36.25 O ATOM 0 H GLU A 64 -11.883 22.938 -8.310 1.00 21.87 H new ATOM 0 HA GLU A 64 -10.766 24.989 -7.154 1.00 23.39 H new ATOM 0 HB2 GLU A 64 -13.377 24.003 -6.620 1.00 22.72 H new ATOM 0 HB3 GLU A 64 -12.880 25.376 -6.074 1.00 22.72 H new ATOM 0 HG2 GLU A 64 -12.839 26.314 -8.137 1.00 27.59 H new ATOM 0 HG3 GLU A 64 -12.847 24.928 -8.853 1.00 27.59 H new ATOM 504 N ALA A 65 -11.117 22.563 -5.154 1.00 19.97 N ATOM 505 CA ALA A 65 -10.667 22.042 -3.889 1.00 19.09 C ATOM 506 C ALA A 65 -9.134 21.987 -3.734 1.00 18.75 C ATOM 507 O ALA A 65 -8.595 22.306 -2.671 1.00 17.52 O ATOM 508 CB ALA A 65 -11.296 20.692 -3.638 1.00 19.45 C ATOM 0 H ALA A 65 -11.562 22.009 -5.638 1.00 19.97 H new ATOM 0 HA ALA A 65 -10.961 22.671 -3.212 1.00 19.09 H new ATOM 0 HB1 ALA A 65 -10.990 20.346 -2.785 1.00 19.45 H new ATOM 0 HB2 ALA A 65 -12.262 20.783 -3.622 1.00 19.45 H new ATOM 0 HB3 ALA A 65 -11.041 20.079 -4.346 1.00 19.45 H new ATOM 509 N LEU A 66 -8.447 21.616 -4.810 1.00 18.80 N ATOM 510 CA LEU A 66 -6.992 21.553 -4.807 1.00 19.71 C ATOM 511 C LEU A 66 -6.371 22.979 -4.695 1.00 20.27 C ATOM 512 O LEU A 66 -5.376 23.177 -4.041 1.00 19.90 O ATOM 513 CB LEU A 66 -6.510 20.838 -6.069 1.00 18.86 C ATOM 514 CG LEU A 66 -6.742 19.311 -6.015 1.00 20.97 C ATOM 515 CD1 LEU A 66 -6.365 18.628 -7.308 1.00 20.75 C ATOM 516 CD2 LEU A 66 -5.997 18.669 -4.840 1.00 19.91 C ATOM 0 H LEU A 66 -8.810 21.395 -5.558 1.00 18.80 H new ATOM 0 HA LEU A 66 -6.699 21.050 -4.031 1.00 19.71 H new ATOM 0 HB2 LEU A 66 -6.971 21.204 -6.840 1.00 18.86 H new ATOM 0 HB3 LEU A 66 -5.564 21.013 -6.194 1.00 18.86 H new ATOM 0 HG LEU A 66 -7.695 19.185 -5.881 1.00 20.97 H new ATOM 0 HD11 LEU A 66 -6.526 17.675 -7.230 1.00 20.75 H new ATOM 0 HD12 LEU A 66 -6.901 18.988 -8.032 1.00 20.75 H new ATOM 0 HD13 LEU A 66 -5.426 18.782 -7.494 1.00 20.75 H new ATOM 0 HD21 LEU A 66 -6.163 17.713 -4.835 1.00 19.91 H new ATOM 0 HD22 LEU A 66 -5.045 18.831 -4.933 1.00 19.91 H new ATOM 0 HD23 LEU A 66 -6.311 19.056 -4.008 1.00 19.91 H new ATOM 517 N THR A 67 -6.985 23.933 -5.382 1.00 21.67 N ATOM 518 CA THR A 67 -6.602 25.339 -5.370 1.00 22.98 C ATOM 519 C THR A 67 -6.714 25.861 -3.941 1.00 24.36 C ATOM 520 O THR A 67 -5.754 26.442 -3.422 1.00 26.18 O ATOM 521 CB THR A 67 -7.483 26.086 -6.348 1.00 23.01 C ATOM 522 OG1 THR A 67 -7.181 25.600 -7.660 1.00 22.47 O ATOM 523 CG2 THR A 67 -7.278 27.648 -6.294 1.00 25.38 C ATOM 0 H THR A 67 -7.662 23.774 -5.888 1.00 21.67 H new ATOM 0 HA THR A 67 -5.683 25.468 -5.653 1.00 22.98 H new ATOM 0 HB THR A 67 -8.410 25.928 -6.111 1.00 23.01 H new ATOM 0 HG1 THR A 67 -7.623 24.901 -7.809 1.00 22.47 H new ATOM 0 HG21 THR A 67 -7.865 28.074 -6.938 1.00 25.38 H new ATOM 0 HG22 THR A 67 -7.487 27.971 -5.404 1.00 25.38 H new ATOM 0 HG23 THR A 67 -6.356 27.861 -6.507 1.00 25.38 H new ATOM 524 N LYS A 68 -7.831 25.559 -3.284 1.00 24.40 N ATOM 525 CA LYS A 68 -8.044 25.880 -1.881 1.00 25.55 C ATOM 526 C LYS A 68 -6.956 25.278 -0.976 1.00 24.91 C ATOM 527 O LYS A 68 -6.320 26.022 -0.226 1.00 26.30 O ATOM 528 CB LYS A 68 -9.437 25.424 -1.439 1.00 25.83 C ATOM 529 CG LYS A 68 -9.615 25.538 0.074 1.00 29.38 C ATOM 530 CD LYS A 68 -11.089 25.622 0.448 1.00 32.19 C ATOM 531 CE LYS A 68 -11.247 25.943 1.921 1.00 32.37 C ATOM 532 NZ LYS A 68 -12.695 25.883 2.309 1.00 37.73 N ATOM 0 H LYS A 68 -8.496 25.155 -3.650 1.00 24.40 H new ATOM 0 HA LYS A 68 -7.985 26.844 -1.789 1.00 25.55 H new ATOM 0 HB2 LYS A 68 -10.110 25.961 -1.886 1.00 25.83 H new ATOM 0 HB3 LYS A 68 -9.579 24.505 -1.713 1.00 25.83 H new ATOM 0 HG2 LYS A 68 -9.211 24.771 0.509 1.00 29.38 H new ATOM 0 HG3 LYS A 68 -9.150 26.325 0.399 1.00 29.38 H new ATOM 0 HD2 LYS A 68 -11.525 26.305 -0.086 1.00 32.19 H new ATOM 0 HD3 LYS A 68 -11.528 24.781 0.246 1.00 32.19 H new ATOM 0 HE2 LYS A 68 -10.736 25.313 2.453 1.00 32.37 H new ATOM 0 HE3 LYS A 68 -10.891 26.826 2.107 1.00 32.37 H new ATOM 0 HZ1 LYS A 68 -12.779 26.073 3.175 1.00 37.73 H new ATOM 0 HZ2 LYS A 68 -13.156 26.475 1.830 1.00 37.73 H new ATOM 0 HZ3 LYS A 68 -13.011 25.066 2.153 1.00 37.73 H new ATOM 533 N ALA A 69 -6.726 23.961 -1.075 1.00 22.35 N ATOM 534 CA ALA A 69 -5.604 23.309 -0.420 1.00 22.38 C ATOM 535 C ALA A 69 -4.252 24.013 -0.531 1.00 21.74 C ATOM 536 O ALA A 69 -3.529 24.069 0.467 1.00 21.30 O ATOM 537 CB ALA A 69 -5.471 21.820 -0.868 1.00 21.31 C ATOM 0 H ALA A 69 -7.224 23.426 -1.528 1.00 22.35 H new ATOM 0 HA ALA A 69 -5.834 23.361 0.521 1.00 22.38 H new ATOM 0 HB1 ALA A 69 -4.716 21.412 -0.416 1.00 21.31 H new ATOM 0 HB2 ALA A 69 -6.282 21.340 -0.640 1.00 21.31 H new ATOM 0 HB3 ALA A 69 -5.332 21.782 -1.827 1.00 21.31 H new ATOM 538 N VAL A 70 -3.898 24.485 -1.721 1.00 21.94 N ATOM 539 CA VAL A 70 -2.593 25.148 -1.958 1.00 23.85 C ATOM 540 C VAL A 70 -2.495 26.430 -1.145 1.00 25.02 C ATOM 541 O VAL A 70 -1.424 26.773 -0.644 1.00 26.54 O ATOM 542 CB VAL A 70 -2.306 25.429 -3.486 1.00 23.44 C ATOM 543 CG1 VAL A 70 -1.074 26.305 -3.680 1.00 24.30 C ATOM 544 CG2 VAL A 70 -2.122 24.111 -4.267 1.00 20.52 C ATOM 0 H VAL A 70 -4.398 24.436 -2.419 1.00 21.94 H new ATOM 0 HA VAL A 70 -1.908 24.528 -1.663 1.00 23.85 H new ATOM 0 HB VAL A 70 -3.079 25.903 -3.832 1.00 23.44 H new ATOM 0 HG11 VAL A 70 -0.930 26.456 -4.627 1.00 24.30 H new ATOM 0 HG12 VAL A 70 -1.208 27.156 -3.235 1.00 24.30 H new ATOM 0 HG13 VAL A 70 -0.299 25.862 -3.302 1.00 24.30 H new ATOM 0 HG21 VAL A 70 -1.947 24.309 -5.200 1.00 20.52 H new ATOM 0 HG22 VAL A 70 -1.374 23.617 -3.896 1.00 20.52 H new ATOM 0 HG23 VAL A 70 -2.929 23.577 -4.196 1.00 20.52 H new ATOM 545 N GLY A 71 -3.615 27.122 -0.991 1.00 26.19 N ATOM 546 CA GLY A 71 -3.674 28.264 -0.094 1.00 27.72 C ATOM 547 C GLY A 71 -3.579 27.909 1.375 1.00 28.90 C ATOM 548 O GLY A 71 -3.475 28.805 2.212 1.00 30.86 O ATOM 0 H GLY A 71 -4.352 26.946 -1.397 1.00 26.19 H new ATOM 0 HA2 GLY A 71 -2.953 28.874 -0.316 1.00 27.72 H new ATOM 0 HA3 GLY A 71 -4.505 28.740 -0.248 1.00 27.72 H new ATOM 549 N HIS A 72 -3.661 26.626 1.734 1.00 28.77 N ATOM 550 CA HIS A 72 -3.674 26.269 3.165 1.00 28.95 C ATOM 551 C HIS A 72 -2.741 25.123 3.532 1.00 28.35 C ATOM 552 O HIS A 72 -3.115 24.281 4.337 1.00 27.36 O ATOM 553 CB HIS A 72 -5.115 25.939 3.652 1.00 29.73 C ATOM 554 CG HIS A 72 -6.092 27.066 3.493 1.00 30.55 C ATOM 555 ND1 HIS A 72 -6.788 27.289 2.321 1.00 32.55 N ATOM 556 CD2 HIS A 72 -6.491 28.029 4.358 1.00 33.02 C ATOM 557 CE1 HIS A 72 -7.580 28.340 2.479 1.00 37.76 C ATOM 558 NE2 HIS A 72 -7.418 28.806 3.706 1.00 35.71 N ATOM 0 H HIS A 72 -3.709 25.963 1.188 1.00 28.77 H new ATOM 0 HA HIS A 72 -3.342 27.059 3.620 1.00 28.95 H new ATOM 0 HB2 HIS A 72 -5.443 25.169 3.162 1.00 29.73 H new ATOM 0 HB3 HIS A 72 -5.079 25.685 4.588 1.00 29.73 H new ATOM 0 HD1 HIS A 72 -6.719 26.821 1.603 1.00 32.55 H new ATOM 0 HD2 HIS A 72 -6.193 28.143 5.231 1.00 33.02 H new ATOM 0 HE1 HIS A 72 -8.153 28.691 1.836 1.00 37.76 H new ATOM 559 N LEU A 73 -1.544 25.083 2.944 1.00 27.88 N ATOM 560 CA LEU A 73 -0.570 24.006 3.170 1.00 29.39 C ATOM 561 C LEU A 73 -0.215 23.768 4.630 1.00 31.15 C ATOM 562 O LEU A 73 -0.003 22.625 5.045 1.00 31.89 O ATOM 563 CB LEU A 73 0.712 24.238 2.337 1.00 29.18 C ATOM 564 CG LEU A 73 0.402 24.215 0.843 1.00 28.12 C ATOM 565 CD1 LEU A 73 1.623 24.412 -0.009 1.00 31.78 C ATOM 566 CD2 LEU A 73 -0.316 22.913 0.448 1.00 27.80 C ATOM 0 H LEU A 73 -1.270 25.686 2.396 1.00 27.88 H new ATOM 0 HA LEU A 73 -1.015 23.197 2.872 1.00 29.39 H new ATOM 0 HB2 LEU A 73 1.108 25.091 2.576 1.00 29.18 H new ATOM 0 HB3 LEU A 73 1.366 23.553 2.546 1.00 29.18 H new ATOM 0 HG LEU A 73 -0.188 24.967 0.677 1.00 28.12 H new ATOM 0 HD11 LEU A 73 1.371 24.389 -0.946 1.00 31.78 H new ATOM 0 HD12 LEU A 73 2.026 25.270 0.196 1.00 31.78 H new ATOM 0 HD13 LEU A 73 2.261 23.704 0.171 1.00 31.78 H new ATOM 0 HD21 LEU A 73 -0.502 22.922 -0.504 1.00 27.80 H new ATOM 0 HD22 LEU A 73 0.250 22.154 0.659 1.00 27.80 H new ATOM 0 HD23 LEU A 73 -1.149 22.841 0.939 1.00 27.80 H new ATOM 567 N ASP A 74 -0.174 24.831 5.417 1.00 32.78 N ATOM 568 CA ASP A 74 0.096 24.727 6.866 1.00 34.97 C ATOM 569 C ASP A 74 -1.069 24.201 7.728 1.00 35.00 C ATOM 570 O ASP A 74 -0.856 23.813 8.884 1.00 35.42 O ATOM 571 CB ASP A 74 0.565 26.081 7.407 1.00 35.73 C ATOM 572 CG ASP A 74 1.717 26.649 6.617 1.00 39.42 C ATOM 573 OD1 ASP A 74 2.717 25.921 6.440 1.00 43.44 O ATOM 574 OD2 ASP A 74 1.619 27.818 6.147 1.00 43.72 O ATOM 0 H ASP A 74 -0.300 25.635 5.139 1.00 32.78 H new ATOM 0 HA ASP A 74 0.790 24.054 6.941 1.00 34.97 H new ATOM 0 HB2 ASP A 74 -0.176 26.707 7.390 1.00 35.73 H new ATOM 0 HB3 ASP A 74 0.830 25.981 8.335 1.00 35.73 H new ATOM 575 N ASP A 75 -2.282 24.172 7.175 1.00 34.37 N ATOM 576 CA ASP A 75 -3.424 23.595 7.876 1.00 34.12 C ATOM 577 C ASP A 75 -4.451 22.840 6.961 1.00 33.09 C ATOM 578 O ASP A 75 -5.597 23.280 6.761 1.00 32.79 O ATOM 579 CB ASP A 75 -4.102 24.697 8.692 1.00 34.46 C ATOM 580 CG ASP A 75 -5.222 24.177 9.529 1.00 38.11 C ATOM 581 OD1 ASP A 75 -5.055 23.101 10.168 1.00 39.57 O ATOM 582 OD2 ASP A 75 -6.279 24.848 9.515 1.00 42.92 O ATOM 0 H ASP A 75 -2.463 24.482 6.394 1.00 34.37 H new ATOM 0 HA ASP A 75 -3.079 22.899 8.457 1.00 34.12 H new ATOM 0 HB2 ASP A 75 -3.445 25.123 9.264 1.00 34.46 H new ATOM 0 HB3 ASP A 75 -4.440 25.379 8.091 1.00 34.46 H new ATOM 583 N LEU A 76 -4.029 21.701 6.406 1.00 31.36 N ATOM 584 CA LEU A 76 -4.888 20.932 5.507 1.00 29.25 C ATOM 585 C LEU A 76 -6.094 20.308 6.229 1.00 28.55 C ATOM 586 O LEU A 76 -7.221 20.394 5.737 1.00 28.43 O ATOM 587 CB LEU A 76 -4.086 19.894 4.713 1.00 29.11 C ATOM 588 CG LEU A 76 -3.108 20.467 3.683 1.00 28.97 C ATOM 589 CD1 LEU A 76 -2.394 19.341 2.978 1.00 29.71 C ATOM 590 CD2 LEU A 76 -3.858 21.328 2.639 1.00 26.61 C ATOM 0 H LEU A 76 -3.251 21.359 6.538 1.00 31.36 H new ATOM 0 HA LEU A 76 -5.257 21.561 4.867 1.00 29.25 H new ATOM 0 HB2 LEU A 76 -3.588 19.345 5.339 1.00 29.11 H new ATOM 0 HB3 LEU A 76 -4.709 19.308 4.254 1.00 29.11 H new ATOM 0 HG LEU A 76 -2.465 21.025 4.148 1.00 28.97 H new ATOM 0 HD11 LEU A 76 -1.776 19.707 2.327 1.00 29.71 H new ATOM 0 HD12 LEU A 76 -1.904 18.812 3.627 1.00 29.71 H new ATOM 0 HD13 LEU A 76 -3.043 18.779 2.527 1.00 29.71 H new ATOM 0 HD21 LEU A 76 -3.224 21.682 1.996 1.00 26.61 H new ATOM 0 HD22 LEU A 76 -4.513 20.781 2.179 1.00 26.61 H new ATOM 0 HD23 LEU A 76 -4.307 22.062 3.087 1.00 26.61 H new ATOM 591 N PRO A 77 -5.880 19.722 7.421 1.00 28.41 N ATOM 592 CA PRO A 77 -7.024 19.170 8.137 1.00 28.97 C ATOM 593 C PRO A 77 -8.089 20.229 8.324 1.00 29.90 C ATOM 594 O PRO A 77 -9.275 19.928 8.203 1.00 30.57 O ATOM 595 CB PRO A 77 -6.444 18.813 9.508 1.00 29.07 C ATOM 596 CG PRO A 77 -4.965 18.620 9.249 1.00 29.88 C ATOM 597 CD PRO A 77 -4.621 19.597 8.187 1.00 27.88 C ATOM 0 HA PRO A 77 -7.430 18.423 7.670 1.00 28.97 H new ATOM 0 HB2 PRO A 77 -6.601 19.519 10.154 1.00 29.07 H new ATOM 0 HB3 PRO A 77 -6.849 18.007 9.865 1.00 29.07 H new ATOM 0 HG2 PRO A 77 -4.446 18.779 10.052 1.00 29.88 H new ATOM 0 HG3 PRO A 77 -4.775 17.712 8.964 1.00 29.88 H new ATOM 0 HD2 PRO A 77 -4.343 20.448 8.560 1.00 27.88 H new ATOM 0 HD3 PRO A 77 -3.893 19.279 7.630 1.00 27.88 H new ATOM 598 N GLY A 78 -7.660 21.465 8.626 1.00 30.06 N ATOM 599 CA GLY A 78 -8.576 22.580 8.863 1.00 29.59 C ATOM 600 C GLY A 78 -9.315 23.014 7.610 1.00 29.48 C ATOM 601 O GLY A 78 -10.539 23.079 7.612 1.00 30.85 O ATOM 0 H GLY A 78 -6.829 21.674 8.698 1.00 30.06 H new ATOM 0 HA2 GLY A 78 -9.221 22.324 9.541 1.00 29.59 H new ATOM 0 HA3 GLY A 78 -8.077 23.333 9.216 1.00 29.59 H new ATOM 602 N ALA A 79 -8.594 23.319 6.532 1.00 29.40 N ATOM 603 CA ALA A 79 -9.240 23.680 5.260 1.00 28.03 C ATOM 604 C ALA A 79 -10.169 22.594 4.672 1.00 27.91 C ATOM 605 O ALA A 79 -11.121 22.890 3.953 1.00 27.04 O ATOM 606 CB ALA A 79 -8.185 24.061 4.229 1.00 28.44 C ATOM 0 H ALA A 79 -7.734 23.324 6.511 1.00 29.40 H new ATOM 0 HA ALA A 79 -9.813 24.434 5.468 1.00 28.03 H new ATOM 0 HB1 ALA A 79 -8.619 24.297 3.394 1.00 28.44 H new ATOM 0 HB2 ALA A 79 -7.674 24.819 4.553 1.00 28.44 H new ATOM 0 HB3 ALA A 79 -7.590 23.309 4.082 1.00 28.44 H new ATOM 607 N LEU A 80 -9.881 21.328 4.953 1.00 27.07 N ATOM 608 CA LEU A 80 -10.470 20.288 4.128 1.00 26.50 C ATOM 609 C LEU A 80 -11.470 19.378 4.868 1.00 26.31 C ATOM 610 O LEU A 80 -11.811 18.293 4.361 1.00 25.59 O ATOM 611 CB LEU A 80 -9.361 19.434 3.479 1.00 26.90 C ATOM 612 CG LEU A 80 -8.405 20.067 2.456 1.00 25.92 C ATOM 613 CD1 LEU A 80 -7.446 18.991 1.946 1.00 25.37 C ATOM 614 CD2 LEU A 80 -9.184 20.663 1.317 1.00 27.19 C ATOM 0 H LEU A 80 -9.369 21.060 5.590 1.00 27.07 H new ATOM 0 HA LEU A 80 -10.985 20.751 3.449 1.00 26.50 H new ATOM 0 HB2 LEU A 80 -8.818 19.073 4.197 1.00 26.90 H new ATOM 0 HB3 LEU A 80 -9.793 18.682 3.044 1.00 26.90 H new ATOM 0 HG LEU A 80 -7.897 20.778 2.877 1.00 25.92 H new ATOM 0 HD11 LEU A 80 -6.837 19.380 1.299 1.00 25.37 H new ATOM 0 HD12 LEU A 80 -6.939 18.630 2.690 1.00 25.37 H new ATOM 0 HD13 LEU A 80 -7.953 18.279 1.525 1.00 25.37 H new ATOM 0 HD21 LEU A 80 -8.571 21.059 0.678 1.00 27.19 H new ATOM 0 HD22 LEU A 80 -9.701 19.968 0.880 1.00 27.19 H new ATOM 0 HD23 LEU A 80 -9.783 21.346 1.657 1.00 27.19 H new ATOM 615 N SER A 81 -11.933 19.813 6.038 1.00 25.49 N ATOM 616 CA SER A 81 -12.726 18.951 6.908 1.00 25.53 C ATOM 617 C SER A 81 -14.086 18.625 6.323 1.00 24.85 C ATOM 618 O SER A 81 -14.550 17.466 6.443 1.00 24.29 O ATOM 619 CB SER A 81 -12.834 19.501 8.342 1.00 27.65 C ATOM 620 OG SER A 81 -13.726 20.593 8.411 1.00 32.36 O ATOM 0 H SER A 81 -11.798 20.605 6.346 1.00 25.49 H new ATOM 0 HA SER A 81 -12.241 18.113 6.966 1.00 25.53 H new ATOM 0 HB2 SER A 81 -13.135 18.797 8.938 1.00 27.65 H new ATOM 0 HB3 SER A 81 -11.957 19.778 8.651 1.00 27.65 H new ATOM 0 HG SER A 81 -13.767 20.872 9.202 1.00 32.36 H new ATOM 621 N THR A 82 -14.714 19.591 5.650 1.00 22.57 N ATOM 622 CA THR A 82 -15.956 19.275 4.960 1.00 23.12 C ATOM 623 C THR A 82 -15.780 18.153 3.878 1.00 22.52 C ATOM 624 O THR A 82 -16.682 17.336 3.638 1.00 21.29 O ATOM 625 CB THR A 82 -16.657 20.513 4.328 1.00 23.71 C ATOM 626 OG1 THR A 82 -17.989 20.133 3.956 1.00 27.41 O ATOM 627 CG2 THR A 82 -15.945 20.994 3.035 1.00 25.09 C ATOM 0 H THR A 82 -14.447 20.406 5.583 1.00 22.57 H new ATOM 0 HA THR A 82 -16.537 18.940 5.661 1.00 23.12 H new ATOM 0 HB THR A 82 -16.638 21.229 4.983 1.00 23.71 H new ATOM 0 HG1 THR A 82 -18.383 20.791 3.614 1.00 27.41 H new ATOM 0 HG21 THR A 82 -16.412 21.764 2.675 1.00 25.09 H new ATOM 0 HG22 THR A 82 -15.030 21.239 3.242 1.00 25.09 H new ATOM 0 HG23 THR A 82 -15.947 20.279 2.379 1.00 25.09 H new ATOM 628 N LEU A 83 -14.622 18.124 3.238 1.00 20.28 N ATOM 629 CA LEU A 83 -14.381 17.122 2.189 1.00 20.90 C ATOM 630 C LEU A 83 -14.038 15.754 2.802 1.00 19.74 C ATOM 631 O LEU A 83 -14.332 14.668 2.216 1.00 19.84 O ATOM 632 CB LEU A 83 -13.281 17.636 1.215 1.00 21.09 C ATOM 633 CG LEU A 83 -13.718 18.701 0.211 1.00 22.09 C ATOM 634 CD1 LEU A 83 -12.500 19.064 -0.615 1.00 21.63 C ATOM 635 CD2 LEU A 83 -14.806 18.168 -0.725 1.00 21.42 C ATOM 0 H LEU A 83 -13.967 18.662 3.386 1.00 20.28 H new ATOM 0 HA LEU A 83 -15.193 16.993 1.674 1.00 20.90 H new ATOM 0 HB2 LEU A 83 -12.550 17.995 1.742 1.00 21.09 H new ATOM 0 HB3 LEU A 83 -12.930 16.877 0.723 1.00 21.09 H new ATOM 0 HG LEU A 83 -14.078 19.467 0.685 1.00 22.09 H new ATOM 0 HD11 LEU A 83 -12.741 19.741 -1.267 1.00 21.63 H new ATOM 0 HD12 LEU A 83 -11.805 19.409 -0.033 1.00 21.63 H new ATOM 0 HD13 LEU A 83 -12.174 18.275 -1.075 1.00 21.63 H new ATOM 0 HD21 LEU A 83 -15.064 18.863 -1.350 1.00 21.42 H new ATOM 0 HD22 LEU A 83 -14.466 17.403 -1.215 1.00 21.42 H new ATOM 0 HD23 LEU A 83 -15.579 17.900 -0.204 1.00 21.42 H new ATOM 636 N SER A 84 -13.459 15.798 4.000 1.00 19.44 N ATOM 637 CA SER A 84 -13.224 14.602 4.798 1.00 20.48 C ATOM 638 C SER A 84 -14.531 13.986 5.323 1.00 21.40 C ATOM 639 O SER A 84 -14.777 12.784 5.143 1.00 20.57 O ATOM 640 CB SER A 84 -12.218 14.904 5.875 1.00 21.17 C ATOM 641 OG SER A 84 -12.077 13.823 6.759 1.00 23.41 O ATOM 0 H SER A 84 -13.191 16.526 4.372 1.00 19.44 H new ATOM 0 HA SER A 84 -12.843 13.912 4.232 1.00 20.48 H new ATOM 0 HB2 SER A 84 -11.360 15.108 5.471 1.00 21.17 H new ATOM 0 HB3 SER A 84 -12.495 15.693 6.367 1.00 21.17 H new ATOM 0 HG SER A 84 -11.459 13.985 7.304 1.00 23.41 H new ATOM 642 N ASP A 85 -15.413 14.810 5.879 1.00 22.52 N ATOM 643 CA ASP A 85 -16.807 14.410 6.146 1.00 23.05 C ATOM 644 C ASP A 85 -17.361 13.622 4.990 1.00 23.18 C ATOM 645 O ASP A 85 -17.865 12.496 5.166 1.00 22.62 O ATOM 646 CB ASP A 85 -17.722 15.627 6.379 1.00 24.67 C ATOM 647 CG ASP A 85 -17.446 16.305 7.707 1.00 27.57 C ATOM 648 OD1 ASP A 85 -17.053 15.589 8.636 1.00 30.44 O ATOM 649 OD2 ASP A 85 -17.611 17.556 7.823 1.00 34.23 O ATOM 0 H ASP A 85 -15.228 15.616 6.114 1.00 22.52 H new ATOM 0 HA ASP A 85 -16.790 13.868 6.950 1.00 23.05 H new ATOM 0 HB2 ASP A 85 -17.598 16.266 5.660 1.00 24.67 H new ATOM 0 HB3 ASP A 85 -18.649 15.343 6.349 1.00 24.67 H new ATOM 650 N LEU A 86 -17.279 14.203 3.801 1.00 22.07 N ATOM 651 CA LEU A 86 -17.867 13.552 2.625 1.00 21.53 C ATOM 652 C LEU A 86 -17.172 12.226 2.236 1.00 21.41 C ATOM 653 O LEU A 86 -17.838 11.217 1.945 1.00 20.88 O ATOM 654 CB LEU A 86 -17.791 14.488 1.423 1.00 22.08 C ATOM 655 CG LEU A 86 -18.883 14.629 0.364 1.00 24.40 C ATOM 656 CD1 LEU A 86 -18.296 15.388 -0.890 1.00 22.68 C ATOM 657 CD2 LEU A 86 -19.566 13.319 -0.063 1.00 26.70 C ATOM 0 H LEU A 86 -16.897 14.958 3.649 1.00 22.07 H new ATOM 0 HA LEU A 86 -18.784 13.348 2.867 1.00 21.53 H new ATOM 0 HB2 LEU A 86 -17.651 15.377 1.784 1.00 22.08 H new ATOM 0 HB3 LEU A 86 -16.983 14.245 0.945 1.00 22.08 H new ATOM 0 HG LEU A 86 -19.593 15.141 0.782 1.00 24.40 H new ATOM 0 HD11 LEU A 86 -18.986 15.480 -1.565 1.00 22.68 H new ATOM 0 HD12 LEU A 86 -17.988 16.268 -0.621 1.00 22.68 H new ATOM 0 HD13 LEU A 86 -17.552 14.883 -1.255 1.00 22.68 H new ATOM 0 HD21 LEU A 86 -20.240 13.509 -0.734 1.00 26.70 H new ATOM 0 HD22 LEU A 86 -18.904 12.714 -0.433 1.00 26.70 H new ATOM 0 HD23 LEU A 86 -19.985 12.906 0.708 1.00 26.70 H new ATOM 658 N HIS A 87 -15.844 12.244 2.180 1.00 19.95 N ATOM 659 CA HIS A 87 -15.114 11.115 1.584 1.00 20.25 C ATOM 660 C HIS A 87 -14.910 10.008 2.592 1.00 19.43 C ATOM 661 O HIS A 87 -15.071 8.825 2.256 1.00 17.27 O ATOM 662 CB HIS A 87 -13.773 11.570 0.953 1.00 18.44 C ATOM 663 CG HIS A 87 -13.947 12.378 -0.297 1.00 20.58 C ATOM 664 ND1 HIS A 87 -14.092 13.744 -0.283 1.00 19.70 N ATOM 665 CD2 HIS A 87 -13.998 12.004 -1.602 1.00 15.92 C ATOM 666 CE1 HIS A 87 -14.223 14.184 -1.523 1.00 21.06 C ATOM 667 NE2 HIS A 87 -14.151 13.148 -2.345 1.00 22.53 N ATOM 0 H HIS A 87 -15.350 12.884 2.473 1.00 19.95 H new ATOM 0 HA HIS A 87 -15.659 10.760 0.864 1.00 20.25 H new ATOM 0 HB2 HIS A 87 -13.279 12.094 1.603 1.00 18.44 H new ATOM 0 HB3 HIS A 87 -13.236 10.788 0.752 1.00 18.44 H new ATOM 0 HD1 HIS A 87 -14.097 14.236 0.422 1.00 19.70 H new ATOM 0 HD2 HIS A 87 -13.940 11.136 -1.930 1.00 15.92 H new ATOM 0 HE1 HIS A 87 -14.345 15.071 -1.775 1.00 21.06 H new ATOM 668 N ALA A 88 -14.553 10.396 3.823 1.00 19.29 N ATOM 669 CA ALA A 88 -14.295 9.414 4.851 1.00 21.62 C ATOM 670 C ALA A 88 -15.576 8.963 5.576 1.00 23.74 C ATOM 671 O ALA A 88 -15.767 7.757 5.797 1.00 24.67 O ATOM 672 CB ALA A 88 -13.296 9.929 5.850 1.00 21.05 C ATOM 0 H ALA A 88 -14.459 11.215 4.069 1.00 19.29 H new ATOM 0 HA ALA A 88 -13.927 8.638 4.400 1.00 21.62 H new ATOM 0 HB1 ALA A 88 -13.139 9.254 6.529 1.00 21.05 H new ATOM 0 HB2 ALA A 88 -12.462 10.133 5.398 1.00 21.05 H new ATOM 0 HB3 ALA A 88 -13.641 10.733 6.268 1.00 21.05 H new ATOM 673 N HIS A 89 -16.424 9.900 5.997 1.00 23.91 N ATOM 674 CA HIS A 89 -17.599 9.515 6.795 1.00 24.39 C ATOM 675 C HIS A 89 -18.771 9.022 5.931 1.00 24.64 C ATOM 676 O HIS A 89 -19.325 7.971 6.184 1.00 24.85 O ATOM 677 CB HIS A 89 -18.036 10.660 7.705 1.00 25.82 C ATOM 678 CG HIS A 89 -17.019 11.050 8.747 1.00 30.48 C ATOM 679 ND1 HIS A 89 -17.029 10.915 10.100 1.00 31.40 N flip ATOM 680 CD2 HIS A 89 -15.827 11.680 8.439 1.00 30.95 C flip ATOM 681 CE1 HIS A 89 -15.865 11.474 10.573 1.00 32.32 C flip ATOM 682 NE2 HIS A 89 -15.154 11.920 9.553 1.00 34.57 N flip ATOM 0 H HIS A 89 -16.346 10.742 5.840 1.00 23.91 H new ATOM 0 HA HIS A 89 -17.327 8.765 7.347 1.00 24.39 H new ATOM 0 HB2 HIS A 89 -18.236 11.435 7.158 1.00 25.82 H new ATOM 0 HB3 HIS A 89 -18.860 10.408 8.151 1.00 25.82 H new ATOM 0 HD1 HIS A 89 -17.648 10.549 10.572 1.00 31.40 H new ATOM 0 HD2 HIS A 89 -15.542 11.901 7.582 1.00 30.95 H new ATOM 0 HE1 HIS A 89 -15.618 11.529 11.468 1.00 32.32 H new ATOM 683 N LYS A 90 -19.136 9.755 4.888 1.00 23.91 N ATOM 684 CA LYS A 90 -20.336 9.424 4.118 1.00 24.86 C ATOM 685 C LYS A 90 -20.108 8.427 2.972 1.00 23.50 C ATOM 686 O LYS A 90 -20.881 7.486 2.804 1.00 23.56 O ATOM 687 CB LYS A 90 -20.975 10.689 3.524 1.00 25.13 C ATOM 688 CG LYS A 90 -22.310 10.376 2.860 1.00 29.13 C ATOM 689 CD LYS A 90 -23.026 11.564 2.183 1.00 28.14 C ATOM 690 CE LYS A 90 -24.304 11.049 1.441 1.00 33.18 C ATOM 691 NZ LYS A 90 -25.320 12.169 1.100 1.00 36.31 N ATOM 0 H LYS A 90 -18.708 10.446 4.607 1.00 23.91 H new ATOM 0 HA LYS A 90 -20.923 8.999 4.763 1.00 24.86 H new ATOM 0 HB2 LYS A 90 -21.106 11.347 4.225 1.00 25.13 H new ATOM 0 HB3 LYS A 90 -20.373 11.083 2.874 1.00 25.13 H new ATOM 0 HG2 LYS A 90 -22.165 9.686 2.193 1.00 29.13 H new ATOM 0 HG3 LYS A 90 -22.904 10.003 3.530 1.00 29.13 H new ATOM 0 HD2 LYS A 90 -23.271 12.227 2.847 1.00 28.14 H new ATOM 0 HD3 LYS A 90 -22.428 11.999 1.555 1.00 28.14 H new ATOM 0 HE2 LYS A 90 -24.036 10.606 0.621 1.00 33.18 H new ATOM 0 HE3 LYS A 90 -24.742 10.383 1.993 1.00 33.18 H new ATOM 0 HZ1 LYS A 90 -26.022 11.816 0.681 1.00 36.31 H new ATOM 0 HZ2 LYS A 90 -25.590 12.563 1.851 1.00 36.31 H new ATOM 0 HZ3 LYS A 90 -24.932 12.771 0.572 1.00 36.31 H new ATOM 692 N LEU A 91 -19.084 8.666 2.160 1.00 21.19 N ATOM 693 CA LEU A 91 -18.837 7.789 0.990 1.00 22.10 C ATOM 694 C LEU A 91 -17.982 6.556 1.314 1.00 20.79 C ATOM 695 O LEU A 91 -18.107 5.537 0.658 1.00 21.45 O ATOM 696 CB LEU A 91 -18.229 8.580 -0.144 1.00 21.15 C ATOM 697 CG LEU A 91 -19.060 9.722 -0.742 1.00 24.14 C ATOM 698 CD1 LEU A 91 -18.137 10.658 -1.538 1.00 23.98 C ATOM 699 CD2 LEU A 91 -20.144 9.186 -1.643 1.00 25.45 C ATOM 0 H LEU A 91 -18.525 9.313 2.255 1.00 21.19 H new ATOM 0 HA LEU A 91 -19.703 7.448 0.718 1.00 22.10 H new ATOM 0 HB2 LEU A 91 -17.390 8.953 0.169 1.00 21.15 H new ATOM 0 HB3 LEU A 91 -18.015 7.960 -0.859 1.00 21.15 H new ATOM 0 HG LEU A 91 -19.482 10.211 -0.019 1.00 24.14 H new ATOM 0 HD11 LEU A 91 -18.659 11.382 -1.918 1.00 23.98 H new ATOM 0 HD12 LEU A 91 -17.460 11.024 -0.948 1.00 23.98 H new ATOM 0 HD13 LEU A 91 -17.708 10.160 -2.252 1.00 23.98 H new ATOM 0 HD21 LEU A 91 -20.655 9.925 -2.009 1.00 25.45 H new ATOM 0 HD22 LEU A 91 -19.743 8.681 -2.367 1.00 25.45 H new ATOM 0 HD23 LEU A 91 -20.732 8.607 -1.133 1.00 25.45 H new ATOM 700 N ARG A 92 -17.100 6.677 2.306 1.00 21.00 N ATOM 701 CA ARG A 92 -16.252 5.568 2.749 1.00 20.30 C ATOM 702 C ARG A 92 -15.378 5.060 1.591 1.00 19.58 C ATOM 703 O ARG A 92 -15.294 3.861 1.355 1.00 18.80 O ATOM 704 CB ARG A 92 -17.111 4.427 3.351 1.00 20.94 C ATOM 705 CG ARG A 92 -17.554 4.662 4.807 1.00 25.42 C ATOM 706 CD ARG A 92 -18.912 4.022 5.101 1.00 32.96 C ATOM 707 NE ARG A 92 -19.741 4.285 3.932 1.00 41.83 N ATOM 708 CZ ARG A 92 -20.799 3.576 3.554 1.00 46.48 C ATOM 709 NH1 ARG A 92 -21.233 2.545 4.296 1.00 47.61 N ATOM 710 NH2 ARG A 92 -21.431 3.925 2.436 1.00 45.28 N ATOM 0 H ARG A 92 -16.976 7.407 2.743 1.00 21.00 H new ATOM 0 HA ARG A 92 -15.661 5.892 3.447 1.00 20.30 H new ATOM 0 HB2 ARG A 92 -17.900 4.306 2.800 1.00 20.94 H new ATOM 0 HB3 ARG A 92 -16.606 3.600 3.308 1.00 20.94 H new ATOM 0 HG2 ARG A 92 -16.888 4.297 5.410 1.00 25.42 H new ATOM 0 HG3 ARG A 92 -17.602 5.615 4.980 1.00 25.42 H new ATOM 0 HD2 ARG A 92 -18.821 3.069 5.255 1.00 32.96 H new ATOM 0 HD3 ARG A 92 -19.309 4.401 5.901 1.00 32.96 H new ATOM 0 HE ARG A 92 -19.526 4.959 3.443 1.00 41.83 H new ATOM 0 HH11 ARG A 92 -20.825 2.338 5.024 1.00 47.61 H new ATOM 0 HH12 ARG A 92 -21.919 2.092 4.043 1.00 47.61 H new ATOM 0 HH21 ARG A 92 -21.152 4.596 1.976 1.00 45.28 H new ATOM 0 HH22 ARG A 92 -22.118 3.479 2.173 1.00 45.28 H new ATOM 711 N VAL A 93 -14.699 5.994 0.901 1.00 18.61 N ATOM 712 CA VAL A 93 -13.864 5.667 -0.261 1.00 17.40 C ATOM 713 C VAL A 93 -12.647 4.847 0.198 1.00 16.57 C ATOM 714 O VAL A 93 -11.958 5.217 1.131 1.00 16.67 O ATOM 715 CB VAL A 93 -13.440 6.946 -1.017 1.00 17.13 C ATOM 716 CG1 VAL A 93 -12.476 6.656 -2.213 1.00 16.97 C ATOM 717 CG2 VAL A 93 -14.721 7.804 -1.465 1.00 18.81 C ATOM 0 H VAL A 93 -14.713 6.831 1.097 1.00 18.61 H new ATOM 0 HA VAL A 93 -14.379 5.131 -0.884 1.00 17.40 H new ATOM 0 HB VAL A 93 -12.928 7.484 -0.393 1.00 17.13 H new ATOM 0 HG11 VAL A 93 -12.243 7.490 -2.650 1.00 16.97 H new ATOM 0 HG12 VAL A 93 -11.670 6.228 -1.883 1.00 16.97 H new ATOM 0 HG13 VAL A 93 -12.916 6.070 -2.849 1.00 16.97 H new ATOM 0 HG21 VAL A 93 -14.429 8.600 -1.936 1.00 18.81 H new ATOM 0 HG22 VAL A 93 -15.280 7.269 -2.050 1.00 18.81 H new ATOM 0 HG23 VAL A 93 -15.229 8.062 -0.680 1.00 18.81 H new ATOM 718 N ASP A 94 -12.402 3.716 -0.451 1.00 15.22 N ATOM 719 CA ASP A 94 -11.219 2.925 -0.131 1.00 14.36 C ATOM 720 C ASP A 94 -9.970 3.791 -0.534 1.00 13.82 C ATOM 721 O ASP A 94 -9.912 4.294 -1.648 1.00 13.55 O ATOM 722 CB ASP A 94 -11.319 1.605 -0.911 1.00 14.07 C ATOM 723 CG ASP A 94 -10.208 0.634 -0.554 1.00 16.24 C ATOM 724 OD1 ASP A 94 -9.058 1.103 -0.460 1.00 20.19 O ATOM 725 OD2 ASP A 94 -10.493 -0.580 -0.387 1.00 16.10 O ATOM 0 H ASP A 94 -12.900 3.391 -1.072 1.00 15.22 H new ATOM 0 HA ASP A 94 -11.141 2.701 0.810 1.00 14.36 H new ATOM 0 HB2 ASP A 94 -12.177 1.190 -0.731 1.00 14.07 H new ATOM 0 HB3 ASP A 94 -11.288 1.792 -1.862 1.00 14.07 H new ATOM 726 N PRO A 95 -9.011 4.015 0.394 1.00 14.77 N ATOM 727 CA PRO A 95 -7.797 4.818 0.128 1.00 14.59 C ATOM 728 C PRO A 95 -7.036 4.453 -1.124 1.00 15.13 C ATOM 729 O PRO A 95 -6.409 5.333 -1.715 1.00 15.75 O ATOM 730 CB PRO A 95 -6.896 4.564 1.341 1.00 15.47 C ATOM 731 CG PRO A 95 -7.737 3.949 2.377 1.00 16.66 C ATOM 732 CD PRO A 95 -9.094 3.595 1.813 1.00 14.92 C ATOM 0 HA PRO A 95 -8.061 5.741 -0.010 1.00 14.59 H new ATOM 0 HB2 PRO A 95 -6.159 3.979 1.105 1.00 15.47 H new ATOM 0 HB3 PRO A 95 -6.509 5.394 1.661 1.00 15.47 H new ATOM 0 HG2 PRO A 95 -7.305 3.151 2.721 1.00 16.66 H new ATOM 0 HG3 PRO A 95 -7.840 4.560 3.123 1.00 16.66 H new ATOM 0 HD2 PRO A 95 -9.275 2.645 1.893 1.00 14.92 H new ATOM 0 HD3 PRO A 95 -9.806 4.060 2.280 1.00 14.92 H new ATOM 733 N VAL A 96 -7.071 3.185 -1.550 1.00 14.74 N ATOM 734 CA VAL A 96 -6.461 2.829 -2.850 1.00 15.85 C ATOM 735 C VAL A 96 -6.899 3.767 -3.995 1.00 16.14 C ATOM 736 O VAL A 96 -6.100 4.103 -4.855 1.00 14.62 O ATOM 737 CB VAL A 96 -6.616 1.320 -3.238 1.00 16.78 C ATOM 738 CG1 VAL A 96 -8.097 0.920 -3.622 1.00 16.46 C ATOM 739 CG2 VAL A 96 -5.660 0.977 -4.408 1.00 23.51 C ATOM 0 H VAL A 96 -7.430 2.531 -1.121 1.00 14.74 H new ATOM 0 HA VAL A 96 -5.510 2.967 -2.717 1.00 15.85 H new ATOM 0 HB VAL A 96 -6.384 0.805 -2.449 1.00 16.78 H new ATOM 0 HG11 VAL A 96 -8.129 -0.022 -3.852 1.00 16.46 H new ATOM 0 HG12 VAL A 96 -8.684 1.089 -2.868 1.00 16.46 H new ATOM 0 HG13 VAL A 96 -8.388 1.448 -4.382 1.00 16.46 H new ATOM 0 HG21 VAL A 96 -5.760 0.042 -4.644 1.00 23.51 H new ATOM 0 HG22 VAL A 96 -5.877 1.529 -5.176 1.00 23.51 H new ATOM 0 HG23 VAL A 96 -4.744 1.146 -4.138 1.00 23.51 H new ATOM 740 N ASN A 97 -8.168 4.183 -3.989 1.00 14.73 N ATOM 741 CA ASN A 97 -8.688 4.981 -5.097 1.00 14.97 C ATOM 742 C ASN A 97 -8.053 6.363 -5.145 1.00 14.63 C ATOM 743 O ASN A 97 -7.975 6.956 -6.209 1.00 14.63 O ATOM 744 CB ASN A 97 -10.209 5.064 -5.039 1.00 13.05 C ATOM 745 CG ASN A 97 -10.855 3.673 -5.202 1.00 16.64 C ATOM 746 OD1 ASN A 97 -10.713 3.019 -6.269 1.00 21.79 O ATOM 747 ND2 ASN A 97 -11.450 3.167 -4.127 1.00 13.61 N ATOM 0 H ASN A 97 -8.734 4.016 -3.363 1.00 14.73 H new ATOM 0 HA ASN A 97 -8.446 4.532 -5.922 1.00 14.97 H new ATOM 0 HB2 ASN A 97 -10.481 5.452 -4.193 1.00 13.05 H new ATOM 0 HB3 ASN A 97 -10.529 5.655 -5.738 1.00 13.05 H new ATOM 0 HD21 ASN A 97 -11.756 2.363 -4.143 1.00 13.61 H new ATOM 0 HD22 ASN A 97 -11.529 3.643 -3.415 1.00 13.61 H new ATOM 748 N PHE A 98 -7.609 6.865 -3.994 1.00 13.78 N ATOM 749 CA PHE A 98 -6.917 8.145 -3.953 1.00 15.59 C ATOM 750 C PHE A 98 -5.581 8.089 -4.650 1.00 15.35 C ATOM 751 O PHE A 98 -5.226 9.045 -5.315 1.00 15.46 O ATOM 752 CB PHE A 98 -6.774 8.645 -2.496 1.00 15.56 C ATOM 753 CG PHE A 98 -8.051 9.191 -1.969 1.00 19.73 C ATOM 754 CD1 PHE A 98 -8.268 10.574 -1.947 1.00 21.75 C ATOM 755 CD2 PHE A 98 -9.093 8.343 -1.646 1.00 20.46 C ATOM 756 CE1 PHE A 98 -9.473 11.087 -1.536 1.00 21.95 C ATOM 757 CE2 PHE A 98 -10.320 8.874 -1.201 1.00 24.35 C ATOM 758 CZ PHE A 98 -10.501 10.246 -1.158 1.00 20.32 C ATOM 0 H PHE A 98 -7.699 6.480 -3.230 1.00 13.78 H new ATOM 0 HA PHE A 98 -7.460 8.785 -4.440 1.00 15.59 H new ATOM 0 HB2 PHE A 98 -6.478 7.914 -1.931 1.00 15.56 H new ATOM 0 HB3 PHE A 98 -6.089 9.330 -2.456 1.00 15.56 H new ATOM 0 HD1 PHE A 98 -7.589 11.151 -2.214 1.00 21.75 H new ATOM 0 HD2 PHE A 98 -8.985 7.422 -1.722 1.00 20.46 H new ATOM 0 HE1 PHE A 98 -9.598 12.008 -1.512 1.00 21.95 H new ATOM 0 HE2 PHE A 98 -11.006 8.305 -0.937 1.00 24.35 H new ATOM 0 HZ PHE A 98 -11.313 10.600 -0.875 1.00 20.32 H new ATOM 759 N LYS A 99 -4.851 6.974 -4.519 1.00 16.26 N ATOM 760 CA LYS A 99 -3.602 6.786 -5.281 1.00 17.72 C ATOM 761 C LYS A 99 -3.887 6.758 -6.789 1.00 16.10 C ATOM 762 O LYS A 99 -3.080 7.223 -7.590 1.00 17.06 O ATOM 763 CB LYS A 99 -2.884 5.487 -4.877 1.00 17.12 C ATOM 764 CG LYS A 99 -2.427 5.465 -3.401 1.00 21.17 C ATOM 765 CD LYS A 99 -1.968 4.059 -2.971 1.00 22.07 C ATOM 766 CE LYS A 99 -0.903 4.168 -1.860 1.00 31.39 C ATOM 767 NZ LYS A 99 -1.516 4.600 -0.523 1.00 34.79 N ATOM 0 H LYS A 99 -5.057 6.320 -4.000 1.00 16.26 H new ATOM 0 HA LYS A 99 -3.024 7.537 -5.073 1.00 17.72 H new ATOM 0 HB2 LYS A 99 -3.477 4.736 -5.035 1.00 17.12 H new ATOM 0 HB3 LYS A 99 -2.110 5.363 -5.449 1.00 17.12 H new ATOM 0 HG2 LYS A 99 -1.700 6.095 -3.277 1.00 21.17 H new ATOM 0 HG3 LYS A 99 -3.156 5.757 -2.831 1.00 21.17 H new ATOM 0 HD2 LYS A 99 -2.727 3.546 -2.652 1.00 22.07 H new ATOM 0 HD3 LYS A 99 -1.603 3.582 -3.733 1.00 22.07 H new ATOM 0 HE2 LYS A 99 -0.461 3.312 -1.751 1.00 31.39 H new ATOM 0 HE3 LYS A 99 -0.223 4.807 -2.125 1.00 31.39 H new ATOM 0 HZ1 LYS A 99 -0.877 4.653 0.094 1.00 34.79 H new ATOM 0 HZ2 LYS A 99 -1.903 5.396 -0.617 1.00 34.79 H new ATOM 0 HZ3 LYS A 99 -2.125 4.003 -0.268 1.00 34.79 H new ATOM 768 N LEU A 100 -5.033 6.248 -7.186 1.00 14.66 N ATOM 769 CA LEU A 100 -5.372 6.238 -8.661 1.00 14.77 C ATOM 770 C LEU A 100 -5.693 7.656 -9.184 1.00 13.54 C ATOM 771 O LEU A 100 -5.208 8.081 -10.183 1.00 13.43 O ATOM 772 CB LEU A 100 -6.545 5.272 -8.939 1.00 13.18 C ATOM 773 CG LEU A 100 -6.351 3.821 -8.397 1.00 17.86 C ATOM 774 CD1 LEU A 100 -7.540 2.924 -8.709 1.00 17.03 C ATOM 775 CD2 LEU A 100 -5.011 3.112 -8.842 1.00 18.97 C ATOM 0 H LEU A 100 -5.629 5.908 -6.667 1.00 14.66 H new ATOM 0 HA LEU A 100 -4.590 5.923 -9.141 1.00 14.77 H new ATOM 0 HB2 LEU A 100 -7.351 5.643 -8.548 1.00 13.18 H new ATOM 0 HB3 LEU A 100 -6.689 5.228 -9.897 1.00 13.18 H new ATOM 0 HG LEU A 100 -6.285 3.946 -7.437 1.00 17.86 H new ATOM 0 HD11 LEU A 100 -7.377 2.036 -8.355 1.00 17.03 H new ATOM 0 HD12 LEU A 100 -8.339 3.292 -8.301 1.00 17.03 H new ATOM 0 HD13 LEU A 100 -7.663 2.871 -9.670 1.00 17.03 H new ATOM 0 HD21 LEU A 100 -4.975 2.220 -8.462 1.00 18.97 H new ATOM 0 HD22 LEU A 100 -4.982 3.052 -9.810 1.00 18.97 H new ATOM 0 HD23 LEU A 100 -4.252 3.628 -8.528 1.00 18.97 H new ATOM 776 N LEU A 101 -6.506 8.415 -8.475 1.00 13.22 N ATOM 777 CA LEU A 101 -6.794 9.757 -8.981 1.00 13.45 C ATOM 778 C LEU A 101 -5.534 10.609 -8.927 1.00 12.93 C ATOM 779 O LEU A 101 -5.322 11.423 -9.796 1.00 13.82 O ATOM 780 CB LEU A 101 -7.928 10.412 -8.188 1.00 13.11 C ATOM 781 CG LEU A 101 -8.328 11.810 -8.703 1.00 15.01 C ATOM 782 CD1 LEU A 101 -8.688 11.748 -10.176 1.00 14.49 C ATOM 783 CD2 LEU A 101 -9.570 12.331 -7.924 1.00 16.55 C ATOM 0 H LEU A 101 -6.888 8.196 -7.736 1.00 13.22 H new ATOM 0 HA LEU A 101 -7.085 9.685 -9.903 1.00 13.45 H new ATOM 0 HB2 LEU A 101 -8.706 9.833 -8.215 1.00 13.11 H new ATOM 0 HB3 LEU A 101 -7.660 10.484 -7.258 1.00 13.11 H new ATOM 0 HG LEU A 101 -7.574 12.405 -8.571 1.00 15.01 H new ATOM 0 HD11 LEU A 101 -8.937 12.633 -10.486 1.00 14.49 H new ATOM 0 HD12 LEU A 101 -7.924 11.431 -10.683 1.00 14.49 H new ATOM 0 HD13 LEU A 101 -9.433 11.140 -10.302 1.00 14.49 H new ATOM 0 HD21 LEU A 101 -9.814 13.210 -8.254 1.00 16.55 H new ATOM 0 HD22 LEU A 101 -10.312 11.720 -8.052 1.00 16.55 H new ATOM 0 HD23 LEU A 101 -9.359 12.388 -6.979 1.00 16.55 H new ATOM 784 N SER A 102 -4.719 10.446 -7.887 1.00 13.22 N ATOM 785 CA SER A 102 -3.499 11.257 -7.730 1.00 12.18 C ATOM 786 C SER A 102 -2.580 10.960 -8.911 1.00 11.71 C ATOM 787 O SER A 102 -1.973 11.873 -9.459 1.00 12.63 O ATOM 788 CB SER A 102 -2.819 11.010 -6.371 1.00 13.81 C ATOM 789 OG SER A 102 -3.717 11.288 -5.265 1.00 16.22 O ATOM 0 H SER A 102 -4.849 9.873 -7.259 1.00 13.22 H new ATOM 0 HA SER A 102 -3.724 12.201 -7.732 1.00 12.18 H new ATOM 0 HB2 SER A 102 -2.519 10.089 -6.321 1.00 13.81 H new ATOM 0 HB3 SER A 102 -2.030 11.570 -6.297 1.00 13.81 H new ATOM 0 HG SER A 102 -4.246 10.643 -5.164 1.00 16.22 H new ATOM 790 N HIS A 103 -2.417 9.688 -9.266 1.00 10.93 N ATOM 791 CA HIS A 103 -1.617 9.314 -10.449 1.00 10.98 C ATOM 792 C HIS A 103 -2.218 9.946 -11.731 1.00 8.87 C ATOM 793 O HIS A 103 -1.506 10.551 -12.509 1.00 9.38 O ATOM 794 CB HIS A 103 -1.495 7.755 -10.568 1.00 12.02 C ATOM 795 CG HIS A 103 -1.077 7.272 -11.929 1.00 12.78 C ATOM 796 ND1 HIS A 103 0.204 7.453 -12.424 1.00 14.13 N ATOM 797 CD2 HIS A 103 -1.738 6.531 -12.857 1.00 11.91 C ATOM 798 CE1 HIS A 103 0.292 6.887 -13.617 1.00 11.61 C ATOM 799 NE2 HIS A 103 -0.877 6.330 -13.911 1.00 9.80 N ATOM 0 H HIS A 103 -2.758 9.022 -8.841 1.00 10.93 H new ATOM 0 HA HIS A 103 -0.719 9.665 -10.342 1.00 10.98 H new ATOM 0 HB2 HIS A 103 -0.853 7.440 -9.913 1.00 12.02 H new ATOM 0 HB3 HIS A 103 -2.350 7.356 -10.342 1.00 12.02 H new ATOM 0 HD2 HIS A 103 -2.611 6.218 -12.792 1.00 11.91 H new ATOM 0 HE1 HIS A 103 1.047 6.880 -14.160 1.00 11.61 H new ATOM 0 HE2 HIS A 103 -1.065 5.913 -14.639 1.00 9.80 H new ATOM 800 N CYS A 104 -3.532 9.901 -11.915 1.00 8.92 N ATOM 801 CA CYS A 104 -4.121 10.524 -13.112 1.00 11.22 C ATOM 802 C CYS A 104 -3.934 12.043 -13.178 1.00 11.64 C ATOM 803 O CYS A 104 -3.791 12.609 -14.259 1.00 12.68 O ATOM 804 CB CYS A 104 -5.618 10.168 -13.236 1.00 11.57 C ATOM 805 SG CYS A 104 -5.764 8.398 -13.660 1.00 13.80 S ATOM 0 H CYS A 104 -4.092 9.528 -11.380 1.00 8.92 H new ATOM 0 HA CYS A 104 -3.633 10.155 -13.865 1.00 11.22 H new ATOM 0 HB2 CYS A 104 -6.078 10.353 -12.402 1.00 11.57 H new ATOM 0 HB3 CYS A 104 -6.038 10.713 -13.919 1.00 11.57 H new ATOM 0 HG CYS A 104 -6.541 7.870 -12.914 1.00 13.80 H new ATOM 806 N LEU A 105 -3.990 12.692 -12.011 1.00 11.84 N ATOM 807 CA LEU A 105 -3.740 14.123 -11.970 1.00 13.09 C ATOM 808 C LEU A 105 -2.325 14.409 -12.447 1.00 11.98 C ATOM 809 O LEU A 105 -2.108 15.274 -13.278 1.00 12.24 O ATOM 810 CB LEU A 105 -3.963 14.649 -10.523 1.00 12.29 C ATOM 811 CG LEU A 105 -5.448 14.707 -10.158 1.00 16.04 C ATOM 812 CD1 LEU A 105 -5.662 14.916 -8.602 1.00 17.57 C ATOM 813 CD2 LEU A 105 -6.068 15.908 -10.907 1.00 19.14 C ATOM 0 H LEU A 105 -4.167 12.327 -11.252 1.00 11.84 H new ATOM 0 HA LEU A 105 -4.357 14.583 -12.560 1.00 13.09 H new ATOM 0 HB2 LEU A 105 -3.498 14.074 -9.895 1.00 12.29 H new ATOM 0 HB3 LEU A 105 -3.575 15.534 -10.438 1.00 12.29 H new ATOM 0 HG LEU A 105 -5.866 13.868 -10.407 1.00 16.04 H new ATOM 0 HD11 LEU A 105 -6.612 14.948 -8.407 1.00 17.57 H new ATOM 0 HD12 LEU A 105 -5.258 14.179 -8.118 1.00 17.57 H new ATOM 0 HD13 LEU A 105 -5.248 15.749 -8.327 1.00 17.57 H new ATOM 0 HD21 LEU A 105 -7.012 15.970 -10.694 1.00 19.14 H new ATOM 0 HD22 LEU A 105 -5.621 16.725 -10.635 1.00 19.14 H new ATOM 0 HD23 LEU A 105 -5.960 15.784 -11.863 1.00 19.14 H new ATOM 814 N LEU A 106 -1.343 13.661 -11.947 1.00 13.40 N ATOM 815 CA LEU A 106 0.050 13.871 -12.389 1.00 13.12 C ATOM 816 C LEU A 106 0.256 13.612 -13.875 1.00 13.15 C ATOM 817 O LEU A 106 0.976 14.357 -14.563 1.00 13.07 O ATOM 818 CB LEU A 106 1.055 13.031 -11.558 1.00 13.80 C ATOM 819 CG LEU A 106 1.130 13.314 -10.044 1.00 16.99 C ATOM 820 CD1 LEU A 106 2.066 12.335 -9.449 1.00 18.20 C ATOM 821 CD2 LEU A 106 1.585 14.739 -9.624 1.00 16.00 C ATOM 0 H LEU A 106 -1.451 13.038 -11.364 1.00 13.40 H new ATOM 0 HA LEU A 106 0.227 14.812 -12.234 1.00 13.12 H new ATOM 0 HB2 LEU A 106 0.834 12.094 -11.678 1.00 13.80 H new ATOM 0 HB3 LEU A 106 1.940 13.164 -11.933 1.00 13.80 H new ATOM 0 HG LEU A 106 0.218 13.239 -9.722 1.00 16.99 H new ATOM 0 HD11 LEU A 106 2.133 12.490 -8.494 1.00 18.20 H new ATOM 0 HD12 LEU A 106 1.738 11.436 -9.608 1.00 18.20 H new ATOM 0 HD13 LEU A 106 2.941 12.436 -9.855 1.00 18.20 H new ATOM 0 HD21 LEU A 106 1.595 14.803 -8.656 1.00 16.00 H new ATOM 0 HD22 LEU A 106 2.476 14.909 -9.969 1.00 16.00 H new ATOM 0 HD23 LEU A 106 0.968 15.395 -9.985 1.00 16.00 H new ATOM 822 N VAL A 107 -0.373 12.550 -14.383 1.00 12.83 N ATOM 823 CA VAL A 107 -0.352 12.252 -15.794 1.00 12.79 C ATOM 824 C VAL A 107 -0.865 13.453 -16.574 1.00 13.40 C ATOM 825 O VAL A 107 -0.304 13.813 -17.608 1.00 13.21 O ATOM 826 CB VAL A 107 -1.144 10.959 -16.131 1.00 12.74 C ATOM 827 CG1 VAL A 107 -1.446 10.798 -17.658 1.00 12.97 C ATOM 828 CG2 VAL A 107 -0.377 9.766 -15.604 1.00 11.35 C ATOM 0 H VAL A 107 -0.821 11.988 -13.910 1.00 12.83 H new ATOM 0 HA VAL A 107 0.565 12.078 -16.059 1.00 12.79 H new ATOM 0 HB VAL A 107 -2.010 11.021 -15.699 1.00 12.74 H new ATOM 0 HG11 VAL A 107 -1.940 9.976 -17.805 1.00 12.97 H new ATOM 0 HG12 VAL A 107 -1.974 11.552 -17.965 1.00 12.97 H new ATOM 0 HG13 VAL A 107 -0.612 10.766 -18.151 1.00 12.97 H new ATOM 0 HG21 VAL A 107 -0.863 8.952 -15.809 1.00 11.35 H new ATOM 0 HG22 VAL A 107 0.498 9.733 -16.021 1.00 11.35 H new ATOM 0 HG23 VAL A 107 -0.273 9.847 -14.643 1.00 11.35 H new ATOM 829 N THR A 108 -1.898 14.078 -16.043 1.00 11.48 N ATOM 830 CA THR A 108 -2.558 15.172 -16.747 1.00 13.03 C ATOM 831 C THR A 108 -1.685 16.452 -16.647 1.00 13.74 C ATOM 832 O THR A 108 -1.549 17.169 -17.628 1.00 15.39 O ATOM 833 CB THR A 108 -4.002 15.403 -16.215 1.00 11.65 C ATOM 834 OG1 THR A 108 -4.778 14.173 -16.383 1.00 14.41 O ATOM 835 CG2 THR A 108 -4.702 16.590 -16.985 1.00 14.31 C ATOM 0 H THR A 108 -2.237 13.888 -15.276 1.00 11.48 H new ATOM 0 HA THR A 108 -2.649 14.937 -17.684 1.00 13.03 H new ATOM 0 HB THR A 108 -3.957 15.639 -15.275 1.00 11.65 H new ATOM 0 HG1 THR A 108 -4.560 13.620 -15.789 1.00 14.41 H new ATOM 0 HG21 THR A 108 -5.599 16.717 -16.638 1.00 14.31 H new ATOM 0 HG22 THR A 108 -4.190 17.404 -16.860 1.00 14.31 H new ATOM 0 HG23 THR A 108 -4.748 16.380 -17.931 1.00 14.31 H new ATOM 836 N LEU A 109 -1.076 16.718 -15.498 1.00 14.67 N ATOM 837 CA LEU A 109 -0.221 17.917 -15.400 1.00 15.05 C ATOM 838 C LEU A 109 1.051 17.776 -16.203 1.00 16.45 C ATOM 839 O LEU A 109 1.499 18.728 -16.843 1.00 18.46 O ATOM 840 CB LEU A 109 0.081 18.244 -13.943 1.00 14.30 C ATOM 841 CG LEU A 109 -1.144 18.603 -13.093 1.00 17.92 C ATOM 842 CD1 LEU A 109 -0.697 18.718 -11.652 1.00 20.26 C ATOM 843 CD2 LEU A 109 -1.791 19.959 -13.558 1.00 23.71 C ATOM 0 H LEU A 109 -1.134 16.243 -14.783 1.00 14.67 H new ATOM 0 HA LEU A 109 -0.715 18.658 -15.784 1.00 15.05 H new ATOM 0 HB2 LEU A 109 0.526 17.482 -13.540 1.00 14.30 H new ATOM 0 HB3 LEU A 109 0.706 18.985 -13.915 1.00 14.30 H new ATOM 0 HG LEU A 109 -1.816 17.910 -13.194 1.00 17.92 H new ATOM 0 HD11 LEU A 109 -1.457 18.945 -11.094 1.00 20.26 H new ATOM 0 HD12 LEU A 109 -0.324 17.872 -11.360 1.00 20.26 H new ATOM 0 HD13 LEU A 109 -0.023 19.411 -11.576 1.00 20.26 H new ATOM 0 HD21 LEU A 109 -2.561 20.158 -13.003 1.00 23.71 H new ATOM 0 HD22 LEU A 109 -1.140 20.673 -13.475 1.00 23.71 H new ATOM 0 HD23 LEU A 109 -2.071 19.883 -14.483 1.00 23.71 H new ATOM 844 N ALA A 110 1.685 16.614 -16.163 1.00 16.46 N ATOM 845 CA ALA A 110 2.833 16.372 -17.048 1.00 16.41 C ATOM 846 C ALA A 110 2.456 16.525 -18.549 1.00 15.60 C ATOM 847 O ALA A 110 3.281 16.982 -19.361 1.00 14.12 O ATOM 848 CB ALA A 110 3.355 14.985 -16.800 1.00 16.58 C ATOM 0 H ALA A 110 1.478 15.960 -15.645 1.00 16.46 H new ATOM 0 HA ALA A 110 3.512 17.035 -16.849 1.00 16.41 H new ATOM 0 HB1 ALA A 110 4.114 14.816 -17.380 1.00 16.58 H new ATOM 0 HB2 ALA A 110 3.632 14.904 -15.874 1.00 16.58 H new ATOM 0 HB3 ALA A 110 2.656 14.338 -16.985 1.00 16.58 H new ATOM 849 N ASN A 111 1.235 16.148 -18.901 1.00 16.23 N ATOM 850 CA ASN A 111 0.720 16.267 -20.288 1.00 17.89 C ATOM 851 C ASN A 111 0.653 17.728 -20.832 1.00 18.84 C ATOM 852 O ASN A 111 1.024 17.977 -21.979 1.00 19.17 O ATOM 853 CB ASN A 111 -0.656 15.617 -20.421 1.00 17.25 C ATOM 854 CG ASN A 111 -0.986 15.226 -21.854 1.00 19.11 C ATOM 855 OD1 ASN A 111 -1.494 16.042 -22.639 1.00 17.34 O ATOM 856 ND2 ASN A 111 -0.732 13.943 -22.203 1.00 14.82 N ATOM 0 H ASN A 111 0.668 15.812 -18.349 1.00 16.23 H new ATOM 0 HA ASN A 111 1.371 15.797 -20.832 1.00 17.89 H new ATOM 0 HB2 ASN A 111 -0.692 14.828 -19.858 1.00 17.25 H new ATOM 0 HB3 ASN A 111 -1.332 16.230 -20.093 1.00 17.25 H new ATOM 0 HD21 ASN A 111 -0.924 13.667 -22.995 1.00 14.82 H new ATOM 0 HD22 ASN A 111 -0.379 13.404 -21.633 1.00 14.82 H new ATOM 857 N HIS A 112 0.210 18.654 -19.995 1.00 19.48 N ATOM 858 CA HIS A 112 -0.096 20.022 -20.409 1.00 20.64 C ATOM 859 C HIS A 112 1.006 21.004 -20.048 1.00 21.96 C ATOM 860 O HIS A 112 1.145 22.057 -20.681 1.00 22.10 O ATOM 861 CB HIS A 112 -1.407 20.465 -19.771 1.00 19.66 C ATOM 862 CG HIS A 112 -2.599 19.731 -20.308 1.00 23.02 C ATOM 863 ND1 HIS A 112 -3.140 20.008 -21.552 1.00 22.94 N ATOM 864 CD2 HIS A 112 -3.331 18.709 -19.796 1.00 19.21 C ATOM 865 CE1 HIS A 112 -4.175 19.212 -21.758 1.00 23.71 C ATOM 866 NE2 HIS A 112 -4.297 18.400 -20.720 1.00 19.34 N ATOM 0 H HIS A 112 0.076 18.507 -19.158 1.00 19.48 H new ATOM 0 HA HIS A 112 -0.172 20.021 -21.376 1.00 20.64 H new ATOM 0 HB2 HIS A 112 -1.356 20.330 -18.812 1.00 19.66 H new ATOM 0 HB3 HIS A 112 -1.527 21.416 -19.917 1.00 19.66 H new ATOM 0 HD2 HIS A 112 -3.202 18.296 -18.973 1.00 19.21 H new ATOM 0 HE1 HIS A 112 -4.726 19.221 -22.507 1.00 23.71 H new ATOM 0 HE2 HIS A 112 -4.886 17.779 -20.638 1.00 19.34 H new ATOM 867 N HIS A 113 1.810 20.666 -19.042 1.00 21.44 N ATOM 868 CA HIS A 113 2.864 21.573 -18.607 1.00 21.08 C ATOM 869 C HIS A 113 4.202 20.932 -18.499 1.00 20.07 C ATOM 870 O HIS A 113 4.741 20.901 -17.415 1.00 20.20 O ATOM 871 CB HIS A 113 2.465 22.205 -17.263 1.00 21.31 C ATOM 872 CG HIS A 113 1.140 22.912 -17.321 1.00 25.31 C ATOM 873 ND1 HIS A 113 0.976 24.125 -17.954 1.00 31.26 N ATOM 874 CD2 HIS A 113 -0.087 22.563 -16.852 1.00 28.99 C ATOM 875 CE1 HIS A 113 -0.293 24.495 -17.874 1.00 31.57 C ATOM 876 NE2 HIS A 113 -0.959 23.564 -17.213 1.00 31.98 N ATOM 0 H HIS A 113 1.762 19.927 -18.605 1.00 21.44 H new ATOM 0 HA HIS A 113 2.952 22.253 -19.293 1.00 21.08 H new ATOM 0 HB2 HIS A 113 2.428 21.514 -16.584 1.00 21.31 H new ATOM 0 HB3 HIS A 113 3.151 22.834 -16.990 1.00 21.31 H new ATOM 0 HD2 HIS A 113 -0.298 21.792 -16.376 1.00 28.99 H new ATOM 0 HE1 HIS A 113 -0.654 25.277 -18.224 1.00 31.57 H new ATOM 0 HE2 HIS A 113 -1.801 23.581 -17.037 1.00 31.98 H new ATOM 877 N PRO A 114 4.736 20.357 -19.605 1.00 20.93 N ATOM 878 CA PRO A 114 5.972 19.588 -19.435 1.00 20.87 C ATOM 879 C PRO A 114 7.145 20.408 -18.948 1.00 20.79 C ATOM 880 O PRO A 114 7.979 19.883 -18.260 1.00 21.75 O ATOM 881 CB PRO A 114 6.249 19.008 -20.844 1.00 20.92 C ATOM 882 CG PRO A 114 5.353 19.749 -21.778 1.00 20.36 C ATOM 883 CD PRO A 114 4.247 20.324 -20.998 1.00 20.48 C ATOM 0 HA PRO A 114 5.863 18.912 -18.748 1.00 20.87 H new ATOM 0 HB2 PRO A 114 7.180 19.125 -21.090 1.00 20.92 H new ATOM 0 HB3 PRO A 114 6.066 18.056 -20.870 1.00 20.92 H new ATOM 0 HG2 PRO A 114 5.845 20.450 -22.234 1.00 20.36 H new ATOM 0 HG3 PRO A 114 5.010 19.153 -22.462 1.00 20.36 H new ATOM 0 HD2 PRO A 114 4.022 21.214 -21.312 1.00 20.48 H new ATOM 0 HD3 PRO A 114 3.445 19.784 -21.076 1.00 20.48 H new ATOM 884 N SER A 115 7.216 21.686 -19.292 1.00 22.01 N ATOM 885 CA SER A 115 8.305 22.576 -18.808 1.00 22.75 C ATOM 886 C SER A 115 8.348 22.759 -17.295 1.00 21.95 C ATOM 887 O SER A 115 9.425 22.741 -16.694 1.00 23.10 O ATOM 888 CB SER A 115 8.188 23.957 -19.461 1.00 22.45 C ATOM 889 OG SER A 115 8.435 23.759 -20.822 1.00 26.62 O ATOM 0 H SER A 115 6.647 22.074 -19.807 1.00 22.01 H new ATOM 0 HA SER A 115 9.128 22.130 -19.062 1.00 22.75 H new ATOM 0 HB2 SER A 115 7.306 24.335 -19.319 1.00 22.45 H new ATOM 0 HB3 SER A 115 8.828 24.578 -19.078 1.00 22.45 H new ATOM 0 HG SER A 115 8.380 24.493 -21.227 1.00 26.62 H new ATOM 890 N GLU A 116 7.189 22.883 -16.678 1.00 21.99 N ATOM 891 CA GLU A 116 7.101 23.041 -15.209 1.00 22.68 C ATOM 892 C GLU A 116 7.293 21.735 -14.474 1.00 21.36 C ATOM 893 O GLU A 116 7.719 21.756 -13.329 1.00 20.74 O ATOM 894 CB GLU A 116 5.756 23.612 -14.786 1.00 23.31 C ATOM 895 CG GLU A 116 5.371 24.855 -15.577 1.00 30.59 C ATOM 896 CD GLU A 116 6.375 25.979 -15.347 1.00 38.24 C ATOM 897 OE1 GLU A 116 6.561 26.332 -14.140 1.00 38.42 O ATOM 898 OE2 GLU A 116 6.971 26.468 -16.354 1.00 39.12 O ATOM 0 H GLU A 116 6.429 22.880 -17.080 1.00 21.99 H new ATOM 0 HA GLU A 116 7.817 23.652 -14.975 1.00 22.68 H new ATOM 0 HB2 GLU A 116 5.071 22.935 -14.901 1.00 23.31 H new ATOM 0 HB3 GLU A 116 5.784 23.830 -13.841 1.00 23.31 H new ATOM 0 HG2 GLU A 116 5.330 24.641 -16.522 1.00 30.59 H new ATOM 0 HG3 GLU A 116 4.485 25.149 -15.314 1.00 30.59 H new ATOM 899 N PHE A 117 6.971 20.608 -15.131 1.00 19.30 N ATOM 900 CA PHE A 117 6.960 19.284 -14.499 1.00 17.90 C ATOM 901 C PHE A 117 8.370 18.661 -14.493 1.00 18.18 C ATOM 902 O PHE A 117 8.608 17.582 -15.090 1.00 16.52 O ATOM 903 CB PHE A 117 5.960 18.350 -15.241 1.00 17.34 C ATOM 904 CG PHE A 117 5.434 17.211 -14.394 1.00 17.83 C ATOM 905 CD1 PHE A 117 4.441 17.443 -13.420 1.00 19.10 C ATOM 906 CD2 PHE A 117 5.900 15.893 -14.587 1.00 16.66 C ATOM 907 CE1 PHE A 117 3.919 16.385 -12.624 1.00 17.62 C ATOM 908 CE2 PHE A 117 5.394 14.820 -13.782 1.00 17.48 C ATOM 909 CZ PHE A 117 4.408 15.086 -12.795 1.00 16.37 C ATOM 0 H PHE A 117 6.752 20.595 -15.962 1.00 19.30 H new ATOM 0 HA PHE A 117 6.675 19.388 -13.578 1.00 17.90 H new ATOM 0 HB2 PHE A 117 5.211 18.879 -15.556 1.00 17.34 H new ATOM 0 HB3 PHE A 117 6.397 17.982 -16.025 1.00 17.34 H new ATOM 0 HD1 PHE A 117 4.120 18.307 -13.295 1.00 19.10 H new ATOM 0 HD2 PHE A 117 6.539 15.719 -15.240 1.00 16.66 H new ATOM 0 HE1 PHE A 117 3.257 16.556 -11.994 1.00 17.62 H new ATOM 0 HE2 PHE A 117 5.710 13.954 -13.905 1.00 17.48 H new ATOM 0 HZ PHE A 117 4.087 14.395 -12.262 1.00 16.37 H new ATOM 910 N THR A 118 9.305 19.352 -13.839 1.00 16.23 N ATOM 911 CA THR A 118 10.638 18.839 -13.592 1.00 16.35 C ATOM 912 C THR A 118 10.579 17.674 -12.561 1.00 16.83 C ATOM 913 O THR A 118 9.575 17.476 -11.809 1.00 16.42 O ATOM 914 CB THR A 118 11.555 19.969 -13.035 1.00 16.11 C ATOM 915 OG1 THR A 118 10.971 20.447 -11.809 1.00 18.40 O ATOM 916 CG2 THR A 118 11.700 21.130 -14.028 1.00 16.84 C ATOM 0 H THR A 118 9.174 20.142 -13.525 1.00 16.23 H new ATOM 0 HA THR A 118 11.002 18.513 -14.430 1.00 16.35 H new ATOM 0 HB THR A 118 12.443 19.610 -12.884 1.00 16.11 H new ATOM 0 HG1 THR A 118 11.470 21.032 -11.470 1.00 18.40 H new ATOM 0 HG21 THR A 118 12.276 21.812 -13.647 1.00 16.84 H new ATOM 0 HG22 THR A 118 12.089 20.803 -14.854 1.00 16.84 H new ATOM 0 HG23 THR A 118 10.827 21.510 -14.211 1.00 16.84 H new ATOM 917 N PRO A 119 11.649 16.863 -12.505 1.00 18.01 N ATOM 918 CA PRO A 119 11.695 15.834 -11.440 1.00 17.23 C ATOM 919 C PRO A 119 11.467 16.386 -10.004 1.00 16.51 C ATOM 920 O PRO A 119 10.758 15.764 -9.234 1.00 15.33 O ATOM 921 CB PRO A 119 13.107 15.288 -11.597 1.00 18.65 C ATOM 922 CG PRO A 119 13.359 15.492 -13.109 1.00 17.74 C ATOM 923 CD PRO A 119 12.829 16.790 -13.409 1.00 17.35 C ATOM 0 HA PRO A 119 10.985 15.180 -11.536 1.00 17.23 H new ATOM 0 HB2 PRO A 119 13.747 15.773 -11.053 1.00 18.65 H new ATOM 0 HB3 PRO A 119 13.167 14.354 -11.341 1.00 18.65 H new ATOM 0 HG2 PRO A 119 14.306 15.444 -13.316 1.00 17.74 H new ATOM 0 HG3 PRO A 119 12.919 14.805 -13.633 1.00 17.74 H new ATOM 0 HD2 PRO A 119 13.470 17.495 -13.226 1.00 17.35 H new ATOM 0 HD3 PRO A 119 12.577 16.872 -14.342 1.00 17.35 H new ATOM 924 N ALA A 120 12.031 17.555 -9.657 1.00 15.61 N ATOM 925 CA ALA A 120 11.831 18.088 -8.287 1.00 16.64 C ATOM 926 C ALA A 120 10.369 18.562 -8.024 1.00 15.16 C ATOM 927 O ALA A 120 9.834 18.358 -6.921 1.00 15.50 O ATOM 928 CB ALA A 120 12.821 19.215 -7.975 1.00 15.85 C ATOM 0 H ALA A 120 12.516 18.042 -10.175 1.00 15.61 H new ATOM 0 HA ALA A 120 12.002 17.346 -7.686 1.00 16.64 H new ATOM 0 HB1 ALA A 120 12.666 19.542 -7.075 1.00 15.85 H new ATOM 0 HB2 ALA A 120 13.728 18.878 -8.044 1.00 15.85 H new ATOM 0 HB3 ALA A 120 12.697 19.940 -8.608 1.00 15.85 H new ATOM 929 N VAL A 121 9.736 19.169 -9.024 1.00 14.53 N ATOM 930 CA VAL A 121 8.319 19.532 -8.911 1.00 13.90 C ATOM 931 C VAL A 121 7.395 18.267 -8.888 1.00 14.29 C ATOM 932 O VAL A 121 6.465 18.165 -8.105 1.00 13.84 O ATOM 933 CB VAL A 121 7.962 20.512 -10.004 1.00 14.07 C ATOM 934 CG1 VAL A 121 6.459 20.876 -10.004 1.00 12.36 C ATOM 935 CG2 VAL A 121 8.765 21.744 -9.816 1.00 15.43 C ATOM 0 H VAL A 121 10.103 19.380 -9.773 1.00 14.53 H new ATOM 0 HA VAL A 121 8.168 19.972 -8.060 1.00 13.90 H new ATOM 0 HB VAL A 121 8.157 20.093 -10.857 1.00 14.07 H new ATOM 0 HG11 VAL A 121 6.278 21.505 -10.720 1.00 12.36 H new ATOM 0 HG12 VAL A 121 5.931 20.073 -10.139 1.00 12.36 H new ATOM 0 HG13 VAL A 121 6.223 21.278 -9.153 1.00 12.36 H new ATOM 0 HG21 VAL A 121 8.546 22.383 -10.512 1.00 15.43 H new ATOM 0 HG22 VAL A 121 8.567 22.131 -8.949 1.00 15.43 H new ATOM 0 HG23 VAL A 121 9.709 21.526 -9.864 1.00 15.43 H new ATOM 936 N HIS A 122 7.668 17.285 -9.754 1.00 14.55 N ATOM 937 CA HIS A 122 6.973 15.989 -9.704 1.00 13.42 C ATOM 938 C HIS A 122 7.005 15.417 -8.280 1.00 13.57 C ATOM 939 O HIS A 122 5.970 15.032 -7.753 1.00 14.00 O ATOM 940 CB HIS A 122 7.701 15.067 -10.708 1.00 14.11 C ATOM 941 CG HIS A 122 7.163 13.672 -10.807 1.00 13.13 C ATOM 942 ND1 HIS A 122 7.590 12.804 -11.796 1.00 14.28 N ATOM 943 CD2 HIS A 122 6.228 13.001 -10.093 1.00 15.13 C ATOM 944 CE1 HIS A 122 6.951 11.649 -11.674 1.00 12.92 C ATOM 945 NE2 HIS A 122 6.142 11.732 -10.626 1.00 13.28 N ATOM 0 H HIS A 122 8.254 17.348 -10.380 1.00 14.55 H new ATOM 0 HA HIS A 122 6.036 16.075 -9.941 1.00 13.42 H new ATOM 0 HB2 HIS A 122 7.661 15.476 -11.587 1.00 14.11 H new ATOM 0 HB3 HIS A 122 8.637 15.019 -10.460 1.00 14.11 H new ATOM 0 HD2 HIS A 122 5.736 13.334 -9.377 1.00 15.13 H new ATOM 0 HE1 HIS A 122 7.052 10.909 -12.227 1.00 12.92 H new ATOM 0 HE2 HIS A 122 5.644 11.097 -10.327 1.00 13.28 H new ATOM 946 N ALA A 123 8.195 15.413 -7.628 1.00 14.54 N ATOM 947 CA ALA A 123 8.350 14.930 -6.262 1.00 14.42 C ATOM 948 C ALA A 123 7.453 15.668 -5.245 1.00 14.89 C ATOM 949 O ALA A 123 6.648 15.019 -4.520 1.00 14.19 O ATOM 950 CB ALA A 123 9.820 14.953 -5.857 1.00 15.27 C ATOM 0 H ALA A 123 8.927 15.695 -7.981 1.00 14.54 H new ATOM 0 HA ALA A 123 8.042 14.010 -6.247 1.00 14.42 H new ATOM 0 HB1 ALA A 123 9.910 14.630 -4.947 1.00 15.27 H new ATOM 0 HB2 ALA A 123 10.329 14.383 -6.454 1.00 15.27 H new ATOM 0 HB3 ALA A 123 10.157 15.861 -5.912 1.00 15.27 H new ATOM 951 N SER A 124 7.505 17.009 -5.280 1.00 15.20 N ATOM 952 CA SER A 124 6.722 17.824 -4.338 1.00 16.33 C ATOM 953 C SER A 124 5.202 17.639 -4.541 1.00 15.81 C ATOM 954 O SER A 124 4.479 17.557 -3.563 1.00 16.34 O ATOM 955 CB SER A 124 7.074 19.306 -4.480 1.00 15.59 C ATOM 956 OG SER A 124 8.467 19.518 -4.314 1.00 17.00 O ATOM 0 H SER A 124 7.982 17.461 -5.835 1.00 15.20 H new ATOM 0 HA SER A 124 6.951 17.520 -3.446 1.00 16.33 H new ATOM 0 HB2 SER A 124 6.797 19.625 -5.353 1.00 15.59 H new ATOM 0 HB3 SER A 124 6.584 19.822 -3.821 1.00 15.59 H new ATOM 0 HG SER A 124 8.711 19.210 -3.571 1.00 17.00 H new ATOM 957 N LEU A 125 4.755 17.549 -5.807 1.00 16.89 N ATOM 958 CA LEU A 125 3.320 17.363 -6.126 1.00 16.90 C ATOM 959 C LEU A 125 2.772 16.030 -5.719 1.00 17.78 C ATOM 960 O LEU A 125 1.659 15.949 -5.185 1.00 17.79 O ATOM 961 CB LEU A 125 3.040 17.579 -7.601 1.00 18.23 C ATOM 962 CG LEU A 125 3.221 18.992 -8.175 1.00 18.77 C ATOM 963 CD1 LEU A 125 2.966 18.959 -9.670 1.00 15.80 C ATOM 964 CD2 LEU A 125 2.364 20.028 -7.466 1.00 21.80 C ATOM 0 H LEU A 125 5.266 17.593 -6.497 1.00 16.89 H new ATOM 0 HA LEU A 125 2.866 18.039 -5.599 1.00 16.90 H new ATOM 0 HB2 LEU A 125 3.615 16.980 -8.102 1.00 18.23 H new ATOM 0 HB3 LEU A 125 2.126 17.305 -7.772 1.00 18.23 H new ATOM 0 HG LEU A 125 4.136 19.272 -8.018 1.00 18.77 H new ATOM 0 HD11 LEU A 125 3.079 19.850 -10.037 1.00 15.80 H new ATOM 0 HD12 LEU A 125 3.595 18.353 -10.092 1.00 15.80 H new ATOM 0 HD13 LEU A 125 2.061 18.653 -9.837 1.00 15.80 H new ATOM 0 HD21 LEU A 125 2.514 20.900 -7.864 1.00 21.80 H new ATOM 0 HD22 LEU A 125 1.428 19.789 -7.555 1.00 21.80 H new ATOM 0 HD23 LEU A 125 2.602 20.057 -6.526 1.00 21.80 H new ATOM 965 N ASP A 126 3.547 14.962 -5.966 1.00 17.13 N ATOM 966 CA ASP A 126 3.195 13.640 -5.431 1.00 17.45 C ATOM 967 C ASP A 126 2.941 13.684 -3.891 1.00 16.64 C ATOM 968 O ASP A 126 1.946 13.151 -3.401 1.00 15.39 O ATOM 969 CB ASP A 126 4.297 12.654 -5.763 1.00 16.21 C ATOM 970 CG ASP A 126 3.935 11.262 -5.410 1.00 20.60 C ATOM 971 OD1 ASP A 126 3.299 10.594 -6.221 1.00 20.48 O ATOM 972 OD2 ASP A 126 4.324 10.821 -4.337 1.00 24.15 O ATOM 0 H ASP A 126 4.269 14.982 -6.433 1.00 17.13 H new ATOM 0 HA ASP A 126 2.366 13.354 -5.846 1.00 17.45 H new ATOM 0 HB2 ASP A 126 4.496 12.703 -6.711 1.00 16.21 H new ATOM 0 HB3 ASP A 126 5.106 12.905 -5.290 1.00 16.21 H new ATOM 973 N LYS A 127 3.880 14.265 -3.132 1.00 16.61 N ATOM 974 CA LYS A 127 3.733 14.351 -1.685 1.00 17.76 C ATOM 975 C LYS A 127 2.524 15.243 -1.327 1.00 16.36 C ATOM 976 O LYS A 127 1.787 14.886 -0.431 1.00 18.01 O ATOM 977 CB LYS A 127 4.964 14.952 -1.019 1.00 18.90 C ATOM 978 CG LYS A 127 6.224 14.158 -1.104 1.00 21.88 C ATOM 979 CD LYS A 127 7.340 15.052 -0.515 1.00 28.33 C ATOM 980 CE LYS A 127 7.172 15.261 0.976 1.00 25.01 C ATOM 981 NZ LYS A 127 8.431 15.691 1.587 1.00 33.45 N ATOM 0 H LYS A 127 4.604 14.612 -3.440 1.00 16.61 H new ATOM 0 HA LYS A 127 3.608 13.445 -1.363 1.00 17.76 H new ATOM 0 HB2 LYS A 127 5.127 15.823 -1.413 1.00 18.90 H new ATOM 0 HB3 LYS A 127 4.761 15.099 -0.082 1.00 18.90 H new ATOM 0 HG2 LYS A 127 6.145 13.329 -0.606 1.00 21.88 H new ATOM 0 HG3 LYS A 127 6.421 13.919 -2.023 1.00 21.88 H new ATOM 0 HD2 LYS A 127 8.204 14.646 -0.689 1.00 28.33 H new ATOM 0 HD3 LYS A 127 7.335 15.912 -0.964 1.00 28.33 H new ATOM 0 HE2 LYS A 127 6.485 15.927 1.138 1.00 25.01 H new ATOM 0 HE3 LYS A 127 6.872 14.437 1.390 1.00 25.01 H new ATOM 0 HZ1 LYS A 127 8.336 15.724 2.471 1.00 33.45 H new ATOM 0 HZ2 LYS A 127 9.075 15.112 1.380 1.00 33.45 H new ATOM 0 HZ3 LYS A 127 8.649 16.498 1.282 1.00 33.45 H new ATOM 982 N PHE A 128 2.308 16.345 -2.060 1.00 16.74 N ATOM 983 CA PHE A 128 1.110 17.198 -1.886 1.00 15.08 C ATOM 984 C PHE A 128 -0.163 16.320 -1.983 1.00 15.90 C ATOM 985 O PHE A 128 -0.998 16.331 -1.083 1.00 14.96 O ATOM 986 CB PHE A 128 1.054 18.266 -2.962 1.00 14.84 C ATOM 987 CG PHE A 128 -0.227 19.094 -2.989 1.00 13.74 C ATOM 988 CD1 PHE A 128 -0.675 19.791 -1.859 1.00 13.72 C ATOM 989 CD2 PHE A 128 -0.951 19.224 -4.173 1.00 14.43 C ATOM 990 CE1 PHE A 128 -1.828 20.557 -1.929 1.00 14.04 C ATOM 991 CE2 PHE A 128 -2.111 20.010 -4.267 1.00 20.08 C ATOM 992 CZ PHE A 128 -2.566 20.674 -3.132 1.00 17.20 C ATOM 0 H PHE A 128 2.847 16.621 -2.670 1.00 16.74 H new ATOM 0 HA PHE A 128 1.158 17.627 -1.017 1.00 15.08 H new ATOM 0 HB2 PHE A 128 1.807 18.865 -2.842 1.00 14.84 H new ATOM 0 HB3 PHE A 128 1.165 17.840 -3.826 1.00 14.84 H new ATOM 0 HD1 PHE A 128 -0.199 19.740 -1.062 1.00 13.72 H new ATOM 0 HD2 PHE A 128 -0.654 18.773 -4.930 1.00 14.43 H new ATOM 0 HE1 PHE A 128 -2.124 21.004 -1.169 1.00 14.04 H new ATOM 0 HE2 PHE A 128 -2.567 20.085 -5.074 1.00 20.08 H new ATOM 0 HZ PHE A 128 -3.342 21.186 -3.163 1.00 17.20 H new ATOM 993 N LEU A 129 -0.289 15.582 -3.097 1.00 13.50 N ATOM 994 CA LEU A 129 -1.460 14.728 -3.310 1.00 15.07 C ATOM 995 C LEU A 129 -1.562 13.622 -2.288 1.00 15.42 C ATOM 996 O LEU A 129 -2.649 13.336 -1.861 1.00 17.48 O ATOM 997 CB LEU A 129 -1.529 14.190 -4.782 1.00 13.72 C ATOM 998 CG LEU A 129 -1.720 15.302 -5.816 1.00 14.63 C ATOM 999 CD1 LEU A 129 -1.544 14.830 -7.277 1.00 12.28 C ATOM 1000 CD2 LEU A 129 -3.029 15.999 -5.677 1.00 18.74 C ATOM 0 H LEU A 129 0.289 15.564 -3.734 1.00 13.50 H new ATOM 0 HA LEU A 129 -2.241 15.288 -3.178 1.00 15.07 H new ATOM 0 HB2 LEU A 129 -0.713 13.705 -4.983 1.00 13.72 H new ATOM 0 HB3 LEU A 129 -2.260 13.557 -4.856 1.00 13.72 H new ATOM 0 HG LEU A 129 -1.007 15.930 -5.620 1.00 14.63 H new ATOM 0 HD11 LEU A 129 -1.678 15.580 -7.878 1.00 12.28 H new ATOM 0 HD12 LEU A 129 -0.649 14.475 -7.397 1.00 12.28 H new ATOM 0 HD13 LEU A 129 -2.195 14.138 -7.474 1.00 12.28 H new ATOM 0 HD21 LEU A 129 -3.100 16.692 -6.352 1.00 18.74 H new ATOM 0 HD22 LEU A 129 -3.750 15.360 -5.792 1.00 18.74 H new ATOM 0 HD23 LEU A 129 -3.090 16.400 -4.796 1.00 18.74 H new ATOM 1001 N ALA A 130 -0.454 13.012 -1.874 1.00 15.91 N ATOM 1002 CA ALA A 130 -0.497 12.061 -0.780 1.00 17.00 C ATOM 1003 C ALA A 130 -1.012 12.692 0.535 1.00 17.60 C ATOM 1004 O ALA A 130 -1.725 12.052 1.293 1.00 18.72 O ATOM 1005 CB ALA A 130 0.903 11.447 -0.534 1.00 15.81 C ATOM 0 H ALA A 130 0.326 13.137 -2.214 1.00 15.91 H new ATOM 0 HA ALA A 130 -1.122 11.368 -1.045 1.00 17.00 H new ATOM 0 HB1 ALA A 130 0.855 10.815 0.200 1.00 15.81 H new ATOM 0 HB2 ALA A 130 1.201 10.989 -1.336 1.00 15.81 H new ATOM 0 HB3 ALA A 130 1.531 12.152 -0.312 1.00 15.81 H new ATOM 1006 N ASN A 131 -0.597 13.906 0.847 1.00 19.81 N ATOM 1007 CA ASN A 131 -1.041 14.553 2.091 1.00 21.23 C ATOM 1008 C ASN A 131 -2.552 14.847 2.053 1.00 20.99 C ATOM 1009 O ASN A 131 -3.270 14.644 3.050 1.00 21.60 O ATOM 1010 CB ASN A 131 -0.300 15.887 2.246 1.00 22.37 C ATOM 1011 CG ASN A 131 0.848 15.813 3.230 1.00 30.14 C ATOM 1012 OD1 ASN A 131 1.931 15.295 2.916 1.00 35.79 O ATOM 1013 ND2 ASN A 131 0.638 16.381 4.426 1.00 32.81 N ATOM 0 H ASN A 131 -0.063 14.377 0.364 1.00 19.81 H new ATOM 0 HA ASN A 131 -0.852 13.956 2.831 1.00 21.23 H new ATOM 0 HB2 ASN A 131 0.039 16.166 1.381 1.00 22.37 H new ATOM 0 HB3 ASN A 131 -0.927 16.568 2.538 1.00 22.37 H new ATOM 0 HD21 ASN A 131 1.268 16.396 5.011 1.00 32.81 H new ATOM 0 HD22 ASN A 131 -0.127 16.730 4.608 1.00 32.81 H new ATOM 1014 N VAL A 132 -3.003 15.389 0.910 1.00 21.24 N ATOM 1015 CA VAL A 132 -4.426 15.684 0.669 1.00 21.23 C ATOM 1016 C VAL A 132 -5.224 14.400 0.836 1.00 20.77 C ATOM 1017 O VAL A 132 -6.251 14.405 1.544 1.00 19.68 O ATOM 1018 CB VAL A 132 -4.673 16.353 -0.702 1.00 21.12 C ATOM 1019 CG1 VAL A 132 -6.195 16.344 -1.111 1.00 21.86 C ATOM 1020 CG2 VAL A 132 -4.131 17.788 -0.720 1.00 21.89 C ATOM 0 H VAL A 132 -2.490 15.596 0.252 1.00 21.24 H new ATOM 0 HA VAL A 132 -4.726 16.335 1.323 1.00 21.23 H new ATOM 0 HB VAL A 132 -4.191 15.824 -1.357 1.00 21.12 H new ATOM 0 HG11 VAL A 132 -6.301 16.773 -1.975 1.00 21.86 H new ATOM 0 HG12 VAL A 132 -6.511 15.428 -1.164 1.00 21.86 H new ATOM 0 HG13 VAL A 132 -6.712 16.826 -0.446 1.00 21.86 H new ATOM 0 HG21 VAL A 132 -4.297 18.186 -1.589 1.00 21.89 H new ATOM 0 HG22 VAL A 132 -4.576 18.311 -0.035 1.00 21.89 H new ATOM 0 HG23 VAL A 132 -3.176 17.776 -0.548 1.00 21.89 H new ATOM 1021 N SER A 133 -4.737 13.302 0.215 1.00 19.91 N ATOM 1022 CA SER A 133 -5.410 11.992 0.285 1.00 18.98 C ATOM 1023 C SER A 133 -5.601 11.520 1.721 1.00 19.86 C ATOM 1024 O SER A 133 -6.666 10.939 2.059 1.00 18.72 O ATOM 1025 CB SER A 133 -4.670 10.885 -0.535 1.00 19.34 C ATOM 1026 OG SER A 133 -4.625 11.225 -1.918 1.00 20.91 O ATOM 0 H SER A 133 -4.015 13.301 -0.252 1.00 19.91 H new ATOM 0 HA SER A 133 -6.282 12.132 -0.117 1.00 18.98 H new ATOM 0 HB2 SER A 133 -3.768 10.774 -0.196 1.00 19.34 H new ATOM 0 HB3 SER A 133 -5.123 10.035 -0.421 1.00 19.34 H new ATOM 0 HG SER A 133 -4.072 11.846 -2.036 1.00 20.91 H new ATOM 1027 N THR A 134 -4.564 11.723 2.553 1.00 19.59 N ATOM 1028 CA THR A 134 -4.573 11.242 3.957 1.00 20.66 C ATOM 1029 C THR A 134 -5.642 11.993 4.789 1.00 20.70 C ATOM 1030 O THR A 134 -6.409 11.376 5.543 1.00 21.76 O ATOM 1031 CB THR A 134 -3.153 11.334 4.621 1.00 21.11 C ATOM 1032 OG1 THR A 134 -2.265 10.465 3.909 1.00 22.83 O ATOM 1033 CG2 THR A 134 -3.161 10.887 6.076 1.00 22.97 C ATOM 0 H THR A 134 -3.845 12.137 2.327 1.00 19.59 H new ATOM 0 HA THR A 134 -4.812 10.302 3.942 1.00 20.66 H new ATOM 0 HB THR A 134 -2.873 12.262 4.586 1.00 21.11 H new ATOM 0 HG1 THR A 134 -1.995 10.849 3.212 1.00 22.83 H new ATOM 0 HG21 THR A 134 -2.266 10.961 6.442 1.00 22.97 H new ATOM 0 HG22 THR A 134 -3.766 11.450 6.584 1.00 22.97 H new ATOM 0 HG23 THR A 134 -3.457 9.965 6.130 1.00 22.97 H new ATOM 1034 N VAL A 135 -5.718 13.302 4.601 1.00 19.99 N ATOM 1035 CA VAL A 135 -6.787 14.084 5.162 1.00 20.12 C ATOM 1036 C VAL A 135 -8.192 13.610 4.754 1.00 19.66 C ATOM 1037 O VAL A 135 -9.058 13.456 5.634 1.00 20.53 O ATOM 1038 CB VAL A 135 -6.592 15.565 4.852 1.00 19.65 C ATOM 1039 CG1 VAL A 135 -7.806 16.360 5.423 1.00 21.75 C ATOM 1040 CG2 VAL A 135 -5.280 16.026 5.473 1.00 20.94 C ATOM 0 H VAL A 135 -5.148 13.755 4.144 1.00 19.99 H new ATOM 0 HA VAL A 135 -6.739 13.951 6.122 1.00 20.12 H new ATOM 0 HB VAL A 135 -6.548 15.720 3.895 1.00 19.65 H new ATOM 0 HG11 VAL A 135 -7.693 17.304 5.232 1.00 21.75 H new ATOM 0 HG12 VAL A 135 -8.624 16.042 5.010 1.00 21.75 H new ATOM 0 HG13 VAL A 135 -7.857 16.229 6.383 1.00 21.75 H new ATOM 0 HG21 VAL A 135 -5.145 16.967 5.282 1.00 20.94 H new ATOM 0 HG22 VAL A 135 -5.312 15.892 6.433 1.00 20.94 H new ATOM 0 HG23 VAL A 135 -4.547 15.512 5.099 1.00 20.94 H new ATOM 1041 N LEU A 136 -8.423 13.353 3.455 1.00 18.00 N ATOM 1042 CA LEU A 136 -9.766 13.046 2.975 1.00 18.87 C ATOM 1043 C LEU A 136 -10.212 11.595 3.302 1.00 19.69 C ATOM 1044 O LEU A 136 -11.406 11.280 3.253 1.00 20.19 O ATOM 1045 CB LEU A 136 -9.919 13.366 1.450 1.00 18.11 C ATOM 1046 CG LEU A 136 -10.376 14.745 0.934 1.00 18.13 C ATOM 1047 CD1 LEU A 136 -9.662 15.948 1.636 1.00 19.43 C ATOM 1048 CD2 LEU A 136 -10.278 14.885 -0.602 1.00 17.82 C ATOM 0 H LEU A 136 -7.816 13.353 2.846 1.00 18.00 H new ATOM 0 HA LEU A 136 -10.368 13.630 3.463 1.00 18.87 H new ATOM 0 HB2 LEU A 136 -9.057 13.189 1.042 1.00 18.11 H new ATOM 0 HB3 LEU A 136 -10.542 12.715 1.091 1.00 18.11 H new ATOM 0 HG LEU A 136 -11.314 14.786 1.176 1.00 18.13 H new ATOM 0 HD11 LEU A 136 -9.994 16.781 1.267 1.00 19.43 H new ATOM 0 HD12 LEU A 136 -9.844 15.922 2.588 1.00 19.43 H new ATOM 0 HD13 LEU A 136 -8.705 15.887 1.488 1.00 19.43 H new ATOM 0 HD21 LEU A 136 -10.577 15.769 -0.866 1.00 17.82 H new ATOM 0 HD22 LEU A 136 -9.357 14.759 -0.881 1.00 17.82 H new ATOM 0 HD23 LEU A 136 -10.838 14.215 -1.025 1.00 17.82 H new ATOM 1049 N THR A 137 -9.267 10.738 3.690 1.00 19.70 N ATOM 1050 CA THR A 137 -9.596 9.386 4.084 1.00 21.11 C ATOM 1051 C THR A 137 -9.584 9.206 5.585 1.00 22.08 C ATOM 1052 O THR A 137 -9.802 8.118 6.038 1.00 21.44 O ATOM 1053 CB THR A 137 -8.620 8.342 3.451 1.00 20.90 C ATOM 1054 OG1 THR A 137 -7.274 8.669 3.838 1.00 22.59 O ATOM 1055 CG2 THR A 137 -8.754 8.399 1.955 1.00 21.08 C ATOM 0 H THR A 137 -8.429 10.928 3.729 1.00 19.70 H new ATOM 0 HA THR A 137 -10.495 9.231 3.754 1.00 21.11 H new ATOM 0 HB THR A 137 -8.833 7.447 3.759 1.00 20.90 H new ATOM 0 HG1 THR A 137 -6.995 9.308 3.370 1.00 22.59 H new ATOM 0 HG21 THR A 137 -8.152 7.754 1.551 1.00 21.08 H new ATOM 0 HG22 THR A 137 -9.667 8.190 1.704 1.00 21.08 H new ATOM 0 HG23 THR A 137 -8.529 9.290 1.644 1.00 21.08 H new ATOM 1056 N SER A 138 -9.321 10.260 6.348 1.00 23.67 N ATOM 1057 CA SER A 138 -9.261 10.140 7.806 1.00 25.73 C ATOM 1058 C SER A 138 -10.466 10.743 8.529 1.00 27.75 C ATOM 1059 O SER A 138 -10.910 11.849 8.211 1.00 26.33 O ATOM 1060 CB SER A 138 -7.992 10.809 8.350 1.00 25.56 C ATOM 1061 OG SER A 138 -6.808 10.211 7.805 1.00 25.83 O ATOM 0 H SER A 138 -9.174 11.052 6.046 1.00 23.67 H new ATOM 0 HA SER A 138 -9.259 9.186 7.982 1.00 25.73 H new ATOM 0 HB2 SER A 138 -8.006 11.755 8.136 1.00 25.56 H new ATOM 0 HB3 SER A 138 -7.976 10.737 9.317 1.00 25.56 H new ATOM 0 HG SER A 138 -6.604 10.596 7.087 1.00 25.83 H new ATOM 1062 N LYS A 139 -10.950 10.020 9.532 1.00 29.13 N ATOM 1063 CA LYS A 139 -11.988 10.530 10.416 1.00 32.13 C ATOM 1064 C LYS A 139 -11.309 11.263 11.583 1.00 32.94 C ATOM 1065 O LYS A 139 -10.714 10.618 12.459 1.00 32.84 O ATOM 1066 CB LYS A 139 -12.887 9.386 10.936 1.00 32.33 C ATOM 1067 CG LYS A 139 -13.831 8.712 9.924 1.00 33.02 C ATOM 1068 CD LYS A 139 -14.928 7.932 10.692 1.00 34.01 C ATOM 1069 CE LYS A 139 -15.448 6.738 9.913 1.00 39.40 C ATOM 1070 NZ LYS A 139 -16.055 5.654 10.804 1.00 39.94 N ATOM 0 H LYS A 139 -10.687 9.223 9.718 1.00 29.13 H new ATOM 0 HA LYS A 139 -12.560 11.143 9.928 1.00 32.13 H new ATOM 0 HB2 LYS A 139 -12.313 8.701 11.313 1.00 32.33 H new ATOM 0 HB3 LYS A 139 -13.426 9.735 11.663 1.00 32.33 H new ATOM 0 HG2 LYS A 139 -14.236 9.380 9.349 1.00 33.02 H new ATOM 0 HG3 LYS A 139 -13.332 8.109 9.351 1.00 33.02 H new ATOM 0 HD2 LYS A 139 -14.570 7.629 11.541 1.00 34.01 H new ATOM 0 HD3 LYS A 139 -15.665 8.530 10.892 1.00 34.01 H new ATOM 0 HE2 LYS A 139 -16.118 7.040 9.279 1.00 39.40 H new ATOM 0 HE3 LYS A 139 -14.721 6.355 9.397 1.00 39.40 H new ATOM 0 HZ1 LYS A 139 -16.458 5.044 10.297 1.00 39.94 H new ATOM 0 HZ2 LYS A 139 -15.411 5.265 11.280 1.00 39.94 H new ATOM 0 HZ3 LYS A 139 -16.650 6.021 11.355 1.00 39.94 H new ATOM 1071 N TYR A 140 -11.352 12.601 11.587 1.00 33.84 N ATOM 1072 CA TYR A 140 -10.723 13.346 12.688 1.00 35.61 C ATOM 1073 C TYR A 140 -11.595 14.415 13.388 1.00 38.63 C ATOM 1074 O TYR A 140 -11.092 15.233 14.186 1.00 38.86 O ATOM 1075 CB TYR A 140 -9.404 13.966 12.239 1.00 34.15 C ATOM 1076 CG TYR A 140 -9.559 14.897 11.068 1.00 32.48 C ATOM 1077 CD1 TYR A 140 -9.589 14.386 9.749 1.00 31.53 C ATOM 1078 CD2 TYR A 140 -9.685 16.285 11.260 1.00 32.33 C ATOM 1079 CE1 TYR A 140 -9.749 15.215 8.657 1.00 28.24 C ATOM 1080 CE2 TYR A 140 -9.840 17.128 10.165 1.00 32.40 C ATOM 1081 CZ TYR A 140 -9.857 16.572 8.859 1.00 30.46 C ATOM 1082 OH TYR A 140 -10.017 17.373 7.775 1.00 28.79 O ATOM 0 H TYR A 140 -11.728 13.084 10.983 1.00 33.84 H new ATOM 0 HA TYR A 140 -10.578 12.668 13.366 1.00 35.61 H new ATOM 0 HB2 TYR A 140 -9.011 14.451 12.982 1.00 34.15 H new ATOM 0 HB3 TYR A 140 -8.784 13.258 12.003 1.00 34.15 H new ATOM 0 HD1 TYR A 140 -9.499 13.470 9.615 1.00 31.53 H new ATOM 0 HD2 TYR A 140 -9.665 16.639 12.120 1.00 32.33 H new ATOM 0 HE1 TYR A 140 -9.783 14.862 7.797 1.00 28.24 H new ATOM 0 HE2 TYR A 140 -9.931 18.045 10.287 1.00 32.40 H new ATOM 0 HH TYR A 140 -9.772 18.154 7.965 1.00 28.79 H new ATOM 1083 N ARG A 141 -12.885 14.438 13.083 1.00 41.54 N ATOM 1084 CA ARG A 141 -13.765 15.411 13.736 1.00 44.38 C ATOM 1085 C ARG A 141 -14.766 14.653 14.576 1.00 45.52 C ATOM 1086 O ARG A 141 -15.938 14.500 14.179 1.00 46.28 O ATOM 1087 CB ARG A 141 -14.462 16.333 12.720 1.00 45.31 C ATOM 1088 CG ARG A 141 -13.510 17.164 11.830 1.00 47.70 C ATOM 1089 CD ARG A 141 -12.811 18.307 12.587 1.00 50.18 C ATOM 1090 NE ARG A 141 -12.497 19.414 11.677 1.00 52.49 N ATOM 1091 CZ ARG A 141 -12.150 20.650 12.042 1.00 53.22 C ATOM 1092 NH1 ARG A 141 -12.058 20.987 13.326 1.00 53.67 N ATOM 1093 NH2 ARG A 141 -11.904 21.562 11.106 1.00 52.44 N ATOM 1094 OXT ARG A 141 -14.371 14.175 15.663 1.00 46.05 O ATOM 0 H ARG A 141 -13.268 13.916 12.517 1.00 41.54 H new ATOM 0 HA ARG A 141 -13.235 15.994 14.302 1.00 44.38 H new ATOM 0 HB2 ARG A 141 -15.028 15.792 12.147 1.00 45.31 H new ATOM 0 HB3 ARG A 141 -15.045 16.940 13.202 1.00 45.31 H new ATOM 0 HG2 ARG A 141 -12.837 16.577 11.451 1.00 47.70 H new ATOM 0 HG3 ARG A 141 -14.013 17.536 11.088 1.00 47.70 H new ATOM 0 HD2 ARG A 141 -13.382 18.624 13.304 1.00 50.18 H new ATOM 0 HD3 ARG A 141 -11.996 17.978 12.998 1.00 50.18 H new ATOM 0 HE ARG A 141 -12.540 19.252 10.833 1.00 52.49 H new ATOM 0 HH11 ARG A 141 -12.223 20.404 13.936 1.00 53.67 H new ATOM 0 HH12 ARG A 141 -11.833 21.788 13.545 1.00 53.67 H new ATOM 0 HH21 ARG A 141 -11.969 21.353 10.274 1.00 52.44 H new ATOM 0 HH22 ARG A 141 -11.680 22.361 11.332 1.00 52.44 H new TER 1095 ARG A 141 ATOM 1096 N VAL B 1 -1.812 -10.403 -20.155 1.00 41.21 N ATOM 1097 CA VAL B 1 -2.819 -9.308 -20.302 1.00 40.48 C ATOM 1098 C VAL B 1 -3.559 -9.429 -21.624 1.00 40.74 C ATOM 1099 O VAL B 1 -2.982 -9.786 -22.661 1.00 40.41 O ATOM 1100 CB VAL B 1 -2.197 -7.876 -20.180 1.00 40.54 C ATOM 1101 CG1 VAL B 1 -0.947 -7.899 -19.324 1.00 40.62 C ATOM 1102 CG2 VAL B 1 -1.873 -7.270 -21.543 1.00 39.38 C ATOM 0 H1 VAL B 1 -1.526 -10.432 -19.313 1.00 41.21 H new ATOM 0 H2 VAL B 1 -2.187 -11.182 -20.368 1.00 41.21 H new ATOM 0 H3 VAL B 1 -1.123 -10.248 -20.697 1.00 41.21 H new ATOM 0 HA VAL B 1 -3.440 -9.417 -19.565 1.00 40.48 H new ATOM 0 HB VAL B 1 -2.867 -7.318 -19.755 1.00 40.54 H new ATOM 0 HG11 VAL B 1 -0.580 -7.003 -19.263 1.00 40.62 H new ATOM 0 HG12 VAL B 1 -1.169 -8.219 -18.435 1.00 40.62 H new ATOM 0 HG13 VAL B 1 -0.291 -8.490 -19.725 1.00 40.62 H new ATOM 0 HG21 VAL B 1 -1.491 -6.387 -21.422 1.00 39.38 H new ATOM 0 HG22 VAL B 1 -1.236 -7.836 -22.006 1.00 39.38 H new ATOM 0 HG23 VAL B 1 -2.686 -7.201 -22.068 1.00 39.38 H new ATOM 1103 N HIS B 2 -4.841 -9.109 -21.595 1.00 40.60 N ATOM 1104 CA HIS B 2 -5.600 -9.206 -22.810 1.00 41.10 C ATOM 1105 C HIS B 2 -6.055 -7.855 -23.301 1.00 39.53 C ATOM 1106 O HIS B 2 -6.765 -7.102 -22.620 1.00 39.63 O ATOM 1107 CB HIS B 2 -6.720 -10.241 -22.687 1.00 42.39 C ATOM 1108 CG HIS B 2 -6.270 -11.631 -23.029 1.00 46.80 C ATOM 1109 ND1 HIS B 2 -5.925 -12.567 -22.069 1.00 50.22 N ATOM 1110 CD2 HIS B 2 -6.086 -12.237 -24.230 1.00 51.25 C ATOM 1111 CE1 HIS B 2 -5.560 -13.691 -22.665 1.00 52.18 C ATOM 1112 NE2 HIS B 2 -5.650 -13.519 -23.976 1.00 52.87 N ATOM 0 H HIS B 2 -5.274 -8.842 -20.902 1.00 40.60 H new ATOM 0 HA HIS B 2 -5.014 -9.539 -23.507 1.00 41.10 H new ATOM 0 HB2 HIS B 2 -7.065 -10.231 -21.780 1.00 42.39 H new ATOM 0 HB3 HIS B 2 -7.452 -9.990 -23.272 1.00 42.39 H new ATOM 0 HD2 HIS B 2 -6.228 -11.858 -25.067 1.00 51.25 H new ATOM 0 HE1 HIS B 2 -5.287 -14.470 -22.236 1.00 52.18 H new ATOM 0 HE2 HIS B 2 -5.466 -14.112 -24.572 1.00 52.87 H new ATOM 1113 N LEU B 3 -5.584 -7.550 -24.496 1.00 37.36 N ATOM 1114 CA LEU B 3 -5.855 -6.282 -25.108 1.00 35.53 C ATOM 1115 C LEU B 3 -6.645 -6.600 -26.365 1.00 34.84 C ATOM 1116 O LEU B 3 -6.317 -7.556 -27.068 1.00 34.71 O ATOM 1117 CB LEU B 3 -4.533 -5.607 -25.488 1.00 34.19 C ATOM 1118 CG LEU B 3 -3.521 -5.120 -24.449 1.00 32.22 C ATOM 1119 CD1 LEU B 3 -2.321 -4.600 -25.226 1.00 27.72 C ATOM 1120 CD2 LEU B 3 -4.084 -4.050 -23.502 1.00 27.34 C ATOM 0 H LEU B 3 -5.098 -8.078 -24.970 1.00 37.36 H new ATOM 0 HA LEU B 3 -6.340 -5.686 -24.516 1.00 35.53 H new ATOM 0 HB2 LEU B 3 -4.061 -6.229 -26.063 1.00 34.19 H new ATOM 0 HB3 LEU B 3 -4.763 -4.837 -26.032 1.00 34.19 H new ATOM 0 HG LEU B 3 -3.277 -5.855 -23.864 1.00 32.22 H new ATOM 0 HD11 LEU B 3 -1.648 -4.278 -24.606 1.00 27.72 H new ATOM 0 HD12 LEU B 3 -1.948 -5.316 -25.764 1.00 27.72 H new ATOM 0 HD13 LEU B 3 -2.600 -3.873 -25.805 1.00 27.72 H new ATOM 0 HD21 LEU B 3 -3.398 -3.784 -22.870 1.00 27.34 H new ATOM 0 HD22 LEU B 3 -4.366 -3.278 -24.017 1.00 27.34 H new ATOM 0 HD23 LEU B 3 -4.844 -4.412 -23.020 1.00 27.34 H new ATOM 1121 N SER B 4 -7.681 -5.819 -26.643 1.00 33.81 N ATOM 1122 CA SER B 4 -8.322 -5.877 -27.958 1.00 33.53 C ATOM 1123 C SER B 4 -7.305 -5.529 -29.087 1.00 33.88 C ATOM 1124 O SER B 4 -6.252 -4.892 -28.834 1.00 32.73 O ATOM 1125 CB SER B 4 -9.510 -4.918 -27.981 1.00 33.22 C ATOM 1126 OG SER B 4 -9.080 -3.586 -28.091 1.00 30.98 O ATOM 0 H SER B 4 -8.027 -5.254 -26.095 1.00 33.81 H new ATOM 0 HA SER B 4 -8.638 -6.780 -28.119 1.00 33.53 H new ATOM 0 HB2 SER B 4 -10.092 -5.136 -28.726 1.00 33.22 H new ATOM 0 HB3 SER B 4 -10.033 -5.027 -27.171 1.00 33.22 H new ATOM 0 HG SER B 4 -9.747 -3.076 -28.103 1.00 30.98 H new ATOM 1127 N SER B 5 -7.602 -5.915 -30.336 1.00 33.40 N ATOM 1128 CA SER B 5 -6.683 -5.555 -31.438 1.00 33.46 C ATOM 1129 C SER B 5 -6.523 -4.008 -31.611 1.00 32.61 C ATOM 1130 O SER B 5 -5.464 -3.533 -32.017 1.00 31.11 O ATOM 1131 CB SER B 5 -7.078 -6.236 -32.744 1.00 33.76 C ATOM 1132 OG SER B 5 -8.181 -5.554 -33.286 1.00 36.03 O ATOM 0 H SER B 5 -8.298 -6.366 -30.564 1.00 33.40 H new ATOM 0 HA SER B 5 -5.808 -5.891 -31.188 1.00 33.46 H new ATOM 0 HB2 SER B 5 -6.335 -6.225 -33.368 1.00 33.76 H new ATOM 0 HB3 SER B 5 -7.302 -7.166 -32.585 1.00 33.76 H new ATOM 0 HG SER B 5 -8.409 -5.918 -34.008 1.00 36.03 H new ATOM 1133 N GLU B 6 -7.571 -3.245 -31.292 1.00 32.12 N ATOM 1134 CA GLU B 6 -7.474 -1.789 -31.284 1.00 32.79 C ATOM 1135 C GLU B 6 -6.536 -1.242 -30.193 1.00 31.55 C ATOM 1136 O GLU B 6 -5.773 -0.320 -30.443 1.00 31.08 O ATOM 1137 CB GLU B 6 -8.854 -1.149 -31.140 1.00 34.17 C ATOM 1138 CG GLU B 6 -9.045 0.000 -32.120 1.00 38.90 C ATOM 1139 CD GLU B 6 -10.440 0.013 -32.743 1.00 46.16 C ATOM 1140 OE1 GLU B 6 -11.402 0.395 -32.018 1.00 49.22 O ATOM 1141 OE2 GLU B 6 -10.568 -0.347 -33.950 1.00 46.65 O ATOM 0 H GLU B 6 -8.345 -3.553 -31.078 1.00 32.12 H new ATOM 0 HA GLU B 6 -7.087 -1.549 -32.140 1.00 32.79 H new ATOM 0 HB2 GLU B 6 -9.539 -1.819 -31.289 1.00 34.17 H new ATOM 0 HB3 GLU B 6 -8.967 -0.824 -30.233 1.00 34.17 H new ATOM 0 HG2 GLU B 6 -8.891 0.841 -31.662 1.00 38.90 H new ATOM 0 HG3 GLU B 6 -8.381 -0.065 -32.824 1.00 38.90 H new ATOM 1142 N GLU B 7 -6.611 -1.808 -28.991 1.00 30.55 N ATOM 1143 CA GLU B 7 -5.680 -1.469 -27.912 1.00 29.95 C ATOM 1144 C GLU B 7 -4.230 -1.814 -28.278 1.00 29.11 C ATOM 1145 O GLU B 7 -3.333 -0.995 -28.103 1.00 27.30 O ATOM 1146 CB GLU B 7 -6.104 -2.160 -26.619 1.00 30.03 C ATOM 1147 CG GLU B 7 -7.379 -1.522 -25.970 1.00 30.31 C ATOM 1148 CD GLU B 7 -7.805 -2.219 -24.701 1.00 31.35 C ATOM 1149 OE1 GLU B 7 -7.772 -3.476 -24.662 1.00 30.87 O ATOM 1150 OE2 GLU B 7 -8.161 -1.503 -23.722 1.00 35.57 O ATOM 0 H GLU B 7 -7.200 -2.397 -28.777 1.00 30.55 H new ATOM 0 HA GLU B 7 -5.713 -0.509 -27.777 1.00 29.95 H new ATOM 0 HB2 GLU B 7 -6.275 -3.097 -26.801 1.00 30.03 H new ATOM 0 HB3 GLU B 7 -5.372 -2.123 -25.984 1.00 30.03 H new ATOM 0 HG2 GLU B 7 -7.205 -0.587 -25.777 1.00 30.31 H new ATOM 0 HG3 GLU B 7 -8.109 -1.549 -26.608 1.00 30.31 H new ATOM 1151 N LYS B 8 -4.011 -3.027 -28.784 1.00 28.37 N ATOM 1152 CA LYS B 8 -2.675 -3.478 -29.211 1.00 29.04 C ATOM 1153 C LYS B 8 -2.028 -2.558 -30.250 1.00 27.48 C ATOM 1154 O LYS B 8 -0.837 -2.265 -30.134 1.00 26.58 O ATOM 1155 CB LYS B 8 -2.671 -4.955 -29.701 1.00 29.70 C ATOM 1156 CG LYS B 8 -1.345 -5.662 -29.350 1.00 31.20 C ATOM 1157 CD LYS B 8 -1.063 -6.929 -30.175 1.00 33.58 C ATOM 1158 CE LYS B 8 0.398 -7.405 -29.954 1.00 36.45 C ATOM 1159 NZ LYS B 8 0.872 -8.321 -31.042 1.00 41.08 N ATOM 0 H LYS B 8 -4.629 -3.615 -28.891 1.00 28.37 H new ATOM 0 HA LYS B 8 -2.128 -3.430 -28.412 1.00 29.04 H new ATOM 0 HB2 LYS B 8 -3.411 -5.434 -29.297 1.00 29.70 H new ATOM 0 HB3 LYS B 8 -2.808 -4.979 -30.661 1.00 29.70 H new ATOM 0 HG2 LYS B 8 -0.614 -5.037 -29.477 1.00 31.20 H new ATOM 0 HG3 LYS B 8 -1.356 -5.898 -28.409 1.00 31.20 H new ATOM 0 HD2 LYS B 8 -1.681 -7.632 -29.920 1.00 33.58 H new ATOM 0 HD3 LYS B 8 -1.212 -6.749 -31.116 1.00 33.58 H new ATOM 0 HE2 LYS B 8 0.983 -6.633 -29.907 1.00 36.45 H new ATOM 0 HE3 LYS B 8 0.461 -7.861 -29.100 1.00 36.45 H new ATOM 0 HZ1 LYS B 8 1.711 -8.569 -30.877 1.00 41.08 H new ATOM 0 HZ2 LYS B 8 0.350 -9.041 -31.072 1.00 41.08 H new ATOM 0 HZ3 LYS B 8 0.837 -7.897 -31.824 1.00 41.08 H new ATOM 1160 N SER B 9 -2.800 -2.098 -31.249 1.00 26.52 N ATOM 1161 CA SER B 9 -2.279 -1.160 -32.273 1.00 26.56 C ATOM 1162 C SER B 9 -1.938 0.228 -31.716 1.00 25.36 C ATOM 1163 O SER B 9 -0.971 0.843 -32.144 1.00 24.79 O ATOM 1164 CB SER B 9 -3.278 -0.984 -33.434 1.00 27.44 C ATOM 1165 OG SER B 9 -3.745 -2.244 -33.852 1.00 31.36 O ATOM 0 H SER B 9 -3.626 -2.314 -31.354 1.00 26.52 H new ATOM 0 HA SER B 9 -1.458 -1.568 -32.590 1.00 26.56 H new ATOM 0 HB2 SER B 9 -4.023 -0.431 -33.151 1.00 27.44 H new ATOM 0 HB3 SER B 9 -2.850 -0.526 -34.174 1.00 27.44 H new ATOM 0 HG SER B 9 -4.299 -2.537 -33.293 1.00 31.36 H new ATOM 1166 N ALA B 10 -2.778 0.732 -30.817 1.00 23.77 N ATOM 1167 CA ALA B 10 -2.513 1.991 -30.117 1.00 23.81 C ATOM 1168 C ALA B 10 -1.213 1.866 -29.279 1.00 23.58 C ATOM 1169 O ALA B 10 -0.334 2.704 -29.372 1.00 23.28 O ATOM 1170 CB ALA B 10 -3.695 2.323 -29.200 1.00 23.51 C ATOM 0 H ALA B 10 -3.518 0.356 -30.594 1.00 23.77 H new ATOM 0 HA ALA B 10 -2.400 2.703 -30.767 1.00 23.81 H new ATOM 0 HB1 ALA B 10 -3.521 3.157 -28.736 1.00 23.51 H new ATOM 0 HB2 ALA B 10 -4.502 2.412 -29.731 1.00 23.51 H new ATOM 0 HB3 ALA B 10 -3.812 1.611 -28.552 1.00 23.51 H new ATOM 1171 N VAL B 11 -1.082 0.788 -28.509 1.00 22.37 N ATOM 1172 CA VAL B 11 0.121 0.557 -27.722 1.00 21.64 C ATOM 1173 C VAL B 11 1.406 0.471 -28.591 1.00 22.42 C ATOM 1174 O VAL B 11 2.414 1.180 -28.316 1.00 20.83 O ATOM 1175 CB VAL B 11 -0.123 -0.643 -26.821 1.00 22.99 C ATOM 1176 CG1 VAL B 11 1.152 -1.215 -26.266 1.00 20.69 C ATOM 1177 CG2 VAL B 11 -1.111 -0.228 -25.684 1.00 21.24 C ATOM 0 H VAL B 11 -1.682 0.177 -28.430 1.00 22.37 H new ATOM 0 HA VAL B 11 0.299 1.324 -27.155 1.00 21.64 H new ATOM 0 HB VAL B 11 -0.519 -1.352 -27.351 1.00 22.99 H new ATOM 0 HG11 VAL B 11 0.946 -1.975 -25.700 1.00 20.69 H new ATOM 0 HG12 VAL B 11 1.723 -1.501 -26.996 1.00 20.69 H new ATOM 0 HG13 VAL B 11 1.610 -0.538 -25.744 1.00 20.69 H new ATOM 0 HG21 VAL B 11 -1.273 -0.988 -25.103 1.00 21.24 H new ATOM 0 HG22 VAL B 11 -0.725 0.497 -25.168 1.00 21.24 H new ATOM 0 HG23 VAL B 11 -1.949 0.065 -26.074 1.00 21.24 H new ATOM 1178 N THR B 12 1.349 -0.318 -29.668 1.00 21.11 N ATOM 1179 CA THR B 12 2.552 -0.583 -30.430 1.00 22.64 C ATOM 1180 C THR B 12 2.920 0.633 -31.269 1.00 21.37 C ATOM 1181 O THR B 12 4.123 0.970 -31.414 1.00 20.52 O ATOM 1182 CB THR B 12 2.422 -1.823 -31.341 1.00 22.91 C ATOM 1183 OG1 THR B 12 1.316 -1.596 -32.196 1.00 28.57 O ATOM 1184 CG2 THR B 12 2.126 -3.067 -30.547 1.00 23.75 C ATOM 0 H THR B 12 0.636 -0.698 -29.963 1.00 21.11 H new ATOM 0 HA THR B 12 3.255 -0.769 -29.788 1.00 22.64 H new ATOM 0 HB THR B 12 3.256 -1.951 -31.820 1.00 22.91 H new ATOM 0 HG1 THR B 12 0.603 -1.740 -31.776 1.00 28.57 H new ATOM 0 HG21 THR B 12 2.051 -3.825 -31.148 1.00 23.75 H new ATOM 0 HG22 THR B 12 2.844 -3.226 -29.915 1.00 23.75 H new ATOM 0 HG23 THR B 12 1.292 -2.953 -30.066 1.00 23.75 H new ATOM 1185 N ALA B 13 1.896 1.305 -31.801 1.00 20.56 N ATOM 1186 CA ALA B 13 2.109 2.531 -32.554 1.00 21.05 C ATOM 1187 C ALA B 13 2.875 3.580 -31.761 1.00 20.29 C ATOM 1188 O ALA B 13 3.792 4.235 -32.288 1.00 20.73 O ATOM 1189 CB ALA B 13 0.792 3.100 -33.058 1.00 21.35 C ATOM 0 H ALA B 13 1.073 1.064 -31.734 1.00 20.56 H new ATOM 0 HA ALA B 13 2.658 2.293 -33.317 1.00 21.05 H new ATOM 0 HB1 ALA B 13 0.961 3.915 -33.556 1.00 21.35 H new ATOM 0 HB2 ALA B 13 0.360 2.452 -33.636 1.00 21.35 H new ATOM 0 HB3 ALA B 13 0.214 3.296 -32.304 1.00 21.35 H new ATOM 1190 N LEU B 14 2.519 3.737 -30.497 1.00 19.34 N ATOM 1191 CA LEU B 14 3.127 4.785 -29.689 1.00 18.68 C ATOM 1192 C LEU B 14 4.545 4.311 -29.294 1.00 18.98 C ATOM 1193 O LEU B 14 5.504 5.085 -29.321 1.00 16.19 O ATOM 1194 CB LEU B 14 2.302 5.013 -28.452 1.00 18.70 C ATOM 1195 CG LEU B 14 2.799 6.207 -27.643 1.00 20.56 C ATOM 1196 CD1 LEU B 14 2.294 7.490 -28.240 1.00 24.82 C ATOM 1197 CD2 LEU B 14 2.390 6.075 -26.217 1.00 21.33 C ATOM 0 H LEU B 14 1.935 3.255 -30.090 1.00 19.34 H new ATOM 0 HA LEU B 14 3.174 5.617 -30.186 1.00 18.68 H new ATOM 0 HB2 LEU B 14 1.376 5.157 -28.704 1.00 18.70 H new ATOM 0 HB3 LEU B 14 2.324 4.217 -27.898 1.00 18.70 H new ATOM 0 HG LEU B 14 3.768 6.225 -27.674 1.00 20.56 H new ATOM 0 HD11 LEU B 14 2.617 8.240 -27.716 1.00 24.82 H new ATOM 0 HD12 LEU B 14 2.614 7.571 -29.152 1.00 24.82 H new ATOM 0 HD13 LEU B 14 1.324 7.489 -28.238 1.00 24.82 H new ATOM 0 HD21 LEU B 14 2.712 6.840 -25.716 1.00 21.33 H new ATOM 0 HD22 LEU B 14 1.422 6.036 -26.160 1.00 21.33 H new ATOM 0 HD23 LEU B 14 2.768 5.263 -25.845 1.00 21.33 H new ATOM 1198 N TRP B 15 4.661 3.023 -28.977 1.00 18.15 N ATOM 1199 CA TRP B 15 5.919 2.478 -28.491 1.00 18.69 C ATOM 1200 C TRP B 15 6.975 2.585 -29.573 1.00 20.07 C ATOM 1201 O TRP B 15 8.137 2.789 -29.252 1.00 20.94 O ATOM 1202 CB TRP B 15 5.757 1.014 -28.088 1.00 19.39 C ATOM 1203 CG TRP B 15 6.922 0.546 -27.267 1.00 19.85 C ATOM 1204 CD1 TRP B 15 7.961 -0.269 -27.676 1.00 19.57 C ATOM 1205 CD2 TRP B 15 7.175 0.876 -25.897 1.00 17.90 C ATOM 1206 NE1 TRP B 15 8.842 -0.434 -26.643 1.00 22.07 N ATOM 1207 CE2 TRP B 15 8.383 0.235 -25.534 1.00 21.72 C ATOM 1208 CE3 TRP B 15 6.485 1.643 -24.932 1.00 21.00 C ATOM 1209 CZ2 TRP B 15 8.946 0.361 -24.245 1.00 23.96 C ATOM 1210 CZ3 TRP B 15 7.022 1.761 -23.643 1.00 21.87 C ATOM 1211 CH2 TRP B 15 8.247 1.122 -23.308 1.00 22.84 C ATOM 0 H TRP B 15 4.022 2.451 -29.037 1.00 18.15 H new ATOM 0 HA TRP B 15 6.191 2.988 -27.712 1.00 18.69 H new ATOM 0 HB2 TRP B 15 4.937 0.904 -27.582 1.00 19.39 H new ATOM 0 HB3 TRP B 15 5.676 0.464 -28.883 1.00 19.39 H new ATOM 0 HD1 TRP B 15 8.047 -0.646 -28.522 1.00 19.57 H new ATOM 0 HE1 TRP B 15 9.572 -0.887 -26.682 1.00 22.07 H new ATOM 0 HE3 TRP B 15 5.685 2.064 -25.149 1.00 21.00 H new ATOM 0 HZ2 TRP B 15 9.753 -0.048 -24.029 1.00 23.96 H new ATOM 0 HZ3 TRP B 15 6.573 2.262 -23.001 1.00 21.87 H new ATOM 0 HH2 TRP B 15 8.589 1.213 -22.448 1.00 22.84 H new ATOM 1212 N GLY B 16 6.571 2.458 -30.845 1.00 19.17 N ATOM 1213 CA GLY B 16 7.501 2.600 -31.972 1.00 21.18 C ATOM 1214 C GLY B 16 8.171 3.964 -32.006 1.00 21.95 C ATOM 1215 O GLY B 16 9.228 4.120 -32.630 1.00 23.39 O ATOM 0 H GLY B 16 5.760 2.289 -31.075 1.00 19.17 H new ATOM 0 HA2 GLY B 16 8.181 1.910 -31.915 1.00 21.18 H new ATOM 0 HA3 GLY B 16 7.021 2.458 -32.803 1.00 21.18 H new ATOM 1216 N LYS B 17 7.562 4.965 -31.358 1.00 20.20 N ATOM 1217 CA LYS B 17 8.065 6.318 -31.405 1.00 20.32 C ATOM 1218 C LYS B 17 8.997 6.619 -30.198 1.00 20.68 C ATOM 1219 O LYS B 17 9.630 7.670 -30.142 1.00 18.36 O ATOM 1220 CB LYS B 17 6.922 7.314 -31.436 1.00 19.99 C ATOM 1221 CG LYS B 17 5.916 7.155 -32.607 1.00 20.26 C ATOM 1222 CD LYS B 17 5.039 8.420 -32.632 1.00 18.17 C ATOM 1223 CE LYS B 17 4.295 8.577 -33.942 1.00 21.41 C ATOM 1224 NZ LYS B 17 3.015 9.332 -33.790 1.00 19.88 N ATOM 0 H LYS B 17 6.851 4.867 -30.885 1.00 20.20 H new ATOM 0 HA LYS B 17 8.584 6.407 -32.220 1.00 20.32 H new ATOM 0 HB2 LYS B 17 6.433 7.245 -30.601 1.00 19.99 H new ATOM 0 HB3 LYS B 17 7.296 8.208 -31.473 1.00 19.99 H new ATOM 0 HG2 LYS B 17 6.386 7.048 -33.449 1.00 20.26 H new ATOM 0 HG3 LYS B 17 5.370 6.363 -32.484 1.00 20.26 H new ATOM 0 HD2 LYS B 17 4.401 8.383 -31.902 1.00 18.17 H new ATOM 0 HD3 LYS B 17 5.596 9.200 -32.483 1.00 18.17 H new ATOM 0 HE2 LYS B 17 4.864 9.036 -34.580 1.00 21.41 H new ATOM 0 HE3 LYS B 17 4.107 7.700 -34.310 1.00 21.41 H new ATOM 0 HZ1 LYS B 17 2.456 9.103 -34.443 1.00 19.88 H new ATOM 0 HZ2 LYS B 17 2.647 9.138 -33.003 1.00 19.88 H new ATOM 0 HZ3 LYS B 17 3.179 10.206 -33.833 1.00 19.88 H new ATOM 1225 N VAL B 18 9.103 5.661 -29.289 1.00 21.46 N ATOM 1226 CA VAL B 18 9.837 5.887 -28.038 1.00 23.42 C ATOM 1227 C VAL B 18 11.348 5.935 -28.280 1.00 24.85 C ATOM 1228 O VAL B 18 11.923 5.046 -28.901 1.00 24.80 O ATOM 1229 CB VAL B 18 9.437 4.846 -26.955 1.00 23.03 C ATOM 1230 CG1 VAL B 18 10.403 4.814 -25.762 1.00 25.03 C ATOM 1231 CG2 VAL B 18 8.017 5.168 -26.442 1.00 21.39 C ATOM 0 H VAL B 18 8.762 4.876 -29.370 1.00 21.46 H new ATOM 0 HA VAL B 18 9.585 6.758 -27.693 1.00 23.42 H new ATOM 0 HB VAL B 18 9.471 3.972 -27.375 1.00 23.03 H new ATOM 0 HG11 VAL B 18 10.105 4.149 -25.122 1.00 25.03 H new ATOM 0 HG12 VAL B 18 11.293 4.586 -26.072 1.00 25.03 H new ATOM 0 HG13 VAL B 18 10.422 5.686 -25.337 1.00 25.03 H new ATOM 0 HG21 VAL B 18 7.763 4.521 -25.766 1.00 21.39 H new ATOM 0 HG22 VAL B 18 8.006 6.058 -26.057 1.00 21.39 H new ATOM 0 HG23 VAL B 18 7.389 5.127 -27.180 1.00 21.39 H new ATOM 1232 N ASN B 19 11.982 6.956 -27.718 1.00 26.11 N ATOM 1233 CA ASN B 19 13.414 7.047 -27.695 1.00 27.74 C ATOM 1234 C ASN B 19 13.939 6.133 -26.598 1.00 29.61 C ATOM 1235 O ASN B 19 13.981 6.492 -25.414 1.00 27.53 O ATOM 1236 CB ASN B 19 13.810 8.502 -27.445 1.00 29.59 C ATOM 1237 CG ASN B 19 15.326 8.729 -27.521 1.00 30.17 C ATOM 1238 OD1 ASN B 19 16.129 7.838 -27.230 1.00 32.00 O ATOM 1239 ND2 ASN B 19 15.706 9.941 -27.886 1.00 33.20 N ATOM 0 H ASN B 19 11.581 7.616 -27.339 1.00 26.11 H new ATOM 0 HA ASN B 19 13.797 6.767 -28.541 1.00 27.74 H new ATOM 0 HB2 ASN B 19 13.369 9.069 -28.097 1.00 29.59 H new ATOM 0 HB3 ASN B 19 13.490 8.774 -26.571 1.00 29.59 H new ATOM 0 HD21 ASN B 19 16.543 10.135 -27.928 1.00 33.20 H new ATOM 0 HD22 ASN B 19 15.116 10.536 -28.081 1.00 33.20 H new ATOM 1240 N VAL B 20 14.303 4.933 -27.030 1.00 31.10 N ATOM 1241 CA VAL B 20 14.823 3.870 -26.191 1.00 33.81 C ATOM 1242 C VAL B 20 16.163 4.262 -25.548 1.00 35.04 C ATOM 1243 O VAL B 20 16.565 3.693 -24.519 1.00 35.44 O ATOM 1244 CB VAL B 20 14.941 2.530 -27.020 1.00 34.13 C ATOM 1245 CG1 VAL B 20 14.682 2.758 -28.542 1.00 35.13 C ATOM 1246 CG2 VAL B 20 16.280 1.831 -26.798 1.00 36.52 C ATOM 0 H VAL B 20 14.250 4.708 -27.858 1.00 31.10 H new ATOM 0 HA VAL B 20 14.199 3.722 -25.464 1.00 33.81 H new ATOM 0 HB VAL B 20 14.245 1.943 -26.686 1.00 34.13 H new ATOM 0 HG11 VAL B 20 14.763 1.915 -29.014 1.00 35.13 H new ATOM 0 HG12 VAL B 20 13.789 3.114 -28.669 1.00 35.13 H new ATOM 0 HG13 VAL B 20 15.333 3.387 -28.890 1.00 35.13 H new ATOM 0 HG21 VAL B 20 16.311 1.016 -27.323 1.00 36.52 H new ATOM 0 HG22 VAL B 20 17.001 2.419 -27.072 1.00 36.52 H new ATOM 0 HG23 VAL B 20 16.380 1.613 -25.858 1.00 36.52 H new ATOM 1247 N GLU B 21 16.848 5.229 -26.157 1.00 35.81 N ATOM 1248 CA GLU B 21 17.991 5.874 -25.512 1.00 36.91 C ATOM 1249 C GLU B 21 17.664 6.631 -24.201 1.00 36.40 C ATOM 1250 O GLU B 21 18.460 6.600 -23.272 1.00 36.57 O ATOM 1251 CB GLU B 21 18.676 6.830 -26.517 1.00 38.05 C ATOM 1252 CG GLU B 21 20.228 6.836 -26.515 1.00 41.93 C ATOM 1253 CD GLU B 21 20.829 5.446 -26.287 1.00 46.88 C ATOM 1254 OE1 GLU B 21 21.610 5.298 -25.308 1.00 48.53 O ATOM 1255 OE2 GLU B 21 20.493 4.513 -27.066 1.00 46.28 O ATOM 0 H GLU B 21 16.667 5.526 -26.944 1.00 35.81 H new ATOM 0 HA GLU B 21 18.585 5.154 -25.248 1.00 36.91 H new ATOM 0 HB2 GLU B 21 18.374 6.600 -27.410 1.00 38.05 H new ATOM 0 HB3 GLU B 21 18.368 7.732 -26.337 1.00 38.05 H new ATOM 0 HG2 GLU B 21 20.547 7.186 -27.362 1.00 41.93 H new ATOM 0 HG3 GLU B 21 20.544 7.437 -25.822 1.00 41.93 H new ATOM 1256 N GLU B 22 16.524 7.329 -24.139 1.00 34.90 N ATOM 1257 CA GLU B 22 16.318 8.376 -23.127 1.00 33.76 C ATOM 1258 C GLU B 22 15.181 8.145 -22.150 1.00 31.62 C ATOM 1259 O GLU B 22 15.318 8.494 -20.975 1.00 31.29 O ATOM 1260 CB GLU B 22 16.094 9.760 -23.762 1.00 34.96 C ATOM 1261 CG GLU B 22 17.272 10.309 -24.614 1.00 41.20 C ATOM 1262 CD GLU B 22 18.538 10.587 -23.803 1.00 48.01 C ATOM 1263 OE1 GLU B 22 18.452 11.118 -22.651 1.00 51.51 O ATOM 1264 OE2 GLU B 22 19.627 10.280 -24.338 1.00 51.45 O ATOM 0 H GLU B 22 15.859 7.213 -24.672 1.00 34.90 H new ATOM 0 HA GLU B 22 17.147 8.338 -22.625 1.00 33.76 H new ATOM 0 HB2 GLU B 22 15.304 9.716 -24.323 1.00 34.96 H new ATOM 0 HB3 GLU B 22 15.905 10.396 -23.054 1.00 34.96 H new ATOM 0 HG2 GLU B 22 17.479 9.671 -25.314 1.00 41.20 H new ATOM 0 HG3 GLU B 22 16.991 11.128 -25.051 1.00 41.20 H new ATOM 1265 N VAL B 23 14.055 7.598 -22.626 1.00 28.02 N ATOM 1266 CA VAL B 23 12.856 7.410 -21.768 1.00 24.85 C ATOM 1267 C VAL B 23 13.171 6.525 -20.529 1.00 23.53 C ATOM 1268 O VAL B 23 12.752 6.839 -19.418 1.00 22.99 O ATOM 1269 CB VAL B 23 11.645 6.905 -22.597 1.00 25.25 C ATOM 1270 CG1 VAL B 23 10.422 6.600 -21.706 1.00 25.42 C ATOM 1271 CG2 VAL B 23 11.270 7.918 -23.665 1.00 24.32 C ATOM 0 H VAL B 23 13.958 7.328 -23.437 1.00 28.02 H new ATOM 0 HA VAL B 23 12.598 8.275 -21.414 1.00 24.85 H new ATOM 0 HB VAL B 23 11.915 6.076 -23.023 1.00 25.25 H new ATOM 0 HG11 VAL B 23 9.688 6.288 -22.259 1.00 25.42 H new ATOM 0 HG12 VAL B 23 10.654 5.914 -21.061 1.00 25.42 H new ATOM 0 HG13 VAL B 23 10.153 7.406 -21.238 1.00 25.42 H new ATOM 0 HG21 VAL B 23 10.513 7.587 -24.173 1.00 24.32 H new ATOM 0 HG22 VAL B 23 11.034 8.760 -23.244 1.00 24.32 H new ATOM 0 HG23 VAL B 23 12.023 8.055 -24.260 1.00 24.32 H new ATOM 1272 N GLY B 24 13.927 5.440 -20.715 1.00 21.50 N ATOM 1273 CA GLY B 24 14.337 4.587 -19.602 1.00 20.63 C ATOM 1274 C GLY B 24 15.064 5.364 -18.483 1.00 21.20 C ATOM 1275 O GLY B 24 14.692 5.265 -17.318 1.00 21.26 O ATOM 0 H GLY B 24 14.213 5.181 -21.484 1.00 21.50 H new ATOM 0 HA2 GLY B 24 13.555 4.151 -19.230 1.00 20.63 H new ATOM 0 HA3 GLY B 24 14.921 3.887 -19.935 1.00 20.63 H new ATOM 1276 N GLY B 25 16.060 6.174 -18.839 1.00 20.30 N ATOM 1277 CA GLY B 25 16.793 6.961 -17.858 1.00 19.59 C ATOM 1278 C GLY B 25 15.895 8.014 -17.189 1.00 18.93 C ATOM 1279 O GLY B 25 16.027 8.272 -15.984 1.00 17.75 O ATOM 0 H GLY B 25 16.326 6.280 -19.650 1.00 20.30 H new ATOM 0 HA2 GLY B 25 17.162 6.373 -17.181 1.00 19.59 H new ATOM 0 HA3 GLY B 25 17.542 7.401 -18.290 1.00 19.59 H new ATOM 1280 N GLU B 26 14.953 8.572 -17.946 1.00 17.78 N ATOM 1281 CA GLU B 26 13.979 9.498 -17.370 1.00 19.41 C ATOM 1282 C GLU B 26 13.029 8.811 -16.379 1.00 17.34 C ATOM 1283 O GLU B 26 12.783 9.345 -15.287 1.00 15.72 O ATOM 1284 CB GLU B 26 13.221 10.253 -18.472 1.00 21.24 C ATOM 1285 CG GLU B 26 13.620 11.766 -18.587 1.00 28.86 C ATOM 1286 CD GLU B 26 12.613 12.708 -17.874 1.00 37.13 C ATOM 1287 OE1 GLU B 26 12.965 13.276 -16.827 1.00 37.84 O ATOM 1288 OE2 GLU B 26 11.447 12.884 -18.354 1.00 42.85 O ATOM 0 H GLU B 26 14.860 8.430 -18.789 1.00 17.78 H new ATOM 0 HA GLU B 26 14.474 10.152 -16.853 1.00 19.41 H new ATOM 0 HB2 GLU B 26 13.385 9.818 -19.323 1.00 21.24 H new ATOM 0 HB3 GLU B 26 12.268 10.190 -18.300 1.00 21.24 H new ATOM 0 HG2 GLU B 26 14.502 11.894 -18.205 1.00 28.86 H new ATOM 0 HG3 GLU B 26 13.678 12.011 -19.524 1.00 28.86 H new ATOM 1289 N ALA B 27 12.525 7.616 -16.713 1.00 15.11 N ATOM 1290 CA ALA B 27 11.658 6.915 -15.790 1.00 14.73 C ATOM 1291 C ALA B 27 12.424 6.441 -14.532 1.00 16.31 C ATOM 1292 O ALA B 27 11.939 6.655 -13.407 1.00 15.14 O ATOM 1293 CB ALA B 27 10.921 5.748 -16.470 1.00 18.02 C ATOM 0 H ALA B 27 12.675 7.210 -17.456 1.00 15.11 H new ATOM 0 HA ALA B 27 10.985 7.550 -15.498 1.00 14.73 H new ATOM 0 HB1 ALA B 27 10.352 5.304 -15.823 1.00 18.02 H new ATOM 0 HB2 ALA B 27 10.378 6.088 -17.198 1.00 18.02 H new ATOM 0 HB3 ALA B 27 11.568 5.115 -16.819 1.00 18.02 H new ATOM 1294 N LEU B 28 13.610 5.814 -14.697 1.00 15.50 N ATOM 1295 CA LEU B 28 14.353 5.362 -13.506 1.00 16.09 C ATOM 1296 C LEU B 28 14.757 6.548 -12.621 1.00 15.64 C ATOM 1297 O LEU B 28 14.644 6.480 -11.379 1.00 16.20 O ATOM 1298 CB LEU B 28 15.622 4.595 -13.900 1.00 17.29 C ATOM 1299 CG LEU B 28 16.327 3.909 -12.715 1.00 19.13 C ATOM 1300 CD1 LEU B 28 15.404 2.859 -12.114 1.00 25.44 C ATOM 1301 CD2 LEU B 28 17.604 3.252 -13.206 1.00 22.96 C ATOM 0 H LEU B 28 13.984 5.649 -15.454 1.00 15.50 H new ATOM 0 HA LEU B 28 13.759 4.775 -13.012 1.00 16.09 H new ATOM 0 HB2 LEU B 28 15.392 3.924 -14.561 1.00 17.29 H new ATOM 0 HB3 LEU B 28 16.242 5.209 -14.323 1.00 17.29 H new ATOM 0 HG LEU B 28 16.544 4.568 -12.037 1.00 19.13 H new ATOM 0 HD11 LEU B 28 15.848 2.427 -11.368 1.00 25.44 H new ATOM 0 HD12 LEU B 28 14.589 3.284 -11.803 1.00 25.44 H new ATOM 0 HD13 LEU B 28 15.186 2.196 -12.788 1.00 25.44 H new ATOM 0 HD21 LEU B 28 18.052 2.818 -12.463 1.00 22.96 H new ATOM 0 HD22 LEU B 28 17.389 2.591 -13.883 1.00 22.96 H new ATOM 0 HD23 LEU B 28 18.189 3.926 -13.587 1.00 22.96 H new ATOM 1302 N GLY B 29 15.257 7.592 -13.278 1.00 14.62 N ATOM 1303 CA GLY B 29 15.664 8.813 -12.614 1.00 14.71 C ATOM 1304 C GLY B 29 14.548 9.400 -11.749 1.00 14.79 C ATOM 1305 O GLY B 29 14.791 9.728 -10.597 1.00 14.44 O ATOM 0 H GLY B 29 15.368 7.605 -14.131 1.00 14.62 H new ATOM 0 HA2 GLY B 29 16.440 8.635 -12.060 1.00 14.71 H new ATOM 0 HA3 GLY B 29 15.933 9.466 -13.279 1.00 14.71 H new ATOM 1306 N ARG B 30 13.348 9.575 -12.312 1.00 13.51 N ATOM 1307 CA ARG B 30 12.189 10.066 -11.530 1.00 14.41 C ATOM 1308 C ARG B 30 11.757 9.188 -10.389 1.00 14.45 C ATOM 1309 O ARG B 30 11.405 9.706 -9.331 1.00 16.29 O ATOM 1310 CB ARG B 30 10.994 10.371 -12.410 1.00 12.92 C ATOM 1311 CG ARG B 30 11.137 11.704 -13.098 1.00 12.33 C ATOM 1312 CD ARG B 30 10.022 11.918 -14.174 1.00 14.03 C ATOM 1313 NE ARG B 30 10.318 13.067 -15.037 1.00 17.15 N ATOM 1314 CZ ARG B 30 9.848 14.291 -14.879 1.00 14.16 C ATOM 1315 NH1 ARG B 30 9.073 14.596 -13.833 1.00 14.32 N ATOM 1316 NH2 ARG B 30 10.183 15.218 -15.741 1.00 12.14 N ATOM 0 H ARG B 30 13.178 9.418 -13.140 1.00 13.51 H new ATOM 0 HA ARG B 30 12.525 10.883 -11.130 1.00 14.41 H new ATOM 0 HB2 ARG B 30 10.894 9.672 -13.075 1.00 12.92 H new ATOM 0 HB3 ARG B 30 10.187 10.368 -11.873 1.00 12.92 H new ATOM 0 HG2 ARG B 30 11.093 12.415 -12.440 1.00 12.33 H new ATOM 0 HG3 ARG B 30 12.009 11.760 -13.519 1.00 12.33 H new ATOM 0 HD2 ARG B 30 9.937 11.118 -14.716 1.00 14.03 H new ATOM 0 HD3 ARG B 30 9.168 12.054 -13.734 1.00 14.03 H new ATOM 0 HE ARG B 30 10.844 12.932 -15.704 1.00 17.15 H new ATOM 0 HH11 ARG B 30 8.875 13.992 -13.254 1.00 14.32 H new ATOM 0 HH12 ARG B 30 8.772 15.396 -13.740 1.00 14.32 H new ATOM 0 HH21 ARG B 30 10.702 15.026 -16.399 1.00 12.14 H new ATOM 0 HH22 ARG B 30 9.884 16.019 -15.649 1.00 12.14 H new ATOM 1317 N LEU B 31 11.793 7.870 -10.592 1.00 15.09 N ATOM 1318 CA LEU B 31 11.497 6.904 -9.514 1.00 14.55 C ATOM 1319 C LEU B 31 12.398 7.196 -8.316 1.00 14.27 C ATOM 1320 O LEU B 31 11.924 7.253 -7.167 1.00 11.49 O ATOM 1321 CB LEU B 31 11.713 5.420 -10.005 1.00 14.77 C ATOM 1322 CG LEU B 31 11.543 4.311 -8.916 1.00 17.12 C ATOM 1323 CD1 LEU B 31 10.070 3.978 -8.600 1.00 16.84 C ATOM 1324 CD2 LEU B 31 12.299 3.007 -9.213 1.00 14.05 C ATOM 0 H LEU B 31 11.987 7.508 -11.348 1.00 15.09 H new ATOM 0 HA LEU B 31 10.567 7.000 -9.257 1.00 14.55 H new ATOM 0 HB2 LEU B 31 11.088 5.241 -10.725 1.00 14.77 H new ATOM 0 HB3 LEU B 31 12.605 5.348 -10.379 1.00 14.77 H new ATOM 0 HG LEU B 31 11.947 4.717 -8.133 1.00 17.12 H new ATOM 0 HD11 LEU B 31 10.033 3.287 -7.921 1.00 16.84 H new ATOM 0 HD12 LEU B 31 9.620 4.774 -8.276 1.00 16.84 H new ATOM 0 HD13 LEU B 31 9.629 3.664 -9.405 1.00 16.84 H new ATOM 0 HD21 LEU B 31 12.145 2.373 -8.496 1.00 14.05 H new ATOM 0 HD22 LEU B 31 11.982 2.632 -10.049 1.00 14.05 H new ATOM 0 HD23 LEU B 31 13.249 3.192 -9.282 1.00 14.05 H new ATOM 1325 N LEU B 32 13.687 7.430 -8.596 1.00 13.27 N ATOM 1326 CA LEU B 32 14.651 7.595 -7.498 1.00 14.05 C ATOM 1327 C LEU B 32 14.490 8.939 -6.789 1.00 14.31 C ATOM 1328 O LEU B 32 14.782 9.045 -5.612 1.00 14.34 O ATOM 1329 CB LEU B 32 16.100 7.436 -8.011 1.00 14.33 C ATOM 1330 CG LEU B 32 16.610 6.073 -8.557 1.00 16.61 C ATOM 1331 CD1 LEU B 32 17.939 6.309 -9.207 1.00 20.37 C ATOM 1332 CD2 LEU B 32 16.792 5.058 -7.544 1.00 18.69 C ATOM 0 H LEU B 32 14.016 7.495 -9.388 1.00 13.27 H new ATOM 0 HA LEU B 32 14.465 6.896 -6.851 1.00 14.05 H new ATOM 0 HB2 LEU B 32 16.225 8.090 -8.717 1.00 14.33 H new ATOM 0 HB3 LEU B 32 16.689 7.689 -7.283 1.00 14.33 H new ATOM 0 HG LEU B 32 15.933 5.744 -9.168 1.00 16.61 H new ATOM 0 HD11 LEU B 32 18.281 5.472 -9.558 1.00 20.37 H new ATOM 0 HD12 LEU B 32 17.836 6.945 -9.932 1.00 20.37 H new ATOM 0 HD13 LEU B 32 18.561 6.663 -8.553 1.00 20.37 H new ATOM 0 HD21 LEU B 32 17.110 4.241 -7.958 1.00 18.69 H new ATOM 0 HD22 LEU B 32 17.442 5.364 -6.892 1.00 18.69 H new ATOM 0 HD23 LEU B 32 15.946 4.888 -7.101 1.00 18.69 H new ATOM 1333 N VAL B 33 14.079 9.953 -7.541 1.00 15.48 N ATOM 1334 CA VAL B 33 13.804 11.288 -6.991 1.00 16.81 C ATOM 1335 C VAL B 33 12.472 11.313 -6.200 1.00 16.87 C ATOM 1336 O VAL B 33 12.440 11.744 -5.043 1.00 16.00 O ATOM 1337 CB VAL B 33 13.854 12.369 -8.126 1.00 15.99 C ATOM 1338 CG1 VAL B 33 13.342 13.730 -7.662 1.00 18.94 C ATOM 1339 CG2 VAL B 33 15.273 12.496 -8.683 1.00 17.74 C ATOM 0 H VAL B 33 13.949 9.892 -8.389 1.00 15.48 H new ATOM 0 HA VAL B 33 14.500 11.508 -6.353 1.00 16.81 H new ATOM 0 HB VAL B 33 13.259 12.066 -8.830 1.00 15.99 H new ATOM 0 HG11 VAL B 33 13.393 14.362 -8.396 1.00 18.94 H new ATOM 0 HG12 VAL B 33 12.421 13.647 -7.370 1.00 18.94 H new ATOM 0 HG13 VAL B 33 13.887 14.047 -6.925 1.00 18.94 H new ATOM 0 HG21 VAL B 33 15.287 13.167 -9.383 1.00 17.74 H new ATOM 0 HG22 VAL B 33 15.878 12.758 -7.972 1.00 17.74 H new ATOM 0 HG23 VAL B 33 15.555 11.643 -9.048 1.00 17.74 H new ATOM 1340 N VAL B 34 11.394 10.794 -6.810 1.00 16.40 N ATOM 1341 CA VAL B 34 10.044 10.850 -6.217 1.00 15.52 C ATOM 1342 C VAL B 34 9.811 9.876 -5.060 1.00 15.61 C ATOM 1343 O VAL B 34 9.024 10.149 -4.183 1.00 15.55 O ATOM 1344 CB VAL B 34 8.939 10.728 -7.362 1.00 14.98 C ATOM 1345 CG1 VAL B 34 7.501 10.829 -6.827 1.00 12.52 C ATOM 1346 CG2 VAL B 34 9.187 11.804 -8.397 1.00 16.01 C ATOM 0 H VAL B 34 11.424 10.402 -7.575 1.00 16.40 H new ATOM 0 HA VAL B 34 9.963 11.720 -5.796 1.00 15.52 H new ATOM 0 HB VAL B 34 9.021 9.846 -7.757 1.00 14.98 H new ATOM 0 HG11 VAL B 34 6.875 10.749 -7.564 1.00 12.52 H new ATOM 0 HG12 VAL B 34 7.342 10.116 -6.189 1.00 12.52 H new ATOM 0 HG13 VAL B 34 7.377 11.686 -6.390 1.00 12.52 H new ATOM 0 HG21 VAL B 34 8.520 11.739 -9.098 1.00 16.01 H new ATOM 0 HG22 VAL B 34 9.130 12.677 -7.977 1.00 16.01 H new ATOM 0 HG23 VAL B 34 10.071 11.687 -8.780 1.00 16.01 H new ATOM 1347 N TYR B 35 10.488 8.730 -5.074 1.00 15.91 N ATOM 1348 CA TYR B 35 10.327 7.667 -4.079 1.00 16.21 C ATOM 1349 C TYR B 35 11.730 7.341 -3.554 1.00 16.53 C ATOM 1350 O TYR B 35 12.363 6.329 -3.946 1.00 16.72 O ATOM 1351 CB TYR B 35 9.576 6.458 -4.690 1.00 15.90 C ATOM 1352 CG TYR B 35 8.259 6.854 -5.349 1.00 18.14 C ATOM 1353 CD1 TYR B 35 7.176 7.386 -4.598 1.00 18.54 C ATOM 1354 CD2 TYR B 35 8.112 6.775 -6.726 1.00 18.39 C ATOM 1355 CE1 TYR B 35 5.973 7.732 -5.240 1.00 18.44 C ATOM 1356 CE2 TYR B 35 6.921 7.157 -7.367 1.00 17.79 C ATOM 1357 CZ TYR B 35 5.873 7.596 -6.618 1.00 19.72 C ATOM 1358 OH TYR B 35 4.749 7.970 -7.274 1.00 19.49 O ATOM 0 H TYR B 35 11.070 8.543 -5.679 1.00 15.91 H new ATOM 0 HA TYR B 35 9.774 7.941 -3.331 1.00 16.21 H new ATOM 0 HB2 TYR B 35 10.145 6.027 -5.347 1.00 15.90 H new ATOM 0 HB3 TYR B 35 9.401 5.805 -3.994 1.00 15.90 H new ATOM 0 HD1 TYR B 35 7.263 7.506 -3.680 1.00 18.54 H new ATOM 0 HD2 TYR B 35 8.821 6.461 -7.239 1.00 18.39 H new ATOM 0 HE1 TYR B 35 5.252 8.049 -4.746 1.00 18.44 H new ATOM 0 HE2 TYR B 35 6.850 7.110 -8.293 1.00 17.79 H new ATOM 0 HH TYR B 35 4.455 8.684 -6.942 1.00 19.49 H new ATOM 1359 N PRO B 36 12.257 8.246 -2.710 1.00 16.43 N ATOM 1360 CA PRO B 36 13.703 8.279 -2.369 1.00 16.91 C ATOM 1361 C PRO B 36 14.207 7.041 -1.666 1.00 16.95 C ATOM 1362 O PRO B 36 15.402 6.782 -1.739 1.00 17.41 O ATOM 1363 CB PRO B 36 13.867 9.535 -1.449 1.00 16.82 C ATOM 1364 CG PRO B 36 12.511 10.245 -1.448 1.00 17.44 C ATOM 1365 CD PRO B 36 11.474 9.270 -1.984 1.00 17.41 C ATOM 0 HA PRO B 36 14.231 8.318 -3.182 1.00 16.91 H new ATOM 0 HB2 PRO B 36 14.122 9.275 -0.550 1.00 16.82 H new ATOM 0 HB3 PRO B 36 14.564 10.121 -1.784 1.00 16.82 H new ATOM 0 HG2 PRO B 36 12.277 10.530 -0.551 1.00 17.44 H new ATOM 0 HG3 PRO B 36 12.545 11.042 -1.999 1.00 17.44 H new ATOM 0 HD2 PRO B 36 10.958 8.874 -1.264 1.00 17.41 H new ATOM 0 HD3 PRO B 36 10.844 9.714 -2.573 1.00 17.41 H new ATOM 1366 N TRP B 37 13.324 6.235 -1.055 1.00 17.51 N ATOM 1367 CA TRP B 37 13.773 4.967 -0.478 1.00 17.15 C ATOM 1368 C TRP B 37 14.343 4.046 -1.534 1.00 17.92 C ATOM 1369 O TRP B 37 15.201 3.219 -1.206 1.00 18.64 O ATOM 1370 CB TRP B 37 12.708 4.204 0.336 1.00 17.51 C ATOM 1371 CG TRP B 37 11.466 3.889 -0.423 1.00 18.00 C ATOM 1372 CD1 TRP B 37 11.178 2.752 -1.104 1.00 15.86 C ATOM 1373 CD2 TRP B 37 10.354 4.771 -0.609 1.00 19.39 C ATOM 1374 NE1 TRP B 37 9.949 2.855 -1.685 1.00 16.28 N ATOM 1375 CE2 TRP B 37 9.425 4.095 -1.432 1.00 19.17 C ATOM 1376 CE3 TRP B 37 10.052 6.061 -0.150 1.00 18.00 C ATOM 1377 CZ2 TRP B 37 8.171 4.651 -1.781 1.00 18.94 C ATOM 1378 CZ3 TRP B 37 8.798 6.630 -0.501 1.00 20.24 C ATOM 1379 CH2 TRP B 37 7.896 5.937 -1.309 1.00 18.45 C ATOM 0 H TRP B 37 12.485 6.401 -0.968 1.00 17.51 H new ATOM 0 HA TRP B 37 14.463 5.231 0.150 1.00 17.15 H new ATOM 0 HB2 TRP B 37 13.096 3.376 0.660 1.00 17.51 H new ATOM 0 HB3 TRP B 37 12.473 4.731 1.116 1.00 17.51 H new ATOM 0 HD1 TRP B 37 11.737 2.011 -1.166 1.00 15.86 H new ATOM 0 HE1 TRP B 37 9.562 2.236 -2.140 1.00 16.28 H new ATOM 0 HE3 TRP B 37 10.659 6.534 0.373 1.00 18.00 H new ATOM 0 HZ2 TRP B 37 7.558 4.182 -2.300 1.00 18.94 H new ATOM 0 HZ3 TRP B 37 8.575 7.477 -0.188 1.00 20.24 H new ATOM 0 HH2 TRP B 37 7.091 6.342 -1.539 1.00 18.45 H new ATOM 1380 N THR B 38 13.878 4.158 -2.774 1.00 18.18 N ATOM 1381 CA THR B 38 14.384 3.266 -3.869 1.00 16.96 C ATOM 1382 C THR B 38 15.886 3.453 -4.144 1.00 18.06 C ATOM 1383 O THR B 38 16.547 2.534 -4.686 1.00 17.16 O ATOM 1384 CB THR B 38 13.566 3.357 -5.203 1.00 17.91 C ATOM 1385 OG1 THR B 38 13.652 4.672 -5.773 1.00 15.46 O ATOM 1386 CG2 THR B 38 12.077 2.980 -4.970 1.00 18.21 C ATOM 0 H THR B 38 13.281 4.726 -3.019 1.00 18.18 H new ATOM 0 HA THR B 38 14.248 2.370 -3.522 1.00 16.96 H new ATOM 0 HB THR B 38 13.954 2.723 -5.826 1.00 17.91 H new ATOM 0 HG1 THR B 38 13.288 5.226 -5.257 1.00 15.46 H new ATOM 0 HG21 THR B 38 11.592 3.044 -5.808 1.00 18.21 H new ATOM 0 HG22 THR B 38 12.022 2.072 -4.633 1.00 18.21 H new ATOM 0 HG23 THR B 38 11.686 3.589 -4.324 1.00 18.21 H new ATOM 1387 N GLN B 39 16.428 4.600 -3.726 1.00 17.51 N ATOM 1388 CA GLN B 39 17.874 4.869 -3.856 1.00 19.17 C ATOM 1389 C GLN B 39 18.718 3.823 -3.163 1.00 19.46 C ATOM 1390 O GLN B 39 19.873 3.605 -3.532 1.00 19.63 O ATOM 1391 CB GLN B 39 18.258 6.249 -3.260 1.00 18.13 C ATOM 1392 CG GLN B 39 17.674 7.419 -4.055 1.00 18.19 C ATOM 1393 CD GLN B 39 17.711 8.745 -3.300 1.00 21.47 C ATOM 1394 OE1 GLN B 39 18.572 8.821 -2.304 1.00 23.47 O flip ATOM 1395 NE2 GLN B 39 16.978 9.708 -3.634 1.00 23.09 N flip ATOM 0 H GLN B 39 15.980 5.238 -3.364 1.00 17.51 H new ATOM 0 HA GLN B 39 18.052 4.853 -4.809 1.00 19.17 H new ATOM 0 HB2 GLN B 39 17.947 6.299 -2.343 1.00 18.13 H new ATOM 0 HB3 GLN B 39 19.224 6.329 -3.236 1.00 18.13 H new ATOM 0 HG2 GLN B 39 18.166 7.514 -4.886 1.00 18.19 H new ATOM 0 HG3 GLN B 39 16.756 7.214 -4.291 1.00 18.19 H new ATOM 0 HE21 GLN B 39 16.428 9.622 -4.289 1.00 23.09 H new ATOM 0 HE22 GLN B 39 17.026 10.453 -3.208 1.00 23.09 H new ATOM 1396 N ARG B 40 18.144 3.187 -2.145 1.00 19.65 N ATOM 1397 CA ARG B 40 18.894 2.286 -1.315 1.00 21.13 C ATOM 1398 C ARG B 40 19.336 1.067 -2.166 1.00 20.59 C ATOM 1399 O ARG B 40 20.407 0.488 -1.908 1.00 19.81 O ATOM 1400 CB ARG B 40 18.054 1.825 -0.115 1.00 19.95 C ATOM 1401 CG ARG B 40 18.912 1.211 1.016 1.00 23.47 C ATOM 1402 CD ARG B 40 18.088 0.839 2.252 1.00 25.16 C ATOM 1403 NE ARG B 40 18.885 0.032 3.180 1.00 33.16 N ATOM 1404 CZ ARG B 40 18.979 -1.293 3.129 1.00 38.16 C ATOM 1405 NH1 ARG B 40 18.317 -1.978 2.190 1.00 38.30 N ATOM 1406 NH2 ARG B 40 19.745 -1.929 4.017 1.00 38.49 N ATOM 0 H ARG B 40 17.317 3.272 -1.927 1.00 19.65 H new ATOM 0 HA ARG B 40 19.677 2.744 -0.971 1.00 21.13 H new ATOM 0 HB2 ARG B 40 17.557 2.580 0.236 1.00 19.95 H new ATOM 0 HB3 ARG B 40 17.403 1.171 -0.413 1.00 19.95 H new ATOM 0 HG2 ARG B 40 19.361 0.419 0.682 1.00 23.47 H new ATOM 0 HG3 ARG B 40 19.603 1.842 1.271 1.00 23.47 H new ATOM 0 HD2 ARG B 40 17.782 1.645 2.697 1.00 25.16 H new ATOM 0 HD3 ARG B 40 17.297 0.345 1.983 1.00 25.16 H new ATOM 0 HE ARG B 40 19.320 0.442 3.798 1.00 33.16 H new ATOM 0 HH11 ARG B 40 17.829 -1.561 1.617 1.00 38.30 H new ATOM 0 HH12 ARG B 40 18.379 -2.835 2.159 1.00 38.30 H new ATOM 0 HH21 ARG B 40 20.172 -1.482 4.615 1.00 38.49 H new ATOM 0 HH22 ARG B 40 19.812 -2.786 3.992 1.00 38.49 H new ATOM 1407 N PHE B 41 18.539 0.738 -3.185 1.00 19.43 N ATOM 1408 CA PHE B 41 18.846 -0.430 -4.061 1.00 21.05 C ATOM 1409 C PHE B 41 20.005 -0.188 -5.051 1.00 20.62 C ATOM 1410 O PHE B 41 20.577 -1.142 -5.631 1.00 20.77 O ATOM 1411 CB PHE B 41 17.582 -0.844 -4.792 1.00 20.41 C ATOM 1412 CG PHE B 41 16.562 -1.464 -3.883 1.00 22.90 C ATOM 1413 CD1 PHE B 41 16.718 -2.781 -3.444 1.00 21.54 C ATOM 1414 CD2 PHE B 41 15.451 -0.736 -3.459 1.00 20.01 C ATOM 1415 CE1 PHE B 41 15.777 -3.358 -2.598 1.00 22.45 C ATOM 1416 CE2 PHE B 41 14.504 -1.313 -2.598 1.00 24.22 C ATOM 1417 CZ PHE B 41 14.695 -2.629 -2.152 1.00 21.54 C ATOM 0 H PHE B 41 17.822 1.164 -3.394 1.00 19.43 H new ATOM 0 HA PHE B 41 19.155 -1.147 -3.485 1.00 21.05 H new ATOM 0 HB2 PHE B 41 17.194 -0.067 -5.224 1.00 20.41 H new ATOM 0 HB3 PHE B 41 17.810 -1.474 -5.493 1.00 20.41 H new ATOM 0 HD1 PHE B 41 17.456 -3.275 -3.719 1.00 21.54 H new ATOM 0 HD2 PHE B 41 15.336 0.140 -3.749 1.00 20.01 H new ATOM 0 HE1 PHE B 41 15.878 -4.243 -2.331 1.00 22.45 H new ATOM 0 HE2 PHE B 41 13.758 -0.828 -2.326 1.00 24.22 H new ATOM 0 HZ PHE B 41 14.092 -3.010 -1.555 1.00 21.54 H new ATOM 1418 N PHE B 42 20.385 1.077 -5.182 1.00 21.07 N ATOM 1419 CA PHE B 42 21.237 1.527 -6.290 1.00 22.65 C ATOM 1420 C PHE B 42 22.415 2.321 -5.726 1.00 23.50 C ATOM 1421 O PHE B 42 23.002 3.161 -6.394 1.00 22.20 O ATOM 1422 CB PHE B 42 20.425 2.434 -7.254 1.00 22.04 C ATOM 1423 CG PHE B 42 19.330 1.710 -8.033 1.00 22.45 C ATOM 1424 CD1 PHE B 42 19.643 0.943 -9.160 1.00 21.76 C ATOM 1425 CD2 PHE B 42 17.985 1.829 -7.646 1.00 20.97 C ATOM 1426 CE1 PHE B 42 18.639 0.261 -9.859 1.00 20.32 C ATOM 1427 CE2 PHE B 42 16.969 1.184 -8.352 1.00 18.43 C ATOM 1428 CZ PHE B 42 17.300 0.403 -9.461 1.00 19.27 C ATOM 0 H PHE B 42 20.160 1.702 -4.635 1.00 21.07 H new ATOM 0 HA PHE B 42 21.560 0.753 -6.778 1.00 22.65 H new ATOM 0 HB2 PHE B 42 20.021 3.151 -6.741 1.00 22.04 H new ATOM 0 HB3 PHE B 42 21.036 2.846 -7.885 1.00 22.04 H new ATOM 0 HD1 PHE B 42 20.525 0.885 -9.448 1.00 21.76 H new ATOM 0 HD2 PHE B 42 17.768 2.348 -6.905 1.00 20.97 H new ATOM 0 HE1 PHE B 42 18.858 -0.282 -10.582 1.00 20.32 H new ATOM 0 HE2 PHE B 42 16.082 1.273 -8.087 1.00 18.43 H new ATOM 0 HZ PHE B 42 16.628 -0.027 -9.940 1.00 19.27 H new ATOM 1429 N GLU B 43 22.790 2.027 -4.491 1.00 26.15 N ATOM 1430 CA GLU B 43 23.863 2.762 -3.869 1.00 28.72 C ATOM 1431 C GLU B 43 25.184 2.590 -4.599 1.00 27.89 C ATOM 1432 O GLU B 43 25.980 3.477 -4.577 1.00 28.05 O ATOM 1433 CB GLU B 43 24.039 2.338 -2.422 1.00 30.04 C ATOM 1434 CG GLU B 43 22.913 2.728 -1.588 1.00 36.40 C ATOM 1435 CD GLU B 43 23.113 2.242 -0.193 1.00 42.79 C ATOM 1436 OE1 GLU B 43 24.145 1.562 0.050 1.00 43.45 O ATOM 1437 OE2 GLU B 43 22.248 2.565 0.651 1.00 45.39 O ATOM 0 H GLU B 43 22.438 1.412 -4.004 1.00 26.15 H new ATOM 0 HA GLU B 43 23.613 3.698 -3.912 1.00 28.72 H new ATOM 0 HB2 GLU B 43 24.150 1.375 -2.381 1.00 30.04 H new ATOM 0 HB3 GLU B 43 24.852 2.733 -2.069 1.00 30.04 H new ATOM 0 HG2 GLU B 43 22.819 3.693 -1.591 1.00 36.40 H new ATOM 0 HG3 GLU B 43 22.091 2.362 -1.951 1.00 36.40 H new ATOM 1438 N SER B 44 25.414 1.444 -5.233 1.00 27.84 N ATOM 1439 CA SER B 44 26.606 1.288 -6.049 1.00 28.11 C ATOM 1440 C SER B 44 26.710 2.289 -7.216 1.00 26.82 C ATOM 1441 O SER B 44 27.721 2.283 -7.918 1.00 27.30 O ATOM 1442 CB SER B 44 26.694 -0.141 -6.606 1.00 28.61 C ATOM 1443 OG SER B 44 25.591 -0.413 -7.455 1.00 29.82 O ATOM 0 H SER B 44 24.899 0.756 -5.203 1.00 27.84 H new ATOM 0 HA SER B 44 27.349 1.473 -5.453 1.00 28.11 H new ATOM 0 HB2 SER B 44 27.523 -0.252 -7.098 1.00 28.61 H new ATOM 0 HB3 SER B 44 26.711 -0.778 -5.875 1.00 28.61 H new ATOM 0 HG SER B 44 24.902 -0.533 -6.990 1.00 29.82 H new ATOM 1444 N PHE B 45 25.679 3.108 -7.472 1.00 24.90 N ATOM 1445 CA PHE B 45 25.713 4.012 -8.671 1.00 23.80 C ATOM 1446 C PHE B 45 26.404 5.345 -8.364 1.00 25.00 C ATOM 1447 O PHE B 45 26.658 6.154 -9.277 1.00 24.98 O ATOM 1448 CB PHE B 45 24.318 4.291 -9.225 1.00 21.93 C ATOM 1449 CG PHE B 45 23.727 3.166 -10.088 1.00 21.00 C ATOM 1450 CD1 PHE B 45 24.278 1.905 -10.128 1.00 21.30 C ATOM 1451 CD2 PHE B 45 22.566 3.390 -10.810 1.00 19.97 C ATOM 1452 CE1 PHE B 45 23.714 0.882 -10.941 1.00 22.52 C ATOM 1453 CE2 PHE B 45 21.986 2.355 -11.601 1.00 23.30 C ATOM 1454 CZ PHE B 45 22.554 1.124 -11.646 1.00 20.62 C ATOM 0 H PHE B 45 24.968 3.166 -6.991 1.00 24.90 H new ATOM 0 HA PHE B 45 26.226 3.536 -9.343 1.00 23.80 H new ATOM 0 HB2 PHE B 45 23.717 4.460 -8.482 1.00 21.93 H new ATOM 0 HB3 PHE B 45 24.351 5.103 -9.754 1.00 21.93 H new ATOM 0 HD1 PHE B 45 25.031 1.719 -9.615 1.00 21.30 H new ATOM 0 HD2 PHE B 45 22.160 4.226 -10.778 1.00 19.97 H new ATOM 0 HE1 PHE B 45 24.128 0.051 -10.997 1.00 22.52 H new ATOM 0 HE2 PHE B 45 21.213 2.525 -12.089 1.00 23.30 H new ATOM 0 HZ PHE B 45 22.163 0.447 -12.150 1.00 20.62 H new ATOM 1455 N GLY B 46 26.692 5.565 -7.081 1.00 26.76 N ATOM 1456 CA GLY B 46 27.320 6.793 -6.598 1.00 29.12 C ATOM 1457 C GLY B 46 26.351 7.719 -5.915 1.00 31.68 C ATOM 1458 O GLY B 46 25.366 7.279 -5.313 1.00 31.20 O ATOM 0 H GLY B 46 26.525 4.996 -6.458 1.00 26.76 H new ATOM 0 HA2 GLY B 46 28.032 6.565 -5.980 1.00 29.12 H new ATOM 0 HA3 GLY B 46 27.730 7.256 -7.345 1.00 29.12 H new ATOM 1459 N ASP B 47 26.616 9.017 -6.038 1.00 33.33 N ATOM 1460 CA ASP B 47 25.856 10.045 -5.308 1.00 34.90 C ATOM 1461 C ASP B 47 24.473 10.240 -5.969 1.00 33.67 C ATOM 1462 O ASP B 47 24.379 10.577 -7.144 1.00 33.77 O ATOM 1463 CB ASP B 47 26.685 11.341 -5.340 1.00 36.60 C ATOM 1464 CG ASP B 47 26.009 12.525 -4.649 1.00 40.95 C ATOM 1465 OD1 ASP B 47 25.565 12.397 -3.481 1.00 45.31 O ATOM 1466 OD2 ASP B 47 25.963 13.602 -5.304 1.00 46.79 O ATOM 0 H ASP B 47 27.237 9.331 -6.543 1.00 33.33 H new ATOM 0 HA ASP B 47 25.700 9.782 -4.388 1.00 34.90 H new ATOM 0 HB2 ASP B 47 27.542 11.177 -4.917 1.00 36.60 H new ATOM 0 HB3 ASP B 47 26.865 11.577 -6.264 1.00 36.60 H new ATOM 1467 N LEU B 48 23.424 9.942 -5.220 1.00 33.44 N ATOM 1468 CA LEU B 48 22.065 10.193 -5.640 1.00 33.75 C ATOM 1469 C LEU B 48 21.388 11.162 -4.656 1.00 34.75 C ATOM 1470 O LEU B 48 20.163 11.154 -4.496 1.00 33.55 O ATOM 1471 CB LEU B 48 21.293 8.887 -5.755 1.00 33.30 C ATOM 1472 CG LEU B 48 21.979 7.710 -6.481 1.00 30.53 C ATOM 1473 CD1 LEU B 48 21.343 6.400 -6.079 1.00 31.52 C ATOM 1474 CD2 LEU B 48 21.972 7.879 -7.962 1.00 25.12 C ATOM 0 H LEU B 48 23.486 9.582 -4.441 1.00 33.44 H new ATOM 0 HA LEU B 48 22.072 10.606 -6.518 1.00 33.75 H new ATOM 0 HB2 LEU B 48 21.067 8.594 -4.858 1.00 33.30 H new ATOM 0 HB3 LEU B 48 20.458 9.073 -6.211 1.00 33.30 H new ATOM 0 HG LEU B 48 22.909 7.701 -6.206 1.00 30.53 H new ATOM 0 HD11 LEU B 48 21.784 5.671 -6.542 1.00 31.52 H new ATOM 0 HD12 LEU B 48 21.434 6.276 -5.121 1.00 31.52 H new ATOM 0 HD13 LEU B 48 20.402 6.411 -6.315 1.00 31.52 H new ATOM 0 HD21 LEU B 48 22.411 7.120 -8.377 1.00 25.12 H new ATOM 0 HD22 LEU B 48 21.056 7.934 -8.277 1.00 25.12 H new ATOM 0 HD23 LEU B 48 22.444 8.693 -8.197 1.00 25.12 H new ATOM 1475 N SER B 49 22.200 12.049 -4.067 1.00 35.93 N ATOM 1476 CA SER B 49 21.743 12.941 -2.979 1.00 37.20 C ATOM 1477 C SER B 49 21.131 14.230 -3.500 1.00 37.32 C ATOM 1478 O SER B 49 21.022 15.218 -2.736 1.00 38.30 O ATOM 1479 CB SER B 49 22.910 13.345 -2.084 1.00 36.98 C ATOM 1480 OG SER B 49 23.674 14.344 -2.763 1.00 38.90 O ATOM 0 H SER B 49 23.026 12.153 -4.282 1.00 35.93 H new ATOM 0 HA SER B 49 21.076 12.434 -2.490 1.00 37.20 H new ATOM 0 HB2 SER B 49 22.583 13.687 -1.237 1.00 36.98 H new ATOM 0 HB3 SER B 49 23.464 12.575 -1.884 1.00 36.98 H new ATOM 0 HG SER B 49 24.359 13.993 -3.099 1.00 38.90 H new ATOM 1481 N SER B 50 20.791 14.263 -4.789 1.00 36.06 N ATOM 1482 CA SER B 50 19.972 15.353 -5.316 1.00 34.34 C ATOM 1483 C SER B 50 19.402 15.006 -6.679 1.00 33.27 C ATOM 1484 O SER B 50 19.864 14.063 -7.338 1.00 32.70 O ATOM 1485 CB SER B 50 20.747 16.665 -5.361 1.00 33.56 C ATOM 1486 OG SER B 50 21.422 16.817 -6.585 1.00 34.06 O ATOM 0 H SER B 50 21.022 13.671 -5.368 1.00 36.06 H new ATOM 0 HA SER B 50 19.227 15.475 -4.707 1.00 34.34 H new ATOM 0 HB2 SER B 50 20.137 17.408 -5.231 1.00 33.56 H new ATOM 0 HB3 SER B 50 21.386 16.691 -4.631 1.00 33.56 H new ATOM 0 HG SER B 50 21.839 17.546 -6.586 1.00 34.06 H new ATOM 1487 N ALA B 51 18.388 15.780 -7.073 1.00 32.59 N ATOM 1488 CA ALA B 51 17.712 15.620 -8.338 1.00 31.15 C ATOM 1489 C ALA B 51 18.686 15.739 -9.500 1.00 31.05 C ATOM 1490 O ALA B 51 18.677 14.883 -10.388 1.00 30.33 O ATOM 1491 CB ALA B 51 16.600 16.637 -8.467 1.00 31.71 C ATOM 0 H ALA B 51 18.075 16.423 -6.595 1.00 32.59 H new ATOM 0 HA ALA B 51 17.326 14.730 -8.366 1.00 31.15 H new ATOM 0 HB1 ALA B 51 16.152 16.521 -9.320 1.00 31.71 H new ATOM 0 HB2 ALA B 51 15.962 16.512 -7.748 1.00 31.71 H new ATOM 0 HB3 ALA B 51 16.972 17.531 -8.417 1.00 31.71 H new ATOM 1492 N ASN B 52 19.525 16.789 -9.486 1.00 29.84 N ATOM 1493 CA ASN B 52 20.528 16.997 -10.527 1.00 30.43 C ATOM 1494 C ASN B 52 21.525 15.820 -10.633 1.00 28.57 C ATOM 1495 O ASN B 52 21.810 15.378 -11.739 1.00 29.60 O ATOM 1496 CB ASN B 52 21.296 18.329 -10.333 1.00 31.76 C ATOM 1497 CG ASN B 52 22.219 18.679 -11.540 1.00 37.11 C ATOM 1498 OD1 ASN B 52 23.456 18.867 -11.394 1.00 42.44 O ATOM 1499 ND2 ASN B 52 21.620 18.779 -12.733 1.00 41.49 N ATOM 0 H ASN B 52 19.523 17.393 -8.874 1.00 29.84 H new ATOM 0 HA ASN B 52 20.036 17.045 -11.362 1.00 30.43 H new ATOM 0 HB2 ASN B 52 20.659 19.048 -10.200 1.00 31.76 H new ATOM 0 HB3 ASN B 52 21.833 18.273 -9.527 1.00 31.76 H new ATOM 0 HD21 ASN B 52 22.082 18.977 -13.431 1.00 41.49 H new ATOM 0 HD22 ASN B 52 20.773 18.645 -12.802 1.00 41.49 H new ATOM 1500 N ALA B 53 22.029 15.334 -9.504 1.00 26.43 N ATOM 1501 CA ALA B 53 22.972 14.216 -9.522 1.00 25.33 C ATOM 1502 C ALA B 53 22.322 12.916 -10.055 1.00 24.40 C ATOM 1503 O ALA B 53 22.960 12.182 -10.797 1.00 23.61 O ATOM 1504 CB ALA B 53 23.548 13.992 -8.165 1.00 25.62 C ATOM 0 H ALA B 53 21.841 15.634 -8.720 1.00 26.43 H new ATOM 0 HA ALA B 53 23.688 14.454 -10.132 1.00 25.33 H new ATOM 0 HB1 ALA B 53 24.170 13.248 -8.196 1.00 25.62 H new ATOM 0 HB2 ALA B 53 24.015 14.791 -7.875 1.00 25.62 H new ATOM 0 HB3 ALA B 53 22.834 13.790 -7.540 1.00 25.62 H new ATOM 1505 N VAL B 54 21.057 12.674 -9.701 1.00 22.67 N ATOM 1506 CA VAL B 54 20.343 11.505 -10.177 1.00 22.70 C ATOM 1507 C VAL B 54 20.188 11.525 -11.700 1.00 24.00 C ATOM 1508 O VAL B 54 20.616 10.589 -12.387 1.00 25.16 O ATOM 1509 CB VAL B 54 18.972 11.328 -9.511 1.00 21.63 C ATOM 1510 CG1 VAL B 54 18.221 10.133 -10.183 1.00 20.84 C ATOM 1511 CG2 VAL B 54 19.086 11.095 -8.019 1.00 20.18 C ATOM 0 H VAL B 54 20.598 13.183 -9.182 1.00 22.67 H new ATOM 0 HA VAL B 54 20.887 10.743 -9.925 1.00 22.70 H new ATOM 0 HB VAL B 54 18.472 12.150 -9.635 1.00 21.63 H new ATOM 0 HG11 VAL B 54 17.354 10.019 -9.764 1.00 20.84 H new ATOM 0 HG12 VAL B 54 18.101 10.316 -11.128 1.00 20.84 H new ATOM 0 HG13 VAL B 54 18.741 9.322 -10.075 1.00 20.84 H new ATOM 0 HG21 VAL B 54 18.200 10.989 -7.639 1.00 20.18 H new ATOM 0 HG22 VAL B 54 19.606 10.293 -7.855 1.00 20.18 H new ATOM 0 HG23 VAL B 54 19.526 11.854 -7.605 1.00 20.18 H new ATOM 1512 N MET B 55 19.622 12.617 -12.228 1.00 25.72 N ATOM 1513 CA MET B 55 19.254 12.733 -13.633 1.00 27.91 C ATOM 1514 C MET B 55 20.497 12.834 -14.536 1.00 29.95 C ATOM 1515 O MET B 55 20.456 12.409 -15.699 1.00 30.58 O ATOM 1516 CB MET B 55 18.300 13.935 -13.890 1.00 28.52 C ATOM 1517 CG MET B 55 17.026 13.910 -13.019 1.00 29.21 C ATOM 1518 SD MET B 55 16.095 12.360 -13.373 1.00 32.54 S ATOM 1519 CE MET B 55 14.604 12.598 -12.468 1.00 35.85 C ATOM 0 H MET B 55 19.441 13.320 -11.767 1.00 25.72 H new ATOM 0 HA MET B 55 18.775 11.921 -13.861 1.00 27.91 H new ATOM 0 HB2 MET B 55 18.781 14.761 -13.723 1.00 28.52 H new ATOM 0 HB3 MET B 55 18.043 13.940 -14.825 1.00 28.52 H new ATOM 0 HG2 MET B 55 17.261 13.953 -12.079 1.00 29.21 H new ATOM 0 HG3 MET B 55 16.474 14.684 -13.209 1.00 29.21 H new ATOM 0 HE1 MET B 55 14.419 11.809 -11.936 1.00 35.85 H new ATOM 0 HE2 MET B 55 14.699 13.366 -11.884 1.00 35.85 H new ATOM 0 HE3 MET B 55 13.871 12.750 -13.085 1.00 35.85 H new ATOM 1520 N ASN B 56 21.596 13.374 -14.016 1.00 29.78 N ATOM 1521 CA ASN B 56 22.834 13.370 -14.806 1.00 29.97 C ATOM 1522 C ASN B 56 23.749 12.135 -14.613 1.00 29.06 C ATOM 1523 O ASN B 56 24.759 11.997 -15.308 1.00 30.40 O ATOM 1524 CB ASN B 56 23.611 14.675 -14.624 1.00 30.03 C ATOM 1525 CG ASN B 56 24.255 14.782 -13.279 1.00 34.56 C ATOM 1526 OD1 ASN B 56 24.405 13.791 -12.575 1.00 41.61 O ATOM 1527 ND2 ASN B 56 24.676 16.002 -12.903 1.00 40.52 N ATOM 0 H ASN B 56 21.652 13.736 -13.238 1.00 29.78 H new ATOM 0 HA ASN B 56 22.533 13.301 -15.726 1.00 29.97 H new ATOM 0 HB2 ASN B 56 24.293 14.739 -15.311 1.00 30.03 H new ATOM 0 HB3 ASN B 56 23.009 15.425 -14.751 1.00 30.03 H new ATOM 0 HD21 ASN B 56 25.066 16.107 -12.144 1.00 40.52 H new ATOM 0 HD22 ASN B 56 24.555 16.677 -13.421 1.00 40.52 H new ATOM 1528 N ASN B 57 23.409 11.232 -13.696 1.00 27.48 N ATOM 1529 CA ASN B 57 24.248 10.054 -13.439 1.00 24.82 C ATOM 1530 C ASN B 57 24.268 9.039 -14.620 1.00 23.19 C ATOM 1531 O ASN B 57 23.253 8.483 -14.953 1.00 22.73 O ATOM 1532 CB ASN B 57 23.793 9.416 -12.102 1.00 23.74 C ATOM 1533 CG ASN B 57 24.669 8.246 -11.662 1.00 24.26 C ATOM 1534 OD1 ASN B 57 24.917 7.318 -12.432 1.00 24.11 O ATOM 1535 ND2 ASN B 57 25.116 8.267 -10.413 1.00 23.57 N ATOM 0 H ASN B 57 22.700 11.279 -13.212 1.00 27.48 H new ATOM 0 HA ASN B 57 25.172 10.338 -13.362 1.00 24.82 H new ATOM 0 HB2 ASN B 57 23.798 10.094 -11.409 1.00 23.74 H new ATOM 0 HB3 ASN B 57 22.877 9.110 -12.192 1.00 23.74 H new ATOM 0 HD21 ASN B 57 25.596 7.618 -10.117 1.00 23.57 H new ATOM 0 HD22 ASN B 57 24.926 8.930 -9.899 1.00 23.57 H new ATOM 1536 N PRO B 58 25.435 8.779 -15.259 1.00 22.84 N ATOM 1537 CA PRO B 58 25.361 7.882 -16.448 1.00 21.77 C ATOM 1538 C PRO B 58 24.895 6.438 -16.151 1.00 21.38 C ATOM 1539 O PRO B 58 24.414 5.753 -17.059 1.00 21.25 O ATOM 1540 CB PRO B 58 26.807 7.843 -16.935 1.00 21.23 C ATOM 1541 CG PRO B 58 27.599 8.089 -15.691 1.00 24.16 C ATOM 1542 CD PRO B 58 26.829 9.223 -15.023 1.00 21.86 C ATOM 0 HA PRO B 58 24.706 8.219 -17.079 1.00 21.77 H new ATOM 0 HB2 PRO B 58 27.026 6.987 -17.335 1.00 21.23 H new ATOM 0 HB3 PRO B 58 26.976 8.522 -17.607 1.00 21.23 H new ATOM 0 HG2 PRO B 58 27.640 7.300 -15.128 1.00 24.16 H new ATOM 0 HG3 PRO B 58 28.514 8.343 -15.890 1.00 24.16 H new ATOM 0 HD2 PRO B 58 27.036 9.303 -14.079 1.00 21.86 H new ATOM 0 HD3 PRO B 58 27.015 10.084 -15.428 1.00 21.86 H new ATOM 1543 N LYS B 59 25.082 5.959 -14.919 1.00 20.72 N ATOM 1544 CA LYS B 59 24.731 4.566 -14.601 1.00 21.73 C ATOM 1545 C LYS B 59 23.194 4.442 -14.510 1.00 20.62 C ATOM 1546 O LYS B 59 22.591 3.431 -14.904 1.00 19.19 O ATOM 1547 CB LYS B 59 25.432 4.086 -13.321 1.00 20.79 C ATOM 1548 CG LYS B 59 26.841 3.522 -13.583 1.00 24.39 C ATOM 1549 CD LYS B 59 27.492 2.877 -12.372 1.00 24.76 C ATOM 1550 CE LYS B 59 28.478 1.754 -12.760 1.00 31.71 C ATOM 1551 NZ LYS B 59 27.812 0.351 -12.743 1.00 34.38 N ATOM 0 H LYS B 59 25.404 6.412 -14.263 1.00 20.72 H new ATOM 0 HA LYS B 59 25.046 3.984 -15.311 1.00 21.73 H new ATOM 0 HB2 LYS B 59 25.496 4.825 -12.696 1.00 20.79 H new ATOM 0 HB3 LYS B 59 24.889 3.403 -12.897 1.00 20.79 H new ATOM 0 HG2 LYS B 59 26.788 2.866 -14.296 1.00 24.39 H new ATOM 0 HG3 LYS B 59 27.411 4.240 -13.900 1.00 24.39 H new ATOM 0 HD2 LYS B 59 27.963 3.555 -11.862 1.00 24.76 H new ATOM 0 HD3 LYS B 59 26.804 2.513 -11.793 1.00 24.76 H new ATOM 0 HE2 LYS B 59 28.833 1.930 -13.645 1.00 31.71 H new ATOM 0 HE3 LYS B 59 29.229 1.760 -12.147 1.00 31.71 H new ATOM 0 HZ1 LYS B 59 28.412 -0.265 -12.971 1.00 34.38 H new ATOM 0 HZ2 LYS B 59 27.505 0.178 -11.926 1.00 34.38 H new ATOM 0 HZ3 LYS B 59 27.136 0.336 -13.322 1.00 34.38 H new ATOM 1552 N VAL B 60 22.568 5.489 -14.008 1.00 19.59 N ATOM 1553 CA VAL B 60 21.115 5.610 -14.080 1.00 19.47 C ATOM 1554 C VAL B 60 20.588 5.545 -15.551 1.00 20.01 C ATOM 1555 O VAL B 60 19.626 4.842 -15.812 1.00 19.03 O ATOM 1556 CB VAL B 60 20.620 6.891 -13.356 1.00 18.84 C ATOM 1557 CG1 VAL B 60 19.107 7.122 -13.592 1.00 19.66 C ATOM 1558 CG2 VAL B 60 20.896 6.774 -11.864 1.00 18.90 C ATOM 0 H VAL B 60 22.963 6.146 -13.619 1.00 19.59 H new ATOM 0 HA VAL B 60 20.744 4.844 -13.615 1.00 19.47 H new ATOM 0 HB VAL B 60 21.101 7.650 -13.721 1.00 18.84 H new ATOM 0 HG11 VAL B 60 18.826 7.927 -13.129 1.00 19.66 H new ATOM 0 HG12 VAL B 60 18.939 7.221 -14.542 1.00 19.66 H new ATOM 0 HG13 VAL B 60 18.607 6.363 -13.253 1.00 19.66 H new ATOM 0 HG21 VAL B 60 20.586 7.575 -11.414 1.00 18.90 H new ATOM 0 HG22 VAL B 60 20.429 6.002 -11.508 1.00 18.90 H new ATOM 0 HG23 VAL B 60 21.849 6.670 -11.718 1.00 18.90 H new ATOM 1559 N LYS B 61 21.193 6.292 -16.480 1.00 20.94 N ATOM 1560 CA LYS B 61 20.782 6.274 -17.894 1.00 23.55 C ATOM 1561 C LYS B 61 21.011 4.881 -18.518 1.00 22.32 C ATOM 1562 O LYS B 61 20.097 4.331 -19.204 1.00 22.53 O ATOM 1563 CB LYS B 61 21.529 7.340 -18.751 1.00 23.16 C ATOM 1564 CG LYS B 61 21.258 8.798 -18.337 1.00 26.27 C ATOM 1565 CD LYS B 61 21.849 9.814 -19.358 1.00 27.14 C ATOM 1566 CE LYS B 61 21.348 11.274 -19.106 1.00 30.85 C ATOM 1567 NZ LYS B 61 21.726 11.778 -17.722 1.00 35.15 N ATOM 0 H LYS B 61 21.850 6.821 -16.312 1.00 20.94 H new ATOM 0 HA LYS B 61 19.836 6.489 -17.900 1.00 23.55 H new ATOM 0 HB2 LYS B 61 22.483 7.172 -18.696 1.00 23.16 H new ATOM 0 HB3 LYS B 61 21.275 7.227 -19.680 1.00 23.16 H new ATOM 0 HG2 LYS B 61 20.301 8.939 -18.259 1.00 26.27 H new ATOM 0 HG3 LYS B 61 21.641 8.961 -17.461 1.00 26.27 H new ATOM 0 HD2 LYS B 61 22.817 9.794 -19.307 1.00 27.14 H new ATOM 0 HD3 LYS B 61 21.607 9.543 -20.257 1.00 27.14 H new ATOM 0 HE2 LYS B 61 21.724 11.864 -19.778 1.00 30.85 H new ATOM 0 HE3 LYS B 61 20.384 11.306 -19.208 1.00 30.85 H new ATOM 0 HZ1 LYS B 61 20.988 11.914 -17.243 1.00 35.15 H new ATOM 0 HZ2 LYS B 61 22.236 11.173 -17.315 1.00 35.15 H new ATOM 0 HZ3 LYS B 61 22.175 12.543 -17.797 1.00 35.15 H new ATOM 1568 N ALA B 62 22.201 4.314 -18.271 1.00 21.76 N ATOM 1569 CA ALA B 62 22.524 2.959 -18.769 1.00 21.41 C ATOM 1570 C ALA B 62 21.556 1.922 -18.226 1.00 21.35 C ATOM 1571 O ALA B 62 21.042 1.115 -19.001 1.00 21.92 O ATOM 1572 CB ALA B 62 23.930 2.570 -18.467 1.00 22.24 C ATOM 0 H ALA B 62 22.831 4.690 -17.822 1.00 21.76 H new ATOM 0 HA ALA B 62 22.429 2.989 -19.734 1.00 21.41 H new ATOM 0 HB1 ALA B 62 24.100 1.678 -18.809 1.00 22.24 H new ATOM 0 HB2 ALA B 62 24.537 3.198 -18.888 1.00 22.24 H new ATOM 0 HB3 ALA B 62 24.070 2.580 -17.507 1.00 22.24 H new ATOM 1573 N HIS B 63 21.276 1.949 -16.919 1.00 20.94 N ATOM 1574 CA HIS B 63 20.254 1.054 -16.327 1.00 20.52 C ATOM 1575 C HIS B 63 18.827 1.239 -16.882 1.00 19.79 C ATOM 1576 O HIS B 63 18.149 0.263 -17.178 1.00 18.93 O ATOM 1577 CB HIS B 63 20.242 1.068 -14.793 1.00 21.17 C ATOM 1578 CG HIS B 63 19.517 -0.103 -14.217 1.00 23.07 C ATOM 1579 ND1 HIS B 63 20.026 -1.385 -14.278 1.00 24.01 N ATOM 1580 CD2 HIS B 63 18.261 -0.218 -13.715 1.00 20.24 C ATOM 1581 CE1 HIS B 63 19.138 -2.230 -13.779 1.00 24.23 C ATOM 1582 NE2 HIS B 63 18.060 -1.546 -13.428 1.00 22.21 N ATOM 0 H HIS B 63 21.660 2.473 -16.355 1.00 20.94 H new ATOM 0 HA HIS B 63 20.546 0.175 -16.615 1.00 20.52 H new ATOM 0 HB2 HIS B 63 21.155 1.073 -14.465 1.00 21.17 H new ATOM 0 HB3 HIS B 63 19.825 1.887 -14.483 1.00 21.17 H new ATOM 0 HD2 HIS B 63 17.651 0.473 -13.589 1.00 20.24 H new ATOM 0 HE1 HIS B 63 19.252 -3.149 -13.690 1.00 24.23 H new ATOM 0 HE2 HIS B 63 17.349 -1.879 -13.077 1.00 22.21 H new ATOM 1583 N GLY B 64 18.399 2.487 -17.059 1.00 21.18 N ATOM 1584 CA GLY B 64 17.061 2.803 -17.559 1.00 21.07 C ATOM 1585 C GLY B 64 16.813 2.204 -18.925 1.00 22.15 C ATOM 1586 O GLY B 64 15.710 1.753 -19.228 1.00 21.62 O ATOM 0 H GLY B 64 18.880 3.180 -16.891 1.00 21.18 H new ATOM 0 HA2 GLY B 64 16.396 2.471 -16.935 1.00 21.07 H new ATOM 0 HA3 GLY B 64 16.952 3.766 -17.604 1.00 21.07 H new ATOM 1587 N LYS B 65 17.844 2.213 -19.759 1.00 21.61 N ATOM 1588 CA LYS B 65 17.809 1.563 -21.050 1.00 24.19 C ATOM 1589 C LYS B 65 17.509 0.027 -20.945 1.00 23.22 C ATOM 1590 O LYS B 65 16.727 -0.534 -21.730 1.00 23.46 O ATOM 1591 CB LYS B 65 19.164 1.833 -21.734 1.00 23.86 C ATOM 1592 CG LYS B 65 19.173 1.607 -23.192 1.00 26.69 C ATOM 1593 CD LYS B 65 20.521 2.038 -23.832 1.00 28.28 C ATOM 1594 CE LYS B 65 20.501 1.644 -25.342 1.00 35.79 C ATOM 1595 NZ LYS B 65 19.967 0.220 -25.497 1.00 35.29 N ATOM 0 H LYS B 65 18.591 2.603 -19.585 1.00 21.61 H new ATOM 0 HA LYS B 65 17.081 1.926 -21.578 1.00 24.19 H new ATOM 0 HB2 LYS B 65 19.424 2.751 -21.560 1.00 23.86 H new ATOM 0 HB3 LYS B 65 19.837 1.266 -21.327 1.00 23.86 H new ATOM 0 HG2 LYS B 65 19.013 0.668 -23.375 1.00 26.69 H new ATOM 0 HG3 LYS B 65 18.447 2.103 -23.601 1.00 26.69 H new ATOM 0 HD2 LYS B 65 20.650 2.995 -23.735 1.00 28.28 H new ATOM 0 HD3 LYS B 65 21.262 1.605 -23.380 1.00 28.28 H new ATOM 0 HE2 LYS B 65 19.944 2.263 -25.839 1.00 35.79 H new ATOM 0 HE3 LYS B 65 21.395 1.706 -25.713 1.00 35.79 H new ATOM 0 HZ1 LYS B 65 20.278 -0.133 -26.252 1.00 35.29 H new ATOM 0 HZ2 LYS B 65 20.234 -0.274 -24.807 1.00 35.29 H new ATOM 0 HZ3 LYS B 65 19.078 0.237 -25.522 1.00 35.29 H new ATOM 1596 N LYS B 66 18.155 -0.638 -19.990 1.00 23.07 N ATOM 1597 CA LYS B 66 17.963 -2.068 -19.734 1.00 24.00 C ATOM 1598 C LYS B 66 16.533 -2.394 -19.250 1.00 22.41 C ATOM 1599 O LYS B 66 15.878 -3.328 -19.703 1.00 20.87 O ATOM 1600 CB LYS B 66 19.010 -2.529 -18.709 1.00 24.29 C ATOM 1601 CG LYS B 66 20.423 -2.741 -19.311 1.00 27.19 C ATOM 1602 CD LYS B 66 21.415 -3.152 -18.206 1.00 27.35 C ATOM 1603 CE LYS B 66 22.890 -3.096 -18.648 1.00 31.78 C ATOM 1604 NZ LYS B 66 23.818 -2.968 -17.426 1.00 35.85 N ATOM 0 H LYS B 66 18.726 -0.268 -19.464 1.00 23.07 H new ATOM 0 HA LYS B 66 18.080 -2.549 -20.568 1.00 24.00 H new ATOM 0 HB2 LYS B 66 19.066 -1.872 -17.998 1.00 24.29 H new ATOM 0 HB3 LYS B 66 18.712 -3.359 -18.305 1.00 24.29 H new ATOM 0 HG2 LYS B 66 20.390 -3.426 -19.997 1.00 27.19 H new ATOM 0 HG3 LYS B 66 20.725 -1.925 -19.739 1.00 27.19 H new ATOM 0 HD2 LYS B 66 21.293 -2.570 -17.440 1.00 27.35 H new ATOM 0 HD3 LYS B 66 21.207 -4.053 -17.914 1.00 27.35 H new ATOM 0 HE2 LYS B 66 23.114 -3.897 -19.148 1.00 31.78 H new ATOM 0 HE3 LYS B 66 23.026 -2.343 -19.244 1.00 31.78 H new ATOM 0 HZ1 LYS B 66 24.665 -2.937 -17.698 1.00 35.85 H new ATOM 0 HZ2 LYS B 66 23.622 -2.222 -16.981 1.00 35.85 H new ATOM 0 HZ3 LYS B 66 23.704 -3.670 -16.892 1.00 35.85 H new ATOM 1605 N VAL B 67 16.036 -1.596 -18.327 1.00 20.92 N ATOM 1606 CA VAL B 67 14.625 -1.706 -17.916 1.00 21.55 C ATOM 1607 C VAL B 67 13.658 -1.615 -19.115 1.00 22.01 C ATOM 1608 O VAL B 67 12.757 -2.470 -19.281 1.00 22.93 O ATOM 1609 CB VAL B 67 14.277 -0.639 -16.854 1.00 20.54 C ATOM 1610 CG1 VAL B 67 12.836 -0.786 -16.353 1.00 21.96 C ATOM 1611 CG2 VAL B 67 15.270 -0.724 -15.681 1.00 19.44 C ATOM 0 H VAL B 67 16.484 -0.984 -17.921 1.00 20.92 H new ATOM 0 HA VAL B 67 14.512 -2.585 -17.523 1.00 21.55 H new ATOM 0 HB VAL B 67 14.349 0.234 -17.271 1.00 20.54 H new ATOM 0 HG11 VAL B 67 12.652 -0.102 -15.690 1.00 21.96 H new ATOM 0 HG12 VAL B 67 12.223 -0.686 -17.098 1.00 21.96 H new ATOM 0 HG13 VAL B 67 12.720 -1.662 -15.954 1.00 21.96 H new ATOM 0 HG21 VAL B 67 15.046 -0.052 -15.018 1.00 19.44 H new ATOM 0 HG22 VAL B 67 15.220 -1.605 -15.278 1.00 19.44 H new ATOM 0 HG23 VAL B 67 16.170 -0.569 -16.007 1.00 19.44 H new ATOM 1612 N LEU B 68 13.851 -0.602 -19.951 1.00 22.52 N ATOM 1613 CA LEU B 68 12.958 -0.362 -21.079 1.00 23.36 C ATOM 1614 C LEU B 68 13.017 -1.486 -22.119 1.00 23.72 C ATOM 1615 O LEU B 68 11.997 -1.818 -22.726 1.00 22.94 O ATOM 1616 CB LEU B 68 13.317 0.927 -21.790 1.00 24.14 C ATOM 1617 CG LEU B 68 12.013 1.550 -22.283 1.00 27.43 C ATOM 1618 CD1 LEU B 68 11.454 2.435 -21.176 1.00 24.99 C ATOM 1619 CD2 LEU B 68 12.245 2.350 -23.522 1.00 32.53 C ATOM 0 H LEU B 68 14.497 -0.039 -19.882 1.00 22.52 H new ATOM 0 HA LEU B 68 12.065 -0.314 -20.702 1.00 23.36 H new ATOM 0 HB2 LEU B 68 13.780 1.532 -21.189 1.00 24.14 H new ATOM 0 HB3 LEU B 68 13.915 0.753 -22.533 1.00 24.14 H new ATOM 0 HG LEU B 68 11.378 0.850 -22.500 1.00 27.43 H new ATOM 0 HD11 LEU B 68 10.624 2.840 -21.473 1.00 24.99 H new ATOM 0 HD12 LEU B 68 11.287 1.898 -20.386 1.00 24.99 H new ATOM 0 HD13 LEU B 68 12.095 3.132 -20.964 1.00 24.99 H new ATOM 0 HD21 LEU B 68 11.407 2.737 -23.819 1.00 32.53 H new ATOM 0 HD22 LEU B 68 12.880 3.059 -23.335 1.00 32.53 H new ATOM 0 HD23 LEU B 68 12.599 1.774 -24.218 1.00 32.53 H new ATOM 1620 N ALA B 69 14.227 -1.990 -22.370 1.00 23.82 N ATOM 1621 CA ALA B 69 14.421 -3.141 -23.256 1.00 25.24 C ATOM 1622 C ALA B 69 13.635 -4.344 -22.767 1.00 25.44 C ATOM 1623 O ALA B 69 13.081 -5.098 -23.577 1.00 26.03 O ATOM 1624 CB ALA B 69 15.898 -3.468 -23.413 1.00 25.35 C ATOM 0 H ALA B 69 14.954 -1.677 -22.034 1.00 23.82 H new ATOM 0 HA ALA B 69 14.079 -2.905 -24.133 1.00 25.24 H new ATOM 0 HB1 ALA B 69 16.000 -4.232 -24.003 1.00 25.35 H new ATOM 0 HB2 ALA B 69 16.360 -2.704 -23.792 1.00 25.35 H new ATOM 0 HB3 ALA B 69 16.277 -3.677 -22.545 1.00 25.35 H new ATOM 1625 N ALA B 70 13.536 -4.489 -21.440 1.00 25.93 N ATOM 1626 CA ALA B 70 12.688 -5.521 -20.822 1.00 25.92 C ATOM 1627 C ALA B 70 11.208 -5.281 -21.035 1.00 26.56 C ATOM 1628 O ALA B 70 10.499 -6.238 -21.364 1.00 27.42 O ATOM 1629 CB ALA B 70 12.982 -5.686 -19.335 1.00 26.39 C ATOM 0 H ALA B 70 13.956 -3.995 -20.875 1.00 25.93 H new ATOM 0 HA ALA B 70 12.917 -6.346 -21.277 1.00 25.92 H new ATOM 0 HB1 ALA B 70 12.405 -6.372 -18.965 1.00 26.39 H new ATOM 0 HB2 ALA B 70 13.909 -5.944 -19.215 1.00 26.39 H new ATOM 0 HB3 ALA B 70 12.819 -4.846 -18.878 1.00 26.39 H new ATOM 1630 N PHE B 71 10.728 -4.040 -20.817 1.00 26.37 N ATOM 1631 CA PHE B 71 9.334 -3.664 -21.153 1.00 26.01 C ATOM 1632 C PHE B 71 9.014 -3.962 -22.626 1.00 26.34 C ATOM 1633 O PHE B 71 7.921 -4.422 -22.932 1.00 25.49 O ATOM 1634 CB PHE B 71 9.051 -2.168 -20.895 1.00 24.79 C ATOM 1635 CG PHE B 71 8.453 -1.871 -19.541 1.00 26.90 C ATOM 1636 CD1 PHE B 71 7.095 -2.079 -19.293 1.00 26.97 C ATOM 1637 CD2 PHE B 71 9.258 -1.370 -18.508 1.00 27.56 C ATOM 1638 CE1 PHE B 71 6.540 -1.772 -18.043 1.00 28.34 C ATOM 1639 CE2 PHE B 71 8.723 -1.075 -17.240 1.00 31.20 C ATOM 1640 CZ PHE B 71 7.347 -1.277 -17.000 1.00 29.16 C ATOM 0 H PHE B 71 11.193 -3.402 -20.476 1.00 26.37 H new ATOM 0 HA PHE B 71 8.770 -4.199 -20.573 1.00 26.01 H new ATOM 0 HB2 PHE B 71 9.880 -1.673 -20.986 1.00 24.79 H new ATOM 0 HB3 PHE B 71 8.449 -1.841 -21.581 1.00 24.79 H new ATOM 0 HD1 PHE B 71 6.553 -2.425 -19.965 1.00 26.97 H new ATOM 0 HD2 PHE B 71 10.164 -1.230 -18.664 1.00 27.56 H new ATOM 0 HE1 PHE B 71 5.629 -1.896 -17.901 1.00 28.34 H new ATOM 0 HE2 PHE B 71 9.273 -0.749 -16.565 1.00 31.20 H new ATOM 0 HZ PHE B 71 6.979 -1.087 -16.167 1.00 29.16 H new ATOM 1641 N SER B 72 9.950 -3.654 -23.527 1.00 26.68 N ATOM 1642 CA SER B 72 9.801 -3.969 -24.968 1.00 29.49 C ATOM 1643 C SER B 72 9.566 -5.447 -25.212 1.00 30.62 C ATOM 1644 O SER B 72 8.607 -5.848 -25.925 1.00 31.10 O ATOM 1645 CB SER B 72 11.039 -3.561 -25.778 1.00 29.22 C ATOM 1646 OG SER B 72 11.006 -2.196 -26.079 1.00 30.88 O ATOM 0 H SER B 72 10.688 -3.259 -23.329 1.00 26.68 H new ATOM 0 HA SER B 72 9.029 -3.459 -25.259 1.00 29.49 H new ATOM 0 HB2 SER B 72 11.842 -3.766 -25.275 1.00 29.22 H new ATOM 0 HB3 SER B 72 11.079 -4.077 -26.599 1.00 29.22 H new ATOM 0 HG SER B 72 10.798 -1.762 -25.391 1.00 30.88 H new ATOM 1647 N GLU B 73 10.452 -6.270 -24.645 1.00 31.63 N ATOM 1648 CA GLU B 73 10.285 -7.724 -24.731 1.00 32.31 C ATOM 1649 C GLU B 73 8.903 -8.179 -24.282 1.00 32.12 C ATOM 1650 O GLU B 73 8.248 -8.979 -24.973 1.00 32.87 O ATOM 1651 CB GLU B 73 11.379 -8.456 -23.933 1.00 33.15 C ATOM 1652 CG GLU B 73 12.598 -8.766 -24.757 1.00 38.66 C ATOM 1653 CD GLU B 73 12.291 -9.751 -25.891 1.00 45.49 C ATOM 1654 OE1 GLU B 73 12.182 -10.979 -25.595 1.00 49.29 O ATOM 1655 OE2 GLU B 73 12.141 -9.295 -27.064 1.00 45.83 O ATOM 0 H GLU B 73 11.148 -6.011 -24.211 1.00 31.63 H new ATOM 0 HA GLU B 73 10.374 -7.958 -25.668 1.00 32.31 H new ATOM 0 HB2 GLU B 73 11.638 -7.911 -23.174 1.00 33.15 H new ATOM 0 HB3 GLU B 73 11.016 -9.282 -23.578 1.00 33.15 H new ATOM 0 HG2 GLU B 73 12.952 -7.944 -25.131 1.00 38.66 H new ATOM 0 HG3 GLU B 73 13.288 -9.138 -24.185 1.00 38.66 H new ATOM 1656 N GLY B 74 8.461 -7.688 -23.123 1.00 32.15 N ATOM 1657 CA GLY B 74 7.111 -7.968 -22.630 1.00 32.71 C ATOM 1658 C GLY B 74 5.986 -7.653 -23.623 1.00 33.68 C ATOM 1659 O GLY B 74 4.984 -8.388 -23.691 1.00 33.41 O ATOM 0 H GLY B 74 8.931 -7.188 -22.605 1.00 32.15 H new ATOM 0 HA2 GLY B 74 7.057 -8.905 -22.386 1.00 32.71 H new ATOM 0 HA3 GLY B 74 6.963 -7.455 -21.820 1.00 32.71 H new ATOM 1660 N LEU B 75 6.155 -6.565 -24.394 1.00 33.67 N ATOM 1661 CA LEU B 75 5.170 -6.121 -25.376 1.00 33.77 C ATOM 1662 C LEU B 75 5.016 -7.128 -26.493 1.00 34.94 C ATOM 1663 O LEU B 75 3.945 -7.218 -27.080 1.00 34.41 O ATOM 1664 CB LEU B 75 5.530 -4.745 -25.955 1.00 33.81 C ATOM 1665 CG LEU B 75 5.314 -3.550 -25.005 1.00 34.08 C ATOM 1666 CD1 LEU B 75 5.821 -2.260 -25.586 1.00 28.22 C ATOM 1667 CD2 LEU B 75 3.809 -3.426 -24.663 1.00 34.18 C ATOM 0 H LEU B 75 6.854 -6.065 -24.355 1.00 33.67 H new ATOM 0 HA LEU B 75 4.323 -6.043 -24.911 1.00 33.77 H new ATOM 0 HB2 LEU B 75 6.461 -4.759 -26.226 1.00 33.81 H new ATOM 0 HB3 LEU B 75 5.003 -4.601 -26.757 1.00 33.81 H new ATOM 0 HG LEU B 75 5.825 -3.719 -24.198 1.00 34.08 H new ATOM 0 HD11 LEU B 75 5.665 -1.538 -24.957 1.00 28.22 H new ATOM 0 HD12 LEU B 75 6.772 -2.336 -25.762 1.00 28.22 H new ATOM 0 HD13 LEU B 75 5.354 -2.072 -26.415 1.00 28.22 H new ATOM 0 HD21 LEU B 75 3.674 -2.674 -24.065 1.00 34.18 H new ATOM 0 HD22 LEU B 75 3.302 -3.286 -25.478 1.00 34.18 H new ATOM 0 HD23 LEU B 75 3.507 -4.240 -24.231 1.00 34.18 H new ATOM 1668 N SER B 76 6.081 -7.873 -26.802 1.00 35.91 N ATOM 1669 CA SER B 76 6.026 -8.881 -27.879 1.00 37.50 C ATOM 1670 C SER B 76 5.455 -10.203 -27.371 1.00 37.92 C ATOM 1671 O SER B 76 5.322 -11.163 -28.132 1.00 38.60 O ATOM 1672 CB SER B 76 7.427 -9.115 -28.481 1.00 37.84 C ATOM 1673 OG SER B 76 7.912 -7.976 -29.191 1.00 39.66 O ATOM 0 H SER B 76 6.842 -7.814 -26.406 1.00 35.91 H new ATOM 0 HA SER B 76 5.438 -8.537 -28.570 1.00 37.50 H new ATOM 0 HB2 SER B 76 8.048 -9.338 -27.770 1.00 37.84 H new ATOM 0 HB3 SER B 76 7.395 -9.877 -29.080 1.00 37.84 H new ATOM 0 HG SER B 76 8.675 -8.143 -29.501 1.00 39.66 H new ATOM 1674 N HIS B 77 5.101 -10.239 -26.082 1.00 38.44 N ATOM 1675 CA HIS B 77 4.848 -11.490 -25.335 1.00 37.94 C ATOM 1676 C HIS B 77 3.771 -11.360 -24.261 1.00 37.61 C ATOM 1677 O HIS B 77 3.874 -11.947 -23.193 1.00 36.92 O ATOM 1678 CB HIS B 77 6.153 -11.979 -24.697 1.00 38.80 C ATOM 1679 CG HIS B 77 7.182 -12.416 -25.700 1.00 41.25 C ATOM 1680 ND1 HIS B 77 6.951 -13.430 -26.610 1.00 43.30 N ATOM 1681 CD2 HIS B 77 8.437 -11.966 -25.948 1.00 42.96 C ATOM 1682 CE1 HIS B 77 8.019 -13.587 -27.373 1.00 44.15 C ATOM 1683 NE2 HIS B 77 8.937 -12.714 -26.991 1.00 45.45 N ATOM 0 H HIS B 77 4.998 -9.530 -25.606 1.00 38.44 H new ATOM 0 HA HIS B 77 4.515 -12.133 -25.981 1.00 37.94 H new ATOM 0 HB2 HIS B 77 6.525 -11.268 -24.152 1.00 38.80 H new ATOM 0 HB3 HIS B 77 5.956 -12.720 -24.102 1.00 38.80 H new ATOM 0 HD2 HIS B 77 8.877 -11.281 -25.498 1.00 42.96 H new ATOM 0 HE1 HIS B 77 8.110 -14.206 -28.061 1.00 44.15 H new ATOM 0 HE2 HIS B 77 9.719 -12.628 -27.338 1.00 45.45 H new ATOM 1684 N LEU B 78 2.732 -10.591 -24.566 1.00 37.58 N ATOM 1685 CA LEU B 78 1.666 -10.267 -23.623 1.00 38.38 C ATOM 1686 C LEU B 78 0.869 -11.456 -23.121 1.00 38.91 C ATOM 1687 O LEU B 78 0.313 -11.430 -22.023 1.00 38.92 O ATOM 1688 CB LEU B 78 0.728 -9.223 -24.247 1.00 38.34 C ATOM 1689 CG LEU B 78 1.350 -7.845 -24.509 1.00 36.50 C ATOM 1690 CD1 LEU B 78 0.422 -7.011 -25.318 1.00 36.19 C ATOM 1691 CD2 LEU B 78 1.682 -7.116 -23.208 1.00 36.02 C ATOM 0 H LEU B 78 2.624 -10.236 -25.342 1.00 37.58 H new ATOM 0 HA LEU B 78 2.108 -9.911 -22.836 1.00 38.38 H new ATOM 0 HB2 LEU B 78 0.393 -9.574 -25.087 1.00 38.34 H new ATOM 0 HB3 LEU B 78 -0.037 -9.109 -23.662 1.00 38.34 H new ATOM 0 HG LEU B 78 2.177 -7.987 -24.996 1.00 36.50 H new ATOM 0 HD11 LEU B 78 0.823 -6.143 -25.478 1.00 36.19 H new ATOM 0 HD12 LEU B 78 0.249 -7.449 -26.166 1.00 36.19 H new ATOM 0 HD13 LEU B 78 -0.413 -6.897 -24.838 1.00 36.19 H new ATOM 0 HD21 LEU B 78 2.072 -6.252 -23.412 1.00 36.02 H new ATOM 0 HD22 LEU B 78 0.871 -6.990 -22.691 1.00 36.02 H new ATOM 0 HD23 LEU B 78 2.314 -7.642 -22.694 1.00 36.02 H new ATOM 1692 N ASP B 79 0.820 -12.517 -23.908 1.00 40.10 N ATOM 1693 CA ASP B 79 0.036 -13.686 -23.490 1.00 41.04 C ATOM 1694 C ASP B 79 0.888 -14.699 -22.711 1.00 40.65 C ATOM 1695 O ASP B 79 0.427 -15.794 -22.368 1.00 41.16 O ATOM 1696 CB ASP B 79 -0.675 -14.323 -24.698 1.00 42.45 C ATOM 1697 CG ASP B 79 0.248 -14.536 -25.885 1.00 45.32 C ATOM 1698 OD1 ASP B 79 1.481 -14.716 -25.681 1.00 49.51 O ATOM 1699 OD2 ASP B 79 -0.260 -14.513 -27.037 1.00 49.17 O ATOM 0 H ASP B 79 1.217 -12.589 -24.667 1.00 40.10 H new ATOM 0 HA ASP B 79 -0.650 -13.383 -22.875 1.00 41.04 H new ATOM 0 HB2 ASP B 79 -1.053 -15.176 -24.432 1.00 42.45 H new ATOM 0 HB3 ASP B 79 -1.415 -13.756 -24.967 1.00 42.45 H new ATOM 1700 N ASN B 80 2.137 -14.324 -22.441 1.00 39.62 N ATOM 1701 CA ASN B 80 3.022 -15.122 -21.601 1.00 38.94 C ATOM 1702 C ASN B 80 4.038 -14.263 -20.836 1.00 37.68 C ATOM 1703 O ASN B 80 5.256 -14.429 -21.000 1.00 37.54 O ATOM 1704 CB ASN B 80 3.736 -16.188 -22.444 1.00 39.11 C ATOM 1705 CG ASN B 80 4.515 -17.160 -21.594 1.00 41.09 C ATOM 1706 OD1 ASN B 80 4.190 -17.386 -20.418 1.00 43.40 O ATOM 1707 ND2 ASN B 80 5.579 -17.718 -22.167 1.00 44.44 N ATOM 0 H ASN B 80 2.493 -13.601 -22.740 1.00 39.62 H new ATOM 0 HA ASN B 80 2.469 -15.560 -20.935 1.00 38.94 H new ATOM 0 HB2 ASN B 80 3.082 -16.674 -22.970 1.00 39.11 H new ATOM 0 HB3 ASN B 80 4.337 -15.754 -23.069 1.00 39.11 H new ATOM 0 HD21 ASN B 80 6.074 -18.260 -21.719 1.00 44.44 H new ATOM 0 HD22 ASN B 80 5.772 -17.536 -22.985 1.00 44.44 H new ATOM 1708 N LEU B 81 3.542 -13.336 -20.010 1.00 36.61 N ATOM 1709 CA LEU B 81 4.437 -12.401 -19.306 1.00 35.13 C ATOM 1710 C LEU B 81 5.186 -13.120 -18.223 1.00 34.97 C ATOM 1711 O LEU B 81 6.356 -12.864 -18.004 1.00 35.00 O ATOM 1712 CB LEU B 81 3.689 -11.178 -18.756 1.00 34.60 C ATOM 1713 CG LEU B 81 3.202 -10.164 -19.798 1.00 32.75 C ATOM 1714 CD1 LEU B 81 2.475 -8.950 -19.159 1.00 30.10 C ATOM 1715 CD2 LEU B 81 4.355 -9.669 -20.617 1.00 28.34 C ATOM 0 H LEU B 81 2.705 -13.230 -19.844 1.00 36.61 H new ATOM 0 HA LEU B 81 5.076 -12.061 -19.952 1.00 35.13 H new ATOM 0 HB2 LEU B 81 2.922 -11.490 -18.251 1.00 34.60 H new ATOM 0 HB3 LEU B 81 4.272 -10.719 -18.131 1.00 34.60 H new ATOM 0 HG LEU B 81 2.563 -10.630 -20.360 1.00 32.75 H new ATOM 0 HD11 LEU B 81 2.188 -8.341 -19.857 1.00 30.10 H new ATOM 0 HD12 LEU B 81 1.701 -9.260 -18.663 1.00 30.10 H new ATOM 0 HD13 LEU B 81 3.081 -8.490 -18.558 1.00 30.10 H new ATOM 0 HD21 LEU B 81 4.036 -9.029 -21.272 1.00 28.34 H new ATOM 0 HD22 LEU B 81 5.004 -9.241 -20.037 1.00 28.34 H new ATOM 0 HD23 LEU B 81 4.773 -10.416 -21.073 1.00 28.34 H new ATOM 1716 N LYS B 82 4.517 -14.073 -17.584 1.00 36.11 N ATOM 1717 CA LYS B 82 5.116 -14.875 -16.510 1.00 36.99 C ATOM 1718 C LYS B 82 6.410 -15.617 -16.867 1.00 36.76 C ATOM 1719 O LYS B 82 7.337 -15.678 -16.048 1.00 36.64 O ATOM 1720 CB LYS B 82 4.093 -15.848 -15.919 1.00 38.11 C ATOM 1721 CG LYS B 82 3.312 -15.239 -14.750 1.00 40.16 C ATOM 1722 CD LYS B 82 2.049 -14.473 -15.232 1.00 44.58 C ATOM 1723 CE LYS B 82 1.324 -13.747 -14.073 1.00 43.08 C ATOM 1724 NZ LYS B 82 0.847 -14.721 -13.036 1.00 45.17 N ATOM 0 H LYS B 82 3.700 -14.277 -17.758 1.00 36.11 H new ATOM 0 HA LYS B 82 5.383 -14.218 -15.848 1.00 36.99 H new ATOM 0 HB2 LYS B 82 3.472 -16.120 -16.612 1.00 38.11 H new ATOM 0 HB3 LYS B 82 4.550 -16.649 -15.617 1.00 38.11 H new ATOM 0 HG2 LYS B 82 3.048 -15.943 -14.136 1.00 40.16 H new ATOM 0 HG3 LYS B 82 3.888 -14.634 -14.257 1.00 40.16 H new ATOM 0 HD2 LYS B 82 2.304 -13.825 -15.907 1.00 44.58 H new ATOM 0 HD3 LYS B 82 1.437 -15.096 -15.654 1.00 44.58 H new ATOM 0 HE2 LYS B 82 1.925 -13.104 -13.665 1.00 43.08 H new ATOM 0 HE3 LYS B 82 0.569 -13.248 -14.423 1.00 43.08 H new ATOM 0 HZ1 LYS B 82 0.372 -14.289 -12.419 1.00 45.17 H new ATOM 0 HZ2 LYS B 82 0.338 -15.340 -13.422 1.00 45.17 H new ATOM 0 HZ3 LYS B 82 1.548 -15.112 -12.651 1.00 45.17 H new ATOM 1725 N GLY B 83 6.481 -16.183 -18.067 1.00 36.20 N ATOM 1726 CA GLY B 83 7.661 -16.981 -18.447 1.00 35.56 C ATOM 1727 C GLY B 83 8.730 -16.091 -19.033 1.00 35.47 C ATOM 1728 O GLY B 83 9.920 -16.386 -18.900 1.00 35.25 O ATOM 0 H GLY B 83 5.872 -16.124 -18.672 1.00 36.20 H new ATOM 0 HA2 GLY B 83 8.009 -17.446 -17.670 1.00 35.56 H new ATOM 0 HA3 GLY B 83 7.406 -17.659 -19.092 1.00 35.56 H new ATOM 1729 N THR B 84 8.302 -14.991 -19.676 1.00 34.43 N ATOM 1730 CA THR B 84 9.222 -13.965 -20.164 1.00 34.14 C ATOM 1731 C THR B 84 9.999 -13.320 -19.001 1.00 33.53 C ATOM 1732 O THR B 84 11.221 -13.152 -19.097 1.00 33.46 O ATOM 1733 CB THR B 84 8.478 -12.857 -20.989 1.00 34.87 C ATOM 1734 OG1 THR B 84 7.671 -13.473 -22.001 1.00 35.16 O ATOM 1735 CG2 THR B 84 9.466 -11.883 -21.650 1.00 35.32 C ATOM 0 H THR B 84 7.474 -14.826 -19.837 1.00 34.43 H new ATOM 0 HA THR B 84 9.850 -14.409 -20.755 1.00 34.14 H new ATOM 0 HB THR B 84 7.921 -12.352 -20.376 1.00 34.87 H new ATOM 0 HG1 THR B 84 6.955 -13.748 -21.659 1.00 35.16 H new ATOM 0 HG21 THR B 84 8.974 -11.213 -22.150 1.00 35.32 H new ATOM 0 HG22 THR B 84 9.999 -11.448 -20.966 1.00 35.32 H new ATOM 0 HG23 THR B 84 10.049 -12.372 -22.251 1.00 35.32 H new ATOM 1736 N PHE B 85 9.299 -12.999 -17.910 1.00 31.93 N ATOM 1737 CA PHE B 85 9.921 -12.363 -16.759 1.00 31.83 C ATOM 1738 C PHE B 85 10.356 -13.269 -15.606 1.00 31.33 C ATOM 1739 O PHE B 85 10.689 -12.774 -14.530 1.00 31.37 O ATOM 1740 CB PHE B 85 9.008 -11.250 -16.217 1.00 31.60 C ATOM 1741 CG PHE B 85 8.858 -10.081 -17.154 1.00 32.94 C ATOM 1742 CD1 PHE B 85 9.808 -9.058 -17.162 1.00 34.11 C ATOM 1743 CD2 PHE B 85 7.771 -9.998 -18.025 1.00 33.44 C ATOM 1744 CE1 PHE B 85 9.678 -7.964 -18.018 1.00 36.88 C ATOM 1745 CE2 PHE B 85 7.633 -8.901 -18.900 1.00 35.05 C ATOM 1746 CZ PHE B 85 8.586 -7.881 -18.890 1.00 36.02 C ATOM 0 H PHE B 85 8.456 -13.145 -17.822 1.00 31.93 H new ATOM 0 HA PHE B 85 10.754 -12.017 -17.115 1.00 31.83 H new ATOM 0 HB2 PHE B 85 8.131 -11.622 -16.034 1.00 31.60 H new ATOM 0 HB3 PHE B 85 9.364 -10.933 -15.372 1.00 31.60 H new ATOM 0 HD1 PHE B 85 10.538 -9.107 -16.588 1.00 34.11 H new ATOM 0 HD2 PHE B 85 7.131 -10.673 -18.028 1.00 33.44 H new ATOM 0 HE1 PHE B 85 10.318 -7.289 -18.009 1.00 36.88 H new ATOM 0 HE2 PHE B 85 6.909 -8.857 -19.482 1.00 35.05 H new ATOM 0 HZ PHE B 85 8.496 -7.151 -19.459 1.00 36.02 H new ATOM 1747 N ALA B 86 10.376 -14.580 -15.815 1.00 31.46 N ATOM 1748 CA ALA B 86 10.762 -15.534 -14.761 1.00 30.24 C ATOM 1749 C ALA B 86 12.137 -15.276 -14.166 1.00 29.67 C ATOM 1750 O ALA B 86 12.267 -15.228 -12.952 1.00 29.76 O ATOM 1751 CB ALA B 86 10.675 -16.990 -15.291 1.00 30.77 C ATOM 0 H ALA B 86 10.169 -14.947 -16.564 1.00 31.46 H new ATOM 0 HA ALA B 86 10.127 -15.403 -14.040 1.00 30.24 H new ATOM 0 HB1 ALA B 86 10.932 -17.607 -14.587 1.00 30.77 H new ATOM 0 HB2 ALA B 86 9.766 -17.179 -15.570 1.00 30.77 H new ATOM 0 HB3 ALA B 86 11.273 -17.096 -16.047 1.00 30.77 H new ATOM 1752 N LYS B 87 13.152 -15.097 -15.013 1.00 29.69 N ATOM 1753 CA LYS B 87 14.508 -14.769 -14.557 1.00 30.19 C ATOM 1754 C LYS B 87 14.482 -13.454 -13.794 1.00 28.38 C ATOM 1755 O LYS B 87 15.132 -13.314 -12.767 1.00 27.28 O ATOM 1756 CB LYS B 87 15.496 -14.587 -15.734 1.00 30.72 C ATOM 1757 CG LYS B 87 16.401 -15.763 -16.124 1.00 35.18 C ATOM 1758 CD LYS B 87 17.185 -15.423 -17.437 1.00 33.94 C ATOM 1759 CE LYS B 87 17.119 -16.595 -18.486 1.00 40.61 C ATOM 1760 NZ LYS B 87 18.104 -16.409 -19.629 1.00 40.95 N ATOM 0 H LYS B 87 13.076 -15.162 -15.867 1.00 29.69 H new ATOM 0 HA LYS B 87 14.803 -15.508 -14.002 1.00 30.19 H new ATOM 0 HB2 LYS B 87 14.979 -14.341 -16.517 1.00 30.72 H new ATOM 0 HB3 LYS B 87 16.068 -13.832 -15.524 1.00 30.72 H new ATOM 0 HG2 LYS B 87 17.025 -15.953 -15.406 1.00 35.18 H new ATOM 0 HG3 LYS B 87 15.867 -16.562 -16.255 1.00 35.18 H new ATOM 0 HD2 LYS B 87 16.818 -14.616 -17.832 1.00 33.94 H new ATOM 0 HD3 LYS B 87 18.112 -15.237 -17.220 1.00 33.94 H new ATOM 0 HE2 LYS B 87 17.302 -17.436 -18.039 1.00 40.61 H new ATOM 0 HE3 LYS B 87 16.220 -16.654 -18.844 1.00 40.61 H new ATOM 0 HZ1 LYS B 87 18.033 -17.091 -20.196 1.00 40.95 H new ATOM 0 HZ2 LYS B 87 17.924 -15.649 -20.056 1.00 40.95 H new ATOM 0 HZ3 LYS B 87 18.932 -16.378 -19.305 1.00 40.95 H new ATOM 1761 N LEU B 88 13.764 -12.466 -14.313 1.00 27.17 N ATOM 1762 CA LEU B 88 13.765 -11.159 -13.626 1.00 26.24 C ATOM 1763 C LEU B 88 13.005 -11.178 -12.304 1.00 25.39 C ATOM 1764 O LEU B 88 13.345 -10.436 -11.423 1.00 24.26 O ATOM 1765 CB LEU B 88 13.222 -10.064 -14.540 1.00 26.27 C ATOM 1766 CG LEU B 88 14.090 -9.614 -15.701 1.00 27.98 C ATOM 1767 CD1 LEU B 88 13.313 -8.511 -16.451 1.00 29.79 C ATOM 1768 CD2 LEU B 88 15.404 -9.052 -15.148 1.00 27.62 C ATOM 0 H LEU B 88 13.287 -12.515 -15.027 1.00 27.17 H new ATOM 0 HA LEU B 88 14.691 -10.964 -13.412 1.00 26.24 H new ATOM 0 HB2 LEU B 88 12.376 -10.371 -14.902 1.00 26.27 H new ATOM 0 HB3 LEU B 88 13.031 -9.287 -13.992 1.00 26.27 H new ATOM 0 HG LEU B 88 14.294 -10.349 -16.300 1.00 27.98 H new ATOM 0 HD11 LEU B 88 13.840 -8.198 -17.203 1.00 29.79 H new ATOM 0 HD12 LEU B 88 12.471 -8.870 -16.773 1.00 29.79 H new ATOM 0 HD13 LEU B 88 13.139 -7.771 -15.849 1.00 29.79 H new ATOM 0 HD21 LEU B 88 15.967 -8.761 -15.883 1.00 27.62 H new ATOM 0 HD22 LEU B 88 15.215 -8.298 -14.568 1.00 27.62 H new ATOM 0 HD23 LEU B 88 15.863 -9.741 -14.643 1.00 27.62 H new ATOM 1769 N SER B 89 11.969 -12.023 -12.193 1.00 25.11 N ATOM 1770 CA SER B 89 11.187 -12.139 -10.967 1.00 26.22 C ATOM 1771 C SER B 89 12.037 -12.736 -9.835 1.00 27.36 C ATOM 1772 O SER B 89 12.050 -12.236 -8.685 1.00 26.62 O ATOM 1773 CB SER B 89 9.905 -12.950 -11.203 1.00 25.78 C ATOM 1774 OG SER B 89 9.187 -13.091 -9.997 1.00 26.23 O ATOM 0 H SER B 89 11.706 -12.540 -12.828 1.00 25.11 H new ATOM 0 HA SER B 89 10.917 -11.249 -10.693 1.00 26.22 H new ATOM 0 HB2 SER B 89 9.352 -12.508 -11.866 1.00 25.78 H new ATOM 0 HB3 SER B 89 10.129 -13.825 -11.558 1.00 25.78 H new ATOM 0 HG SER B 89 8.912 -12.338 -9.745 1.00 26.23 H new ATOM 1775 N GLU B 90 12.774 -13.790 -10.179 1.00 28.03 N ATOM 1776 CA GLU B 90 13.730 -14.421 -9.264 1.00 29.13 C ATOM 1777 C GLU B 90 14.851 -13.460 -8.797 1.00 28.08 C ATOM 1778 O GLU B 90 15.143 -13.341 -7.580 1.00 28.52 O ATOM 1779 CB GLU B 90 14.308 -15.650 -9.946 1.00 30.12 C ATOM 1780 CG GLU B 90 15.800 -15.818 -9.711 1.00 36.53 C ATOM 1781 CD GLU B 90 16.287 -17.238 -9.973 1.00 42.66 C ATOM 1782 OE1 GLU B 90 15.926 -17.826 -11.036 1.00 45.27 O ATOM 1783 OE2 GLU B 90 17.033 -17.744 -9.104 1.00 45.04 O ATOM 0 H GLU B 90 12.735 -14.163 -10.953 1.00 28.03 H new ATOM 0 HA GLU B 90 13.257 -14.675 -8.456 1.00 29.13 H new ATOM 0 HB2 GLU B 90 13.845 -16.439 -9.624 1.00 30.12 H new ATOM 0 HB3 GLU B 90 14.141 -15.592 -10.900 1.00 30.12 H new ATOM 0 HG2 GLU B 90 16.284 -15.204 -10.285 1.00 36.53 H new ATOM 0 HG3 GLU B 90 16.008 -15.574 -8.796 1.00 36.53 H new ATOM 1784 N LEU B 91 15.479 -12.769 -9.736 1.00 26.58 N ATOM 1785 CA LEU B 91 16.454 -11.743 -9.339 1.00 27.22 C ATOM 1786 C LEU B 91 15.861 -10.680 -8.376 1.00 27.06 C ATOM 1787 O LEU B 91 16.488 -10.369 -7.331 1.00 25.50 O ATOM 1788 CB LEU B 91 17.083 -11.038 -10.564 1.00 27.58 C ATOM 1789 CG LEU B 91 17.781 -9.685 -10.291 1.00 27.52 C ATOM 1790 CD1 LEU B 91 19.092 -9.873 -9.553 1.00 29.85 C ATOM 1791 CD2 LEU B 91 17.983 -8.947 -11.587 1.00 27.06 C ATOM 0 H LEU B 91 15.367 -12.867 -10.583 1.00 26.58 H new ATOM 0 HA LEU B 91 17.147 -12.223 -8.860 1.00 27.22 H new ATOM 0 HB2 LEU B 91 17.731 -11.640 -10.963 1.00 27.58 H new ATOM 0 HB3 LEU B 91 16.386 -10.894 -11.223 1.00 27.58 H new ATOM 0 HG LEU B 91 17.209 -9.154 -9.715 1.00 27.52 H new ATOM 0 HD11 LEU B 91 19.503 -9.008 -9.398 1.00 29.85 H new ATOM 0 HD12 LEU B 91 18.925 -10.309 -8.702 1.00 29.85 H new ATOM 0 HD13 LEU B 91 19.688 -10.423 -10.086 1.00 29.85 H new ATOM 0 HD21 LEU B 91 18.421 -8.099 -11.412 1.00 27.06 H new ATOM 0 HD22 LEU B 91 18.536 -9.480 -12.180 1.00 27.06 H new ATOM 0 HD23 LEU B 91 17.123 -8.786 -12.005 1.00 27.06 H new ATOM 1792 N HIS B 92 14.707 -10.090 -8.734 1.00 26.16 N ATOM 1793 CA HIS B 92 14.200 -8.951 -7.903 1.00 27.45 C ATOM 1794 C HIS B 92 13.632 -9.396 -6.555 1.00 28.22 C ATOM 1795 O HIS B 92 13.827 -8.707 -5.536 1.00 27.03 O ATOM 1796 CB HIS B 92 13.120 -8.120 -8.635 1.00 27.81 C ATOM 1797 CG HIS B 92 13.654 -7.274 -9.757 1.00 24.82 C ATOM 1798 ND1 HIS B 92 13.856 -7.768 -11.029 1.00 22.25 N ATOM 1799 CD2 HIS B 92 14.024 -5.974 -9.792 1.00 20.45 C ATOM 1800 CE1 HIS B 92 14.327 -6.804 -11.802 1.00 22.90 C ATOM 1801 NE2 HIS B 92 14.429 -5.703 -11.078 1.00 23.69 N ATOM 0 H HIS B 92 14.221 -10.309 -9.409 1.00 26.16 H new ATOM 0 HA HIS B 92 14.983 -8.401 -7.746 1.00 27.45 H new ATOM 0 HB2 HIS B 92 12.447 -8.722 -8.989 1.00 27.81 H new ATOM 0 HB3 HIS B 92 12.677 -7.545 -7.992 1.00 27.81 H new ATOM 0 HD1 HIS B 92 13.700 -8.576 -11.280 1.00 22.25 H new ATOM 0 HD2 HIS B 92 14.008 -5.376 -9.080 1.00 20.45 H new ATOM 0 HE1 HIS B 92 14.549 -6.887 -12.701 1.00 22.90 H new ATOM 1802 N CYS B 93 12.927 -10.546 -6.573 1.00 30.20 N ATOM 1803 CA CYS B 93 12.244 -11.077 -5.390 1.00 32.74 C ATOM 1804 C CYS B 93 13.208 -11.880 -4.490 1.00 34.24 C ATOM 1805 O CYS B 93 13.269 -11.637 -3.283 1.00 34.31 O ATOM 1806 CB CYS B 93 11.010 -11.920 -5.768 1.00 32.75 C ATOM 1807 SG CYS B 93 9.746 -11.047 -6.826 1.00 33.24 S ATOM 0 H CYS B 93 12.836 -11.034 -7.275 1.00 30.20 H new ATOM 0 HA CYS B 93 11.930 -10.313 -4.881 1.00 32.74 H new ATOM 0 HB2 CYS B 93 11.310 -12.714 -6.237 1.00 32.75 H new ATOM 0 HB3 CYS B 93 10.578 -12.218 -4.952 1.00 32.75 H new ATOM 0 HG CYS B 93 8.975 -10.455 -6.122 1.00 33.24 H new ATOM 1808 N ASP B 94 13.981 -12.795 -5.066 1.00 35.27 N ATOM 1809 CA ASP B 94 14.792 -13.704 -4.218 1.00 37.14 C ATOM 1810 C ASP B 94 16.160 -13.179 -3.798 1.00 36.78 C ATOM 1811 O ASP B 94 16.564 -13.426 -2.664 1.00 37.54 O ATOM 1812 CB ASP B 94 14.843 -15.152 -4.772 1.00 37.87 C ATOM 1813 CG ASP B 94 13.444 -15.796 -4.867 1.00 42.17 C ATOM 1814 OD1 ASP B 94 12.538 -15.376 -4.091 1.00 45.75 O ATOM 1815 OD2 ASP B 94 13.238 -16.718 -5.708 1.00 45.39 O ATOM 0 H ASP B 94 14.058 -12.914 -5.914 1.00 35.27 H new ATOM 0 HA ASP B 94 14.301 -13.734 -3.382 1.00 37.14 H new ATOM 0 HB2 ASP B 94 15.253 -15.145 -5.651 1.00 37.87 H new ATOM 0 HB3 ASP B 94 15.408 -15.695 -4.200 1.00 37.87 H new ATOM 1816 N LYS B 95 16.836 -12.396 -4.658 1.00 36.04 N ATOM 1817 CA LYS B 95 18.142 -11.816 -4.332 1.00 35.12 C ATOM 1818 C LYS B 95 18.061 -10.388 -3.780 1.00 34.39 C ATOM 1819 O LYS B 95 18.774 -10.029 -2.820 1.00 33.62 O ATOM 1820 CB LYS B 95 19.042 -11.781 -5.567 1.00 35.90 C ATOM 1821 CG LYS B 95 19.157 -13.086 -6.275 1.00 38.93 C ATOM 1822 CD LYS B 95 20.077 -12.964 -7.511 1.00 44.79 C ATOM 1823 CE LYS B 95 19.885 -14.142 -8.504 1.00 46.64 C ATOM 1824 NZ LYS B 95 20.470 -13.844 -9.861 1.00 47.47 N ATOM 0 H LYS B 95 16.547 -12.190 -5.441 1.00 36.04 H new ATOM 0 HA LYS B 95 18.508 -12.391 -3.642 1.00 35.12 H new ATOM 0 HB2 LYS B 95 18.699 -11.118 -6.186 1.00 35.90 H new ATOM 0 HB3 LYS B 95 19.928 -11.489 -5.301 1.00 35.90 H new ATOM 0 HG2 LYS B 95 19.510 -13.757 -5.670 1.00 38.93 H new ATOM 0 HG3 LYS B 95 18.277 -13.387 -6.551 1.00 38.93 H new ATOM 0 HD2 LYS B 95 19.895 -12.127 -7.966 1.00 44.79 H new ATOM 0 HD3 LYS B 95 21.002 -12.935 -7.222 1.00 44.79 H new ATOM 0 HE2 LYS B 95 20.302 -14.939 -8.142 1.00 46.64 H new ATOM 0 HE3 LYS B 95 18.939 -14.334 -8.597 1.00 46.64 H new ATOM 0 HZ1 LYS B 95 20.340 -14.540 -10.400 1.00 47.47 H new ATOM 0 HZ2 LYS B 95 20.073 -13.126 -10.205 1.00 47.47 H new ATOM 0 HZ3 LYS B 95 21.343 -13.690 -9.781 1.00 47.47 H new ATOM 1825 N LEU B 96 17.219 -9.561 -4.405 1.00 32.07 N ATOM 1826 CA LEU B 96 17.197 -8.142 -4.070 1.00 30.49 C ATOM 1827 C LEU B 96 16.173 -7.749 -2.995 1.00 29.51 C ATOM 1828 O LEU B 96 16.338 -6.722 -2.366 1.00 30.54 O ATOM 1829 CB LEU B 96 17.022 -7.304 -5.334 1.00 30.29 C ATOM 1830 CG LEU B 96 18.159 -7.310 -6.369 1.00 29.44 C ATOM 1831 CD1 LEU B 96 17.655 -6.797 -7.724 1.00 26.55 C ATOM 1832 CD2 LEU B 96 19.409 -6.500 -5.846 1.00 29.16 C ATOM 0 H LEU B 96 16.662 -9.800 -5.016 1.00 32.07 H new ATOM 0 HA LEU B 96 18.059 -7.953 -3.668 1.00 30.49 H new ATOM 0 HB2 LEU B 96 16.214 -7.603 -5.779 1.00 30.29 H new ATOM 0 HB3 LEU B 96 16.873 -6.385 -5.063 1.00 30.29 H new ATOM 0 HG LEU B 96 18.456 -8.224 -6.499 1.00 29.44 H new ATOM 0 HD11 LEU B 96 18.383 -6.807 -8.365 1.00 26.55 H new ATOM 0 HD12 LEU B 96 16.938 -7.369 -8.040 1.00 26.55 H new ATOM 0 HD13 LEU B 96 17.325 -5.890 -7.624 1.00 26.55 H new ATOM 0 HD21 LEU B 96 20.110 -6.519 -6.516 1.00 29.16 H new ATOM 0 HD22 LEU B 96 19.151 -5.581 -5.675 1.00 29.16 H new ATOM 0 HD23 LEU B 96 19.735 -6.902 -5.026 1.00 29.16 H new ATOM 1833 N HIS B 97 15.138 -8.566 -2.794 1.00 29.23 N ATOM 1834 CA HIS B 97 14.017 -8.317 -1.822 1.00 29.51 C ATOM 1835 C HIS B 97 13.301 -6.986 -2.033 1.00 27.85 C ATOM 1836 O HIS B 97 12.977 -6.289 -1.051 1.00 27.93 O ATOM 1837 CB HIS B 97 14.483 -8.417 -0.346 1.00 30.12 C ATOM 1838 CG HIS B 97 15.353 -9.602 -0.079 1.00 36.12 C ATOM 1839 ND1 HIS B 97 14.917 -10.900 -0.269 1.00 38.96 N ATOM 1840 CD2 HIS B 97 16.645 -9.686 0.328 1.00 39.39 C ATOM 1841 CE1 HIS B 97 15.903 -11.734 0.019 1.00 40.34 C ATOM 1842 NE2 HIS B 97 16.959 -11.023 0.388 1.00 41.88 N ATOM 0 H HIS B 97 15.049 -9.306 -3.222 1.00 29.23 H new ATOM 0 HA HIS B 97 13.381 -9.026 -2.007 1.00 29.51 H new ATOM 0 HB2 HIS B 97 14.966 -7.610 -0.111 1.00 30.12 H new ATOM 0 HB3 HIS B 97 13.704 -8.459 0.230 1.00 30.12 H new ATOM 0 HD2 HIS B 97 17.210 -8.975 0.528 1.00 39.39 H new ATOM 0 HE1 HIS B 97 15.862 -12.662 -0.029 1.00 40.34 H new ATOM 0 HE2 HIS B 97 17.719 -11.346 0.627 1.00 41.88 H new ATOM 1843 N VAL B 98 13.072 -6.626 -3.305 1.00 26.02 N ATOM 1844 CA VAL B 98 12.266 -5.455 -3.637 1.00 23.32 C ATOM 1845 C VAL B 98 10.819 -5.768 -3.335 1.00 23.71 C ATOM 1846 O VAL B 98 10.256 -6.755 -3.818 1.00 23.03 O ATOM 1847 CB VAL B 98 12.395 -4.996 -5.120 1.00 23.99 C ATOM 1848 CG1 VAL B 98 11.606 -3.616 -5.347 1.00 18.74 C ATOM 1849 CG2 VAL B 98 13.847 -4.875 -5.527 1.00 22.31 C ATOM 0 H VAL B 98 13.378 -7.052 -3.987 1.00 26.02 H new ATOM 0 HA VAL B 98 12.598 -4.720 -3.098 1.00 23.32 H new ATOM 0 HB VAL B 98 11.991 -5.671 -5.687 1.00 23.99 H new ATOM 0 HG11 VAL B 98 11.694 -3.341 -6.273 1.00 18.74 H new ATOM 0 HG12 VAL B 98 10.668 -3.741 -5.135 1.00 18.74 H new ATOM 0 HG13 VAL B 98 11.979 -2.931 -4.770 1.00 18.74 H new ATOM 0 HG21 VAL B 98 13.901 -4.589 -6.452 1.00 22.31 H new ATOM 0 HG22 VAL B 98 14.289 -4.223 -4.961 1.00 22.31 H new ATOM 0 HG23 VAL B 98 14.283 -5.736 -5.429 1.00 22.31 H new ATOM 1850 N ASP B 99 10.212 -4.917 -2.520 1.00 22.58 N ATOM 1851 CA ASP B 99 8.833 -5.118 -2.146 1.00 22.37 C ATOM 1852 C ASP B 99 8.060 -4.861 -3.414 1.00 21.84 C ATOM 1853 O ASP B 99 8.464 -4.011 -4.190 1.00 21.28 O ATOM 1854 CB ASP B 99 8.408 -4.147 -1.038 1.00 21.87 C ATOM 1855 CG ASP B 99 6.940 -4.261 -0.732 1.00 25.21 C ATOM 1856 OD1 ASP B 99 6.599 -5.124 0.103 1.00 25.38 O ATOM 1857 OD2 ASP B 99 6.120 -3.501 -1.327 1.00 27.04 O ATOM 0 H ASP B 99 10.583 -4.221 -2.177 1.00 22.58 H new ATOM 0 HA ASP B 99 8.677 -6.007 -1.790 1.00 22.37 H new ATOM 0 HB2 ASP B 99 8.921 -4.327 -0.235 1.00 21.87 H new ATOM 0 HB3 ASP B 99 8.613 -3.238 -1.308 1.00 21.87 H new ATOM 1858 N PRO B 100 7.020 -5.664 -3.695 1.00 22.09 N ATOM 1859 CA PRO B 100 6.264 -5.486 -4.959 1.00 22.18 C ATOM 1860 C PRO B 100 5.503 -4.159 -5.175 1.00 20.46 C ATOM 1861 O PRO B 100 5.245 -3.769 -6.315 1.00 19.94 O ATOM 1862 CB PRO B 100 5.327 -6.709 -4.998 1.00 21.75 C ATOM 1863 CG PRO B 100 5.353 -7.279 -3.654 1.00 23.21 C ATOM 1864 CD PRO B 100 6.597 -6.888 -2.967 1.00 22.78 C ATOM 0 HA PRO B 100 6.895 -5.428 -5.693 1.00 22.18 H new ATOM 0 HB2 PRO B 100 4.426 -6.449 -5.247 1.00 21.75 H new ATOM 0 HB3 PRO B 100 5.628 -7.356 -5.655 1.00 21.75 H new ATOM 0 HG2 PRO B 100 4.585 -6.971 -3.149 1.00 23.21 H new ATOM 0 HG3 PRO B 100 5.291 -8.246 -3.703 1.00 23.21 H new ATOM 0 HD2 PRO B 100 6.445 -6.710 -2.026 1.00 22.78 H new ATOM 0 HD3 PRO B 100 7.269 -7.586 -3.019 1.00 22.78 H new ATOM 1865 N GLU B 101 5.127 -3.477 -4.121 1.00 20.21 N ATOM 1866 CA GLU B 101 4.634 -2.110 -4.269 1.00 20.05 C ATOM 1867 C GLU B 101 5.549 -1.270 -5.210 1.00 17.70 C ATOM 1868 O GLU B 101 5.068 -0.469 -6.011 1.00 16.97 O ATOM 1869 CB GLU B 101 4.493 -1.479 -2.883 1.00 22.83 C ATOM 1870 CG GLU B 101 4.178 0.041 -2.846 1.00 28.63 C ATOM 1871 CD GLU B 101 2.773 0.403 -3.399 1.00 38.79 C ATOM 1872 OE1 GLU B 101 2.088 -0.450 -4.041 1.00 42.14 O ATOM 1873 OE2 GLU B 101 2.347 1.565 -3.181 1.00 41.85 O ATOM 0 H GLU B 101 5.145 -3.773 -3.314 1.00 20.21 H new ATOM 0 HA GLU B 101 3.761 -2.127 -4.692 1.00 20.05 H new ATOM 0 HB2 GLU B 101 3.790 -1.947 -2.406 1.00 22.83 H new ATOM 0 HB3 GLU B 101 5.317 -1.631 -2.394 1.00 22.83 H new ATOM 0 HG2 GLU B 101 4.247 0.355 -1.931 1.00 28.63 H new ATOM 0 HG3 GLU B 101 4.851 0.515 -3.360 1.00 28.63 H new ATOM 1874 N ASN B 102 6.847 -1.532 -5.177 1.00 16.38 N ATOM 1875 CA ASN B 102 7.827 -0.749 -5.960 1.00 16.56 C ATOM 1876 C ASN B 102 7.778 -0.986 -7.456 1.00 17.32 C ATOM 1877 O ASN B 102 8.076 -0.052 -8.231 1.00 15.10 O ATOM 1878 CB ASN B 102 9.240 -0.946 -5.426 1.00 15.80 C ATOM 1879 CG ASN B 102 9.388 -0.457 -4.016 1.00 18.79 C ATOM 1880 OD1 ASN B 102 9.180 0.737 -3.731 1.00 20.04 O ATOM 1881 ND2 ASN B 102 9.771 -1.376 -3.102 1.00 16.55 N ATOM 0 H ASN B 102 7.195 -2.162 -4.707 1.00 16.38 H new ATOM 0 HA ASN B 102 7.563 0.176 -5.838 1.00 16.56 H new ATOM 0 HB2 ASN B 102 9.470 -1.887 -5.466 1.00 15.80 H new ATOM 0 HB3 ASN B 102 9.868 -0.476 -5.997 1.00 15.80 H new ATOM 0 HD21 ASN B 102 9.882 -1.146 -2.281 1.00 16.55 H new ATOM 0 HD22 ASN B 102 9.904 -2.191 -3.342 1.00 16.55 H new ATOM 1882 N PHE B 103 7.340 -2.185 -7.873 1.00 17.08 N ATOM 1883 CA PHE B 103 7.142 -2.458 -9.306 1.00 18.41 C ATOM 1884 C PHE B 103 6.001 -1.649 -9.863 1.00 18.26 C ATOM 1885 O PHE B 103 6.063 -1.233 -11.007 1.00 18.02 O ATOM 1886 CB PHE B 103 6.832 -3.950 -9.639 1.00 18.33 C ATOM 1887 CG PHE B 103 7.793 -4.926 -9.015 1.00 20.62 C ATOM 1888 CD1 PHE B 103 9.160 -4.646 -8.991 1.00 20.01 C ATOM 1889 CD2 PHE B 103 7.330 -6.120 -8.453 1.00 17.97 C ATOM 1890 CE1 PHE B 103 10.062 -5.532 -8.379 1.00 23.67 C ATOM 1891 CE2 PHE B 103 8.199 -6.988 -7.842 1.00 21.23 C ATOM 1892 CZ PHE B 103 9.595 -6.705 -7.811 1.00 20.30 C ATOM 0 H PHE B 103 7.155 -2.843 -7.351 1.00 17.08 H new ATOM 0 HA PHE B 103 7.991 -2.217 -9.709 1.00 18.41 H new ATOM 0 HB2 PHE B 103 5.933 -4.159 -9.340 1.00 18.33 H new ATOM 0 HB3 PHE B 103 6.845 -4.067 -10.602 1.00 18.33 H new ATOM 0 HD1 PHE B 103 9.477 -3.865 -9.384 1.00 20.01 H new ATOM 0 HD2 PHE B 103 6.424 -6.328 -8.494 1.00 17.97 H new ATOM 0 HE1 PHE B 103 10.970 -5.331 -8.355 1.00 23.67 H new ATOM 0 HE2 PHE B 103 7.875 -7.765 -7.446 1.00 21.23 H new ATOM 0 HZ PHE B 103 10.187 -7.302 -7.413 1.00 20.30 H new ATOM 1893 N ARG B 104 4.939 -1.519 -9.075 1.00 17.56 N ATOM 1894 CA ARG B 104 3.786 -0.748 -9.452 1.00 19.03 C ATOM 1895 C ARG B 104 4.154 0.732 -9.583 1.00 16.14 C ATOM 1896 O ARG B 104 3.690 1.399 -10.516 1.00 15.46 O ATOM 1897 CB ARG B 104 2.638 -0.920 -8.435 1.00 18.91 C ATOM 1898 CG ARG B 104 1.342 -0.174 -8.881 1.00 23.71 C ATOM 1899 CD ARG B 104 0.231 -0.311 -7.792 1.00 25.85 C ATOM 1900 NE ARG B 104 0.589 0.461 -6.610 1.00 35.59 N ATOM 1901 CZ ARG B 104 0.446 1.780 -6.513 1.00 38.27 C ATOM 1902 NH1 ARG B 104 -0.104 2.467 -7.521 1.00 39.72 N ATOM 1903 NH2 ARG B 104 0.833 2.399 -5.401 1.00 39.29 N ATOM 0 H ARG B 104 4.877 -1.884 -8.299 1.00 17.56 H new ATOM 0 HA ARG B 104 3.479 -1.076 -10.312 1.00 19.03 H new ATOM 0 HB2 ARG B 104 2.444 -1.864 -8.324 1.00 18.91 H new ATOM 0 HB3 ARG B 104 2.921 -0.585 -7.570 1.00 18.91 H new ATOM 0 HG2 ARG B 104 1.538 0.763 -9.035 1.00 23.71 H new ATOM 0 HG3 ARG B 104 1.025 -0.539 -9.722 1.00 23.71 H new ATOM 0 HD2 ARG B 104 -0.617 -0.000 -8.145 1.00 25.85 H new ATOM 0 HD3 ARG B 104 0.115 -1.244 -7.554 1.00 25.85 H new ATOM 0 HE ARG B 104 0.912 0.039 -5.934 1.00 35.59 H new ATOM 0 HH11 ARG B 104 -0.364 2.056 -8.230 1.00 39.72 H new ATOM 0 HH12 ARG B 104 -0.197 3.320 -7.460 1.00 39.72 H new ATOM 0 HH21 ARG B 104 1.172 1.947 -4.753 1.00 39.29 H new ATOM 0 HH22 ARG B 104 0.744 3.251 -5.330 1.00 39.29 H new ATOM 1904 N LEU B 105 4.980 1.221 -8.665 1.00 13.03 N ATOM 1905 CA LEU B 105 5.445 2.635 -8.695 1.00 14.17 C ATOM 1906 C LEU B 105 6.256 2.907 -9.929 1.00 12.68 C ATOM 1907 O LEU B 105 5.983 3.817 -10.649 1.00 13.04 O ATOM 1908 CB LEU B 105 6.260 3.003 -7.429 1.00 13.10 C ATOM 1909 CG LEU B 105 5.498 3.021 -6.113 1.00 14.58 C ATOM 1910 CD1 LEU B 105 6.456 3.477 -5.034 1.00 15.56 C ATOM 1911 CD2 LEU B 105 4.218 3.946 -6.097 1.00 17.89 C ATOM 0 H LEU B 105 5.292 0.761 -8.009 1.00 13.03 H new ATOM 0 HA LEU B 105 4.652 3.194 -8.711 1.00 14.17 H new ATOM 0 HB2 LEU B 105 6.993 2.374 -7.347 1.00 13.10 H new ATOM 0 HB3 LEU B 105 6.652 3.880 -7.565 1.00 13.10 H new ATOM 0 HG LEU B 105 5.165 2.122 -5.967 1.00 14.58 H new ATOM 0 HD11 LEU B 105 5.996 3.498 -4.180 1.00 15.56 H new ATOM 0 HD12 LEU B 105 7.203 2.861 -4.983 1.00 15.56 H new ATOM 0 HD13 LEU B 105 6.784 4.365 -5.246 1.00 15.56 H new ATOM 0 HD21 LEU B 105 3.795 3.898 -5.225 1.00 17.89 H new ATOM 0 HD22 LEU B 105 4.478 4.862 -6.280 1.00 17.89 H new ATOM 0 HD23 LEU B 105 3.593 3.646 -6.776 1.00 17.89 H new ATOM 1912 N LEU B 106 7.224 2.072 -10.229 1.00 14.35 N ATOM 1913 CA LEU B 106 7.942 2.223 -11.515 1.00 14.91 C ATOM 1914 C LEU B 106 7.049 2.187 -12.761 1.00 15.15 C ATOM 1915 O LEU B 106 7.265 2.973 -13.693 1.00 14.11 O ATOM 1916 CB LEU B 106 9.065 1.189 -11.653 1.00 13.37 C ATOM 1917 CG LEU B 106 10.055 1.406 -12.824 1.00 17.57 C ATOM 1918 CD1 LEU B 106 10.476 2.899 -12.994 1.00 23.50 C ATOM 1919 CD2 LEU B 106 11.295 0.579 -12.642 1.00 16.43 C ATOM 0 H LEU B 106 7.489 1.423 -9.731 1.00 14.35 H new ATOM 0 HA LEU B 106 8.316 3.117 -11.477 1.00 14.91 H new ATOM 0 HB2 LEU B 106 9.570 1.176 -10.825 1.00 13.37 H new ATOM 0 HB3 LEU B 106 8.662 0.313 -11.753 1.00 13.37 H new ATOM 0 HG LEU B 106 9.580 1.129 -13.623 1.00 17.57 H new ATOM 0 HD11 LEU B 106 11.094 2.979 -13.738 1.00 23.50 H new ATOM 0 HD12 LEU B 106 9.690 3.439 -13.168 1.00 23.50 H new ATOM 0 HD13 LEU B 106 10.907 3.208 -12.182 1.00 23.50 H new ATOM 0 HD21 LEU B 106 11.898 0.732 -13.386 1.00 16.43 H new ATOM 0 HD22 LEU B 106 11.733 0.831 -11.814 1.00 16.43 H new ATOM 0 HD23 LEU B 106 11.056 -0.360 -12.608 1.00 16.43 H new ATOM 1920 N GLY B 107 6.097 1.229 -12.826 1.00 16.34 N ATOM 1921 CA GLY B 107 5.127 1.190 -13.958 1.00 16.71 C ATOM 1922 C GLY B 107 4.395 2.531 -14.143 1.00 16.84 C ATOM 1923 O GLY B 107 4.227 3.024 -15.244 1.00 17.65 O ATOM 0 H GLY B 107 5.995 0.606 -12.242 1.00 16.34 H new ATOM 0 HA2 GLY B 107 5.596 0.964 -14.776 1.00 16.71 H new ATOM 0 HA3 GLY B 107 4.477 0.488 -13.801 1.00 16.71 H new ATOM 1924 N ASN B 108 3.908 3.090 -13.058 1.00 16.02 N ATOM 1925 CA ASN B 108 3.158 4.376 -13.122 1.00 16.06 C ATOM 1926 C ASN B 108 4.035 5.576 -13.474 1.00 13.89 C ATOM 1927 O ASN B 108 3.652 6.456 -14.237 1.00 13.27 O ATOM 1928 CB ASN B 108 2.435 4.587 -11.792 1.00 15.45 C ATOM 1929 CG ASN B 108 1.110 3.804 -11.724 1.00 18.78 C ATOM 1930 OD1 ASN B 108 0.704 3.072 -12.670 1.00 19.44 O ATOM 1931 ND2 ASN B 108 0.442 3.958 -10.628 1.00 23.17 N ATOM 0 H ASN B 108 3.988 2.761 -12.268 1.00 16.02 H new ATOM 0 HA ASN B 108 2.516 4.312 -13.847 1.00 16.06 H new ATOM 0 HB2 ASN B 108 3.012 4.309 -11.064 1.00 15.45 H new ATOM 0 HB3 ASN B 108 2.258 5.533 -11.668 1.00 15.45 H new ATOM 0 HD21 ASN B 108 -0.310 3.554 -10.522 1.00 23.17 H new ATOM 0 HD22 ASN B 108 0.749 4.465 -10.005 1.00 23.17 H new ATOM 1932 N VAL B 109 5.246 5.575 -12.945 1.00 12.76 N ATOM 1933 CA VAL B 109 6.205 6.604 -13.297 1.00 12.83 C ATOM 1934 C VAL B 109 6.477 6.519 -14.791 1.00 12.93 C ATOM 1935 O VAL B 109 6.518 7.526 -15.451 1.00 13.44 O ATOM 1936 CB VAL B 109 7.503 6.409 -12.498 1.00 12.73 C ATOM 1937 CG1 VAL B 109 8.709 7.161 -13.222 1.00 16.36 C ATOM 1938 CG2 VAL B 109 7.272 6.872 -11.010 1.00 13.65 C ATOM 0 H VAL B 109 5.532 4.990 -12.383 1.00 12.76 H new ATOM 0 HA VAL B 109 5.849 7.480 -13.081 1.00 12.83 H new ATOM 0 HB VAL B 109 7.750 5.472 -12.467 1.00 12.73 H new ATOM 0 HG11 VAL B 109 9.524 7.033 -12.711 1.00 16.36 H new ATOM 0 HG12 VAL B 109 8.827 6.799 -14.114 1.00 16.36 H new ATOM 0 HG13 VAL B 109 8.511 8.109 -13.281 1.00 16.36 H new ATOM 0 HG21 VAL B 109 8.090 6.750 -10.502 1.00 13.65 H new ATOM 0 HG22 VAL B 109 7.021 7.809 -10.998 1.00 13.65 H new ATOM 0 HG23 VAL B 109 6.563 6.342 -10.612 1.00 13.65 H new ATOM 1939 N LEU B 110 6.602 5.315 -15.364 1.00 12.33 N ATOM 1940 CA LEU B 110 6.800 5.234 -16.820 1.00 14.07 C ATOM 1941 C LEU B 110 5.613 5.811 -17.575 1.00 13.37 C ATOM 1942 O LEU B 110 5.793 6.430 -18.613 1.00 13.90 O ATOM 1943 CB LEU B 110 6.958 3.782 -17.273 1.00 13.75 C ATOM 1944 CG LEU B 110 6.979 3.610 -18.783 1.00 17.63 C ATOM 1945 CD1 LEU B 110 8.158 4.365 -19.401 1.00 22.40 C ATOM 1946 CD2 LEU B 110 7.053 2.119 -19.124 1.00 16.95 C ATOM 0 H LEU B 110 6.577 4.562 -14.949 1.00 12.33 H new ATOM 0 HA LEU B 110 7.603 5.743 -17.014 1.00 14.07 H new ATOM 0 HB2 LEU B 110 7.781 3.424 -16.904 1.00 13.75 H new ATOM 0 HB3 LEU B 110 6.230 3.256 -16.906 1.00 13.75 H new ATOM 0 HG LEU B 110 6.164 3.982 -19.155 1.00 17.63 H new ATOM 0 HD11 LEU B 110 8.153 4.242 -20.363 1.00 22.40 H new ATOM 0 HD12 LEU B 110 8.081 5.310 -19.196 1.00 22.40 H new ATOM 0 HD13 LEU B 110 8.989 4.022 -19.036 1.00 22.40 H new ATOM 0 HD21 LEU B 110 7.066 2.007 -20.087 1.00 16.95 H new ATOM 0 HD22 LEU B 110 7.861 1.740 -18.744 1.00 16.95 H new ATOM 0 HD23 LEU B 110 6.279 1.664 -18.757 1.00 16.95 H new ATOM 1947 N VAL B 111 4.391 5.572 -17.101 1.00 13.49 N ATOM 1948 CA VAL B 111 3.219 6.193 -17.770 1.00 12.23 C ATOM 1949 C VAL B 111 3.271 7.731 -17.616 1.00 12.76 C ATOM 1950 O VAL B 111 2.853 8.445 -18.520 1.00 13.27 O ATOM 1951 CB VAL B 111 1.896 5.643 -17.166 1.00 13.21 C ATOM 1952 CG1 VAL B 111 0.667 6.479 -17.580 1.00 8.96 C ATOM 1953 CG2 VAL B 111 1.734 4.087 -17.467 1.00 13.99 C ATOM 0 H VAL B 111 4.211 5.076 -16.422 1.00 13.49 H new ATOM 0 HA VAL B 111 3.247 5.969 -18.713 1.00 12.23 H new ATOM 0 HB VAL B 111 1.950 5.736 -16.202 1.00 13.21 H new ATOM 0 HG11 VAL B 111 -0.132 6.100 -17.181 1.00 8.96 H new ATOM 0 HG12 VAL B 111 0.779 7.392 -17.273 1.00 8.96 H new ATOM 0 HG13 VAL B 111 0.581 6.471 -18.546 1.00 8.96 H new ATOM 0 HG21 VAL B 111 0.903 3.767 -17.081 1.00 13.99 H new ATOM 0 HG22 VAL B 111 1.721 3.942 -18.426 1.00 13.99 H new ATOM 0 HG23 VAL B 111 2.478 3.603 -17.077 1.00 13.99 H new ATOM 1954 N ILE B 112 3.763 8.243 -16.462 1.00 12.27 N ATOM 1955 CA ILE B 112 3.960 9.692 -16.309 1.00 12.46 C ATOM 1956 C ILE B 112 4.944 10.189 -17.344 1.00 13.66 C ATOM 1957 O ILE B 112 4.680 11.203 -18.006 1.00 15.39 O ATOM 1958 CB ILE B 112 4.437 10.169 -14.874 1.00 12.89 C ATOM 1959 CG1 ILE B 112 3.487 9.737 -13.768 1.00 14.80 C ATOM 1960 CG2 ILE B 112 4.594 11.742 -14.754 1.00 12.01 C ATOM 1961 CD1 ILE B 112 2.175 9.582 -14.153 1.00 18.68 C ATOM 0 H ILE B 112 3.982 7.773 -15.776 1.00 12.27 H new ATOM 0 HA ILE B 112 3.078 10.076 -16.435 1.00 12.46 H new ATOM 0 HB ILE B 112 5.302 9.743 -14.767 1.00 12.89 H new ATOM 0 HG12 ILE B 112 3.803 8.897 -13.399 1.00 14.80 H new ATOM 0 HG13 ILE B 112 3.525 10.392 -13.054 1.00 14.80 H new ATOM 0 HG21 ILE B 112 4.887 11.971 -13.858 1.00 12.01 H new ATOM 0 HG22 ILE B 112 5.251 12.052 -15.397 1.00 12.01 H new ATOM 0 HG23 ILE B 112 3.741 12.167 -14.933 1.00 12.01 H new ATOM 0 HD11 ILE B 112 1.644 9.307 -13.389 1.00 18.68 H new ATOM 0 HD12 ILE B 112 1.836 10.424 -14.495 1.00 18.68 H new ATOM 0 HD13 ILE B 112 2.119 8.906 -14.846 1.00 18.68 H new ATOM 1962 N VAL B 113 6.053 9.473 -17.530 1.00 13.58 N ATOM 1963 CA VAL B 113 7.047 9.920 -18.480 1.00 12.41 C ATOM 1964 C VAL B 113 6.482 9.883 -19.894 1.00 13.40 C ATOM 1965 O VAL B 113 6.691 10.831 -20.627 1.00 12.81 O ATOM 1966 CB VAL B 113 8.362 9.161 -18.337 1.00 13.11 C ATOM 1967 CG1 VAL B 113 9.323 9.415 -19.547 1.00 13.97 C ATOM 1968 CG2 VAL B 113 9.002 9.467 -16.936 1.00 11.18 C ATOM 0 H VAL B 113 6.240 8.740 -17.121 1.00 13.58 H new ATOM 0 HA VAL B 113 7.265 10.844 -18.283 1.00 12.41 H new ATOM 0 HB VAL B 113 8.185 8.208 -18.366 1.00 13.11 H new ATOM 0 HG11 VAL B 113 10.145 8.916 -19.418 1.00 13.97 H new ATOM 0 HG12 VAL B 113 8.894 9.125 -20.367 1.00 13.97 H new ATOM 0 HG13 VAL B 113 9.526 10.362 -19.606 1.00 13.97 H new ATOM 0 HG21 VAL B 113 9.838 8.983 -16.849 1.00 11.18 H new ATOM 0 HG22 VAL B 113 9.171 10.419 -16.858 1.00 11.18 H new ATOM 0 HG23 VAL B 113 8.393 9.189 -16.234 1.00 11.18 H new ATOM 1969 N LEU B 114 5.804 8.798 -20.319 1.00 13.38 N ATOM 1970 CA LEU B 114 5.131 8.824 -21.617 1.00 12.66 C ATOM 1971 C LEU B 114 4.194 10.072 -21.841 1.00 12.55 C ATOM 1972 O LEU B 114 4.196 10.699 -22.907 1.00 12.26 O ATOM 1973 CB LEU B 114 4.355 7.529 -21.828 1.00 12.93 C ATOM 1974 CG LEU B 114 5.206 6.241 -21.854 1.00 12.10 C ATOM 1975 CD1 LEU B 114 4.379 4.997 -22.016 1.00 13.37 C ATOM 1976 CD2 LEU B 114 6.220 6.302 -22.920 1.00 16.63 C ATOM 0 H LEU B 114 5.727 8.062 -19.880 1.00 13.38 H new ATOM 0 HA LEU B 114 5.834 8.907 -22.280 1.00 12.66 H new ATOM 0 HB2 LEU B 114 3.694 7.447 -21.122 1.00 12.93 H new ATOM 0 HB3 LEU B 114 3.869 7.594 -22.665 1.00 12.93 H new ATOM 0 HG LEU B 114 5.644 6.190 -20.990 1.00 12.10 H new ATOM 0 HD11 LEU B 114 4.960 4.221 -22.026 1.00 13.37 H new ATOM 0 HD12 LEU B 114 3.756 4.924 -21.276 1.00 13.37 H new ATOM 0 HD13 LEU B 114 3.886 5.042 -22.850 1.00 13.37 H new ATOM 0 HD21 LEU B 114 6.742 5.484 -22.918 1.00 16.63 H new ATOM 0 HD22 LEU B 114 5.781 6.403 -23.779 1.00 16.63 H new ATOM 0 HD23 LEU B 114 6.806 7.059 -22.766 1.00 16.63 H new ATOM 1977 N SER B 115 3.403 10.424 -20.836 1.00 12.78 N ATOM 1978 CA SER B 115 2.470 11.543 -20.970 1.00 13.58 C ATOM 1979 C SER B 115 3.327 12.804 -21.149 1.00 12.26 C ATOM 1980 O SER B 115 3.081 13.646 -22.004 1.00 13.62 O ATOM 1981 CB SER B 115 1.555 11.610 -19.723 1.00 13.28 C ATOM 1982 OG SER B 115 0.644 12.717 -19.768 1.00 15.14 O ATOM 0 H SER B 115 3.388 10.032 -20.070 1.00 12.78 H new ATOM 0 HA SER B 115 1.879 11.445 -21.733 1.00 13.58 H new ATOM 0 HB2 SER B 115 1.052 10.784 -19.650 1.00 13.28 H new ATOM 0 HB3 SER B 115 2.104 11.679 -18.926 1.00 13.28 H new ATOM 0 HG SER B 115 0.440 12.944 -18.985 1.00 15.14 H new ATOM 1983 N HIS B 116 4.387 12.917 -20.357 1.00 14.51 N ATOM 1984 CA HIS B 116 5.262 14.137 -20.336 1.00 15.76 C ATOM 1985 C HIS B 116 5.838 14.337 -21.765 1.00 16.61 C ATOM 1986 O HIS B 116 5.839 15.421 -22.335 1.00 15.03 O ATOM 1987 CB HIS B 116 6.412 13.901 -19.331 1.00 15.83 C ATOM 1988 CG HIS B 116 7.371 15.046 -19.196 1.00 18.21 C ATOM 1989 ND1 HIS B 116 8.646 15.191 -19.621 1.00 24.25 N flip ATOM 1990 CD2 HIS B 116 7.047 16.223 -18.550 1.00 21.84 C flip ATOM 1991 CE1 HIS B 116 9.061 16.451 -19.250 1.00 25.36 C flip ATOM 1992 NE2 HIS B 116 8.082 17.048 -18.597 1.00 25.41 N flip ATOM 0 H HIS B 116 4.636 12.301 -19.810 1.00 14.51 H new ATOM 0 HA HIS B 116 4.761 14.924 -20.069 1.00 15.76 H new ATOM 0 HB2 HIS B 116 6.030 13.711 -18.460 1.00 15.83 H new ATOM 0 HB3 HIS B 116 6.906 13.112 -19.603 1.00 15.83 H new ATOM 0 HD2 HIS B 116 6.230 16.407 -18.145 1.00 21.84 H new ATOM 0 HE1 HIS B 116 9.895 16.821 -19.430 1.00 25.36 H new ATOM 0 HE2 HIS B 116 8.111 17.838 -18.259 1.00 25.41 H new ATOM 1993 N HIS B 117 6.309 13.242 -22.343 1.00 18.00 N ATOM 1994 CA HIS B 117 6.961 13.243 -23.653 1.00 19.63 C ATOM 1995 C HIS B 117 6.024 13.474 -24.814 1.00 18.34 C ATOM 1996 O HIS B 117 6.381 14.181 -25.740 1.00 17.74 O ATOM 1997 CB HIS B 117 7.605 11.864 -23.900 1.00 20.40 C ATOM 1998 CG HIS B 117 9.077 11.832 -23.672 1.00 28.41 C ATOM 1999 ND1 HIS B 117 10.104 11.609 -24.530 1.00 34.26 N flip ATOM 2000 CD2 HIS B 117 9.653 12.061 -22.430 1.00 34.11 C flip ATOM 2001 CE1 HIS B 117 11.271 11.713 -23.797 1.00 32.85 C flip ATOM 2002 NE2 HIS B 117 10.970 11.990 -22.536 1.00 37.57 N flip ATOM 0 H HIS B 117 6.260 12.463 -21.983 1.00 18.00 H new ATOM 0 HA HIS B 117 7.599 13.973 -23.620 1.00 19.63 H new ATOM 0 HB2 HIS B 117 7.183 11.212 -23.319 1.00 20.40 H new ATOM 0 HB3 HIS B 117 7.423 11.591 -24.813 1.00 20.40 H new ATOM 0 HD2 HIS B 117 9.186 12.237 -21.645 1.00 34.11 H new ATOM 0 HE1 HIS B 117 12.131 11.606 -24.135 1.00 32.85 H new ATOM 0 HE2 HIS B 117 11.534 12.104 -21.897 1.00 37.57 H new ATOM 2003 N PHE B 118 4.876 12.796 -24.807 1.00 17.93 N ATOM 2004 CA PHE B 118 3.977 12.742 -25.984 1.00 17.54 C ATOM 2005 C PHE B 118 2.845 13.748 -26.006 1.00 18.22 C ATOM 2006 O PHE B 118 2.294 14.023 -27.080 1.00 19.29 O ATOM 2007 CB PHE B 118 3.457 11.316 -26.211 1.00 17.31 C ATOM 2008 CG PHE B 118 4.535 10.394 -26.757 1.00 18.45 C ATOM 2009 CD1 PHE B 118 5.056 10.615 -28.046 1.00 20.31 C ATOM 2010 CD2 PHE B 118 5.108 9.399 -25.957 1.00 18.84 C ATOM 2011 CE1 PHE B 118 6.072 9.789 -28.576 1.00 19.85 C ATOM 2012 CE2 PHE B 118 6.138 8.565 -26.464 1.00 19.43 C ATOM 2013 CZ PHE B 118 6.612 8.768 -27.766 1.00 20.07 C ATOM 0 H PHE B 118 4.590 12.354 -24.127 1.00 17.93 H new ATOM 0 HA PHE B 118 4.541 13.011 -26.726 1.00 17.54 H new ATOM 0 HB2 PHE B 118 3.121 10.959 -25.374 1.00 17.31 H new ATOM 0 HB3 PHE B 118 2.710 11.340 -26.829 1.00 17.31 H new ATOM 0 HD1 PHE B 118 4.725 11.318 -28.558 1.00 20.31 H new ATOM 0 HD2 PHE B 118 4.810 9.283 -25.084 1.00 18.84 H new ATOM 0 HE1 PHE B 118 6.380 9.916 -29.444 1.00 19.85 H new ATOM 0 HE2 PHE B 118 6.496 7.889 -25.935 1.00 19.43 H new ATOM 0 HZ PHE B 118 7.289 8.225 -28.100 1.00 20.07 H new ATOM 2014 N GLY B 119 2.519 14.307 -24.842 1.00 17.40 N ATOM 2015 CA GLY B 119 1.457 15.308 -24.752 1.00 17.62 C ATOM 2016 C GLY B 119 0.150 14.726 -25.270 1.00 17.91 C ATOM 2017 O GLY B 119 -0.198 13.561 -24.974 1.00 16.12 O ATOM 0 H GLY B 119 2.900 14.121 -24.094 1.00 17.40 H new ATOM 0 HA2 GLY B 119 1.350 15.595 -23.832 1.00 17.62 H new ATOM 0 HA3 GLY B 119 1.697 16.093 -25.268 1.00 17.62 H new ATOM 2018 N LYS B 120 -0.534 15.523 -26.097 1.00 17.36 N ATOM 2019 CA LYS B 120 -1.938 15.294 -26.501 1.00 18.17 C ATOM 2020 C LYS B 120 -2.152 13.905 -27.133 1.00 17.08 C ATOM 2021 O LYS B 120 -3.221 13.270 -27.026 1.00 17.38 O ATOM 2022 CB LYS B 120 -2.275 16.431 -27.486 1.00 18.37 C ATOM 2023 CG LYS B 120 -3.705 16.762 -27.638 1.00 23.38 C ATOM 2024 CD LYS B 120 -3.908 17.826 -28.679 1.00 27.12 C ATOM 2025 CE LYS B 120 -2.842 18.942 -28.582 1.00 35.38 C ATOM 2026 NZ LYS B 120 -3.261 20.264 -29.216 1.00 40.53 N ATOM 0 H LYS B 120 -0.191 16.229 -26.449 1.00 17.36 H new ATOM 0 HA LYS B 120 -2.526 15.303 -25.730 1.00 18.17 H new ATOM 0 HB2 LYS B 120 -1.806 17.231 -27.200 1.00 18.37 H new ATOM 0 HB3 LYS B 120 -1.923 16.193 -28.358 1.00 18.37 H new ATOM 0 HG2 LYS B 120 -4.200 15.965 -27.885 1.00 23.38 H new ATOM 0 HG3 LYS B 120 -4.062 17.065 -26.788 1.00 23.38 H new ATOM 0 HD2 LYS B 120 -3.875 17.424 -29.561 1.00 27.12 H new ATOM 0 HD3 LYS B 120 -4.791 18.214 -28.576 1.00 27.12 H new ATOM 0 HE2 LYS B 120 -2.633 19.095 -27.647 1.00 35.38 H new ATOM 0 HE3 LYS B 120 -2.027 18.635 -29.008 1.00 35.38 H new ATOM 0 HZ1 LYS B 120 -2.638 20.526 -29.795 1.00 40.53 H new ATOM 0 HZ2 LYS B 120 -4.035 20.157 -29.642 1.00 40.53 H new ATOM 0 HZ3 LYS B 120 -3.354 20.881 -28.582 1.00 40.53 H new ATOM 2027 N GLU B 121 -1.085 13.396 -27.729 1.00 16.58 N ATOM 2028 CA GLU B 121 -1.095 12.112 -28.394 1.00 17.28 C ATOM 2029 C GLU B 121 -1.359 10.970 -27.390 1.00 17.70 C ATOM 2030 O GLU B 121 -1.989 9.926 -27.752 1.00 15.51 O ATOM 2031 CB GLU B 121 0.263 11.883 -29.122 1.00 17.47 C ATOM 2032 CG GLU B 121 0.302 10.576 -29.970 1.00 17.20 C ATOM 2033 CD GLU B 121 1.607 10.443 -30.729 1.00 18.76 C ATOM 2034 OE1 GLU B 121 2.428 11.402 -30.672 1.00 20.28 O ATOM 2035 OE2 GLU B 121 1.785 9.427 -31.448 1.00 13.32 O ATOM 0 H GLU B 121 -0.324 13.796 -27.757 1.00 16.58 H new ATOM 0 HA GLU B 121 -1.813 12.111 -29.046 1.00 17.28 H new ATOM 0 HB2 GLU B 121 0.443 12.641 -29.700 1.00 17.47 H new ATOM 0 HB3 GLU B 121 0.974 11.854 -28.463 1.00 17.47 H new ATOM 0 HG2 GLU B 121 0.185 9.808 -29.389 1.00 17.20 H new ATOM 0 HG3 GLU B 121 -0.439 10.573 -30.596 1.00 17.20 H new ATOM 2036 N PHE B 122 -0.848 11.144 -26.146 1.00 15.57 N ATOM 2037 CA PHE B 122 -1.082 10.158 -25.100 1.00 15.57 C ATOM 2038 C PHE B 122 -2.486 10.394 -24.532 1.00 15.14 C ATOM 2039 O PHE B 122 -2.642 10.947 -23.444 1.00 14.22 O ATOM 2040 CB PHE B 122 0.026 10.233 -24.020 1.00 16.63 C ATOM 2041 CG PHE B 122 0.095 9.030 -23.117 1.00 18.16 C ATOM 2042 CD1 PHE B 122 0.546 7.796 -23.597 1.00 16.78 C ATOM 2043 CD2 PHE B 122 -0.284 9.131 -21.773 1.00 15.40 C ATOM 2044 CE1 PHE B 122 0.612 6.693 -22.749 1.00 15.79 C ATOM 2045 CE2 PHE B 122 -0.208 8.006 -20.908 1.00 16.41 C ATOM 2046 CZ PHE B 122 0.235 6.790 -21.416 1.00 16.30 C ATOM 0 H PHE B 122 -0.373 11.820 -25.906 1.00 15.57 H new ATOM 0 HA PHE B 122 -1.041 9.257 -25.458 1.00 15.57 H new ATOM 0 HB2 PHE B 122 0.884 10.344 -24.459 1.00 16.63 H new ATOM 0 HB3 PHE B 122 -0.119 11.024 -23.477 1.00 16.63 H new ATOM 0 HD1 PHE B 122 0.803 7.712 -24.487 1.00 16.78 H new ATOM 0 HD2 PHE B 122 -0.589 9.945 -21.442 1.00 15.40 H new ATOM 0 HE1 PHE B 122 0.913 5.878 -23.081 1.00 15.79 H new ATOM 0 HE2 PHE B 122 -0.451 8.082 -20.014 1.00 16.41 H new ATOM 0 HZ PHE B 122 0.279 6.043 -20.864 1.00 16.30 H new ATOM 2047 N THR B 123 -3.511 9.987 -25.280 1.00 15.17 N ATOM 2048 CA THR B 123 -4.921 10.252 -24.898 1.00 15.54 C ATOM 2049 C THR B 123 -5.381 9.395 -23.717 1.00 15.38 C ATOM 2050 O THR B 123 -4.702 8.453 -23.310 1.00 14.47 O ATOM 2051 CB THR B 123 -5.861 9.911 -26.039 1.00 15.96 C ATOM 2052 OG1 THR B 123 -5.747 8.505 -26.326 1.00 15.91 O ATOM 2053 CG2 THR B 123 -5.558 10.758 -27.316 1.00 20.05 C ATOM 0 H THR B 123 -3.421 9.553 -26.017 1.00 15.17 H new ATOM 0 HA THR B 123 -4.950 11.193 -24.666 1.00 15.54 H new ATOM 0 HB THR B 123 -6.768 10.124 -25.770 1.00 15.96 H new ATOM 0 HG1 THR B 123 -6.209 8.318 -27.002 1.00 15.91 H new ATOM 0 HG21 THR B 123 -6.177 10.513 -28.021 1.00 20.05 H new ATOM 0 HG22 THR B 123 -5.659 11.701 -27.111 1.00 20.05 H new ATOM 0 HG23 THR B 123 -4.649 10.587 -27.610 1.00 20.05 H new ATOM 2054 N PRO B 124 -6.540 9.719 -23.113 1.00 16.63 N ATOM 2055 CA PRO B 124 -6.982 8.849 -22.026 1.00 16.18 C ATOM 2056 C PRO B 124 -7.133 7.336 -22.439 1.00 16.32 C ATOM 2057 O PRO B 124 -6.924 6.426 -21.612 1.00 14.18 O ATOM 2058 CB PRO B 124 -8.330 9.451 -21.661 1.00 16.96 C ATOM 2059 CG PRO B 124 -8.123 10.978 -21.937 1.00 17.25 C ATOM 2060 CD PRO B 124 -7.456 10.854 -23.311 1.00 17.07 C ATOM 0 HA PRO B 124 -6.339 8.819 -21.301 1.00 16.18 H new ATOM 0 HB2 PRO B 124 -9.046 9.082 -22.202 1.00 16.96 H new ATOM 0 HB3 PRO B 124 -8.559 9.282 -20.734 1.00 16.96 H new ATOM 0 HG2 PRO B 124 -8.956 11.475 -21.963 1.00 17.25 H new ATOM 0 HG3 PRO B 124 -7.556 11.409 -21.278 1.00 17.25 H new ATOM 0 HD2 PRO B 124 -8.102 10.679 -24.013 1.00 17.07 H new ATOM 0 HD3 PRO B 124 -6.982 11.663 -23.557 1.00 17.07 H new ATOM 2061 N GLN B 125 -7.493 7.100 -23.698 1.00 16.42 N ATOM 2062 CA GLN B 125 -7.676 5.726 -24.217 1.00 16.86 C ATOM 2063 C GLN B 125 -6.373 4.987 -24.375 1.00 15.71 C ATOM 2064 O GLN B 125 -6.301 3.788 -24.128 1.00 17.94 O ATOM 2065 CB GLN B 125 -8.402 5.779 -25.568 1.00 18.28 C ATOM 2066 CG GLN B 125 -9.881 6.358 -25.504 1.00 21.24 C ATOM 2067 CD GLN B 125 -10.015 7.950 -25.508 1.00 26.10 C ATOM 2068 OE1 GLN B 125 -9.053 8.700 -25.711 1.00 25.23 O ATOM 2069 NE2 GLN B 125 -11.239 8.426 -25.258 1.00 31.40 N ATOM 0 H GLN B 125 -7.639 7.719 -24.277 1.00 16.42 H new ATOM 0 HA GLN B 125 -8.206 5.241 -23.565 1.00 16.86 H new ATOM 0 HB2 GLN B 125 -7.881 6.322 -26.180 1.00 18.28 H new ATOM 0 HB3 GLN B 125 -8.434 4.884 -25.940 1.00 18.28 H new ATOM 0 HG2 GLN B 125 -10.379 6.008 -26.260 1.00 21.24 H new ATOM 0 HG3 GLN B 125 -10.307 6.018 -24.702 1.00 21.24 H new ATOM 0 HE21 GLN B 125 -11.892 7.883 -25.120 1.00 31.40 H new ATOM 0 HE22 GLN B 125 -11.374 9.275 -25.235 1.00 31.40 H new ATOM 2070 N VAL B 126 -5.335 5.672 -24.859 1.00 16.54 N ATOM 2071 CA VAL B 126 -4.010 5.055 -25.011 1.00 15.01 C ATOM 2072 C VAL B 126 -3.459 4.765 -23.610 1.00 13.47 C ATOM 2073 O VAL B 126 -2.915 3.686 -23.332 1.00 12.11 O ATOM 2074 CB VAL B 126 -3.037 6.027 -25.793 1.00 15.52 C ATOM 2075 CG1 VAL B 126 -1.562 5.662 -25.609 1.00 14.22 C ATOM 2076 CG2 VAL B 126 -3.426 6.145 -27.291 1.00 15.79 C ATOM 0 H VAL B 126 -5.375 6.495 -25.106 1.00 16.54 H new ATOM 0 HA VAL B 126 -4.081 4.232 -25.520 1.00 15.01 H new ATOM 0 HB VAL B 126 -3.148 6.905 -25.397 1.00 15.52 H new ATOM 0 HG11 VAL B 126 -1.010 6.285 -26.106 1.00 14.22 H new ATOM 0 HG12 VAL B 126 -1.332 5.707 -24.668 1.00 14.22 H new ATOM 0 HG13 VAL B 126 -1.408 4.762 -25.936 1.00 14.22 H new ATOM 0 HG21 VAL B 126 -2.811 6.747 -27.739 1.00 15.79 H new ATOM 0 HG22 VAL B 126 -3.382 5.270 -27.707 1.00 15.79 H new ATOM 0 HG23 VAL B 126 -4.329 6.493 -27.365 1.00 15.79 H new ATOM 2077 N GLN B 127 -3.587 5.755 -22.702 1.00 11.46 N ATOM 2078 CA GLN B 127 -3.212 5.536 -21.318 1.00 10.72 C ATOM 2079 C GLN B 127 -3.900 4.308 -20.704 1.00 10.93 C ATOM 2080 O GLN B 127 -3.267 3.491 -20.028 1.00 12.97 O ATOM 2081 CB GLN B 127 -3.518 6.788 -20.422 1.00 7.93 C ATOM 2082 CG GLN B 127 -3.138 6.433 -18.940 1.00 12.25 C ATOM 2083 CD GLN B 127 -3.617 7.462 -17.897 1.00 11.65 C ATOM 2084 OE1 GLN B 127 -4.131 8.488 -18.267 1.00 15.05 O ATOM 2085 NE2 GLN B 127 -3.435 7.170 -16.603 1.00 15.34 N ATOM 0 H GLN B 127 -3.885 6.542 -22.877 1.00 11.46 H new ATOM 0 HA GLN B 127 -2.255 5.378 -21.336 1.00 10.72 H new ATOM 0 HB2 GLN B 127 -3.009 7.555 -20.727 1.00 7.93 H new ATOM 0 HB3 GLN B 127 -4.456 7.027 -20.483 1.00 7.93 H new ATOM 0 HG2 GLN B 127 -3.514 5.566 -18.720 1.00 12.25 H new ATOM 0 HG3 GLN B 127 -2.174 6.349 -18.876 1.00 12.25 H new ATOM 0 HE21 GLN B 127 -3.064 6.427 -16.378 1.00 15.34 H new ATOM 0 HE22 GLN B 127 -3.689 7.725 -15.997 1.00 15.34 H new ATOM 2086 N ALA B 128 -5.216 4.174 -20.869 1.00 12.08 N ATOM 2087 CA ALA B 128 -5.887 3.014 -20.311 1.00 12.50 C ATOM 2088 C ALA B 128 -5.270 1.680 -20.779 1.00 13.57 C ATOM 2089 O ALA B 128 -5.210 0.745 -20.005 1.00 15.02 O ATOM 2090 CB ALA B 128 -7.418 3.027 -20.660 1.00 12.74 C ATOM 0 H ALA B 128 -5.722 4.729 -21.289 1.00 12.08 H new ATOM 0 HA ALA B 128 -5.768 3.075 -19.350 1.00 12.50 H new ATOM 0 HB1 ALA B 128 -7.844 2.244 -20.277 1.00 12.74 H new ATOM 0 HB2 ALA B 128 -7.826 3.828 -20.295 1.00 12.74 H new ATOM 0 HB3 ALA B 128 -7.531 3.017 -21.623 1.00 12.74 H new ATOM 2091 N ALA B 129 -4.891 1.573 -22.039 1.00 13.09 N ATOM 2092 CA ALA B 129 -4.299 0.297 -22.536 1.00 14.09 C ATOM 2093 C ALA B 129 -2.916 0.095 -21.922 1.00 14.12 C ATOM 2094 O ALA B 129 -2.545 -1.039 -21.514 1.00 14.61 O ATOM 2095 CB ALA B 129 -4.185 0.351 -24.061 1.00 13.66 C ATOM 0 H ALA B 129 -4.957 2.198 -22.626 1.00 13.09 H new ATOM 0 HA ALA B 129 -4.870 -0.445 -22.281 1.00 14.09 H new ATOM 0 HB1 ALA B 129 -3.800 -0.478 -24.386 1.00 13.66 H new ATOM 0 HB2 ALA B 129 -5.066 0.472 -24.448 1.00 13.66 H new ATOM 0 HB3 ALA B 129 -3.616 1.094 -24.317 1.00 13.66 H new ATOM 2096 N TYR B 130 -2.145 1.194 -21.827 1.00 14.28 N ATOM 2097 CA TYR B 130 -0.879 1.175 -21.085 1.00 14.16 C ATOM 2098 C TYR B 130 -1.021 0.783 -19.623 1.00 15.34 C ATOM 2099 O TYR B 130 -0.112 0.070 -19.095 1.00 16.72 O ATOM 2100 CB TYR B 130 -0.044 2.485 -21.260 1.00 15.78 C ATOM 2101 CG TYR B 130 0.854 2.412 -22.489 1.00 14.45 C ATOM 2102 CD1 TYR B 130 2.115 1.795 -22.419 1.00 18.46 C ATOM 2103 CD2 TYR B 130 0.426 2.880 -23.723 1.00 15.35 C ATOM 2104 CE1 TYR B 130 2.945 1.683 -23.550 1.00 18.75 C ATOM 2105 CE2 TYR B 130 1.257 2.750 -24.901 1.00 16.73 C ATOM 2106 CZ TYR B 130 2.501 2.153 -24.784 1.00 17.69 C ATOM 2107 OH TYR B 130 3.323 2.060 -25.903 1.00 21.45 O ATOM 0 H TYR B 130 -2.339 1.952 -22.184 1.00 14.28 H new ATOM 0 HA TYR B 130 -0.371 0.460 -21.500 1.00 14.16 H new ATOM 0 HB2 TYR B 130 -0.643 3.244 -21.339 1.00 15.78 H new ATOM 0 HB3 TYR B 130 0.498 2.633 -20.469 1.00 15.78 H new ATOM 0 HD1 TYR B 130 2.408 1.452 -21.606 1.00 18.46 H new ATOM 0 HD2 TYR B 130 -0.409 3.284 -23.794 1.00 15.35 H new ATOM 0 HE1 TYR B 130 3.787 1.296 -23.474 1.00 18.75 H new ATOM 0 HE2 TYR B 130 0.960 3.063 -25.725 1.00 16.73 H new ATOM 0 HH TYR B 130 2.875 1.784 -26.558 1.00 21.45 H new ATOM 2108 N GLN B 131 -2.128 1.161 -18.950 1.00 14.56 N ATOM 2109 CA GLN B 131 -2.255 0.742 -17.549 1.00 14.42 C ATOM 2110 C GLN B 131 -2.417 -0.792 -17.472 1.00 14.79 C ATOM 2111 O GLN B 131 -1.923 -1.422 -16.550 1.00 14.41 O ATOM 2112 CB GLN B 131 -3.398 1.404 -16.766 1.00 13.55 C ATOM 2113 CG GLN B 131 -3.311 2.926 -16.704 1.00 12.68 C ATOM 2114 CD GLN B 131 -2.251 3.426 -15.724 1.00 15.39 C ATOM 2115 OE1 GLN B 131 -2.013 4.719 -15.781 1.00 14.76 O flip ATOM 2116 NE2 GLN B 131 -1.658 2.659 -14.918 1.00 12.52 N flip ATOM 0 H GLN B 131 -2.775 1.630 -19.267 1.00 14.56 H new ATOM 0 HA GLN B 131 -1.435 1.039 -17.125 1.00 14.42 H new ATOM 0 HB2 GLN B 131 -4.243 1.154 -17.172 1.00 13.55 H new ATOM 0 HB3 GLN B 131 -3.404 1.053 -15.862 1.00 13.55 H new ATOM 0 HG2 GLN B 131 -3.113 3.270 -17.589 1.00 12.68 H new ATOM 0 HG3 GLN B 131 -4.175 3.284 -16.448 1.00 12.68 H new ATOM 0 HE21 GLN B 131 -1.841 1.819 -14.911 1.00 12.52 H new ATOM 0 HE22 GLN B 131 -1.071 2.976 -14.376 1.00 12.52 H new ATOM 2117 N LYS B 132 -3.120 -1.369 -18.425 1.00 15.79 N ATOM 2118 CA LYS B 132 -3.222 -2.854 -18.470 1.00 17.71 C ATOM 2119 C LYS B 132 -1.855 -3.468 -18.680 1.00 17.05 C ATOM 2120 O LYS B 132 -1.532 -4.448 -18.056 1.00 18.39 O ATOM 2121 CB LYS B 132 -4.180 -3.339 -19.570 1.00 18.62 C ATOM 2122 CG LYS B 132 -5.603 -2.827 -19.396 1.00 22.88 C ATOM 2123 CD LYS B 132 -6.490 -3.674 -20.346 1.00 29.28 C ATOM 2124 CE LYS B 132 -7.717 -2.919 -20.779 1.00 31.69 C ATOM 2125 NZ LYS B 132 -8.707 -3.850 -21.436 1.00 37.26 N ATOM 0 H LYS B 132 -3.542 -0.952 -19.048 1.00 15.79 H new ATOM 0 HA LYS B 132 -3.583 -3.140 -17.616 1.00 17.71 H new ATOM 0 HB2 LYS B 132 -3.843 -3.053 -20.433 1.00 18.62 H new ATOM 0 HB3 LYS B 132 -4.190 -4.309 -19.577 1.00 18.62 H new ATOM 0 HG2 LYS B 132 -5.894 -2.921 -18.476 1.00 22.88 H new ATOM 0 HG3 LYS B 132 -5.661 -1.884 -19.617 1.00 22.88 H new ATOM 0 HD2 LYS B 132 -5.975 -3.931 -21.127 1.00 29.28 H new ATOM 0 HD3 LYS B 132 -6.754 -4.493 -19.898 1.00 29.28 H new ATOM 0 HE2 LYS B 132 -8.128 -2.491 -20.011 1.00 31.69 H new ATOM 0 HE3 LYS B 132 -7.468 -2.214 -21.397 1.00 31.69 H new ATOM 0 HZ1 LYS B 132 -9.426 -3.390 -21.686 1.00 37.26 H new ATOM 0 HZ2 LYS B 132 -8.332 -4.226 -22.150 1.00 37.26 H new ATOM 0 HZ3 LYS B 132 -8.947 -4.484 -20.859 1.00 37.26 H new ATOM 2126 N VAL B 133 -1.043 -2.901 -19.553 1.00 17.30 N ATOM 2127 CA VAL B 133 0.324 -3.451 -19.757 1.00 17.87 C ATOM 2128 C VAL B 133 1.220 -3.331 -18.507 1.00 17.90 C ATOM 2129 O VAL B 133 1.801 -4.363 -18.054 1.00 16.45 O ATOM 2130 CB VAL B 133 1.035 -2.836 -20.977 1.00 18.72 C ATOM 2131 CG1 VAL B 133 2.459 -3.381 -21.090 1.00 21.26 C ATOM 2132 CG2 VAL B 133 0.247 -3.111 -22.247 1.00 19.89 C ATOM 0 H VAL B 133 -1.239 -2.216 -20.034 1.00 17.30 H new ATOM 0 HA VAL B 133 0.186 -4.395 -19.930 1.00 17.87 H new ATOM 0 HB VAL B 133 1.085 -1.875 -20.856 1.00 18.72 H new ATOM 0 HG11 VAL B 133 2.896 -2.987 -21.861 1.00 21.26 H new ATOM 0 HG12 VAL B 133 2.956 -3.157 -20.288 1.00 21.26 H new ATOM 0 HG13 VAL B 133 2.429 -4.345 -21.193 1.00 21.26 H new ATOM 0 HG21 VAL B 133 0.707 -2.718 -23.005 1.00 19.89 H new ATOM 0 HG22 VAL B 133 0.168 -4.069 -22.378 1.00 19.89 H new ATOM 0 HG23 VAL B 133 -0.638 -2.722 -22.169 1.00 19.89 H new ATOM 2133 N VAL B 134 1.334 -2.120 -17.895 1.00 16.41 N ATOM 2134 CA VAL B 134 2.210 -2.051 -16.720 1.00 16.70 C ATOM 2135 C VAL B 134 1.761 -2.911 -15.550 1.00 16.30 C ATOM 2136 O VAL B 134 2.608 -3.436 -14.822 1.00 15.48 O ATOM 2137 CB VAL B 134 2.512 -0.576 -16.201 1.00 17.89 C ATOM 2138 CG1 VAL B 134 3.199 0.202 -17.281 1.00 18.65 C ATOM 2139 CG2 VAL B 134 1.243 0.118 -15.737 1.00 16.79 C ATOM 0 H VAL B 134 0.943 -1.391 -18.129 1.00 16.41 H new ATOM 0 HA VAL B 134 3.037 -2.420 -17.067 1.00 16.70 H new ATOM 0 HB VAL B 134 3.100 -0.628 -15.431 1.00 17.89 H new ATOM 0 HG11 VAL B 134 3.383 1.101 -16.966 1.00 18.65 H new ATOM 0 HG12 VAL B 134 4.033 -0.235 -17.515 1.00 18.65 H new ATOM 0 HG13 VAL B 134 2.627 0.245 -18.063 1.00 18.65 H new ATOM 0 HG21 VAL B 134 1.457 1.012 -15.427 1.00 16.79 H new ATOM 0 HG22 VAL B 134 0.616 0.174 -16.475 1.00 16.79 H new ATOM 0 HG23 VAL B 134 0.844 -0.388 -15.012 1.00 16.79 H new ATOM 2140 N ALA B 135 0.453 -3.052 -15.356 1.00 15.79 N ATOM 2141 CA ALA B 135 -0.052 -3.983 -14.355 1.00 16.62 C ATOM 2142 C ALA B 135 0.367 -5.418 -14.666 1.00 17.58 C ATOM 2143 O ALA B 135 0.842 -6.131 -13.776 1.00 15.85 O ATOM 2144 CB ALA B 135 -1.643 -3.917 -14.201 1.00 16.78 C ATOM 0 H ALA B 135 -0.153 -2.622 -15.789 1.00 15.79 H new ATOM 0 HA ALA B 135 0.344 -3.708 -13.513 1.00 16.62 H new ATOM 0 HB1 ALA B 135 -1.930 -4.552 -13.526 1.00 16.78 H new ATOM 0 HB2 ALA B 135 -1.906 -3.022 -13.934 1.00 16.78 H new ATOM 0 HB3 ALA B 135 -2.060 -4.137 -15.049 1.00 16.78 H new ATOM 2145 N GLY B 136 0.194 -5.845 -15.920 1.00 18.95 N ATOM 2146 CA GLY B 136 0.707 -7.201 -16.313 1.00 19.70 C ATOM 2147 C GLY B 136 2.189 -7.380 -15.954 1.00 20.50 C ATOM 2148 O GLY B 136 2.606 -8.420 -15.412 1.00 17.98 O ATOM 0 H GLY B 136 -0.197 -5.401 -16.545 1.00 18.95 H new ATOM 0 HA2 GLY B 136 0.182 -7.886 -15.869 1.00 19.70 H new ATOM 0 HA3 GLY B 136 0.589 -7.327 -17.267 1.00 19.70 H new ATOM 2149 N VAL B 137 2.991 -6.336 -16.190 1.00 21.57 N ATOM 2150 CA VAL B 137 4.446 -6.442 -15.954 1.00 21.30 C ATOM 2151 C VAL B 137 4.756 -6.521 -14.446 1.00 21.14 C ATOM 2152 O VAL B 137 5.492 -7.412 -13.990 1.00 19.88 O ATOM 2153 CB VAL B 137 5.249 -5.300 -16.719 1.00 21.75 C ATOM 2154 CG1 VAL B 137 6.761 -5.338 -16.420 1.00 23.63 C ATOM 2155 CG2 VAL B 137 5.064 -5.445 -18.207 1.00 23.02 C ATOM 0 H VAL B 137 2.725 -5.572 -16.481 1.00 21.57 H new ATOM 0 HA VAL B 137 4.761 -7.276 -16.336 1.00 21.30 H new ATOM 0 HB VAL B 137 4.893 -4.455 -16.403 1.00 21.75 H new ATOM 0 HG11 VAL B 137 7.205 -4.626 -16.907 1.00 23.63 H new ATOM 0 HG12 VAL B 137 6.906 -5.218 -15.468 1.00 23.63 H new ATOM 0 HG13 VAL B 137 7.124 -6.194 -16.696 1.00 23.63 H new ATOM 0 HG21 VAL B 137 5.556 -4.745 -18.664 1.00 23.02 H new ATOM 0 HG22 VAL B 137 5.395 -6.311 -18.491 1.00 23.02 H new ATOM 0 HG23 VAL B 137 4.122 -5.372 -18.425 1.00 23.02 H new ATOM 2156 N ALA B 138 4.185 -5.602 -13.672 1.00 21.20 N ATOM 2157 CA ALA B 138 4.330 -5.612 -12.211 1.00 22.06 C ATOM 2158 C ALA B 138 3.999 -6.996 -11.624 1.00 22.63 C ATOM 2159 O ALA B 138 4.779 -7.533 -10.784 1.00 22.69 O ATOM 2160 CB ALA B 138 3.437 -4.587 -11.607 1.00 20.48 C ATOM 0 H ALA B 138 3.704 -4.956 -13.974 1.00 21.20 H new ATOM 0 HA ALA B 138 5.254 -5.406 -12.001 1.00 22.06 H new ATOM 0 HB1 ALA B 138 3.537 -4.598 -10.642 1.00 20.48 H new ATOM 0 HB2 ALA B 138 3.675 -3.710 -11.946 1.00 20.48 H new ATOM 0 HB3 ALA B 138 2.516 -4.783 -11.838 1.00 20.48 H new ATOM 2161 N ASN B 139 2.830 -7.523 -12.019 1.00 21.99 N ATOM 2162 CA ASN B 139 2.330 -8.832 -11.552 1.00 23.00 C ATOM 2163 C ASN B 139 3.295 -9.964 -11.930 1.00 23.12 C ATOM 2164 O ASN B 139 3.576 -10.830 -11.095 1.00 23.75 O ATOM 2165 CB ASN B 139 0.905 -9.111 -12.085 1.00 23.85 C ATOM 2166 CG ASN B 139 -0.198 -8.433 -11.230 1.00 28.27 C ATOM 2167 OD1 ASN B 139 0.059 -8.064 -10.087 1.00 33.50 O ATOM 2168 ND2 ASN B 139 -1.428 -8.275 -11.786 1.00 31.25 N ATOM 0 H ASN B 139 2.300 -7.129 -12.570 1.00 21.99 H new ATOM 0 HA ASN B 139 2.281 -8.798 -10.584 1.00 23.00 H new ATOM 0 HB2 ASN B 139 0.839 -8.796 -13.000 1.00 23.85 H new ATOM 0 HB3 ASN B 139 0.752 -10.069 -12.103 1.00 23.85 H new ATOM 0 HD21 ASN B 139 -2.060 -7.905 -11.335 1.00 31.25 H new ATOM 0 HD22 ASN B 139 -1.575 -8.545 -12.589 1.00 31.25 H new ATOM 2169 N ALA B 140 3.822 -9.928 -13.158 1.00 23.03 N ATOM 2170 CA ALA B 140 4.825 -10.905 -13.622 1.00 23.53 C ATOM 2171 C ALA B 140 6.110 -10.794 -12.847 1.00 24.21 C ATOM 2172 O ALA B 140 6.679 -11.814 -12.490 1.00 24.28 O ATOM 2173 CB ALA B 140 5.108 -10.773 -15.099 1.00 23.19 C ATOM 0 H ALA B 140 3.611 -9.338 -13.747 1.00 23.03 H new ATOM 0 HA ALA B 140 4.440 -11.781 -13.464 1.00 23.53 H new ATOM 0 HB1 ALA B 140 5.770 -11.431 -15.362 1.00 23.19 H new ATOM 0 HB2 ALA B 140 4.290 -10.920 -15.600 1.00 23.19 H new ATOM 0 HB3 ALA B 140 5.446 -9.883 -15.286 1.00 23.19 H new ATOM 2174 N LEU B 141 6.559 -9.571 -12.557 1.00 23.40 N ATOM 2175 CA LEU B 141 7.751 -9.428 -11.722 1.00 24.66 C ATOM 2176 C LEU B 141 7.561 -9.890 -10.290 1.00 25.10 C ATOM 2177 O LEU B 141 8.534 -10.334 -9.657 1.00 26.49 O ATOM 2178 CB LEU B 141 8.284 -7.999 -11.747 1.00 24.02 C ATOM 2179 CG LEU B 141 9.256 -7.710 -12.873 1.00 25.80 C ATOM 2180 CD1 LEU B 141 9.216 -6.272 -13.190 1.00 29.79 C ATOM 2181 CD2 LEU B 141 10.669 -8.172 -12.466 1.00 25.02 C ATOM 0 H LEU B 141 6.202 -8.835 -12.824 1.00 23.40 H new ATOM 0 HA LEU B 141 8.408 -10.022 -12.118 1.00 24.66 H new ATOM 0 HB2 LEU B 141 7.534 -7.388 -11.817 1.00 24.02 H new ATOM 0 HB3 LEU B 141 8.722 -7.815 -10.901 1.00 24.02 H new ATOM 0 HG LEU B 141 9.006 -8.200 -13.672 1.00 25.80 H new ATOM 0 HD11 LEU B 141 9.837 -6.082 -13.911 1.00 29.79 H new ATOM 0 HD12 LEU B 141 8.319 -6.026 -13.464 1.00 29.79 H new ATOM 0 HD13 LEU B 141 9.466 -5.760 -12.405 1.00 29.79 H new ATOM 0 HD21 LEU B 141 11.291 -7.987 -13.187 1.00 25.02 H new ATOM 0 HD22 LEU B 141 10.948 -7.696 -11.669 1.00 25.02 H new ATOM 0 HD23 LEU B 141 10.659 -9.125 -12.286 1.00 25.02 H new ATOM 2182 N ALA B 142 6.335 -9.779 -9.782 1.00 25.85 N ATOM 2183 CA ALA B 142 5.968 -10.222 -8.430 1.00 27.76 C ATOM 2184 C ALA B 142 5.582 -11.704 -8.295 1.00 30.07 C ATOM 2185 O ALA B 142 5.306 -12.169 -7.198 1.00 29.17 O ATOM 2186 CB ALA B 142 4.854 -9.365 -7.890 1.00 26.78 C ATOM 0 H ALA B 142 5.678 -9.438 -10.220 1.00 25.85 H new ATOM 0 HA ALA B 142 6.781 -10.120 -7.911 1.00 27.76 H new ATOM 0 HB1 ALA B 142 4.618 -9.664 -6.998 1.00 26.78 H new ATOM 0 HB2 ALA B 142 5.145 -8.440 -7.854 1.00 26.78 H new ATOM 0 HB3 ALA B 142 4.080 -9.437 -8.470 1.00 26.78 H new ATOM 2187 N HIS B 143 5.576 -12.446 -9.396 1.00 33.02 N ATOM 2188 CA HIS B 143 5.147 -13.846 -9.408 1.00 37.64 C ATOM 2189 C HIS B 143 5.829 -14.790 -8.364 1.00 39.42 C ATOM 2190 O HIS B 143 5.146 -15.599 -7.729 1.00 40.04 O ATOM 2191 CB HIS B 143 5.253 -14.400 -10.844 1.00 38.31 C ATOM 2192 CG HIS B 143 4.893 -15.842 -10.947 1.00 43.74 C ATOM 2193 ND1 HIS B 143 3.616 -16.310 -10.688 1.00 46.00 N ATOM 2194 CD2 HIS B 143 5.649 -16.930 -11.230 1.00 44.61 C ATOM 2195 CE1 HIS B 143 3.603 -17.624 -10.822 1.00 48.60 C ATOM 2196 NE2 HIS B 143 4.820 -18.023 -11.155 1.00 47.97 N ATOM 0 H HIS B 143 5.822 -12.151 -10.166 1.00 33.02 H new ATOM 0 HA HIS B 143 4.223 -13.838 -9.113 1.00 37.64 H new ATOM 0 HB2 HIS B 143 4.672 -13.886 -11.426 1.00 38.31 H new ATOM 0 HB3 HIS B 143 6.160 -14.276 -11.166 1.00 38.31 H new ATOM 0 HD2 HIS B 143 6.556 -16.936 -11.436 1.00 44.61 H new ATOM 0 HE1 HIS B 143 2.864 -18.175 -10.703 1.00 48.60 H new ATOM 0 HE2 HIS B 143 5.055 -18.837 -11.301 1.00 47.97 H new ATOM 2197 N LYS B 144 7.147 -14.664 -8.172 1.00 41.97 N ATOM 2198 CA LYS B 144 7.903 -15.475 -7.188 1.00 44.65 C ATOM 2199 C LYS B 144 7.534 -15.284 -5.713 1.00 46.40 C ATOM 2200 O LYS B 144 7.880 -16.137 -4.889 1.00 47.01 O ATOM 2201 CB LYS B 144 9.418 -15.285 -7.311 1.00 44.38 C ATOM 2202 CG LYS B 144 10.085 -15.845 -8.572 1.00 47.28 C ATOM 2203 CD LYS B 144 9.628 -17.259 -9.019 1.00 49.46 C ATOM 2204 CE LYS B 144 10.239 -18.401 -8.171 1.00 51.09 C ATOM 2205 NZ LYS B 144 11.736 -18.383 -8.032 1.00 51.77 N ATOM 0 H LYS B 144 7.635 -14.105 -8.607 1.00 41.97 H new ATOM 0 HA LYS B 144 7.634 -16.374 -7.435 1.00 44.65 H new ATOM 0 HB2 LYS B 144 9.608 -14.335 -7.265 1.00 44.38 H new ATOM 0 HB3 LYS B 144 9.838 -15.696 -6.539 1.00 44.38 H new ATOM 0 HG2 LYS B 144 9.923 -15.227 -9.302 1.00 47.28 H new ATOM 0 HG3 LYS B 144 11.044 -15.867 -8.426 1.00 47.28 H new ATOM 0 HD2 LYS B 144 8.661 -17.310 -8.968 1.00 49.46 H new ATOM 0 HD3 LYS B 144 9.870 -17.391 -9.949 1.00 49.46 H new ATOM 0 HE2 LYS B 144 9.848 -18.367 -7.284 1.00 51.09 H new ATOM 0 HE3 LYS B 144 9.978 -19.248 -8.564 1.00 51.09 H new ATOM 0 HZ1 LYS B 144 12.033 -19.213 -7.910 1.00 51.77 H new ATOM 0 HZ2 LYS B 144 12.099 -18.044 -8.770 1.00 51.77 H new ATOM 0 HZ3 LYS B 144 11.963 -17.882 -7.333 1.00 51.77 H new ATOM 2206 N TYR B 145 6.883 -14.170 -5.370 1.00 48.26 N ATOM 2207 CA TYR B 145 6.301 -13.995 -4.034 1.00 50.07 C ATOM 2208 C TYR B 145 5.026 -14.843 -3.876 1.00 52.19 C ATOM 2209 O TYR B 145 4.850 -15.535 -2.859 1.00 52.79 O ATOM 2210 CB TYR B 145 5.979 -12.517 -3.733 1.00 49.31 C ATOM 2211 CG TYR B 145 7.185 -11.620 -3.524 1.00 48.45 C ATOM 2212 CD1 TYR B 145 8.076 -11.845 -2.483 1.00 47.80 C ATOM 2213 CD2 TYR B 145 7.415 -10.532 -4.357 1.00 49.21 C ATOM 2214 CE1 TYR B 145 9.184 -11.026 -2.295 1.00 47.69 C ATOM 2215 CE2 TYR B 145 8.526 -9.690 -4.180 1.00 47.63 C ATOM 2216 CZ TYR B 145 9.404 -9.940 -3.150 1.00 47.63 C ATOM 2217 OH TYR B 145 10.496 -9.118 -2.961 1.00 45.63 O ATOM 0 H TYR B 145 6.767 -13.501 -5.898 1.00 48.26 H new ATOM 0 HA TYR B 145 6.968 -14.295 -3.396 1.00 50.07 H new ATOM 0 HB2 TYR B 145 5.452 -12.160 -4.465 1.00 49.31 H new ATOM 0 HB3 TYR B 145 5.424 -12.478 -2.939 1.00 49.31 H new ATOM 0 HD1 TYR B 145 7.929 -12.556 -1.901 1.00 47.80 H new ATOM 0 HD2 TYR B 145 6.819 -10.357 -5.049 1.00 49.21 H new ATOM 0 HE1 TYR B 145 9.779 -11.200 -1.601 1.00 47.69 H new ATOM 0 HE2 TYR B 145 8.667 -8.971 -4.753 1.00 47.63 H new ATOM 0 HH TYR B 145 10.405 -8.421 -3.421 1.00 45.63 H new ATOM 2218 N HIS B 146 4.154 -14.774 -4.887 1.00 53.93 N ATOM 2219 CA HIS B 146 2.835 -15.426 -4.879 1.00 55.60 C ATOM 2220 C HIS B 146 2.921 -16.962 -4.915 1.00 56.26 C ATOM 2221 O HIS B 146 4.005 -17.583 -4.935 1.00 56.52 O ATOM 2222 CB HIS B 146 1.964 -14.945 -6.067 1.00 55.89 C ATOM 2223 CG HIS B 146 1.882 -13.449 -6.226 1.00 57.86 C ATOM 2224 ND1 HIS B 146 1.457 -12.852 -7.397 1.00 59.86 N ATOM 2225 CD2 HIS B 146 2.165 -12.431 -5.372 1.00 59.96 C ATOM 2226 CE1 HIS B 146 1.473 -11.536 -7.255 1.00 60.05 C ATOM 2227 NE2 HIS B 146 1.900 -11.253 -6.037 1.00 60.45 N ATOM 2228 OXT HIS B 146 1.873 -17.626 -4.942 1.00 57.03 O ATOM 0 H HIS B 146 4.314 -14.339 -5.611 1.00 53.93 H new ATOM 0 HA HIS B 146 2.423 -15.168 -4.040 1.00 55.60 H new ATOM 0 HB2 HIS B 146 2.318 -15.326 -6.886 1.00 55.89 H new ATOM 0 HB3 HIS B 146 1.066 -15.295 -5.956 1.00 55.89 H new ATOM 0 HD2 HIS B 146 2.479 -12.514 -4.501 1.00 59.96 H new ATOM 0 HE1 HIS B 146 1.226 -10.916 -7.903 1.00 60.05 H new ATOM 0 HE2 HIS B 146 1.997 -10.463 -5.712 1.00 60.45 H new TER 2229 HIS B 146 ATOM 2230 N VAL C 1 -4.642 11.566 10.264 1.00 29.29 N ATOM 2231 CA VAL C 1 -5.016 12.699 11.178 1.00 28.68 C ATOM 2232 C VAL C 1 -5.776 12.201 12.393 1.00 28.32 C ATOM 2233 O VAL C 1 -6.861 11.597 12.248 1.00 28.83 O ATOM 2234 CB VAL C 1 -5.919 13.725 10.482 1.00 28.40 C ATOM 2235 CG1 VAL C 1 -6.224 14.884 11.416 1.00 28.33 C ATOM 2236 CG2 VAL C 1 -5.280 14.225 9.175 1.00 29.37 C ATOM 0 H1 VAL C 1 -4.024 11.842 9.686 1.00 29.29 H new ATOM 0 H2 VAL C 1 -4.318 10.891 10.745 1.00 29.29 H new ATOM 0 H3 VAL C 1 -5.363 11.293 9.819 1.00 29.29 H new ATOM 0 HA VAL C 1 -4.177 13.111 11.438 1.00 28.68 H new ATOM 0 HB VAL C 1 -6.755 13.289 10.254 1.00 28.40 H new ATOM 0 HG11 VAL C 1 -6.795 15.524 10.963 1.00 28.33 H new ATOM 0 HG12 VAL C 1 -6.676 14.552 12.207 1.00 28.33 H new ATOM 0 HG13 VAL C 1 -5.396 15.318 11.675 1.00 28.33 H new ATOM 0 HG21 VAL C 1 -5.868 14.871 8.754 1.00 29.37 H new ATOM 0 HG22 VAL C 1 -4.427 14.644 9.371 1.00 29.37 H new ATOM 0 HG23 VAL C 1 -5.141 13.476 8.575 1.00 29.37 H new ATOM 2237 N LEU C 2 -5.247 12.509 13.581 1.00 26.63 N ATOM 2238 CA LEU C 2 -5.856 12.050 14.836 1.00 25.96 C ATOM 2239 C LEU C 2 -7.069 12.891 15.287 1.00 25.52 C ATOM 2240 O LEU C 2 -7.010 14.109 15.242 1.00 25.19 O ATOM 2241 CB LEU C 2 -4.789 11.958 15.961 1.00 24.82 C ATOM 2242 CG LEU C 2 -3.547 11.123 15.632 1.00 24.15 C ATOM 2243 CD1 LEU C 2 -2.538 11.108 16.790 1.00 25.58 C ATOM 2244 CD2 LEU C 2 -3.891 9.691 15.237 1.00 23.89 C ATOM 0 H LEU C 2 -4.536 12.982 13.683 1.00 26.63 H new ATOM 0 HA LEU C 2 -6.207 11.164 14.656 1.00 25.96 H new ATOM 0 HB2 LEU C 2 -4.503 12.857 16.188 1.00 24.82 H new ATOM 0 HB3 LEU C 2 -5.209 11.586 16.752 1.00 24.82 H new ATOM 0 HG LEU C 2 -3.138 11.558 14.867 1.00 24.15 H new ATOM 0 HD11 LEU C 2 -1.769 10.571 16.543 1.00 25.58 H new ATOM 0 HD12 LEU C 2 -2.251 12.015 16.981 1.00 25.58 H new ATOM 0 HD13 LEU C 2 -2.956 10.729 17.579 1.00 25.58 H new ATOM 0 HD21 LEU C 2 -3.075 9.205 15.039 1.00 23.89 H new ATOM 0 HD22 LEU C 2 -4.357 9.256 15.969 1.00 23.89 H new ATOM 0 HD23 LEU C 2 -4.460 9.700 14.452 1.00 23.89 H new ATOM 2245 N SER C 3 -8.154 12.240 15.708 1.00 25.44 N ATOM 2246 CA SER C 3 -9.301 12.942 16.316 1.00 25.76 C ATOM 2247 C SER C 3 -9.011 13.262 17.798 1.00 26.73 C ATOM 2248 O SER C 3 -8.112 12.668 18.414 1.00 25.35 O ATOM 2249 CB SER C 3 -10.564 12.068 16.238 1.00 25.54 C ATOM 2250 OG SER C 3 -10.543 11.076 17.266 1.00 25.20 O ATOM 0 H SER C 3 -8.251 11.387 15.653 1.00 25.44 H new ATOM 0 HA SER C 3 -9.443 13.767 15.826 1.00 25.76 H new ATOM 0 HB2 SER C 3 -11.355 12.622 16.330 1.00 25.54 H new ATOM 0 HB3 SER C 3 -10.617 11.641 15.369 1.00 25.54 H new ATOM 0 HG SER C 3 -11.237 10.605 17.216 1.00 25.20 H new ATOM 2251 N PRO C 4 -9.781 14.198 18.397 1.00 27.87 N ATOM 2252 CA PRO C 4 -9.654 14.429 19.845 1.00 27.02 C ATOM 2253 C PRO C 4 -9.857 13.139 20.614 1.00 26.10 C ATOM 2254 O PRO C 4 -9.109 12.869 21.546 1.00 25.05 O ATOM 2255 CB PRO C 4 -10.788 15.439 20.118 1.00 27.61 C ATOM 2256 CG PRO C 4 -10.830 16.222 18.866 1.00 28.23 C ATOM 2257 CD PRO C 4 -10.756 15.145 17.801 1.00 28.70 C ATOM 0 HA PRO C 4 -8.781 14.752 20.119 1.00 27.02 H new ATOM 0 HB2 PRO C 4 -11.632 14.995 20.294 1.00 27.61 H new ATOM 0 HB3 PRO C 4 -10.596 15.998 20.887 1.00 27.61 H new ATOM 0 HG2 PRO C 4 -11.644 16.745 18.795 1.00 28.23 H new ATOM 0 HG3 PRO C 4 -10.087 16.843 18.804 1.00 28.23 H new ATOM 0 HD2 PRO C 4 -11.618 14.729 17.643 1.00 28.70 H new ATOM 0 HD3 PRO C 4 -10.450 15.495 16.950 1.00 28.70 H new ATOM 2258 N ALA C 5 -10.836 12.313 20.199 1.00 25.69 N ATOM 2259 CA ALA C 5 -11.019 11.001 20.818 1.00 24.66 C ATOM 2260 C ALA C 5 -9.777 10.103 20.696 1.00 24.51 C ATOM 2261 O ALA C 5 -9.394 9.496 21.689 1.00 24.79 O ATOM 2262 CB ALA C 5 -12.292 10.287 20.279 1.00 24.82 C ATOM 0 H ALA C 5 -11.393 12.497 19.570 1.00 25.69 H new ATOM 0 HA ALA C 5 -11.147 11.164 21.766 1.00 24.66 H new ATOM 0 HB1 ALA C 5 -12.384 9.422 20.708 1.00 24.82 H new ATOM 0 HB2 ALA C 5 -13.073 10.828 20.472 1.00 24.82 H new ATOM 0 HB3 ALA C 5 -12.213 10.165 19.320 1.00 24.82 H new ATOM 2263 N ASP C 6 -9.159 10.010 19.505 1.00 23.78 N ATOM 2264 CA ASP C 6 -7.923 9.215 19.311 1.00 22.87 C ATOM 2265 C ASP C 6 -6.824 9.651 20.321 1.00 22.66 C ATOM 2266 O ASP C 6 -6.139 8.824 20.936 1.00 21.17 O ATOM 2267 CB ASP C 6 -7.316 9.416 17.892 1.00 21.78 C ATOM 2268 CG ASP C 6 -8.160 8.817 16.744 1.00 22.87 C ATOM 2269 OD1 ASP C 6 -8.746 7.715 16.879 1.00 24.76 O ATOM 2270 OD2 ASP C 6 -8.216 9.472 15.681 1.00 23.18 O ATOM 0 H ASP C 6 -9.439 10.401 18.792 1.00 23.78 H new ATOM 0 HA ASP C 6 -8.181 8.289 19.440 1.00 22.87 H new ATOM 0 HB2 ASP C 6 -7.202 10.366 17.733 1.00 21.78 H new ATOM 0 HB3 ASP C 6 -6.432 9.017 17.871 1.00 21.78 H new ATOM 2271 N LYS C 7 -6.599 10.960 20.419 1.00 23.12 N ATOM 2272 CA LYS C 7 -5.584 11.501 21.332 1.00 24.28 C ATOM 2273 C LYS C 7 -5.768 10.991 22.785 1.00 23.29 C ATOM 2274 O LYS C 7 -4.820 10.524 23.422 1.00 22.13 O ATOM 2275 CB LYS C 7 -5.564 13.033 21.253 1.00 24.15 C ATOM 2276 CG LYS C 7 -5.180 13.562 19.862 1.00 27.29 C ATOM 2277 CD LYS C 7 -5.251 15.134 19.750 1.00 26.75 C ATOM 2278 CE LYS C 7 -4.599 15.567 18.417 1.00 29.47 C ATOM 2279 NZ LYS C 7 -4.666 17.044 18.133 1.00 30.55 N ATOM 0 H LYS C 7 -7.023 11.555 19.966 1.00 23.12 H new ATOM 0 HA LYS C 7 -4.717 11.173 21.045 1.00 24.28 H new ATOM 0 HB2 LYS C 7 -6.440 13.375 21.492 1.00 24.15 H new ATOM 0 HB3 LYS C 7 -4.937 13.377 21.908 1.00 24.15 H new ATOM 0 HG2 LYS C 7 -4.280 13.269 19.649 1.00 27.29 H new ATOM 0 HG3 LYS C 7 -5.770 13.170 19.200 1.00 27.29 H new ATOM 0 HD2 LYS C 7 -6.173 15.432 19.785 1.00 26.75 H new ATOM 0 HD3 LYS C 7 -4.791 15.545 20.498 1.00 26.75 H new ATOM 0 HE2 LYS C 7 -3.668 15.293 18.423 1.00 29.47 H new ATOM 0 HE3 LYS C 7 -5.031 15.091 17.690 1.00 29.47 H new ATOM 0 HZ1 LYS C 7 -4.723 17.175 17.255 1.00 30.55 H new ATOM 0 HZ2 LYS C 7 -5.382 17.391 18.531 1.00 30.55 H new ATOM 0 HZ3 LYS C 7 -3.933 17.440 18.445 1.00 30.55 H new ATOM 2280 N THR C 8 -7.004 11.029 23.274 1.00 23.42 N ATOM 2281 CA THR C 8 -7.340 10.532 24.603 1.00 24.27 C ATOM 2282 C THR C 8 -7.099 9.033 24.770 1.00 24.30 C ATOM 2283 O THR C 8 -6.571 8.607 25.803 1.00 24.02 O ATOM 2284 CB THR C 8 -8.805 10.857 24.956 1.00 24.97 C ATOM 2285 OG1 THR C 8 -9.002 12.272 24.860 1.00 27.16 O ATOM 2286 CG2 THR C 8 -9.141 10.415 26.356 1.00 26.06 C ATOM 0 H THR C 8 -7.675 11.346 22.840 1.00 23.42 H new ATOM 0 HA THR C 8 -6.741 10.990 25.214 1.00 24.27 H new ATOM 0 HB THR C 8 -9.382 10.384 24.336 1.00 24.97 H new ATOM 0 HG1 THR C 8 -9.799 12.458 25.050 1.00 27.16 H new ATOM 0 HG21 THR C 8 -10.066 10.631 26.551 1.00 26.06 H new ATOM 0 HG22 THR C 8 -9.010 9.457 26.433 1.00 26.06 H new ATOM 0 HG23 THR C 8 -8.563 10.872 26.987 1.00 26.06 H new ATOM 2287 N ASN C 9 -7.497 8.242 23.757 1.00 23.78 N ATOM 2288 CA ASN C 9 -7.306 6.776 23.773 1.00 23.87 C ATOM 2289 C ASN C 9 -5.835 6.477 23.856 1.00 22.89 C ATOM 2290 O ASN C 9 -5.444 5.565 24.583 1.00 22.63 O ATOM 2291 CB ASN C 9 -7.945 6.091 22.539 1.00 22.45 C ATOM 2292 CG ASN C 9 -9.500 6.132 22.576 1.00 26.55 C ATOM 2293 OD1 ASN C 9 -10.071 6.376 23.641 1.00 23.45 O ATOM 2294 ND2 ASN C 9 -10.177 5.873 21.427 1.00 20.51 N ATOM 0 H ASN C 9 -7.882 8.537 23.047 1.00 23.78 H new ATOM 0 HA ASN C 9 -7.758 6.413 24.551 1.00 23.87 H new ATOM 0 HB2 ASN C 9 -7.632 6.528 21.732 1.00 22.45 H new ATOM 0 HB3 ASN C 9 -7.649 5.168 22.495 1.00 22.45 H new ATOM 0 HD21 ASN C 9 -11.037 5.875 21.425 1.00 20.51 H new ATOM 0 HD22 ASN C 9 -9.746 5.707 20.702 1.00 20.51 H new ATOM 2295 N ILE C 10 -5.026 7.257 23.140 1.00 23.15 N ATOM 2296 CA ILE C 10 -3.595 7.001 23.103 1.00 24.52 C ATOM 2297 C ILE C 10 -2.968 7.343 24.456 1.00 25.78 C ATOM 2298 O ILE C 10 -2.216 6.529 25.040 1.00 25.12 O ATOM 2299 CB ILE C 10 -2.898 7.732 21.925 1.00 24.45 C ATOM 2300 CG1 ILE C 10 -3.374 7.140 20.573 1.00 26.00 C ATOM 2301 CG2 ILE C 10 -1.404 7.611 22.011 1.00 23.70 C ATOM 2302 CD1 ILE C 10 -3.394 8.149 19.416 1.00 21.98 C ATOM 0 H ILE C 10 -5.286 7.932 22.674 1.00 23.15 H new ATOM 0 HA ILE C 10 -3.459 6.055 22.939 1.00 24.52 H new ATOM 0 HB ILE C 10 -3.138 8.670 21.981 1.00 24.45 H new ATOM 0 HG12 ILE C 10 -2.794 6.400 20.333 1.00 26.00 H new ATOM 0 HG13 ILE C 10 -4.266 6.776 20.687 1.00 26.00 H new ATOM 0 HG21 ILE C 10 -0.998 8.077 21.263 1.00 23.70 H new ATOM 0 HG22 ILE C 10 -1.095 8.004 22.842 1.00 23.70 H new ATOM 0 HG23 ILE C 10 -1.153 6.674 21.983 1.00 23.70 H new ATOM 0 HD11 ILE C 10 -3.701 7.709 18.608 1.00 21.98 H new ATOM 0 HD12 ILE C 10 -3.994 8.879 19.634 1.00 21.98 H new ATOM 0 HD13 ILE C 10 -2.500 8.497 19.275 1.00 21.98 H new ATOM 2303 N LYS C 11 -3.285 8.538 24.950 1.00 26.63 N ATOM 2304 CA LYS C 11 -2.694 9.008 26.215 1.00 28.70 C ATOM 2305 C LYS C 11 -3.091 8.055 27.347 1.00 28.01 C ATOM 2306 O LYS C 11 -2.244 7.598 28.104 1.00 27.49 O ATOM 2307 CB LYS C 11 -3.109 10.452 26.529 1.00 28.04 C ATOM 2308 CG LYS C 11 -2.279 11.489 25.825 1.00 29.11 C ATOM 2309 CD LYS C 11 -2.503 12.907 26.435 1.00 32.10 C ATOM 2310 CE LYS C 11 -1.342 13.910 26.061 1.00 37.47 C ATOM 2311 NZ LYS C 11 0.047 13.649 26.685 1.00 39.93 N ATOM 0 H LYS C 11 -3.831 9.089 24.579 1.00 26.63 H new ATOM 0 HA LYS C 11 -1.728 9.008 26.127 1.00 28.70 H new ATOM 0 HB2 LYS C 11 -4.039 10.573 26.283 1.00 28.04 H new ATOM 0 HB3 LYS C 11 -3.048 10.596 27.486 1.00 28.04 H new ATOM 0 HG2 LYS C 11 -1.340 11.252 25.888 1.00 29.11 H new ATOM 0 HG3 LYS C 11 -2.505 11.501 24.882 1.00 29.11 H new ATOM 0 HD2 LYS C 11 -3.349 13.262 26.120 1.00 32.10 H new ATOM 0 HD3 LYS C 11 -2.567 12.835 27.400 1.00 32.10 H new ATOM 0 HE2 LYS C 11 -1.243 13.908 25.096 1.00 37.47 H new ATOM 0 HE3 LYS C 11 -1.623 14.803 26.316 1.00 37.47 H new ATOM 0 HZ1 LYS C 11 0.619 14.271 26.407 1.00 39.93 H new ATOM 0 HZ2 LYS C 11 -0.015 13.679 27.572 1.00 39.93 H new ATOM 0 HZ3 LYS C 11 0.338 12.846 26.436 1.00 39.93 H new ATOM 2312 N THR C 12 -4.379 7.737 27.423 1.00 29.00 N ATOM 2313 CA THR C 12 -4.896 6.770 28.401 1.00 30.30 C ATOM 2314 C THR C 12 -4.262 5.388 28.331 1.00 30.26 C ATOM 2315 O THR C 12 -3.815 4.865 29.360 1.00 29.84 O ATOM 2316 CB THR C 12 -6.444 6.703 28.349 1.00 30.78 C ATOM 2317 OG1 THR C 12 -6.947 7.978 28.763 1.00 33.46 O ATOM 2318 CG2 THR C 12 -6.964 5.672 29.283 1.00 32.20 C ATOM 0 H THR C 12 -4.982 8.073 26.911 1.00 29.00 H new ATOM 0 HA THR C 12 -4.628 7.111 29.269 1.00 30.30 H new ATOM 0 HB THR C 12 -6.725 6.476 27.449 1.00 30.78 H new ATOM 0 HG1 THR C 12 -7.011 8.484 28.096 1.00 33.46 H new ATOM 0 HG21 THR C 12 -7.932 5.649 29.233 1.00 32.20 H new ATOM 0 HG22 THR C 12 -6.607 4.804 29.038 1.00 32.20 H new ATOM 0 HG23 THR C 12 -6.693 5.889 30.189 1.00 32.20 H new ATOM 2319 N ALA C 13 -4.221 4.789 27.135 1.00 30.11 N ATOM 2320 CA ALA C 13 -3.617 3.483 26.991 1.00 30.96 C ATOM 2321 C ALA C 13 -2.115 3.530 27.304 1.00 31.63 C ATOM 2322 O ALA C 13 -1.607 2.609 27.898 1.00 31.83 O ATOM 2323 CB ALA C 13 -3.859 2.913 25.596 1.00 31.10 C ATOM 0 H ALA C 13 -4.536 5.126 26.409 1.00 30.11 H new ATOM 0 HA ALA C 13 -4.041 2.893 27.634 1.00 30.96 H new ATOM 0 HB1 ALA C 13 -3.444 2.039 25.527 1.00 31.10 H new ATOM 0 HB2 ALA C 13 -4.813 2.831 25.441 1.00 31.10 H new ATOM 0 HB3 ALA C 13 -3.474 3.506 24.932 1.00 31.10 H new ATOM 2324 N TRP C 14 -1.410 4.589 26.895 1.00 33.05 N ATOM 2325 CA TRP C 14 0.013 4.692 27.214 1.00 34.95 C ATOM 2326 C TRP C 14 0.341 4.783 28.733 1.00 36.61 C ATOM 2327 O TRP C 14 1.388 4.310 29.189 1.00 36.20 O ATOM 2328 CB TRP C 14 0.659 5.838 26.432 1.00 35.13 C ATOM 2329 CG TRP C 14 2.015 5.459 26.007 1.00 34.06 C ATOM 2330 CD1 TRP C 14 3.196 5.857 26.565 1.00 34.25 C ATOM 2331 CD2 TRP C 14 2.346 4.546 24.956 1.00 33.71 C ATOM 2332 NE1 TRP C 14 4.245 5.258 25.913 1.00 35.00 N ATOM 2333 CE2 TRP C 14 3.754 4.456 24.914 1.00 33.18 C ATOM 2334 CE3 TRP C 14 1.586 3.817 24.022 1.00 34.59 C ATOM 2335 CZ2 TRP C 14 4.427 3.646 23.992 1.00 34.85 C ATOM 2336 CZ3 TRP C 14 2.254 3.015 23.103 1.00 34.45 C ATOM 2337 CH2 TRP C 14 3.663 2.930 23.103 1.00 34.48 C ATOM 0 H TRP C 14 -1.731 5.245 26.441 1.00 33.05 H new ATOM 0 HA TRP C 14 0.402 3.850 26.932 1.00 34.95 H new ATOM 0 HB2 TRP C 14 0.118 6.055 25.657 1.00 35.13 H new ATOM 0 HB3 TRP C 14 0.696 6.635 26.984 1.00 35.13 H new ATOM 0 HD1 TRP C 14 3.278 6.446 27.280 1.00 34.25 H new ATOM 0 HE1 TRP C 14 5.077 5.368 26.101 1.00 35.00 H new ATOM 0 HE3 TRP C 14 0.658 3.871 24.020 1.00 34.59 H new ATOM 0 HZ2 TRP C 14 5.356 3.595 23.982 1.00 34.85 H new ATOM 0 HZ3 TRP C 14 1.765 2.528 22.480 1.00 34.45 H new ATOM 0 HH2 TRP C 14 4.084 2.376 22.486 1.00 34.48 H new ATOM 2338 N GLU C 15 -0.570 5.388 29.502 1.00 39.09 N ATOM 2339 CA GLU C 15 -0.509 5.421 30.967 1.00 41.53 C ATOM 2340 C GLU C 15 -0.430 3.998 31.536 1.00 42.73 C ATOM 2341 O GLU C 15 0.333 3.723 32.455 1.00 42.58 O ATOM 2342 CB GLU C 15 -1.775 6.076 31.497 1.00 41.93 C ATOM 2343 CG GLU C 15 -1.549 7.252 32.401 1.00 45.94 C ATOM 2344 CD GLU C 15 -2.679 8.251 32.286 1.00 50.14 C ATOM 2345 OE1 GLU C 15 -3.858 7.852 32.436 1.00 52.29 O ATOM 2346 OE2 GLU C 15 -2.391 9.434 32.024 1.00 51.52 O ATOM 0 H GLU C 15 -1.254 5.798 29.180 1.00 39.09 H new ATOM 0 HA GLU C 15 0.279 5.919 31.235 1.00 41.53 H new ATOM 0 HB2 GLU C 15 -2.314 6.363 30.744 1.00 41.93 H new ATOM 0 HB3 GLU C 15 -2.291 5.410 31.978 1.00 41.93 H new ATOM 0 HG2 GLU C 15 -1.474 6.948 33.319 1.00 45.94 H new ATOM 0 HG3 GLU C 15 -0.709 7.681 32.175 1.00 45.94 H new ATOM 2347 N LYS C 16 -1.230 3.103 30.975 1.00 44.43 N ATOM 2348 CA LYS C 16 -1.339 1.731 31.467 1.00 46.48 C ATOM 2349 C LYS C 16 -0.128 0.886 31.112 1.00 47.35 C ATOM 2350 O LYS C 16 0.114 -0.130 31.745 1.00 47.58 O ATOM 2351 CB LYS C 16 -2.613 1.038 30.944 1.00 46.53 C ATOM 2352 CG LYS C 16 -3.901 1.875 30.960 1.00 48.50 C ATOM 2353 CD LYS C 16 -4.484 2.071 32.340 1.00 51.02 C ATOM 2354 CE LYS C 16 -4.186 3.475 32.897 1.00 54.43 C ATOM 2355 NZ LYS C 16 -4.952 4.568 32.213 1.00 54.50 N ATOM 0 H LYS C 16 -1.729 3.272 30.295 1.00 44.43 H new ATOM 0 HA LYS C 16 -1.387 1.802 32.433 1.00 46.48 H new ATOM 0 HB2 LYS C 16 -2.450 0.749 30.033 1.00 46.53 H new ATOM 0 HB3 LYS C 16 -2.763 0.239 31.473 1.00 46.53 H new ATOM 0 HG2 LYS C 16 -3.717 2.744 30.569 1.00 48.50 H new ATOM 0 HG3 LYS C 16 -4.563 1.445 30.396 1.00 48.50 H new ATOM 0 HD2 LYS C 16 -5.444 1.934 32.307 1.00 51.02 H new ATOM 0 HD3 LYS C 16 -4.122 1.402 32.941 1.00 51.02 H new ATOM 0 HE2 LYS C 16 -4.393 3.489 33.844 1.00 54.43 H new ATOM 0 HE3 LYS C 16 -3.236 3.654 32.812 1.00 54.43 H new ATOM 0 HZ1 LYS C 16 -4.865 5.325 32.673 1.00 54.50 H new ATOM 0 HZ2 LYS C 16 -4.634 4.683 31.390 1.00 54.50 H new ATOM 0 HZ3 LYS C 16 -5.813 4.345 32.170 1.00 54.50 H new ATOM 2356 N ILE C 17 0.617 1.279 30.083 1.00 48.64 N ATOM 2357 CA ILE C 17 1.838 0.546 29.733 1.00 49.86 C ATOM 2358 C ILE C 17 2.924 0.681 30.828 1.00 50.81 C ATOM 2359 O ILE C 17 3.771 -0.224 30.988 1.00 51.23 O ATOM 2360 CB ILE C 17 2.345 0.913 28.331 1.00 49.73 C ATOM 2361 CG1 ILE C 17 1.713 -0.020 27.289 1.00 49.71 C ATOM 2362 CG2 ILE C 17 3.874 0.833 28.253 1.00 49.14 C ATOM 2363 CD1 ILE C 17 0.194 0.017 27.200 1.00 49.22 C ATOM 0 H ILE C 17 0.441 1.954 29.581 1.00 48.64 H new ATOM 0 HA ILE C 17 1.611 -0.396 29.696 1.00 49.86 H new ATOM 0 HB ILE C 17 2.085 1.829 28.144 1.00 49.73 H new ATOM 0 HG12 ILE C 17 2.076 0.203 26.418 1.00 49.71 H new ATOM 0 HG13 ILE C 17 1.986 -0.930 27.486 1.00 49.71 H new ATOM 0 HG21 ILE C 17 4.165 1.069 27.358 1.00 49.14 H new ATOM 0 HG22 ILE C 17 4.264 1.449 28.893 1.00 49.14 H new ATOM 0 HG23 ILE C 17 4.162 -0.070 28.458 1.00 49.14 H new ATOM 0 HD11 ILE C 17 -0.106 -0.603 26.517 1.00 49.22 H new ATOM 0 HD12 ILE C 17 -0.187 -0.236 28.056 1.00 49.22 H new ATOM 0 HD13 ILE C 17 -0.095 0.914 26.970 1.00 49.22 H new ATOM 2364 N GLY C 18 2.863 1.786 31.589 1.00 51.21 N ATOM 2365 CA GLY C 18 3.720 1.995 32.765 1.00 50.74 C ATOM 2366 C GLY C 18 5.176 1.939 32.369 1.00 50.51 C ATOM 2367 O GLY C 18 5.568 2.519 31.359 1.00 50.01 O ATOM 0 H GLY C 18 2.321 2.436 31.435 1.00 51.21 H new ATOM 0 HA2 GLY C 18 3.521 2.854 33.169 1.00 50.74 H new ATOM 0 HA3 GLY C 18 3.534 1.317 33.433 1.00 50.74 H new ATOM 2368 N SER C 19 5.958 1.191 33.141 1.00 50.43 N ATOM 2369 CA SER C 19 7.412 1.090 32.936 1.00 50.51 C ATOM 2370 C SER C 19 7.875 -0.093 32.045 1.00 49.61 C ATOM 2371 O SER C 19 9.095 -0.341 31.906 1.00 49.30 O ATOM 2372 CB SER C 19 8.149 1.076 34.303 1.00 51.13 C ATOM 2373 OG SER C 19 7.658 0.055 35.181 1.00 52.35 O ATOM 0 H SER C 19 5.665 0.724 33.802 1.00 50.43 H new ATOM 0 HA SER C 19 7.655 1.883 32.433 1.00 50.51 H new ATOM 0 HB2 SER C 19 9.098 0.941 34.154 1.00 51.13 H new ATOM 0 HB3 SER C 19 8.049 1.941 34.730 1.00 51.13 H new ATOM 0 HG SER C 19 8.082 0.080 35.906 1.00 52.35 H new ATOM 2374 N HIS C 20 6.922 -0.795 31.420 1.00 48.47 N ATOM 2375 CA HIS C 20 7.270 -1.959 30.572 1.00 47.16 C ATOM 2376 C HIS C 20 7.480 -1.657 29.080 1.00 45.39 C ATOM 2377 O HIS C 20 7.731 -2.577 28.289 1.00 44.19 O ATOM 2378 CB HIS C 20 6.254 -3.094 30.732 1.00 48.10 C ATOM 2379 CG HIS C 20 5.688 -3.207 32.113 1.00 51.33 C ATOM 2380 ND1 HIS C 20 6.446 -3.596 33.195 1.00 53.55 N ATOM 2381 CD2 HIS C 20 4.437 -2.981 32.586 1.00 52.64 C ATOM 2382 CE1 HIS C 20 5.689 -3.598 34.279 1.00 54.50 C ATOM 2383 NE2 HIS C 20 4.465 -3.234 33.934 1.00 54.25 N ATOM 0 H HIS C 20 6.081 -0.622 31.469 1.00 48.47 H new ATOM 0 HA HIS C 20 8.138 -2.234 30.907 1.00 47.16 H new ATOM 0 HB2 HIS C 20 5.528 -2.958 30.104 1.00 48.10 H new ATOM 0 HB3 HIS C 20 6.679 -3.933 30.496 1.00 48.10 H new ATOM 0 HD2 HIS C 20 3.700 -2.706 32.090 1.00 52.64 H new ATOM 0 HE1 HIS C 20 5.969 -3.818 35.138 1.00 54.50 H new ATOM 0 HE2 HIS C 20 3.795 -3.167 34.469 1.00 54.25 H new ATOM 2384 N GLY C 21 7.377 -0.378 28.709 1.00 43.55 N ATOM 2385 CA GLY C 21 7.614 0.066 27.341 1.00 41.95 C ATOM 2386 C GLY C 21 8.794 -0.653 26.703 1.00 41.05 C ATOM 2387 O GLY C 21 8.645 -1.339 25.681 1.00 41.32 O ATOM 0 H GLY C 21 7.166 0.257 29.250 1.00 43.55 H new ATOM 0 HA2 GLY C 21 6.817 -0.088 26.810 1.00 41.95 H new ATOM 0 HA3 GLY C 21 7.778 1.022 27.336 1.00 41.95 H new ATOM 2388 N GLY C 22 9.961 -0.524 27.338 1.00 39.41 N ATOM 2389 CA GLY C 22 11.209 -1.116 26.854 1.00 37.07 C ATOM 2390 C GLY C 22 11.086 -2.582 26.506 1.00 34.98 C ATOM 2391 O GLY C 22 11.554 -3.016 25.433 1.00 34.42 O ATOM 0 H GLY C 22 10.050 -0.084 28.072 1.00 39.41 H new ATOM 0 HA2 GLY C 22 11.507 -0.629 26.070 1.00 37.07 H new ATOM 0 HA3 GLY C 22 11.894 -1.008 27.532 1.00 37.07 H new ATOM 2392 N GLU C 23 10.446 -3.339 27.404 1.00 33.09 N ATOM 2393 CA GLU C 23 10.281 -4.785 27.222 1.00 31.92 C ATOM 2394 C GLU C 23 9.325 -5.095 26.055 1.00 29.99 C ATOM 2395 O GLU C 23 9.541 -6.080 25.335 1.00 27.68 O ATOM 2396 CB GLU C 23 9.834 -5.496 28.510 1.00 32.45 C ATOM 2397 CG GLU C 23 10.848 -5.445 29.708 1.00 37.73 C ATOM 2398 CD GLU C 23 10.564 -4.316 30.736 1.00 44.30 C ATOM 2399 OE1 GLU C 23 10.984 -3.147 30.490 1.00 45.45 O ATOM 2400 OE2 GLU C 23 9.930 -4.593 31.802 1.00 45.54 O ATOM 0 H GLU C 23 10.099 -3.032 28.128 1.00 33.09 H new ATOM 0 HA GLU C 23 11.156 -5.138 26.998 1.00 31.92 H new ATOM 0 HB2 GLU C 23 8.996 -5.104 28.801 1.00 32.45 H new ATOM 0 HB3 GLU C 23 9.654 -6.426 28.300 1.00 32.45 H new ATOM 0 HG2 GLU C 23 10.832 -6.299 30.168 1.00 37.73 H new ATOM 0 HG3 GLU C 23 11.744 -5.329 29.355 1.00 37.73 H new ATOM 2401 N TYR C 24 8.281 -4.272 25.872 1.00 27.24 N ATOM 2402 CA TYR C 24 7.384 -4.478 24.735 1.00 26.80 C ATOM 2403 C TYR C 24 8.074 -4.114 23.441 1.00 24.57 C ATOM 2404 O TYR C 24 7.885 -4.775 22.403 1.00 22.92 O ATOM 2405 CB TYR C 24 6.085 -3.705 24.857 1.00 27.98 C ATOM 2406 CG TYR C 24 5.320 -4.004 26.107 1.00 30.86 C ATOM 2407 CD1 TYR C 24 5.389 -5.266 26.713 1.00 33.96 C ATOM 2408 CD2 TYR C 24 4.481 -3.037 26.679 1.00 33.71 C ATOM 2409 CE1 TYR C 24 4.667 -5.548 27.868 1.00 32.70 C ATOM 2410 CE2 TYR C 24 3.740 -3.318 27.839 1.00 33.76 C ATOM 2411 CZ TYR C 24 3.834 -4.569 28.409 1.00 33.37 C ATOM 2412 OH TYR C 24 3.122 -4.840 29.557 1.00 34.80 O ATOM 0 H TYR C 24 8.082 -3.608 26.381 1.00 27.24 H new ATOM 0 HA TYR C 24 7.158 -5.421 24.734 1.00 26.80 H new ATOM 0 HB2 TYR C 24 6.279 -2.755 24.826 1.00 27.98 H new ATOM 0 HB3 TYR C 24 5.526 -3.905 24.090 1.00 27.98 H new ATOM 0 HD1 TYR C 24 5.926 -5.925 26.337 1.00 33.96 H new ATOM 0 HD2 TYR C 24 4.414 -2.197 26.285 1.00 33.71 H new ATOM 0 HE1 TYR C 24 4.739 -6.381 28.275 1.00 32.70 H new ATOM 0 HE2 TYR C 24 3.193 -2.668 28.217 1.00 33.76 H new ATOM 0 HH TYR C 24 2.324 -5.011 29.358 1.00 34.80 H new ATOM 2413 N GLY C 25 8.848 -3.034 23.519 1.00 22.28 N ATOM 2414 CA GLY C 25 9.717 -2.632 22.425 1.00 21.16 C ATOM 2415 C GLY C 25 10.553 -3.772 21.884 1.00 19.34 C ATOM 2416 O GLY C 25 10.536 -4.059 20.688 1.00 19.41 O ATOM 0 H GLY C 25 8.882 -2.518 24.206 1.00 22.28 H new ATOM 0 HA2 GLY C 25 9.177 -2.265 21.708 1.00 21.16 H new ATOM 0 HA3 GLY C 25 10.305 -1.923 22.729 1.00 21.16 H new ATOM 2417 N ALA C 26 11.284 -4.429 22.767 1.00 18.65 N ATOM 2418 CA ALA C 26 12.159 -5.511 22.392 1.00 18.42 C ATOM 2419 C ALA C 26 11.403 -6.719 21.774 1.00 18.42 C ATOM 2420 O ALA C 26 11.834 -7.284 20.770 1.00 18.94 O ATOM 2421 CB ALA C 26 12.973 -5.957 23.628 1.00 17.31 C ATOM 0 H ALA C 26 11.283 -4.254 23.609 1.00 18.65 H new ATOM 0 HA ALA C 26 12.752 -5.181 21.699 1.00 18.42 H new ATOM 0 HB1 ALA C 26 13.564 -6.686 23.381 1.00 17.31 H new ATOM 0 HB2 ALA C 26 13.500 -5.211 23.955 1.00 17.31 H new ATOM 0 HB3 ALA C 26 12.367 -6.255 24.325 1.00 17.31 H new ATOM 2422 N GLU C 27 10.288 -7.113 22.394 1.00 17.79 N ATOM 2423 CA GLU C 27 9.459 -8.167 21.880 1.00 17.60 C ATOM 2424 C GLU C 27 8.863 -7.835 20.514 1.00 16.28 C ATOM 2425 O GLU C 27 8.831 -8.714 19.673 1.00 15.54 O ATOM 2426 CB GLU C 27 8.314 -8.519 22.849 1.00 16.89 C ATOM 2427 CG GLU C 27 7.488 -9.760 22.353 1.00 18.91 C ATOM 2428 CD GLU C 27 6.344 -10.118 23.277 1.00 19.20 C ATOM 2429 OE1 GLU C 27 6.423 -9.824 24.493 1.00 19.91 O ATOM 2430 OE2 GLU C 27 5.336 -10.653 22.785 1.00 22.52 O ATOM 0 H GLU C 27 10.002 -6.766 23.127 1.00 17.79 H new ATOM 0 HA GLU C 27 10.048 -8.932 21.782 1.00 17.60 H new ATOM 0 HB2 GLU C 27 8.680 -8.705 23.728 1.00 16.89 H new ATOM 0 HB3 GLU C 27 7.724 -7.755 22.943 1.00 16.89 H new ATOM 0 HG2 GLU C 27 7.136 -9.575 21.468 1.00 18.91 H new ATOM 0 HG3 GLU C 27 8.080 -10.524 22.269 1.00 18.91 H new ATOM 2431 N ALA C 28 8.387 -6.593 20.296 1.00 14.12 N ATOM 2432 CA ALA C 28 7.844 -6.233 18.962 1.00 14.54 C ATOM 2433 C ALA C 28 8.966 -6.369 17.868 1.00 15.50 C ATOM 2434 O ALA C 28 8.758 -6.916 16.748 1.00 12.81 O ATOM 2435 CB ALA C 28 7.281 -4.794 18.977 1.00 13.99 C ATOM 0 H ALA C 28 8.368 -5.964 20.882 1.00 14.12 H new ATOM 0 HA ALA C 28 7.121 -6.842 18.747 1.00 14.54 H new ATOM 0 HB1 ALA C 28 6.931 -4.574 18.100 1.00 13.99 H new ATOM 0 HB2 ALA C 28 6.570 -4.731 19.634 1.00 13.99 H new ATOM 0 HB3 ALA C 28 7.989 -4.172 19.207 1.00 13.99 H new ATOM 2436 N VAL C 29 10.172 -5.913 18.227 1.00 15.87 N ATOM 2437 CA VAL C 29 11.295 -6.005 17.294 1.00 17.62 C ATOM 2438 C VAL C 29 11.636 -7.459 17.002 1.00 17.31 C ATOM 2439 O VAL C 29 11.814 -7.858 15.822 1.00 17.71 O ATOM 2440 CB VAL C 29 12.526 -5.223 17.813 1.00 18.30 C ATOM 2441 CG1 VAL C 29 13.784 -5.738 17.114 1.00 19.45 C ATOM 2442 CG2 VAL C 29 12.271 -3.718 17.618 1.00 16.91 C ATOM 0 H VAL C 29 10.356 -5.556 18.987 1.00 15.87 H new ATOM 0 HA VAL C 29 11.026 -5.591 16.459 1.00 17.62 H new ATOM 0 HB VAL C 29 12.668 -5.363 18.762 1.00 18.30 H new ATOM 0 HG11 VAL C 29 14.557 -5.250 17.437 1.00 19.45 H new ATOM 0 HG12 VAL C 29 13.896 -6.683 17.304 1.00 19.45 H new ATOM 0 HG13 VAL C 29 13.698 -5.609 16.156 1.00 19.45 H new ATOM 0 HG21 VAL C 29 13.036 -3.216 17.940 1.00 16.91 H new ATOM 0 HG22 VAL C 29 12.136 -3.532 16.676 1.00 16.91 H new ATOM 0 HG23 VAL C 29 11.481 -3.456 18.116 1.00 16.91 H new ATOM 2443 N GLU C 30 11.669 -8.284 18.045 1.00 18.58 N ATOM 2444 CA GLU C 30 11.931 -9.737 17.833 1.00 19.86 C ATOM 2445 C GLU C 30 10.862 -10.412 16.937 1.00 19.40 C ATOM 2446 O GLU C 30 11.171 -11.197 16.041 1.00 18.71 O ATOM 2447 CB GLU C 30 12.023 -10.462 19.177 1.00 19.48 C ATOM 2448 CG GLU C 30 12.574 -11.869 19.131 1.00 24.42 C ATOM 2449 CD GLU C 30 12.772 -12.458 20.526 1.00 25.95 C ATOM 2450 OE1 GLU C 30 13.463 -11.813 21.363 1.00 34.32 O ATOM 2451 OE2 GLU C 30 12.213 -13.541 20.778 1.00 32.63 O ATOM 0 H GLU C 30 11.548 -8.048 18.863 1.00 18.58 H new ATOM 0 HA GLU C 30 12.779 -9.805 17.367 1.00 19.86 H new ATOM 0 HB2 GLU C 30 12.579 -9.935 19.772 1.00 19.48 H new ATOM 0 HB3 GLU C 30 11.137 -10.493 19.570 1.00 19.48 H new ATOM 0 HG2 GLU C 30 11.969 -12.435 18.626 1.00 24.42 H new ATOM 0 HG3 GLU C 30 13.422 -11.867 18.659 1.00 24.42 H new ATOM 2452 N ARG C 31 9.592 -10.131 17.219 1.00 18.81 N ATOM 2453 CA ARG C 31 8.491 -10.606 16.359 1.00 18.21 C ATOM 2454 C ARG C 31 8.653 -10.126 14.911 1.00 18.19 C ATOM 2455 O ARG C 31 8.422 -10.894 13.962 1.00 16.48 O ATOM 2456 CB ARG C 31 7.160 -10.146 16.918 1.00 16.96 C ATOM 2457 CG ARG C 31 6.773 -10.875 18.185 1.00 16.65 C ATOM 2458 CD ARG C 31 5.506 -10.243 18.810 1.00 10.64 C ATOM 2459 NE ARG C 31 5.061 -10.951 20.015 1.00 10.89 N ATOM 2460 CZ ARG C 31 4.427 -12.113 20.068 1.00 13.48 C ATOM 2461 NH1 ARG C 31 4.179 -12.859 18.956 1.00 10.58 N ATOM 2462 NH2 ARG C 31 4.122 -12.588 21.245 1.00 13.36 N ATOM 0 H ARG C 31 9.340 -9.669 17.899 1.00 18.81 H new ATOM 0 HA ARG C 31 8.519 -11.576 16.351 1.00 18.21 H new ATOM 0 HB2 ARG C 31 7.201 -9.194 17.098 1.00 16.96 H new ATOM 0 HB3 ARG C 31 6.470 -10.279 16.250 1.00 16.96 H new ATOM 0 HG2 ARG C 31 6.611 -11.811 17.989 1.00 16.65 H new ATOM 0 HG3 ARG C 31 7.505 -10.841 18.821 1.00 16.65 H new ATOM 0 HD2 ARG C 31 5.686 -9.316 19.031 1.00 10.64 H new ATOM 0 HD3 ARG C 31 4.791 -10.244 18.155 1.00 10.64 H new ATOM 0 HE ARG C 31 5.230 -10.571 20.768 1.00 10.89 H new ATOM 0 HH11 ARG C 31 4.437 -12.580 18.185 1.00 10.58 H new ATOM 0 HH12 ARG C 31 3.765 -13.609 19.025 1.00 10.58 H new ATOM 0 HH21 ARG C 31 4.333 -12.149 21.954 1.00 13.36 H new ATOM 0 HH22 ARG C 31 3.710 -13.340 21.312 1.00 13.36 H new ATOM 2463 N MET C 32 9.102 -8.868 14.739 1.00 17.16 N ATOM 2464 CA MET C 32 9.396 -8.392 13.401 1.00 17.96 C ATOM 2465 C MET C 32 10.479 -9.199 12.690 1.00 17.15 C ATOM 2466 O MET C 32 10.247 -9.671 11.578 1.00 15.84 O ATOM 2467 CB MET C 32 9.750 -6.907 13.347 1.00 17.45 C ATOM 2468 CG MET C 32 9.970 -6.431 11.905 1.00 18.42 C ATOM 2469 SD MET C 32 10.407 -4.702 11.847 1.00 21.25 S ATOM 2470 CE MET C 32 12.082 -4.805 12.471 1.00 20.48 C ATOM 0 H MET C 32 9.235 -8.300 15.371 1.00 17.16 H new ATOM 0 HA MET C 32 8.561 -8.522 12.925 1.00 17.96 H new ATOM 0 HB2 MET C 32 9.038 -6.389 13.755 1.00 17.45 H new ATOM 0 HB3 MET C 32 10.552 -6.746 13.868 1.00 17.45 H new ATOM 0 HG2 MET C 32 10.673 -6.958 11.493 1.00 18.42 H new ATOM 0 HG3 MET C 32 9.163 -6.580 11.387 1.00 18.42 H new ATOM 0 HE1 MET C 32 12.568 -4.001 12.228 1.00 20.48 H new ATOM 0 HE2 MET C 32 12.063 -4.891 13.437 1.00 20.48 H new ATOM 0 HE3 MET C 32 12.524 -5.578 12.086 1.00 20.48 H new ATOM 2471 N PHE C 33 11.660 -9.324 13.303 1.00 17.50 N ATOM 2472 CA PHE C 33 12.762 -10.083 12.650 1.00 17.95 C ATOM 2473 C PHE C 33 12.398 -11.529 12.276 1.00 18.55 C ATOM 2474 O PHE C 33 12.824 -12.036 11.251 1.00 18.85 O ATOM 2475 CB PHE C 33 13.983 -10.113 13.574 1.00 18.22 C ATOM 2476 CG PHE C 33 14.679 -8.776 13.723 1.00 15.48 C ATOM 2477 CD1 PHE C 33 14.568 -7.794 12.755 1.00 13.55 C ATOM 2478 CD2 PHE C 33 15.420 -8.513 14.868 1.00 19.50 C ATOM 2479 CE1 PHE C 33 15.206 -6.567 12.915 1.00 16.05 C ATOM 2480 CE2 PHE C 33 16.051 -7.294 15.053 1.00 18.28 C ATOM 2481 CZ PHE C 33 15.961 -6.320 14.063 1.00 16.49 C ATOM 0 H PHE C 33 11.851 -8.992 14.073 1.00 17.50 H new ATOM 0 HA PHE C 33 12.949 -9.615 11.821 1.00 17.95 H new ATOM 0 HB2 PHE C 33 13.706 -10.422 14.451 1.00 18.22 H new ATOM 0 HB3 PHE C 33 14.619 -10.761 13.233 1.00 18.22 H new ATOM 0 HD1 PHE C 33 14.063 -7.955 11.991 1.00 13.55 H new ATOM 0 HD2 PHE C 33 15.494 -9.169 15.524 1.00 19.50 H new ATOM 0 HE1 PHE C 33 15.129 -5.913 12.258 1.00 16.05 H new ATOM 0 HE2 PHE C 33 16.531 -7.128 15.832 1.00 18.28 H new ATOM 0 HZ PHE C 33 16.402 -5.508 14.166 1.00 16.49 H new ATOM 2482 N LEU C 34 11.600 -12.187 13.115 1.00 19.05 N ATOM 2483 CA LEU C 34 11.248 -13.583 12.916 1.00 19.55 C ATOM 2484 C LEU C 34 10.129 -13.769 11.891 1.00 19.66 C ATOM 2485 O LEU C 34 10.161 -14.719 11.055 1.00 17.84 O ATOM 2486 CB LEU C 34 10.860 -14.282 14.236 1.00 20.45 C ATOM 2487 CG LEU C 34 12.000 -14.753 15.137 1.00 23.51 C ATOM 2488 CD1 LEU C 34 11.546 -14.903 16.566 1.00 27.52 C ATOM 2489 CD2 LEU C 34 12.500 -16.090 14.601 1.00 27.26 C ATOM 0 H LEU C 34 11.249 -11.832 13.815 1.00 19.05 H new ATOM 0 HA LEU C 34 12.051 -14.001 12.567 1.00 19.55 H new ATOM 0 HB2 LEU C 34 10.305 -13.673 14.747 1.00 20.45 H new ATOM 0 HB3 LEU C 34 10.311 -15.051 14.019 1.00 20.45 H new ATOM 0 HG LEU C 34 12.711 -14.093 15.130 1.00 23.51 H new ATOM 0 HD11 LEU C 34 12.290 -15.202 17.112 1.00 27.52 H new ATOM 0 HD12 LEU C 34 11.227 -14.048 16.896 1.00 27.52 H new ATOM 0 HD13 LEU C 34 10.829 -15.555 16.611 1.00 27.52 H new ATOM 0 HD21 LEU C 34 13.226 -16.411 15.158 1.00 27.26 H new ATOM 0 HD22 LEU C 34 11.775 -16.735 14.612 1.00 27.26 H new ATOM 0 HD23 LEU C 34 12.817 -15.976 13.691 1.00 27.26 H new ATOM 2490 N GLY C 35 9.127 -12.908 11.952 1.00 19.12 N ATOM 2491 CA GLY C 35 7.981 -13.074 11.047 1.00 18.50 C ATOM 2492 C GLY C 35 8.175 -12.508 9.663 1.00 18.76 C ATOM 2493 O GLY C 35 7.409 -12.830 8.748 1.00 17.18 O ATOM 0 H GLY C 35 9.081 -12.238 12.489 1.00 19.12 H new ATOM 0 HA2 GLY C 35 7.781 -14.020 10.970 1.00 18.50 H new ATOM 0 HA3 GLY C 35 7.205 -12.652 11.449 1.00 18.50 H new ATOM 2494 N PHE C 36 9.176 -11.620 9.533 1.00 18.73 N ATOM 2495 CA PHE C 36 9.420 -10.852 8.313 1.00 18.98 C ATOM 2496 C PHE C 36 10.908 -10.697 8.120 1.00 18.43 C ATOM 2497 O PHE C 36 11.459 -9.595 8.287 1.00 16.78 O ATOM 2498 CB PHE C 36 8.735 -9.500 8.348 1.00 19.03 C ATOM 2499 CG PHE C 36 7.238 -9.579 8.602 1.00 19.12 C ATOM 2500 CD1 PHE C 36 6.358 -9.869 7.580 1.00 16.54 C ATOM 2501 CD2 PHE C 36 6.738 -9.298 9.862 1.00 20.17 C ATOM 2502 CE1 PHE C 36 4.981 -9.931 7.826 1.00 19.68 C ATOM 2503 CE2 PHE C 36 5.361 -9.350 10.118 1.00 20.98 C ATOM 2504 CZ PHE C 36 4.496 -9.665 9.098 1.00 19.94 C ATOM 0 H PHE C 36 9.736 -11.450 10.163 1.00 18.73 H new ATOM 0 HA PHE C 36 9.041 -11.335 7.562 1.00 18.98 H new ATOM 0 HB2 PHE C 36 9.144 -8.957 9.040 1.00 19.03 H new ATOM 0 HB3 PHE C 36 8.888 -9.047 7.504 1.00 19.03 H new ATOM 0 HD1 PHE C 36 6.681 -10.024 6.722 1.00 16.54 H new ATOM 0 HD2 PHE C 36 7.324 -9.072 10.548 1.00 20.17 H new ATOM 0 HE1 PHE C 36 4.394 -10.150 7.139 1.00 19.68 H new ATOM 0 HE2 PHE C 36 5.036 -9.173 10.971 1.00 20.98 H new ATOM 0 HZ PHE C 36 3.581 -9.700 9.261 1.00 19.94 H new ATOM 2505 N PRO C 37 11.557 -11.825 7.773 1.00 19.11 N ATOM 2506 CA PRO C 37 13.020 -11.956 7.723 1.00 20.22 C ATOM 2507 C PRO C 37 13.734 -10.903 6.883 1.00 19.67 C ATOM 2508 O PRO C 37 14.893 -10.570 7.182 1.00 20.82 O ATOM 2509 CB PRO C 37 13.233 -13.376 7.121 1.00 20.00 C ATOM 2510 CG PRO C 37 12.022 -14.112 7.491 1.00 19.16 C ATOM 2511 CD PRO C 37 10.896 -13.106 7.430 1.00 19.58 C ATOM 0 HA PRO C 37 13.401 -11.827 8.606 1.00 20.22 H new ATOM 0 HB2 PRO C 37 13.344 -13.339 6.158 1.00 20.00 H new ATOM 0 HB3 PRO C 37 14.028 -13.798 7.483 1.00 20.00 H new ATOM 0 HG2 PRO C 37 11.863 -14.850 6.882 1.00 19.16 H new ATOM 0 HG3 PRO C 37 12.103 -14.491 8.380 1.00 19.16 H new ATOM 0 HD2 PRO C 37 10.492 -13.075 6.549 1.00 19.58 H new ATOM 0 HD3 PRO C 37 10.189 -13.323 8.058 1.00 19.58 H new ATOM 2512 N THR C 38 13.076 -10.375 5.866 1.00 19.47 N ATOM 2513 CA THR C 38 13.712 -9.348 5.036 1.00 21.16 C ATOM 2514 C THR C 38 14.041 -8.061 5.831 1.00 20.39 C ATOM 2515 O THR C 38 14.941 -7.298 5.442 1.00 20.66 O ATOM 2516 CB THR C 38 12.883 -9.022 3.802 1.00 21.42 C ATOM 2517 OG1 THR C 38 11.537 -8.794 4.212 1.00 26.37 O ATOM 2518 CG2 THR C 38 12.884 -10.218 2.812 1.00 24.54 C ATOM 0 H THR C 38 12.275 -10.587 5.636 1.00 19.47 H new ATOM 0 HA THR C 38 14.554 -9.727 4.740 1.00 21.16 H new ATOM 0 HB THR C 38 13.260 -8.242 3.366 1.00 21.42 H new ATOM 0 HG1 THR C 38 11.051 -9.423 3.941 1.00 26.37 H new ATOM 0 HG21 THR C 38 12.352 -9.994 2.033 1.00 24.54 H new ATOM 0 HG22 THR C 38 13.794 -10.410 2.537 1.00 24.54 H new ATOM 0 HG23 THR C 38 12.506 -10.999 3.247 1.00 24.54 H new ATOM 2519 N THR C 39 13.361 -7.839 6.963 1.00 18.49 N ATOM 2520 CA THR C 39 13.693 -6.670 7.799 1.00 16.95 C ATOM 2521 C THR C 39 15.112 -6.667 8.431 1.00 17.05 C ATOM 2522 O THR C 39 15.642 -5.607 8.737 1.00 18.11 O ATOM 2523 CB THR C 39 12.605 -6.361 8.919 1.00 15.42 C ATOM 2524 OG1 THR C 39 12.572 -7.418 9.853 1.00 15.87 O ATOM 2525 CG2 THR C 39 11.191 -6.191 8.321 1.00 12.04 C ATOM 0 H THR C 39 12.724 -8.334 7.260 1.00 18.49 H new ATOM 0 HA THR C 39 13.687 -5.953 7.146 1.00 16.95 H new ATOM 0 HB THR C 39 12.860 -5.529 9.347 1.00 15.42 H new ATOM 0 HG1 THR C 39 12.270 -8.109 9.483 1.00 15.87 H new ATOM 0 HG21 THR C 39 10.559 -6.005 9.033 1.00 12.04 H new ATOM 0 HG22 THR C 39 11.193 -5.455 7.690 1.00 12.04 H new ATOM 0 HG23 THR C 39 10.932 -7.007 7.865 1.00 12.04 H new ATOM 2526 N LYS C 40 15.711 -7.829 8.648 1.00 17.76 N ATOM 2527 CA LYS C 40 17.055 -7.926 9.267 1.00 19.54 C ATOM 2528 C LYS C 40 18.181 -7.285 8.396 1.00 20.28 C ATOM 2529 O LYS C 40 19.260 -6.916 8.912 1.00 20.36 O ATOM 2530 CB LYS C 40 17.389 -9.379 9.581 1.00 19.54 C ATOM 2531 CG LYS C 40 16.222 -10.127 10.230 1.00 22.23 C ATOM 2532 CD LYS C 40 16.679 -11.385 10.928 1.00 29.13 C ATOM 2533 CE LYS C 40 17.011 -12.471 9.973 1.00 30.42 C ATOM 2534 NZ LYS C 40 17.699 -13.547 10.768 1.00 32.86 N ATOM 0 H LYS C 40 15.362 -8.589 8.446 1.00 17.76 H new ATOM 0 HA LYS C 40 17.018 -7.415 10.090 1.00 19.54 H new ATOM 0 HB2 LYS C 40 17.643 -9.833 8.762 1.00 19.54 H new ATOM 0 HB3 LYS C 40 18.157 -9.410 10.173 1.00 19.54 H new ATOM 0 HG2 LYS C 40 15.780 -9.545 10.868 1.00 22.23 H new ATOM 0 HG3 LYS C 40 15.566 -10.354 9.552 1.00 22.23 H new ATOM 0 HD2 LYS C 40 17.457 -11.186 11.471 1.00 29.13 H new ATOM 0 HD3 LYS C 40 15.982 -11.689 11.531 1.00 29.13 H new ATOM 0 HE2 LYS C 40 16.209 -12.815 9.549 1.00 30.42 H new ATOM 0 HE3 LYS C 40 17.588 -12.143 9.265 1.00 30.42 H new ATOM 0 HZ1 LYS C 40 17.916 -14.221 10.229 1.00 32.86 H new ATOM 0 HZ2 LYS C 40 18.436 -13.216 11.140 1.00 32.86 H new ATOM 0 HZ3 LYS C 40 17.152 -13.841 11.405 1.00 32.86 H new ATOM 2535 N THR C 41 17.881 -7.116 7.099 1.00 20.87 N ATOM 2536 CA THR C 41 18.770 -6.522 6.109 1.00 21.68 C ATOM 2537 C THR C 41 19.150 -5.110 6.523 1.00 21.15 C ATOM 2538 O THR C 41 20.206 -4.591 6.147 1.00 20.79 O ATOM 2539 CB THR C 41 18.072 -6.496 4.726 1.00 22.88 C ATOM 2540 OG1 THR C 41 18.169 -7.811 4.131 1.00 28.19 O ATOM 2541 CG2 THR C 41 18.716 -5.484 3.786 1.00 23.68 C ATOM 0 H THR C 41 17.124 -7.356 6.768 1.00 20.87 H new ATOM 0 HA THR C 41 19.577 -7.058 6.050 1.00 21.68 H new ATOM 0 HB THR C 41 17.146 -6.238 4.859 1.00 22.88 H new ATOM 0 HG1 THR C 41 17.792 -7.808 3.380 1.00 28.19 H new ATOM 0 HG21 THR C 41 18.255 -5.495 2.933 1.00 23.68 H new ATOM 0 HG22 THR C 41 18.655 -4.597 4.174 1.00 23.68 H new ATOM 0 HG23 THR C 41 19.649 -5.715 3.652 1.00 23.68 H new ATOM 2542 N TYR C 42 18.318 -4.490 7.343 1.00 19.08 N ATOM 2543 CA TYR C 42 18.645 -3.137 7.811 1.00 18.28 C ATOM 2544 C TYR C 42 19.512 -3.146 9.041 1.00 17.38 C ATOM 2545 O TYR C 42 19.948 -2.102 9.485 1.00 16.46 O ATOM 2546 CB TYR C 42 17.375 -2.361 8.129 1.00 19.32 C ATOM 2547 CG TYR C 42 16.590 -1.978 6.901 1.00 19.33 C ATOM 2548 CD1 TYR C 42 16.845 -0.764 6.240 1.00 19.99 C ATOM 2549 CD2 TYR C 42 15.594 -2.833 6.382 1.00 17.67 C ATOM 2550 CE1 TYR C 42 16.137 -0.404 5.083 1.00 18.60 C ATOM 2551 CE2 TYR C 42 14.867 -2.453 5.245 1.00 18.78 C ATOM 2552 CZ TYR C 42 15.146 -1.256 4.606 1.00 18.27 C ATOM 2553 OH TYR C 42 14.440 -0.894 3.473 1.00 20.68 O ATOM 0 H TYR C 42 17.579 -4.816 7.638 1.00 19.08 H new ATOM 0 HA TYR C 42 19.135 -2.712 7.090 1.00 18.28 H new ATOM 0 HB2 TYR C 42 16.813 -2.896 8.711 1.00 19.32 H new ATOM 0 HB3 TYR C 42 17.608 -1.558 8.620 1.00 19.32 H new ATOM 0 HD1 TYR C 42 17.495 -0.189 6.575 1.00 19.99 H new ATOM 0 HD2 TYR C 42 15.420 -3.648 6.794 1.00 17.67 H new ATOM 0 HE1 TYR C 42 16.327 0.392 4.642 1.00 18.60 H new ATOM 0 HE2 TYR C 42 14.195 -3.007 4.919 1.00 18.78 H new ATOM 0 HH TYR C 42 13.876 -1.490 3.291 1.00 20.68 H new ATOM 2554 N PHE C 43 19.760 -4.320 9.621 1.00 17.96 N ATOM 2555 CA PHE C 43 20.538 -4.372 10.870 1.00 19.66 C ATOM 2556 C PHE C 43 21.650 -5.417 10.692 1.00 20.87 C ATOM 2557 O PHE C 43 21.644 -6.411 11.359 1.00 20.36 O ATOM 2558 CB PHE C 43 19.631 -4.812 12.041 1.00 19.36 C ATOM 2559 CG PHE C 43 18.440 -3.888 12.320 1.00 19.35 C ATOM 2560 CD1 PHE C 43 18.450 -3.052 13.417 1.00 17.26 C ATOM 2561 CD2 PHE C 43 17.274 -3.959 11.549 1.00 18.00 C ATOM 2562 CE1 PHE C 43 17.332 -2.219 13.696 1.00 19.23 C ATOM 2563 CE2 PHE C 43 16.135 -3.166 11.849 1.00 20.37 C ATOM 2564 CZ PHE C 43 16.184 -2.288 12.896 1.00 16.56 C ATOM 0 H PHE C 43 19.497 -5.082 9.321 1.00 17.96 H new ATOM 0 HA PHE C 43 20.907 -3.496 11.064 1.00 19.66 H new ATOM 0 HB2 PHE C 43 19.295 -5.703 11.855 1.00 19.36 H new ATOM 0 HB3 PHE C 43 20.170 -4.874 12.845 1.00 19.36 H new ATOM 0 HD1 PHE C 43 19.192 -3.033 13.977 1.00 17.26 H new ATOM 0 HD2 PHE C 43 17.245 -4.539 10.823 1.00 18.00 H new ATOM 0 HE1 PHE C 43 17.363 -1.626 14.412 1.00 19.23 H new ATOM 0 HE2 PHE C 43 15.362 -3.243 11.338 1.00 20.37 H new ATOM 0 HZ PHE C 43 15.457 -1.738 13.077 1.00 16.56 H new ATOM 2565 N PRO C 44 22.614 -5.198 9.765 1.00 22.98 N ATOM 2566 CA PRO C 44 23.595 -6.287 9.529 1.00 23.27 C ATOM 2567 C PRO C 44 24.560 -6.522 10.700 1.00 24.51 C ATOM 2568 O PRO C 44 25.130 -7.595 10.823 1.00 25.02 O ATOM 2569 CB PRO C 44 24.330 -5.823 8.283 1.00 24.44 C ATOM 2570 CG PRO C 44 24.281 -4.320 8.366 1.00 23.96 C ATOM 2571 CD PRO C 44 22.860 -4.034 8.898 1.00 22.77 C ATOM 0 HA PRO C 44 23.157 -7.147 9.431 1.00 23.27 H new ATOM 0 HB2 PRO C 44 25.244 -6.148 8.269 1.00 24.44 H new ATOM 0 HB3 PRO C 44 23.901 -6.148 7.476 1.00 24.44 H new ATOM 0 HG2 PRO C 44 24.962 -3.973 8.963 1.00 23.96 H new ATOM 0 HG3 PRO C 44 24.427 -3.910 7.499 1.00 23.96 H new ATOM 0 HD2 PRO C 44 22.819 -3.200 9.391 1.00 22.77 H new ATOM 0 HD3 PRO C 44 22.210 -3.972 8.181 1.00 22.77 H new ATOM 2572 N HIS C 45 24.679 -5.558 11.597 1.00 24.74 N ATOM 2573 CA HIS C 45 25.530 -5.705 12.762 1.00 26.31 C ATOM 2574 C HIS C 45 24.852 -6.235 14.017 1.00 26.94 C ATOM 2575 O HIS C 45 25.484 -6.268 15.081 1.00 27.89 O ATOM 2576 CB HIS C 45 26.162 -4.349 13.093 1.00 25.94 C ATOM 2577 CG HIS C 45 25.152 -3.292 13.393 1.00 28.21 C ATOM 2578 ND1 HIS C 45 24.241 -2.853 12.454 1.00 29.46 N ATOM 2579 CD2 HIS C 45 24.898 -2.592 14.528 1.00 26.76 C ATOM 2580 CE1 HIS C 45 23.471 -1.924 12.998 1.00 29.01 C ATOM 2581 NE2 HIS C 45 23.847 -1.751 14.254 1.00 28.57 N ATOM 0 H HIS C 45 24.270 -4.803 11.548 1.00 24.74 H new ATOM 0 HA HIS C 45 26.183 -6.377 12.512 1.00 26.31 H new ATOM 0 HB2 HIS C 45 26.753 -4.451 13.856 1.00 25.94 H new ATOM 0 HB3 HIS C 45 26.710 -4.062 12.346 1.00 25.94 H new ATOM 0 HD2 HIS C 45 25.350 -2.667 15.337 1.00 26.76 H new ATOM 0 HE1 HIS C 45 22.782 -1.470 12.569 1.00 29.01 H new ATOM 0 HE2 HIS C 45 23.491 -1.200 14.810 1.00 28.57 H new ATOM 2582 N PHE C 46 23.580 -6.631 13.930 1.00 26.72 N ATOM 2583 CA PHE C 46 22.873 -7.089 15.120 1.00 26.75 C ATOM 2584 C PHE C 46 23.192 -8.557 15.328 1.00 28.55 C ATOM 2585 O PHE C 46 23.360 -9.312 14.369 1.00 28.29 O ATOM 2586 CB PHE C 46 21.353 -6.890 14.981 1.00 25.27 C ATOM 2587 CG PHE C 46 20.818 -5.595 15.612 1.00 25.35 C ATOM 2588 CD1 PHE C 46 21.575 -4.412 15.604 1.00 23.58 C ATOM 2589 CD2 PHE C 46 19.544 -5.564 16.196 1.00 22.30 C ATOM 2590 CE1 PHE C 46 21.089 -3.213 16.194 1.00 20.60 C ATOM 2591 CE2 PHE C 46 19.048 -4.359 16.769 1.00 24.91 C ATOM 2592 CZ PHE C 46 19.833 -3.186 16.751 1.00 22.70 C ATOM 0 H PHE C 46 23.119 -6.641 13.204 1.00 26.72 H new ATOM 0 HA PHE C 46 23.163 -6.568 15.885 1.00 26.75 H new ATOM 0 HB2 PHE C 46 21.123 -6.896 14.039 1.00 25.27 H new ATOM 0 HB3 PHE C 46 20.901 -7.645 15.389 1.00 25.27 H new ATOM 0 HD1 PHE C 46 22.414 -4.413 15.203 1.00 23.58 H new ATOM 0 HD2 PHE C 46 19.021 -6.333 16.209 1.00 22.30 H new ATOM 0 HE1 PHE C 46 21.620 -2.449 16.203 1.00 20.60 H new ATOM 0 HE2 PHE C 46 18.203 -4.345 17.157 1.00 24.91 H new ATOM 0 HZ PHE C 46 19.501 -2.397 17.115 1.00 22.70 H new ATOM 2593 N ASP C 47 23.277 -8.947 16.597 1.00 29.42 N ATOM 2594 CA ASP C 47 23.157 -10.341 17.002 1.00 30.46 C ATOM 2595 C ASP C 47 21.656 -10.589 17.232 1.00 29.71 C ATOM 2596 O ASP C 47 21.011 -9.870 17.985 1.00 27.88 O ATOM 2597 CB ASP C 47 24.052 -10.572 18.244 1.00 31.25 C ATOM 2598 CG ASP C 47 23.650 -11.782 19.076 1.00 34.76 C ATOM 2599 OD1 ASP C 47 23.304 -12.850 18.510 1.00 36.62 O ATOM 2600 OD2 ASP C 47 23.719 -11.651 20.324 1.00 37.62 O ATOM 0 H ASP C 47 23.407 -8.404 17.251 1.00 29.42 H new ATOM 0 HA ASP C 47 23.467 -10.977 16.339 1.00 30.46 H new ATOM 0 HB2 ASP C 47 24.971 -10.681 17.954 1.00 31.25 H new ATOM 0 HB3 ASP C 47 24.023 -9.781 18.804 1.00 31.25 H new ATOM 2601 N PHE C 48 21.117 -11.569 16.510 1.00 30.01 N ATOM 2602 CA PHE C 48 19.682 -11.867 16.472 1.00 31.66 C ATOM 2603 C PHE C 48 19.349 -13.032 17.397 1.00 33.16 C ATOM 2604 O PHE C 48 18.242 -13.566 17.356 1.00 33.66 O ATOM 2605 CB PHE C 48 19.222 -12.203 15.027 1.00 31.03 C ATOM 2606 CG PHE C 48 19.373 -11.064 14.065 1.00 29.99 C ATOM 2607 CD1 PHE C 48 18.498 -9.964 14.112 1.00 28.15 C ATOM 2608 CD2 PHE C 48 20.399 -11.077 13.117 1.00 30.86 C ATOM 2609 CE1 PHE C 48 18.642 -8.864 13.206 1.00 29.39 C ATOM 2610 CE2 PHE C 48 20.564 -9.994 12.213 1.00 31.76 C ATOM 2611 CZ PHE C 48 19.666 -8.887 12.254 1.00 29.24 C ATOM 0 H PHE C 48 21.586 -12.094 16.015 1.00 30.01 H new ATOM 0 HA PHE C 48 19.210 -11.076 16.775 1.00 31.66 H new ATOM 0 HB2 PHE C 48 19.733 -12.960 14.702 1.00 31.03 H new ATOM 0 HB3 PHE C 48 18.292 -12.477 15.048 1.00 31.03 H new ATOM 0 HD1 PHE C 48 17.814 -9.951 14.742 1.00 28.15 H new ATOM 0 HD2 PHE C 48 20.980 -11.802 13.077 1.00 30.86 H new ATOM 0 HE1 PHE C 48 18.059 -8.141 13.251 1.00 29.39 H new ATOM 0 HE2 PHE C 48 21.258 -10.007 11.594 1.00 31.76 H new ATOM 0 HZ PHE C 48 19.761 -8.185 11.652 1.00 29.24 H new ATOM 2612 N THR C 49 20.323 -13.430 18.197 1.00 35.15 N ATOM 2613 CA THR C 49 20.122 -14.389 19.264 1.00 37.50 C ATOM 2614 C THR C 49 19.014 -13.915 20.188 1.00 38.32 C ATOM 2615 O THR C 49 19.014 -12.783 20.645 1.00 38.53 O ATOM 2616 CB THR C 49 21.424 -14.577 20.056 1.00 37.65 C ATOM 2617 OG1 THR C 49 22.360 -15.311 19.267 1.00 38.92 O ATOM 2618 CG2 THR C 49 21.176 -15.287 21.367 1.00 39.32 C ATOM 0 H THR C 49 21.132 -13.146 18.134 1.00 35.15 H new ATOM 0 HA THR C 49 19.865 -15.240 18.876 1.00 37.50 H new ATOM 0 HB THR C 49 21.786 -13.701 20.261 1.00 37.65 H new ATOM 0 HG1 THR C 49 22.860 -14.776 18.855 1.00 38.92 H new ATOM 0 HG21 THR C 49 22.015 -15.391 21.843 1.00 39.32 H new ATOM 0 HG22 THR C 49 20.561 -14.766 21.906 1.00 39.32 H new ATOM 0 HG23 THR C 49 20.793 -16.161 21.194 1.00 39.32 H new ATOM 2619 N HIS C 50 18.062 -14.796 20.452 1.00 40.26 N ATOM 2620 CA HIS C 50 16.947 -14.471 21.314 1.00 41.21 C ATOM 2621 C HIS C 50 17.381 -13.796 22.608 1.00 40.78 C ATOM 2622 O HIS C 50 18.268 -14.255 23.294 1.00 41.51 O ATOM 2623 CB HIS C 50 16.108 -15.708 21.619 1.00 42.30 C ATOM 2624 CG HIS C 50 15.261 -15.554 22.841 1.00 45.86 C ATOM 2625 ND1 HIS C 50 14.228 -14.648 22.915 1.00 48.10 N ATOM 2626 CD2 HIS C 50 15.318 -16.157 24.049 1.00 48.21 C ATOM 2627 CE1 HIS C 50 13.674 -14.710 24.109 1.00 48.64 C ATOM 2628 NE2 HIS C 50 14.319 -15.617 24.818 1.00 49.29 N ATOM 0 H HIS C 50 18.046 -15.596 20.136 1.00 40.26 H new ATOM 0 HA HIS C 50 16.403 -13.834 20.826 1.00 41.21 H new ATOM 0 HB2 HIS C 50 15.537 -15.901 20.859 1.00 42.30 H new ATOM 0 HB3 HIS C 50 16.696 -16.471 21.733 1.00 42.30 H new ATOM 0 HD2 HIS C 50 15.921 -16.815 24.310 1.00 48.21 H new ATOM 0 HE1 HIS C 50 12.952 -14.202 24.402 1.00 48.64 H new ATOM 0 HE2 HIS C 50 14.142 -15.834 25.631 1.00 49.29 H new ATOM 2629 N GLY C 51 16.756 -12.682 22.930 1.00 39.36 N ATOM 2630 CA GLY C 51 17.124 -11.974 24.133 1.00 39.14 C ATOM 2631 C GLY C 51 18.445 -11.240 24.127 1.00 38.69 C ATOM 2632 O GLY C 51 18.886 -10.790 25.168 1.00 38.63 O ATOM 0 H GLY C 51 16.123 -12.323 22.471 1.00 39.36 H new ATOM 0 HA2 GLY C 51 16.424 -11.332 24.329 1.00 39.14 H new ATOM 0 HA3 GLY C 51 17.138 -12.611 24.864 1.00 39.14 H new ATOM 2633 N SER C 52 19.065 -11.108 22.956 1.00 38.00 N ATOM 2634 CA SER C 52 20.300 -10.353 22.807 1.00 35.95 C ATOM 2635 C SER C 52 20.274 -8.988 23.487 1.00 36.26 C ATOM 2636 O SER C 52 19.247 -8.339 23.515 1.00 35.27 O ATOM 2637 CB SER C 52 20.720 -10.260 21.337 1.00 35.78 C ATOM 2638 OG SER C 52 20.243 -9.113 20.676 1.00 34.17 O ATOM 0 H SER C 52 18.777 -11.457 22.224 1.00 38.00 H new ATOM 0 HA SER C 52 20.981 -10.856 23.281 1.00 35.95 H new ATOM 0 HB2 SER C 52 21.689 -10.272 21.286 1.00 35.78 H new ATOM 0 HB3 SER C 52 20.401 -11.048 20.869 1.00 35.78 H new ATOM 0 HG SER C 52 20.397 -9.179 19.853 1.00 34.17 H new ATOM 2639 N GLU C 53 21.404 -8.561 24.044 1.00 35.57 N ATOM 2640 CA GLU C 53 21.439 -7.272 24.748 1.00 36.31 C ATOM 2641 C GLU C 53 21.211 -6.130 23.754 1.00 33.46 C ATOM 2642 O GLU C 53 20.767 -5.038 24.101 1.00 33.87 O ATOM 2643 CB GLU C 53 22.764 -7.100 25.525 1.00 36.33 C ATOM 2644 CG GLU C 53 22.883 -7.961 26.833 1.00 39.30 C ATOM 2645 CD GLU C 53 24.360 -8.359 27.228 1.00 41.17 C ATOM 2646 OE1 GLU C 53 25.304 -8.219 26.382 1.00 45.97 O ATOM 2647 OE2 GLU C 53 24.563 -8.843 28.389 1.00 45.38 O ATOM 0 H GLU C 53 22.150 -8.989 24.029 1.00 35.57 H new ATOM 0 HA GLU C 53 20.723 -7.251 25.402 1.00 36.31 H new ATOM 0 HB2 GLU C 53 23.500 -7.327 24.936 1.00 36.33 H new ATOM 0 HB3 GLU C 53 22.867 -6.164 25.759 1.00 36.33 H new ATOM 0 HG2 GLU C 53 22.486 -7.468 27.568 1.00 39.30 H new ATOM 0 HG3 GLU C 53 22.361 -8.771 26.721 1.00 39.30 H new ATOM 2648 N GLN C 54 21.549 -6.394 22.505 1.00 31.97 N ATOM 2649 CA GLN C 54 21.427 -5.406 21.443 1.00 29.53 C ATOM 2650 C GLN C 54 19.961 -5.131 21.097 1.00 27.29 C ATOM 2651 O GLN C 54 19.516 -3.972 21.030 1.00 26.00 O ATOM 2652 CB GLN C 54 22.153 -5.938 20.206 1.00 29.78 C ATOM 2653 CG GLN C 54 22.662 -4.886 19.328 1.00 29.19 C ATOM 2654 CD GLN C 54 23.896 -5.320 18.580 1.00 31.48 C ATOM 2655 OE1 GLN C 54 24.110 -6.519 18.318 1.00 31.89 O ATOM 2656 NE2 GLN C 54 24.726 -4.338 18.213 1.00 30.39 N ATOM 0 H GLN C 54 21.857 -7.154 22.245 1.00 31.97 H new ATOM 0 HA GLN C 54 21.820 -4.572 21.743 1.00 29.53 H new ATOM 0 HB2 GLN C 54 22.893 -6.498 20.490 1.00 29.78 H new ATOM 0 HB3 GLN C 54 21.547 -6.504 19.703 1.00 29.78 H new ATOM 0 HG2 GLN C 54 21.973 -4.634 18.694 1.00 29.19 H new ATOM 0 HG3 GLN C 54 22.865 -4.097 19.855 1.00 29.19 H new ATOM 0 HE21 GLN C 54 24.542 -3.522 18.413 1.00 30.39 H new ATOM 0 HE22 GLN C 54 25.444 -4.522 17.777 1.00 30.39 H new ATOM 2657 N ILE C 55 19.228 -6.213 20.868 1.00 25.41 N ATOM 2658 CA ILE C 55 17.789 -6.131 20.657 1.00 25.71 C ATOM 2659 C ILE C 55 17.096 -5.526 21.886 1.00 25.37 C ATOM 2660 O ILE C 55 16.213 -4.660 21.760 1.00 25.09 O ATOM 2661 CB ILE C 55 17.207 -7.485 20.323 1.00 24.42 C ATOM 2662 CG1 ILE C 55 17.625 -7.865 18.898 1.00 26.09 C ATOM 2663 CG2 ILE C 55 15.692 -7.438 20.454 1.00 26.17 C ATOM 2664 CD1 ILE C 55 17.287 -9.307 18.508 1.00 25.47 C ATOM 0 H ILE C 55 19.548 -7.010 20.831 1.00 25.41 H new ATOM 0 HA ILE C 55 17.631 -5.547 19.899 1.00 25.71 H new ATOM 0 HB ILE C 55 17.541 -8.156 20.938 1.00 24.42 H new ATOM 0 HG12 ILE C 55 17.193 -7.262 18.273 1.00 26.09 H new ATOM 0 HG13 ILE C 55 18.581 -7.731 18.806 1.00 26.09 H new ATOM 0 HG21 ILE C 55 15.321 -8.308 20.239 1.00 26.17 H new ATOM 0 HG22 ILE C 55 15.453 -7.201 21.364 1.00 26.17 H new ATOM 0 HG23 ILE C 55 15.335 -6.775 19.843 1.00 26.17 H new ATOM 0 HD11 ILE C 55 17.580 -9.473 17.598 1.00 25.47 H new ATOM 0 HD12 ILE C 55 17.739 -9.919 19.110 1.00 25.47 H new ATOM 0 HD13 ILE C 55 16.328 -9.443 18.569 1.00 25.47 H new ATOM 2665 N LYS C 56 17.545 -5.934 23.072 1.00 24.85 N ATOM 2666 CA LYS C 56 17.044 -5.329 24.320 1.00 25.32 C ATOM 2667 C LYS C 56 17.289 -3.826 24.382 1.00 23.73 C ATOM 2668 O LYS C 56 16.371 -3.051 24.671 1.00 22.89 O ATOM 2669 CB LYS C 56 17.638 -6.060 25.552 1.00 26.63 C ATOM 2670 CG LYS C 56 16.974 -7.430 25.844 1.00 31.54 C ATOM 2671 CD LYS C 56 15.567 -7.211 26.420 1.00 38.82 C ATOM 2672 CE LYS C 56 14.664 -8.433 26.314 1.00 37.56 C ATOM 2673 NZ LYS C 56 13.445 -8.198 27.158 1.00 39.84 N ATOM 0 H LYS C 56 18.133 -6.552 23.182 1.00 24.85 H new ATOM 0 HA LYS C 56 16.081 -5.443 24.332 1.00 25.32 H new ATOM 0 HB2 LYS C 56 18.588 -6.194 25.412 1.00 26.63 H new ATOM 0 HB3 LYS C 56 17.544 -5.491 26.332 1.00 26.63 H new ATOM 0 HG2 LYS C 56 16.922 -7.954 25.029 1.00 31.54 H new ATOM 0 HG3 LYS C 56 17.515 -7.934 26.472 1.00 31.54 H new ATOM 0 HD2 LYS C 56 15.644 -6.956 27.353 1.00 38.82 H new ATOM 0 HD3 LYS C 56 15.149 -6.469 25.957 1.00 38.82 H new ATOM 0 HE2 LYS C 56 14.410 -8.586 25.390 1.00 37.56 H new ATOM 0 HE3 LYS C 56 15.134 -9.227 26.614 1.00 37.56 H new ATOM 0 HZ1 LYS C 56 13.408 -8.810 27.803 1.00 39.84 H new ATOM 0 HZ2 LYS C 56 13.487 -7.386 27.521 1.00 39.84 H new ATOM 0 HZ3 LYS C 56 12.716 -8.258 26.651 1.00 39.84 H new ATOM 2674 N ALA C 57 18.531 -3.418 24.105 1.00 22.71 N ATOM 2675 CA ALA C 57 18.898 -2.009 24.074 1.00 21.17 C ATOM 2676 C ALA C 57 18.106 -1.277 22.993 1.00 21.44 C ATOM 2677 O ALA C 57 17.608 -0.179 23.253 1.00 21.78 O ATOM 2678 CB ALA C 57 20.399 -1.861 23.794 1.00 22.49 C ATOM 0 H ALA C 57 19.180 -3.954 23.931 1.00 22.71 H new ATOM 0 HA ALA C 57 18.691 -1.620 24.938 1.00 21.17 H new ATOM 0 HB1 ALA C 57 20.634 -0.920 23.775 1.00 22.49 H new ATOM 0 HB2 ALA C 57 20.904 -2.306 24.492 1.00 22.49 H new ATOM 0 HB3 ALA C 57 20.610 -2.263 22.937 1.00 22.49 H new ATOM 2679 N HIS C 58 17.992 -1.870 21.787 1.00 20.52 N ATOM 2680 CA HIS C 58 17.180 -1.270 20.700 1.00 20.13 C ATOM 2681 C HIS C 58 15.677 -1.070 21.080 1.00 20.04 C ATOM 2682 O HIS C 58 15.140 -0.007 20.858 1.00 19.72 O ATOM 2683 CB HIS C 58 17.319 -2.051 19.357 1.00 19.87 C ATOM 2684 CG HIS C 58 16.778 -1.298 18.171 1.00 20.54 C ATOM 2685 ND1 HIS C 58 17.334 -0.116 17.722 1.00 21.37 N ATOM 2686 CD2 HIS C 58 15.716 -1.542 17.361 1.00 23.14 C ATOM 2687 CE1 HIS C 58 16.627 0.346 16.705 1.00 22.76 C ATOM 2688 NE2 HIS C 58 15.644 -0.507 16.457 1.00 20.49 N ATOM 0 H HIS C 58 18.372 -2.613 21.579 1.00 20.52 H new ATOM 0 HA HIS C 58 17.551 -0.383 20.569 1.00 20.13 H new ATOM 0 HB2 HIS C 58 18.255 -2.254 19.204 1.00 19.87 H new ATOM 0 HB3 HIS C 58 16.854 -2.899 19.434 1.00 19.87 H new ATOM 0 HD2 HIS C 58 15.143 -2.273 17.408 1.00 23.14 H new ATOM 0 HE1 HIS C 58 16.792 1.136 16.242 1.00 22.76 H new ATOM 0 HE2 HIS C 58 15.057 -0.427 15.833 1.00 20.49 H new ATOM 2689 N GLY C 59 15.010 -2.117 21.583 1.00 20.58 N ATOM 2690 CA GLY C 59 13.605 -2.031 22.047 1.00 20.84 C ATOM 2691 C GLY C 59 13.381 -0.888 23.029 1.00 22.16 C ATOM 2692 O GLY C 59 12.397 -0.176 22.925 1.00 21.09 O ATOM 0 H GLY C 59 15.355 -2.900 21.667 1.00 20.58 H new ATOM 0 HA2 GLY C 59 13.022 -1.914 21.281 1.00 20.84 H new ATOM 0 HA3 GLY C 59 13.355 -2.868 22.468 1.00 20.84 H new ATOM 2693 N LYS C 60 14.312 -0.706 23.962 1.00 22.67 N ATOM 2694 CA LYS C 60 14.304 0.442 24.857 1.00 25.40 C ATOM 2695 C LYS C 60 14.229 1.785 24.149 1.00 24.35 C ATOM 2696 O LYS C 60 13.387 2.640 24.498 1.00 24.00 O ATOM 2697 CB LYS C 60 15.523 0.424 25.806 1.00 24.49 C ATOM 2698 CG LYS C 60 15.122 0.792 27.256 1.00 28.43 C ATOM 2699 CD LYS C 60 16.237 0.439 28.247 1.00 29.41 C ATOM 2700 CE LYS C 60 16.643 -1.040 28.110 1.00 35.20 C ATOM 2701 NZ LYS C 60 17.958 -1.338 28.778 1.00 38.70 N ATOM 0 H LYS C 60 14.967 -1.248 24.092 1.00 22.67 H new ATOM 0 HA LYS C 60 13.485 0.351 25.369 1.00 25.40 H new ATOM 0 HB2 LYS C 60 15.929 -0.457 25.795 1.00 24.49 H new ATOM 0 HB3 LYS C 60 16.192 1.049 25.486 1.00 24.49 H new ATOM 0 HG2 LYS C 60 14.927 1.741 27.309 1.00 28.43 H new ATOM 0 HG3 LYS C 60 14.309 0.321 27.499 1.00 28.43 H new ATOM 0 HD2 LYS C 60 17.008 1.006 28.089 1.00 29.41 H new ATOM 0 HD3 LYS C 60 15.938 0.614 29.153 1.00 29.41 H new ATOM 0 HE2 LYS C 60 15.952 -1.600 28.498 1.00 35.20 H new ATOM 0 HE3 LYS C 60 16.701 -1.271 27.170 1.00 35.20 H new ATOM 0 HZ1 LYS C 60 18.155 -2.200 28.676 1.00 38.70 H new ATOM 0 HZ2 LYS C 60 18.598 -0.842 28.408 1.00 38.70 H new ATOM 0 HZ3 LYS C 60 17.900 -1.148 29.646 1.00 38.70 H new ATOM 2702 N LYS C 61 15.095 1.987 23.151 1.00 23.55 N ATOM 2703 CA LYS C 61 15.119 3.272 22.436 1.00 24.14 C ATOM 2704 C LYS C 61 13.829 3.541 21.641 1.00 23.20 C ATOM 2705 O LYS C 61 13.335 4.675 21.597 1.00 24.26 O ATOM 2706 CB LYS C 61 16.293 3.311 21.476 1.00 23.70 C ATOM 2707 CG LYS C 61 17.673 3.214 22.098 1.00 26.57 C ATOM 2708 CD LYS C 61 18.547 2.759 20.926 1.00 32.22 C ATOM 2709 CE LYS C 61 20.016 3.061 21.066 1.00 37.06 C ATOM 2710 NZ LYS C 61 20.668 2.632 19.741 1.00 36.28 N ATOM 0 H LYS C 61 15.667 1.407 22.875 1.00 23.55 H new ATOM 0 HA LYS C 61 15.201 3.960 23.114 1.00 24.14 H new ATOM 0 HB2 LYS C 61 16.193 2.583 20.843 1.00 23.70 H new ATOM 0 HB3 LYS C 61 16.245 4.137 20.969 1.00 23.70 H new ATOM 0 HG2 LYS C 61 17.967 4.067 22.455 1.00 26.57 H new ATOM 0 HG3 LYS C 61 17.693 2.578 22.830 1.00 26.57 H new ATOM 0 HD2 LYS C 61 18.438 1.802 20.812 1.00 32.22 H new ATOM 0 HD3 LYS C 61 18.221 3.180 20.115 1.00 32.22 H new ATOM 0 HE2 LYS C 61 20.161 4.005 21.234 1.00 37.06 H new ATOM 0 HE3 LYS C 61 20.400 2.577 21.814 1.00 37.06 H new ATOM 0 HZ1 LYS C 61 21.533 2.472 19.874 1.00 36.28 H new ATOM 0 HZ2 LYS C 61 20.273 1.893 19.441 1.00 36.28 H new ATOM 0 HZ3 LYS C 61 20.576 3.282 19.140 1.00 36.28 H new ATOM 2711 N VAL C 62 13.293 2.501 21.013 1.00 23.27 N ATOM 2712 CA VAL C 62 12.002 2.591 20.265 1.00 22.73 C ATOM 2713 C VAL C 62 10.849 2.976 21.224 1.00 22.92 C ATOM 2714 O VAL C 62 10.059 3.921 20.978 1.00 20.23 O ATOM 2715 CB VAL C 62 11.711 1.269 19.469 1.00 22.95 C ATOM 2716 CG1 VAL C 62 10.345 1.321 18.726 1.00 23.27 C ATOM 2717 CG2 VAL C 62 12.845 1.000 18.476 1.00 20.03 C ATOM 0 H VAL C 62 13.652 1.720 20.998 1.00 23.27 H new ATOM 0 HA VAL C 62 12.074 3.297 19.603 1.00 22.73 H new ATOM 0 HB VAL C 62 11.661 0.544 20.111 1.00 22.95 H new ATOM 0 HG11 VAL C 62 10.204 0.488 18.249 1.00 23.27 H new ATOM 0 HG12 VAL C 62 9.631 1.449 19.370 1.00 23.27 H new ATOM 0 HG13 VAL C 62 10.347 2.058 18.096 1.00 23.27 H new ATOM 0 HG21 VAL C 62 12.660 0.183 17.987 1.00 20.03 H new ATOM 0 HG22 VAL C 62 12.912 1.741 17.853 1.00 20.03 H new ATOM 0 HG23 VAL C 62 13.682 0.906 18.958 1.00 20.03 H new ATOM 2718 N SER C 63 10.772 2.289 22.359 1.00 23.99 N ATOM 2719 CA SER C 63 9.710 2.654 23.293 1.00 23.87 C ATOM 2720 C SER C 63 9.922 4.075 23.871 1.00 23.61 C ATOM 2721 O SER C 63 8.929 4.782 24.075 1.00 22.64 O ATOM 2722 CB SER C 63 9.534 1.633 24.397 1.00 24.61 C ATOM 2723 OG SER C 63 10.651 1.669 25.251 1.00 29.42 O ATOM 0 H SER C 63 11.290 1.646 22.599 1.00 23.99 H new ATOM 0 HA SER C 63 8.885 2.661 22.782 1.00 23.87 H new ATOM 0 HB2 SER C 63 8.725 1.821 24.898 1.00 24.61 H new ATOM 0 HB3 SER C 63 9.433 0.746 24.018 1.00 24.61 H new ATOM 0 HG SER C 63 11.313 1.975 24.834 1.00 29.42 H new ATOM 2724 N GLU C 64 11.168 4.527 24.068 1.00 23.20 N ATOM 2725 CA GLU C 64 11.383 5.959 24.477 1.00 22.80 C ATOM 2726 C GLU C 64 10.895 6.919 23.420 1.00 21.84 C ATOM 2727 O GLU C 64 10.289 7.934 23.733 1.00 19.66 O ATOM 2728 CB GLU C 64 12.837 6.324 24.710 1.00 23.93 C ATOM 2729 CG GLU C 64 13.423 5.979 26.024 1.00 29.58 C ATOM 2730 CD GLU C 64 14.955 6.147 26.000 1.00 34.79 C ATOM 2731 OE1 GLU C 64 15.490 6.683 25.022 1.00 38.55 O ATOM 2732 OE2 GLU C 64 15.635 5.698 26.937 1.00 38.14 O ATOM 0 H GLU C 64 11.883 4.057 23.979 1.00 23.20 H new ATOM 0 HA GLU C 64 10.885 6.035 25.306 1.00 22.80 H new ATOM 0 HB2 GLU C 64 13.368 5.893 24.022 1.00 23.93 H new ATOM 0 HB3 GLU C 64 12.930 7.281 24.582 1.00 23.93 H new ATOM 0 HG2 GLU C 64 13.042 6.547 26.712 1.00 29.58 H new ATOM 0 HG3 GLU C 64 13.197 5.064 26.254 1.00 29.58 H new ATOM 2733 N ALA C 65 11.199 6.619 22.152 1.00 20.57 N ATOM 2734 CA ALA C 65 10.738 7.434 21.061 1.00 19.59 C ATOM 2735 C ALA C 65 9.177 7.523 20.981 1.00 19.09 C ATOM 2736 O ALA C 65 8.628 8.600 20.755 1.00 17.92 O ATOM 2737 CB ALA C 65 11.357 6.937 19.746 1.00 19.59 C ATOM 0 H ALA C 65 11.674 5.942 21.917 1.00 20.57 H new ATOM 0 HA ALA C 65 11.036 8.343 21.223 1.00 19.59 H new ATOM 0 HB1 ALA C 65 11.044 7.489 19.012 1.00 19.59 H new ATOM 0 HB2 ALA C 65 12.324 6.992 19.802 1.00 19.59 H new ATOM 0 HB3 ALA C 65 11.094 6.016 19.592 1.00 19.59 H new ATOM 2738 N LEU C 66 8.479 6.404 21.207 1.00 18.81 N ATOM 2739 CA LEU C 66 7.011 6.389 21.235 1.00 19.85 C ATOM 2740 C LEU C 66 6.443 7.158 22.447 1.00 20.95 C ATOM 2741 O LEU C 66 5.451 7.889 22.327 1.00 20.94 O ATOM 2742 CB LEU C 66 6.459 4.947 21.154 1.00 18.70 C ATOM 2743 CG LEU C 66 6.757 4.303 19.771 1.00 20.52 C ATOM 2744 CD1 LEU C 66 6.295 2.832 19.684 1.00 21.49 C ATOM 2745 CD2 LEU C 66 6.221 5.134 18.543 1.00 14.79 C ATOM 0 H LEU C 66 8.841 5.637 21.348 1.00 18.81 H new ATOM 0 HA LEU C 66 6.706 6.860 20.443 1.00 19.85 H new ATOM 0 HB2 LEU C 66 6.855 4.407 21.856 1.00 18.70 H new ATOM 0 HB3 LEU C 66 5.502 4.956 21.309 1.00 18.70 H new ATOM 0 HG LEU C 66 7.725 4.316 19.707 1.00 20.52 H new ATOM 0 HD11 LEU C 66 6.503 2.479 18.805 1.00 21.49 H new ATOM 0 HD12 LEU C 66 6.753 2.308 20.359 1.00 21.49 H new ATOM 0 HD13 LEU C 66 5.338 2.784 19.833 1.00 21.49 H new ATOM 0 HD21 LEU C 66 6.443 4.673 17.719 1.00 14.79 H new ATOM 0 HD22 LEU C 66 5.258 5.228 18.611 1.00 14.79 H new ATOM 0 HD23 LEU C 66 6.632 6.013 18.542 1.00 14.79 H new ATOM 2746 N THR C 67 7.098 7.037 23.598 1.00 20.95 N ATOM 2747 CA THR C 67 6.642 7.783 24.778 1.00 21.53 C ATOM 2748 C THR C 67 6.704 9.290 24.510 1.00 22.15 C ATOM 2749 O THR C 67 5.709 10.020 24.759 1.00 22.50 O ATOM 2750 CB THR C 67 7.394 7.316 26.007 1.00 21.48 C ATOM 2751 OG1 THR C 67 7.216 5.900 26.084 1.00 21.92 O ATOM 2752 CG2 THR C 67 6.834 7.955 27.365 1.00 23.11 C ATOM 0 H THR C 67 7.791 6.543 23.721 1.00 20.95 H new ATOM 0 HA THR C 67 5.708 7.598 24.962 1.00 21.53 H new ATOM 0 HB THR C 67 8.321 7.587 25.921 1.00 21.48 H new ATOM 0 HG1 THR C 67 7.750 5.521 25.557 1.00 21.92 H new ATOM 0 HG21 THR C 67 7.350 7.623 28.116 1.00 23.11 H new ATOM 0 HG22 THR C 67 6.910 8.921 27.323 1.00 23.11 H new ATOM 0 HG23 THR C 67 5.903 7.709 27.479 1.00 23.11 H new ATOM 2753 N LYS C 68 7.818 9.740 23.926 1.00 21.62 N ATOM 2754 CA LYS C 68 7.995 11.140 23.520 1.00 22.61 C ATOM 2755 C LYS C 68 6.950 11.680 22.517 1.00 22.28 C ATOM 2756 O LYS C 68 6.441 12.805 22.676 1.00 22.76 O ATOM 2757 CB LYS C 68 9.405 11.333 22.945 1.00 23.37 C ATOM 2758 CG LYS C 68 9.596 12.704 22.328 1.00 25.72 C ATOM 2759 CD LYS C 68 11.078 12.960 22.045 1.00 34.54 C ATOM 2760 CE LYS C 68 11.333 14.405 21.604 1.00 37.76 C ATOM 2761 NZ LYS C 68 12.801 14.611 21.391 1.00 40.39 N ATOM 0 H LYS C 68 8.496 9.240 23.753 1.00 21.62 H new ATOM 0 HA LYS C 68 7.863 11.658 24.329 1.00 22.61 H new ATOM 0 HB2 LYS C 68 10.059 11.205 23.650 1.00 23.37 H new ATOM 0 HB3 LYS C 68 9.574 10.653 22.274 1.00 23.37 H new ATOM 0 HG2 LYS C 68 9.088 12.768 21.504 1.00 25.72 H new ATOM 0 HG3 LYS C 68 9.253 13.385 22.927 1.00 25.72 H new ATOM 0 HD2 LYS C 68 11.597 12.769 22.842 1.00 34.54 H new ATOM 0 HD3 LYS C 68 11.385 12.352 21.354 1.00 34.54 H new ATOM 0 HE2 LYS C 68 10.848 14.594 20.785 1.00 37.76 H new ATOM 0 HE3 LYS C 68 11.004 15.021 22.277 1.00 37.76 H new ATOM 0 HZ1 LYS C 68 12.949 15.450 21.135 1.00 40.39 H new ATOM 0 HZ2 LYS C 68 13.237 14.452 22.151 1.00 40.39 H new ATOM 0 HZ3 LYS C 68 13.091 14.053 20.761 1.00 40.39 H new ATOM 2762 N ALA C 69 6.662 10.901 21.473 1.00 21.26 N ATOM 2763 CA ALA C 69 5.572 11.182 20.533 1.00 21.75 C ATOM 2764 C ALA C 69 4.191 11.371 21.232 1.00 22.39 C ATOM 2765 O ALA C 69 3.456 12.336 20.896 1.00 23.47 O ATOM 2766 CB ALA C 69 5.487 10.050 19.433 1.00 20.61 C ATOM 0 H ALA C 69 7.100 10.184 21.288 1.00 21.26 H new ATOM 0 HA ALA C 69 5.783 12.029 20.110 1.00 21.75 H new ATOM 0 HB1 ALA C 69 4.763 10.249 18.819 1.00 20.61 H new ATOM 0 HB2 ALA C 69 6.324 10.011 18.944 1.00 20.61 H new ATOM 0 HB3 ALA C 69 5.323 9.195 19.860 1.00 20.61 H new ATOM 2767 N VAL C 70 3.862 10.495 22.199 1.00 22.12 N ATOM 2768 CA VAL C 70 2.567 10.512 22.914 1.00 23.28 C ATOM 2769 C VAL C 70 2.421 11.875 23.648 1.00 25.03 C ATOM 2770 O VAL C 70 1.306 12.471 23.682 1.00 24.71 O ATOM 2771 CB VAL C 70 2.405 9.257 23.893 1.00 23.43 C ATOM 2772 CG1 VAL C 70 1.328 9.439 24.938 1.00 22.74 C ATOM 2773 CG2 VAL C 70 2.173 7.992 23.112 1.00 22.60 C ATOM 0 H VAL C 70 4.389 9.868 22.461 1.00 22.12 H new ATOM 0 HA VAL C 70 1.843 10.426 22.274 1.00 23.28 H new ATOM 0 HB VAL C 70 3.244 9.187 24.375 1.00 23.43 H new ATOM 0 HG11 VAL C 70 1.281 8.647 25.496 1.00 22.74 H new ATOM 0 HG12 VAL C 70 1.538 10.210 25.488 1.00 22.74 H new ATOM 0 HG13 VAL C 70 0.473 9.577 24.501 1.00 22.74 H new ATOM 0 HG21 VAL C 70 2.078 7.246 23.725 1.00 22.60 H new ATOM 0 HG22 VAL C 70 1.364 8.081 22.584 1.00 22.60 H new ATOM 0 HG23 VAL C 70 2.927 7.832 22.523 1.00 22.60 H new ATOM 2774 N GLY C 71 3.564 12.368 24.134 1.00 25.03 N ATOM 2775 CA GLY C 71 3.710 13.716 24.726 1.00 26.64 C ATOM 2776 C GLY C 71 3.589 14.866 23.742 1.00 27.20 C ATOM 2777 O GLY C 71 3.346 15.991 24.169 1.00 28.46 O ATOM 0 H GLY C 71 4.298 11.920 24.131 1.00 25.03 H new ATOM 0 HA2 GLY C 71 3.037 13.826 25.416 1.00 26.64 H new ATOM 0 HA3 GLY C 71 4.575 13.771 25.162 1.00 26.64 H new ATOM 2778 N HIS C 72 3.725 14.614 22.430 1.00 27.90 N ATOM 2779 CA HIS C 72 3.724 15.693 21.425 1.00 27.96 C ATOM 2780 C HIS C 72 2.821 15.396 20.252 1.00 28.62 C ATOM 2781 O HIS C 72 3.239 15.531 19.102 1.00 28.33 O ATOM 2782 CB HIS C 72 5.139 15.980 20.878 1.00 28.99 C ATOM 2783 CG HIS C 72 6.127 16.381 21.925 1.00 30.04 C ATOM 2784 ND1 HIS C 72 6.736 15.470 22.764 1.00 31.99 N ATOM 2785 CD2 HIS C 72 6.597 17.600 22.286 1.00 34.17 C ATOM 2786 CE1 HIS C 72 7.554 16.109 23.585 1.00 35.03 C ATOM 2787 NE2 HIS C 72 7.480 17.402 23.319 1.00 34.71 N ATOM 0 H HIS C 72 3.819 13.825 22.102 1.00 27.90 H new ATOM 0 HA HIS C 72 3.389 16.472 21.897 1.00 27.96 H new ATOM 0 HB2 HIS C 72 5.467 15.188 20.424 1.00 28.99 H new ATOM 0 HB3 HIS C 72 5.082 16.685 20.214 1.00 28.99 H new ATOM 0 HD1 HIS C 72 6.605 14.620 22.755 1.00 31.99 H new ATOM 0 HD2 HIS C 72 6.365 18.416 21.906 1.00 34.17 H new ATOM 0 HE1 HIS C 72 8.089 15.716 24.237 1.00 35.03 H new ATOM 2788 N LEU C 73 1.590 14.970 20.527 1.00 28.72 N ATOM 2789 CA LEU C 73 0.678 14.511 19.470 1.00 29.74 C ATOM 2790 C LEU C 73 0.266 15.619 18.494 1.00 30.98 C ATOM 2791 O LEU C 73 -0.019 15.361 17.311 1.00 31.80 O ATOM 2792 CB LEU C 73 -0.569 13.837 20.094 1.00 29.16 C ATOM 2793 CG LEU C 73 -0.343 12.445 20.659 1.00 28.14 C ATOM 2794 CD1 LEU C 73 -1.633 11.852 21.240 1.00 29.01 C ATOM 2795 CD2 LEU C 73 0.257 11.531 19.610 1.00 28.60 C ATOM 0 H LEU C 73 1.259 14.937 21.320 1.00 28.72 H new ATOM 0 HA LEU C 73 1.169 13.861 18.944 1.00 29.74 H new ATOM 0 HB2 LEU C 73 -0.905 14.407 20.803 1.00 29.16 H new ATOM 0 HB3 LEU C 73 -1.263 13.787 19.418 1.00 29.16 H new ATOM 0 HG LEU C 73 0.290 12.523 21.390 1.00 28.14 H new ATOM 0 HD11 LEU C 73 -1.453 10.966 21.591 1.00 29.01 H new ATOM 0 HD12 LEU C 73 -1.958 12.422 21.954 1.00 29.01 H new ATOM 0 HD13 LEU C 73 -2.305 11.793 20.543 1.00 29.01 H new ATOM 0 HD21 LEU C 73 0.394 10.649 19.989 1.00 28.60 H new ATOM 0 HD22 LEU C 73 -0.346 11.467 18.853 1.00 28.60 H new ATOM 0 HD23 LEU C 73 1.108 11.891 19.315 1.00 28.60 H new ATOM 2796 N ASP C 74 0.275 16.856 18.979 1.00 31.91 N ATOM 2797 CA ASP C 74 -0.080 18.005 18.168 1.00 33.15 C ATOM 2798 C ASP C 74 1.072 18.528 17.318 1.00 32.77 C ATOM 2799 O ASP C 74 0.870 19.442 16.524 1.00 32.51 O ATOM 2800 CB ASP C 74 -0.611 19.128 19.075 1.00 34.26 C ATOM 2801 CG ASP C 74 -1.916 18.756 19.744 1.00 38.70 C ATOM 2802 OD1 ASP C 74 -2.735 18.064 19.081 1.00 45.30 O ATOM 2803 OD2 ASP C 74 -2.129 19.141 20.916 1.00 42.20 O ATOM 0 H ASP C 74 0.488 17.049 19.789 1.00 31.91 H new ATOM 0 HA ASP C 74 -0.766 17.711 17.549 1.00 33.15 H new ATOM 0 HB2 ASP C 74 0.051 19.333 19.754 1.00 34.26 H new ATOM 0 HB3 ASP C 74 -0.737 19.933 18.549 1.00 34.26 H new ATOM 2804 N ASP C 75 2.277 17.975 17.500 1.00 32.26 N ATOM 2805 CA ASP C 75 3.428 18.350 16.667 1.00 31.59 C ATOM 2806 C ASP C 75 4.439 17.197 16.492 1.00 30.04 C ATOM 2807 O ASP C 75 5.609 17.311 16.850 1.00 29.44 O ATOM 2808 CB ASP C 75 4.105 19.604 17.248 1.00 32.13 C ATOM 2809 CG ASP C 75 5.152 20.212 16.318 1.00 35.86 C ATOM 2810 OD1 ASP C 75 5.317 19.785 15.128 1.00 31.72 O ATOM 2811 OD2 ASP C 75 5.807 21.172 16.806 1.00 39.52 O ATOM 0 H ASP C 75 2.449 17.382 18.099 1.00 32.26 H new ATOM 0 HA ASP C 75 3.095 18.550 15.778 1.00 31.59 H new ATOM 0 HB2 ASP C 75 3.427 20.270 17.440 1.00 32.13 H new ATOM 0 HB3 ASP C 75 4.525 19.375 18.092 1.00 32.13 H new ATOM 2812 N LEU C 76 3.975 16.081 15.944 1.00 28.29 N ATOM 2813 CA LEU C 76 4.873 14.962 15.666 1.00 26.37 C ATOM 2814 C LEU C 76 6.107 15.331 14.790 1.00 26.15 C ATOM 2815 O LEU C 76 7.244 14.969 15.152 1.00 25.10 O ATOM 2816 CB LEU C 76 4.081 13.756 15.103 1.00 25.35 C ATOM 2817 CG LEU C 76 3.037 13.123 16.054 1.00 24.20 C ATOM 2818 CD1 LEU C 76 2.293 11.992 15.367 1.00 23.71 C ATOM 2819 CD2 LEU C 76 3.654 12.606 17.385 1.00 23.56 C ATOM 0 H LEU C 76 3.153 15.950 15.727 1.00 28.29 H new ATOM 0 HA LEU C 76 5.259 14.703 16.517 1.00 26.37 H new ATOM 0 HB2 LEU C 76 3.625 14.040 14.295 1.00 25.35 H new ATOM 0 HB3 LEU C 76 4.715 13.069 14.844 1.00 25.35 H new ATOM 0 HG LEU C 76 2.418 13.835 16.279 1.00 24.20 H new ATOM 0 HD11 LEU C 76 1.645 11.611 15.980 1.00 23.71 H new ATOM 0 HD12 LEU C 76 1.834 12.335 14.584 1.00 23.71 H new ATOM 0 HD13 LEU C 76 2.924 11.307 15.097 1.00 23.71 H new ATOM 0 HD21 LEU C 76 2.956 12.222 17.938 1.00 23.56 H new ATOM 0 HD22 LEU C 76 4.321 11.929 17.191 1.00 23.56 H new ATOM 0 HD23 LEU C 76 4.070 13.344 17.857 1.00 23.56 H new ATOM 2820 N PRO C 77 5.905 16.068 13.653 1.00 26.24 N ATOM 2821 CA PRO C 77 7.068 16.377 12.840 1.00 26.68 C ATOM 2822 C PRO C 77 8.097 17.159 13.674 1.00 27.94 C ATOM 2823 O PRO C 77 9.289 16.866 13.588 1.00 26.58 O ATOM 2824 CB PRO C 77 6.498 17.286 11.737 1.00 27.24 C ATOM 2825 CG PRO C 77 5.077 16.969 11.675 1.00 25.71 C ATOM 2826 CD PRO C 77 4.677 16.672 13.074 1.00 25.69 C ATOM 0 HA PRO C 77 7.515 15.588 12.497 1.00 26.68 H new ATOM 0 HB2 PRO C 77 6.639 18.222 11.947 1.00 27.24 H new ATOM 0 HB3 PRO C 77 6.932 17.118 10.886 1.00 27.24 H new ATOM 0 HG2 PRO C 77 4.568 17.713 11.317 1.00 25.71 H new ATOM 0 HG3 PRO C 77 4.914 16.208 11.096 1.00 25.71 H new ATOM 0 HD2 PRO C 77 4.413 17.475 13.550 1.00 25.69 H new ATOM 0 HD3 PRO C 77 3.925 16.061 13.110 1.00 25.69 H new ATOM 2827 N GLY C 78 7.611 18.107 14.497 1.00 28.36 N ATOM 2828 CA GLY C 78 8.443 18.787 15.487 1.00 30.04 C ATOM 2829 C GLY C 78 9.205 17.870 16.436 1.00 30.29 C ATOM 2830 O GLY C 78 10.417 17.974 16.554 1.00 31.21 O ATOM 0 H GLY C 78 6.791 18.367 14.490 1.00 28.36 H new ATOM 0 HA2 GLY C 78 9.082 19.348 15.020 1.00 30.04 H new ATOM 0 HA3 GLY C 78 7.879 19.376 16.013 1.00 30.04 H new ATOM 2831 N ALA C 79 8.505 16.949 17.083 1.00 29.72 N ATOM 2832 CA ALA C 79 9.105 16.112 18.124 1.00 29.34 C ATOM 2833 C ALA C 79 10.049 15.073 17.564 1.00 29.52 C ATOM 2834 O ALA C 79 10.965 14.616 18.272 1.00 30.07 O ATOM 2835 CB ALA C 79 8.035 15.426 18.933 1.00 28.48 C ATOM 0 H ALA C 79 7.673 16.789 16.936 1.00 29.72 H new ATOM 0 HA ALA C 79 9.621 16.707 18.691 1.00 29.34 H new ATOM 0 HB1 ALA C 79 8.449 14.876 19.617 1.00 28.48 H new ATOM 0 HB2 ALA C 79 7.469 16.093 19.353 1.00 28.48 H new ATOM 0 HB3 ALA C 79 7.497 14.867 18.351 1.00 28.48 H new ATOM 2836 N LEU C 80 9.814 14.674 16.315 1.00 28.12 N ATOM 2837 CA LEU C 80 10.493 13.494 15.778 1.00 27.13 C ATOM 2838 C LEU C 80 11.484 13.775 14.627 1.00 26.55 C ATOM 2839 O LEU C 80 11.946 12.836 13.976 1.00 26.35 O ATOM 2840 CB LEU C 80 9.460 12.407 15.374 1.00 27.60 C ATOM 2841 CG LEU C 80 8.406 11.917 16.381 1.00 26.92 C ATOM 2842 CD1 LEU C 80 7.497 10.838 15.808 1.00 23.65 C ATOM 2843 CD2 LEU C 80 9.014 11.425 17.685 1.00 28.79 C ATOM 0 H LEU C 80 9.275 15.064 15.770 1.00 28.12 H new ATOM 0 HA LEU C 80 11.047 13.166 16.504 1.00 27.13 H new ATOM 0 HB2 LEU C 80 8.982 12.741 14.599 1.00 27.60 H new ATOM 0 HB3 LEU C 80 9.962 11.629 15.084 1.00 27.60 H new ATOM 0 HG LEU C 80 7.869 12.702 16.572 1.00 26.92 H new ATOM 0 HD11 LEU C 80 6.854 10.566 16.481 1.00 23.65 H new ATOM 0 HD12 LEU C 80 7.027 11.188 15.035 1.00 23.65 H new ATOM 0 HD13 LEU C 80 8.030 10.073 15.543 1.00 23.65 H new ATOM 0 HD21 LEU C 80 8.308 11.129 18.280 1.00 28.79 H new ATOM 0 HD22 LEU C 80 9.614 10.685 17.503 1.00 28.79 H new ATOM 0 HD23 LEU C 80 9.509 12.146 18.104 1.00 28.79 H new ATOM 2844 N SER C 81 11.817 15.048 14.400 1.00 26.31 N ATOM 2845 CA SER C 81 12.671 15.479 13.273 1.00 25.90 C ATOM 2846 C SER C 81 14.023 14.771 13.189 1.00 25.12 C ATOM 2847 O SER C 81 14.448 14.360 12.087 1.00 23.19 O ATOM 2848 CB SER C 81 12.842 17.035 13.222 1.00 26.99 C ATOM 2849 OG SER C 81 13.309 17.548 14.474 1.00 30.86 O ATOM 0 H SER C 81 11.553 15.697 14.899 1.00 26.31 H new ATOM 0 HA SER C 81 12.184 15.199 12.482 1.00 25.90 H new ATOM 0 HB2 SER C 81 13.468 17.271 12.520 1.00 26.99 H new ATOM 0 HB3 SER C 81 11.994 17.449 12.997 1.00 26.99 H new ATOM 0 HG SER C 81 13.394 18.382 14.421 1.00 30.86 H new ATOM 2850 N THR C 82 14.692 14.586 14.331 1.00 23.57 N ATOM 2851 CA THR C 82 15.916 13.803 14.324 1.00 24.21 C ATOM 2852 C THR C 82 15.760 12.335 13.872 1.00 23.33 C ATOM 2853 O THR C 82 16.650 11.797 13.186 1.00 21.27 O ATOM 2854 CB THR C 82 16.619 13.820 15.690 1.00 25.18 C ATOM 2855 OG1 THR C 82 16.812 15.189 16.071 1.00 26.08 O ATOM 2856 CG2 THR C 82 18.010 13.172 15.553 1.00 26.84 C ATOM 0 H THR C 82 14.457 14.898 15.097 1.00 23.57 H new ATOM 0 HA THR C 82 16.457 14.250 13.654 1.00 24.21 H new ATOM 0 HB THR C 82 16.087 13.340 16.344 1.00 25.18 H new ATOM 0 HG1 THR C 82 17.195 15.221 16.818 1.00 26.08 H new ATOM 0 HG21 THR C 82 18.457 13.181 16.414 1.00 26.84 H new ATOM 0 HG22 THR C 82 17.912 12.256 15.249 1.00 26.84 H new ATOM 0 HG23 THR C 82 18.538 13.671 14.910 1.00 26.84 H new ATOM 2857 N LEU C 83 14.657 11.690 14.280 1.00 21.78 N ATOM 2858 CA LEU C 83 14.409 10.290 13.883 1.00 22.64 C ATOM 2859 C LEU C 83 14.036 10.164 12.400 1.00 22.07 C ATOM 2860 O LEU C 83 14.263 9.132 11.770 1.00 23.29 O ATOM 2861 CB LEU C 83 13.345 9.632 14.805 1.00 23.59 C ATOM 2862 CG LEU C 83 13.822 9.448 16.264 1.00 23.50 C ATOM 2863 CD1 LEU C 83 12.680 8.979 17.141 1.00 24.48 C ATOM 2864 CD2 LEU C 83 15.036 8.525 16.372 1.00 23.57 C ATOM 0 H LEU C 83 14.048 12.037 14.779 1.00 21.78 H new ATOM 0 HA LEU C 83 15.241 9.805 13.997 1.00 22.64 H new ATOM 0 HB2 LEU C 83 12.543 10.177 14.801 1.00 23.59 H new ATOM 0 HB3 LEU C 83 13.102 8.767 14.440 1.00 23.59 H new ATOM 0 HG LEU C 83 14.115 10.315 16.585 1.00 23.50 H new ATOM 0 HD11 LEU C 83 12.995 8.869 18.052 1.00 24.48 H new ATOM 0 HD12 LEU C 83 11.967 9.637 17.124 1.00 24.48 H new ATOM 0 HD13 LEU C 83 12.345 8.131 16.810 1.00 24.48 H new ATOM 0 HD21 LEU C 83 15.297 8.441 17.302 1.00 23.57 H new ATOM 0 HD22 LEU C 83 14.810 7.650 16.020 1.00 23.57 H new ATOM 0 HD23 LEU C 83 15.772 8.898 15.862 1.00 23.57 H new ATOM 2865 N SER C 84 13.494 11.250 11.855 1.00 22.69 N ATOM 2866 CA SER C 84 13.118 11.367 10.464 1.00 23.44 C ATOM 2867 C SER C 84 14.356 11.493 9.625 1.00 23.98 C ATOM 2868 O SER C 84 14.525 10.762 8.648 1.00 23.12 O ATOM 2869 CB SER C 84 12.240 12.585 10.293 1.00 23.87 C ATOM 2870 OG SER C 84 11.870 12.748 8.930 1.00 27.15 O ATOM 0 H SER C 84 13.332 11.962 12.309 1.00 22.69 H new ATOM 0 HA SER C 84 12.627 10.579 10.182 1.00 23.44 H new ATOM 0 HB2 SER C 84 11.444 12.496 10.841 1.00 23.87 H new ATOM 0 HB3 SER C 84 12.710 13.375 10.602 1.00 23.87 H new ATOM 0 HG SER C 84 11.275 13.338 8.870 1.00 27.15 H new ATOM 2871 N ASP C 85 15.267 12.383 10.028 1.00 25.74 N ATOM 2872 CA ASP C 85 16.607 12.422 9.399 1.00 26.34 C ATOM 2873 C ASP C 85 17.258 11.078 9.369 1.00 25.27 C ATOM 2874 O ASP C 85 17.786 10.697 8.345 1.00 25.19 O ATOM 2875 CB ASP C 85 17.538 13.368 10.104 1.00 28.47 C ATOM 2876 CG ASP C 85 17.124 14.803 9.920 1.00 32.56 C ATOM 2877 OD1 ASP C 85 16.803 15.180 8.759 1.00 37.83 O ATOM 2878 OD2 ASP C 85 17.141 15.549 10.930 1.00 36.99 O ATOM 0 H ASP C 85 15.140 12.964 10.650 1.00 25.74 H new ATOM 0 HA ASP C 85 16.451 12.730 8.492 1.00 26.34 H new ATOM 0 HB2 ASP C 85 17.558 13.156 11.050 1.00 28.47 H new ATOM 0 HB3 ASP C 85 18.439 13.246 9.767 1.00 28.47 H new ATOM 2879 N LEU C 86 17.205 10.337 10.475 1.00 24.71 N ATOM 2880 CA LEU C 86 17.800 8.989 10.492 1.00 24.01 C ATOM 2881 C LEU C 86 17.143 8.002 9.525 1.00 23.20 C ATOM 2882 O LEU C 86 17.851 7.316 8.758 1.00 23.03 O ATOM 2883 CB LEU C 86 17.892 8.414 11.921 1.00 24.56 C ATOM 2884 CG LEU C 86 18.435 6.993 12.149 1.00 25.23 C ATOM 2885 CD1 LEU C 86 19.815 6.755 11.559 1.00 28.39 C ATOM 2886 CD2 LEU C 86 18.447 6.690 13.633 1.00 25.56 C ATOM 0 H LEU C 86 16.839 10.584 11.213 1.00 24.71 H new ATOM 0 HA LEU C 86 18.704 9.109 10.162 1.00 24.01 H new ATOM 0 HB2 LEU C 86 18.444 9.020 12.440 1.00 24.56 H new ATOM 0 HB3 LEU C 86 17.001 8.446 12.302 1.00 24.56 H new ATOM 0 HG LEU C 86 17.837 6.391 11.679 1.00 25.23 H new ATOM 0 HD11 LEU C 86 20.092 5.843 11.740 1.00 28.39 H new ATOM 0 HD12 LEU C 86 19.787 6.899 10.600 1.00 28.39 H new ATOM 0 HD13 LEU C 86 20.449 7.370 11.959 1.00 28.39 H new ATOM 0 HD21 LEU C 86 18.789 5.794 13.778 1.00 25.56 H new ATOM 0 HD22 LEU C 86 19.015 7.330 14.090 1.00 25.56 H new ATOM 0 HD23 LEU C 86 17.545 6.751 13.983 1.00 25.56 H new ATOM 2887 N HIS C 87 15.808 7.918 9.544 1.00 21.39 N ATOM 2888 CA HIS C 87 15.128 6.815 8.819 1.00 20.70 C ATOM 2889 C HIS C 87 14.932 7.153 7.351 1.00 19.91 C ATOM 2890 O HIS C 87 15.096 6.293 6.489 1.00 18.73 O ATOM 2891 CB HIS C 87 13.778 6.411 9.463 1.00 18.48 C ATOM 2892 CG HIS C 87 13.929 5.759 10.792 1.00 20.54 C ATOM 2893 ND1 HIS C 87 13.964 6.479 11.969 1.00 18.38 N ATOM 2894 CD2 HIS C 87 14.098 4.457 11.137 1.00 17.93 C ATOM 2895 CE1 HIS C 87 14.123 5.651 12.982 1.00 18.41 C ATOM 2896 NE2 HIS C 87 14.205 4.419 12.510 1.00 22.62 N ATOM 0 H HIS C 87 15.286 8.465 9.953 1.00 21.39 H new ATOM 0 HA HIS C 87 15.718 6.048 8.887 1.00 20.70 H new ATOM 0 HB2 HIS C 87 13.224 7.201 9.559 1.00 18.48 H new ATOM 0 HB3 HIS C 87 13.310 5.807 8.865 1.00 18.48 H new ATOM 0 HD1 HIS C 87 13.893 7.334 12.032 1.00 18.38 H new ATOM 0 HD2 HIS C 87 14.135 3.730 10.558 1.00 17.93 H new ATOM 0 HE1 HIS C 87 14.170 5.893 13.879 1.00 18.41 H new ATOM 2897 N ALA C 88 14.575 8.405 7.089 1.00 20.36 N ATOM 2898 CA ALA C 88 14.289 8.826 5.727 1.00 23.05 C ATOM 2899 C ALA C 88 15.532 9.268 4.946 1.00 23.61 C ATOM 2900 O ALA C 88 15.686 8.856 3.805 1.00 23.87 O ATOM 2901 CB ALA C 88 13.209 9.895 5.694 1.00 22.83 C ATOM 0 H ALA C 88 14.493 9.022 7.683 1.00 20.36 H new ATOM 0 HA ALA C 88 13.955 8.037 5.271 1.00 23.05 H new ATOM 0 HB1 ALA C 88 13.040 10.156 4.775 1.00 22.83 H new ATOM 0 HB2 ALA C 88 12.394 9.544 6.086 1.00 22.83 H new ATOM 0 HB3 ALA C 88 13.503 10.668 6.200 1.00 22.83 H new ATOM 2902 N HIS C 89 16.409 10.087 5.542 1.00 24.69 N ATOM 2903 CA HIS C 89 17.606 10.577 4.810 1.00 25.42 C ATOM 2904 C HIS C 89 18.770 9.616 4.854 1.00 25.41 C ATOM 2905 O HIS C 89 19.396 9.356 3.859 1.00 26.84 O ATOM 2906 CB HIS C 89 18.128 11.887 5.395 1.00 27.46 C ATOM 2907 CG HIS C 89 17.244 13.060 5.158 1.00 31.21 C ATOM 2908 ND1 HIS C 89 16.131 13.318 5.933 1.00 37.62 N ATOM 2909 CD2 HIS C 89 17.318 14.062 4.253 1.00 35.03 C ATOM 2910 CE1 HIS C 89 15.560 14.436 5.519 1.00 36.97 C ATOM 2911 NE2 HIS C 89 16.259 14.904 4.498 1.00 38.70 N ATOM 0 H HIS C 89 16.339 10.370 6.351 1.00 24.69 H new ATOM 0 HA HIS C 89 17.296 10.686 3.897 1.00 25.42 H new ATOM 0 HB2 HIS C 89 18.251 11.776 6.351 1.00 27.46 H new ATOM 0 HB3 HIS C 89 19.002 12.072 5.017 1.00 27.46 H new ATOM 0 HD2 HIS C 89 17.963 14.163 3.591 1.00 35.03 H new ATOM 0 HE1 HIS C 89 14.798 14.826 5.883 1.00 36.97 H new ATOM 0 HE2 HIS C 89 16.080 15.621 4.058 1.00 38.70 H new ATOM 2912 N LYS C 90 19.101 9.134 6.031 1.00 24.12 N ATOM 2913 CA LYS C 90 20.270 8.282 6.208 1.00 25.19 C ATOM 2914 C LYS C 90 20.035 6.790 5.907 1.00 24.46 C ATOM 2915 O LYS C 90 20.814 6.165 5.155 1.00 22.95 O ATOM 2916 CB LYS C 90 20.825 8.456 7.631 1.00 26.09 C ATOM 2917 CG LYS C 90 22.276 8.068 7.732 1.00 31.79 C ATOM 2918 CD LYS C 90 22.668 7.478 9.107 1.00 38.57 C ATOM 2919 CE LYS C 90 23.985 6.700 8.986 1.00 40.37 C ATOM 2920 NZ LYS C 90 24.401 6.121 10.305 1.00 46.26 N ATOM 0 H LYS C 90 18.660 9.287 6.753 1.00 24.12 H new ATOM 0 HA LYS C 90 20.915 8.576 5.546 1.00 25.19 H new ATOM 0 HB2 LYS C 90 20.720 9.380 7.906 1.00 26.09 H new ATOM 0 HB3 LYS C 90 20.305 7.916 8.247 1.00 26.09 H new ATOM 0 HG2 LYS C 90 22.478 7.418 7.041 1.00 31.79 H new ATOM 0 HG3 LYS C 90 22.824 8.849 7.556 1.00 31.79 H new ATOM 0 HD2 LYS C 90 22.763 8.191 9.758 1.00 38.57 H new ATOM 0 HD3 LYS C 90 21.965 6.892 9.428 1.00 38.57 H new ATOM 0 HE2 LYS C 90 23.883 5.988 8.336 1.00 40.37 H new ATOM 0 HE3 LYS C 90 24.681 7.289 8.655 1.00 40.37 H new ATOM 0 HZ1 LYS C 90 25.166 5.676 10.206 1.00 46.26 H new ATOM 0 HZ2 LYS C 90 24.514 6.777 10.895 1.00 46.26 H new ATOM 0 HZ3 LYS C 90 23.771 5.565 10.597 1.00 46.26 H new ATOM 2921 N LEU C 91 18.992 6.208 6.494 1.00 22.43 N ATOM 2922 CA LEU C 91 18.752 4.763 6.309 1.00 22.64 C ATOM 2923 C LEU C 91 17.951 4.436 5.035 1.00 22.24 C ATOM 2924 O LEU C 91 18.115 3.357 4.461 1.00 22.61 O ATOM 2925 CB LEU C 91 18.104 4.152 7.542 1.00 23.02 C ATOM 2926 CG LEU C 91 18.964 4.182 8.826 1.00 24.06 C ATOM 2927 CD1 LEU C 91 18.190 3.748 10.069 1.00 22.79 C ATOM 2928 CD2 LEU C 91 20.237 3.379 8.652 1.00 22.67 C ATOM 0 H LEU C 91 18.420 6.613 6.993 1.00 22.43 H new ATOM 0 HA LEU C 91 19.625 4.357 6.188 1.00 22.64 H new ATOM 0 HB2 LEU C 91 17.272 4.619 7.717 1.00 23.02 H new ATOM 0 HB3 LEU C 91 17.875 3.230 7.345 1.00 23.02 H new ATOM 0 HG LEU C 91 19.212 5.108 8.972 1.00 24.06 H new ATOM 0 HD11 LEU C 91 18.773 3.785 10.843 1.00 22.79 H new ATOM 0 HD12 LEU C 91 17.436 4.343 10.205 1.00 22.79 H new ATOM 0 HD13 LEU C 91 17.869 2.841 9.950 1.00 22.79 H new ATOM 0 HD21 LEU C 91 20.757 3.415 9.470 1.00 22.67 H new ATOM 0 HD22 LEU C 91 20.013 2.457 8.451 1.00 22.67 H new ATOM 0 HD23 LEU C 91 20.757 3.751 7.923 1.00 22.67 H new ATOM 2929 N ARG C 92 17.079 5.347 4.613 1.00 21.48 N ATOM 2930 CA ARG C 92 16.239 5.125 3.413 1.00 21.50 C ATOM 2931 C ARG C 92 15.429 3.834 3.515 1.00 20.57 C ATOM 2932 O ARG C 92 15.423 3.023 2.597 1.00 20.44 O ATOM 2933 CB ARG C 92 17.071 5.196 2.103 1.00 22.59 C ATOM 2934 CG ARG C 92 17.566 6.644 1.867 1.00 26.86 C ATOM 2935 CD ARG C 92 18.551 6.759 0.733 1.00 34.62 C ATOM 2936 NE ARG C 92 19.721 5.922 0.915 1.00 39.23 N ATOM 2937 CZ ARG C 92 20.782 5.966 0.116 1.00 43.40 C ATOM 2938 NH1 ARG C 92 20.811 6.820 -0.902 1.00 44.16 N ATOM 2939 NH2 ARG C 92 21.820 5.173 0.340 1.00 44.50 N ATOM 0 H ARG C 92 16.951 6.104 5.001 1.00 21.48 H new ATOM 0 HA ARG C 92 15.598 5.852 3.375 1.00 21.50 H new ATOM 0 HB2 ARG C 92 17.828 4.593 2.159 1.00 22.59 H new ATOM 0 HB3 ARG C 92 16.531 4.904 1.352 1.00 22.59 H new ATOM 0 HG2 ARG C 92 16.803 7.214 1.684 1.00 26.86 H new ATOM 0 HG3 ARG C 92 17.978 6.975 2.680 1.00 26.86 H new ATOM 0 HD2 ARG C 92 18.111 6.517 -0.097 1.00 34.62 H new ATOM 0 HD3 ARG C 92 18.831 7.684 0.646 1.00 34.62 H new ATOM 0 HE ARG C 92 19.729 5.369 1.574 1.00 39.23 H new ATOM 0 HH11 ARG C 92 20.144 7.344 -1.043 1.00 44.16 H new ATOM 0 HH12 ARG C 92 21.497 6.849 -1.419 1.00 44.16 H new ATOM 0 HH21 ARG C 92 21.809 4.627 1.005 1.00 44.50 H new ATOM 0 HH22 ARG C 92 22.505 5.204 -0.179 1.00 44.50 H new ATOM 2940 N VAL C 93 14.734 3.687 4.653 1.00 18.24 N ATOM 2941 CA VAL C 93 13.887 2.548 4.973 1.00 17.85 C ATOM 2942 C VAL C 93 12.646 2.583 4.076 1.00 17.11 C ATOM 2943 O VAL C 93 11.943 3.592 4.025 1.00 17.06 O ATOM 2944 CB VAL C 93 13.447 2.586 6.476 1.00 17.09 C ATOM 2945 CG1 VAL C 93 12.597 1.387 6.842 1.00 16.34 C ATOM 2946 CG2 VAL C 93 14.664 2.694 7.454 1.00 16.51 C ATOM 0 H VAL C 93 14.750 4.277 5.279 1.00 18.24 H new ATOM 0 HA VAL C 93 14.388 1.731 4.822 1.00 17.85 H new ATOM 0 HB VAL C 93 12.912 3.389 6.576 1.00 17.09 H new ATOM 0 HG11 VAL C 93 12.343 1.443 7.777 1.00 16.34 H new ATOM 0 HG12 VAL C 93 11.799 1.376 6.291 1.00 16.34 H new ATOM 0 HG13 VAL C 93 13.104 0.573 6.693 1.00 16.34 H new ATOM 0 HG21 VAL C 93 14.343 2.714 8.369 1.00 16.51 H new ATOM 0 HG22 VAL C 93 15.246 1.927 7.333 1.00 16.51 H new ATOM 0 HG23 VAL C 93 15.158 3.507 7.267 1.00 16.51 H new ATOM 2947 N ASP C 94 12.377 1.476 3.391 1.00 15.55 N ATOM 2948 CA ASP C 94 11.185 1.355 2.552 1.00 15.18 C ATOM 2949 C ASP C 94 9.943 1.399 3.477 1.00 15.30 C ATOM 2950 O ASP C 94 9.895 0.666 4.445 1.00 12.71 O ATOM 2951 CB ASP C 94 11.271 0.041 1.737 1.00 14.82 C ATOM 2952 CG ASP C 94 10.077 -0.160 0.777 1.00 17.36 C ATOM 2953 OD1 ASP C 94 8.915 0.114 1.166 1.00 18.92 O ATOM 2954 OD2 ASP C 94 10.308 -0.628 -0.364 1.00 17.68 O ATOM 0 H ASP C 94 12.877 0.776 3.398 1.00 15.55 H new ATOM 0 HA ASP C 94 11.117 2.084 1.915 1.00 15.18 H new ATOM 0 HB2 ASP C 94 12.094 0.039 1.224 1.00 14.82 H new ATOM 0 HB3 ASP C 94 11.316 -0.710 2.349 1.00 14.82 H new ATOM 2955 N PRO C 95 8.979 2.323 3.210 1.00 17.24 N ATOM 2956 CA PRO C 95 7.811 2.521 4.073 1.00 18.11 C ATOM 2957 C PRO C 95 7.081 1.228 4.377 1.00 18.16 C ATOM 2958 O PRO C 95 6.496 1.122 5.451 1.00 18.88 O ATOM 2959 CB PRO C 95 6.888 3.480 3.281 1.00 18.69 C ATOM 2960 CG PRO C 95 7.604 3.872 2.069 1.00 18.83 C ATOM 2961 CD PRO C 95 9.030 3.335 2.127 1.00 17.54 C ATOM 0 HA PRO C 95 8.080 2.875 4.935 1.00 18.11 H new ATOM 0 HB2 PRO C 95 6.052 3.042 3.057 1.00 18.69 H new ATOM 0 HB3 PRO C 95 6.667 4.259 3.814 1.00 18.69 H new ATOM 0 HG2 PRO C 95 7.149 3.525 1.286 1.00 18.83 H new ATOM 0 HG3 PRO C 95 7.615 4.838 1.986 1.00 18.83 H new ATOM 0 HD2 PRO C 95 9.297 2.940 1.282 1.00 17.54 H new ATOM 0 HD3 PRO C 95 9.668 4.038 2.326 1.00 17.54 H new ATOM 2962 N VAL C 96 7.151 0.249 3.485 1.00 18.02 N ATOM 2963 CA VAL C 96 6.547 -1.070 3.775 1.00 18.88 C ATOM 2964 C VAL C 96 6.970 -1.643 5.128 1.00 18.25 C ATOM 2965 O VAL C 96 6.148 -2.223 5.832 1.00 17.49 O ATOM 2966 CB VAL C 96 6.694 -2.111 2.642 1.00 19.97 C ATOM 2967 CG1 VAL C 96 8.118 -2.751 2.599 1.00 20.57 C ATOM 2968 CG2 VAL C 96 5.731 -3.228 2.867 1.00 22.79 C ATOM 0 H VAL C 96 7.533 0.314 2.717 1.00 18.02 H new ATOM 0 HA VAL C 96 5.597 -0.879 3.829 1.00 18.88 H new ATOM 0 HB VAL C 96 6.528 -1.640 1.810 1.00 19.97 H new ATOM 0 HG11 VAL C 96 8.162 -3.395 1.875 1.00 20.57 H new ATOM 0 HG12 VAL C 96 8.781 -2.057 2.455 1.00 20.57 H new ATOM 0 HG13 VAL C 96 8.297 -3.199 3.441 1.00 20.57 H new ATOM 0 HG21 VAL C 96 5.822 -3.882 2.157 1.00 22.79 H new ATOM 0 HG22 VAL C 96 5.918 -3.650 3.720 1.00 22.79 H new ATOM 0 HG23 VAL C 96 4.826 -2.879 2.871 1.00 22.79 H new ATOM 2969 N ASN C 97 8.231 -1.446 5.514 1.00 17.40 N ATOM 2970 CA ASN C 97 8.717 -1.988 6.802 1.00 17.16 C ATOM 2971 C ASN C 97 8.080 -1.364 8.030 1.00 17.22 C ATOM 2972 O ASN C 97 8.026 -1.972 9.100 1.00 16.50 O ATOM 2973 CB ASN C 97 10.246 -1.856 6.858 1.00 17.38 C ATOM 2974 CG ASN C 97 10.918 -2.595 5.695 1.00 18.87 C ATOM 2975 OD1 ASN C 97 10.794 -3.818 5.584 1.00 24.73 O ATOM 2976 ND2 ASN C 97 11.550 -1.850 4.787 1.00 16.36 N ATOM 0 H ASN C 97 8.817 -1.011 5.060 1.00 17.40 H new ATOM 0 HA ASN C 97 8.450 -2.920 6.829 1.00 17.16 H new ATOM 0 HB2 ASN C 97 10.492 -0.918 6.832 1.00 17.38 H new ATOM 0 HB3 ASN C 97 10.572 -2.211 7.700 1.00 17.38 H new ATOM 0 HD21 ASN C 97 11.891 -2.220 4.090 1.00 16.36 H new ATOM 0 HD22 ASN C 97 11.616 -1.000 4.899 1.00 16.36 H new ATOM 2977 N PHE C 98 7.580 -0.137 7.876 1.00 16.44 N ATOM 2978 CA PHE C 98 6.959 0.562 8.986 1.00 17.13 C ATOM 2979 C PHE C 98 5.618 -0.102 9.321 1.00 18.06 C ATOM 2980 O PHE C 98 5.275 -0.254 10.493 1.00 17.70 O ATOM 2981 CB PHE C 98 6.817 2.055 8.645 1.00 17.81 C ATOM 2982 CG PHE C 98 8.066 2.811 8.896 1.00 19.99 C ATOM 2983 CD1 PHE C 98 8.249 3.486 10.125 1.00 20.05 C ATOM 2984 CD2 PHE C 98 9.097 2.803 7.965 1.00 22.18 C ATOM 2985 CE1 PHE C 98 9.414 4.157 10.396 1.00 20.44 C ATOM 2986 CE2 PHE C 98 10.318 3.514 8.239 1.00 22.74 C ATOM 2987 CZ PHE C 98 10.455 4.178 9.455 1.00 20.99 C ATOM 0 H PHE C 98 7.593 0.302 7.137 1.00 16.44 H new ATOM 0 HA PHE C 98 7.515 0.504 9.779 1.00 17.13 H new ATOM 0 HB2 PHE C 98 6.566 2.149 7.713 1.00 17.81 H new ATOM 0 HB3 PHE C 98 6.098 2.438 9.172 1.00 17.81 H new ATOM 0 HD1 PHE C 98 7.569 3.475 10.759 1.00 20.05 H new ATOM 0 HD2 PHE C 98 8.998 2.339 7.165 1.00 22.18 H new ATOM 0 HE1 PHE C 98 9.515 4.600 11.207 1.00 20.44 H new ATOM 0 HE2 PHE C 98 11.005 3.530 7.613 1.00 22.74 H new ATOM 0 HZ PHE C 98 11.241 4.638 9.645 1.00 20.99 H new ATOM 2988 N LYS C 99 4.896 -0.536 8.286 1.00 17.58 N ATOM 2989 CA LYS C 99 3.625 -1.262 8.485 1.00 18.38 C ATOM 2990 C LYS C 99 3.916 -2.580 9.204 1.00 16.97 C ATOM 2991 O LYS C 99 3.144 -3.016 10.044 1.00 16.68 O ATOM 2992 CB LYS C 99 2.969 -1.540 7.127 1.00 16.96 C ATOM 2993 CG LYS C 99 2.599 -0.255 6.379 1.00 24.24 C ATOM 2994 CD LYS C 99 2.081 -0.619 4.996 1.00 30.94 C ATOM 2995 CE LYS C 99 1.724 0.602 4.192 1.00 36.02 C ATOM 2996 NZ LYS C 99 0.486 1.230 4.754 1.00 40.02 N ATOM 0 H LYS C 99 5.118 -0.424 7.463 1.00 17.58 H new ATOM 0 HA LYS C 99 3.019 -0.726 9.020 1.00 18.38 H new ATOM 0 HB2 LYS C 99 3.574 -2.066 6.581 1.00 16.96 H new ATOM 0 HB3 LYS C 99 2.170 -2.074 7.260 1.00 16.96 H new ATOM 0 HG2 LYS C 99 1.923 0.236 6.871 1.00 24.24 H new ATOM 0 HG3 LYS C 99 3.373 0.324 6.305 1.00 24.24 H new ATOM 0 HD2 LYS C 99 2.755 -1.132 4.523 1.00 30.94 H new ATOM 0 HD3 LYS C 99 1.301 -1.188 5.083 1.00 30.94 H new ATOM 0 HE2 LYS C 99 2.457 1.238 4.210 1.00 36.02 H new ATOM 0 HE3 LYS C 99 1.582 0.359 3.264 1.00 36.02 H new ATOM 0 HZ1 LYS C 99 0.202 1.870 4.205 1.00 40.02 H new ATOM 0 HZ2 LYS C 99 -0.148 0.611 4.840 1.00 40.02 H new ATOM 0 HZ3 LYS C 99 0.667 1.582 5.551 1.00 40.02 H new ATOM 2997 N LEU C 100 5.049 -3.214 8.910 1.00 17.68 N ATOM 2998 CA LEU C 100 5.368 -4.517 9.573 1.00 17.55 C ATOM 2999 C LEU C 100 5.685 -4.249 11.041 1.00 16.50 C ATOM 3000 O LEU C 100 5.182 -4.904 11.923 1.00 15.88 O ATOM 3001 CB LEU C 100 6.551 -5.240 8.855 1.00 17.21 C ATOM 3002 CG LEU C 100 6.321 -5.361 7.322 1.00 19.51 C ATOM 3003 CD1 LEU C 100 7.382 -6.180 6.571 1.00 22.01 C ATOM 3004 CD2 LEU C 100 4.940 -5.945 7.007 1.00 20.11 C ATOM 0 H LEU C 100 5.639 -2.933 8.351 1.00 17.68 H new ATOM 0 HA LEU C 100 4.603 -5.110 9.513 1.00 17.55 H new ATOM 0 HB2 LEU C 100 7.373 -4.753 9.020 1.00 17.21 H new ATOM 0 HB3 LEU C 100 6.665 -6.125 9.234 1.00 17.21 H new ATOM 0 HG LEU C 100 6.390 -4.447 7.004 1.00 19.51 H new ATOM 0 HD11 LEU C 100 7.163 -6.205 5.626 1.00 22.01 H new ATOM 0 HD12 LEU C 100 8.252 -5.769 6.690 1.00 22.01 H new ATOM 0 HD13 LEU C 100 7.401 -7.084 6.922 1.00 22.01 H new ATOM 0 HD21 LEU C 100 4.827 -6.008 6.046 1.00 20.11 H new ATOM 0 HD22 LEU C 100 4.865 -6.829 7.400 1.00 20.11 H new ATOM 0 HD23 LEU C 100 4.253 -5.368 7.376 1.00 20.11 H new ATOM 3005 N LEU C 101 6.499 -3.241 11.328 1.00 16.94 N ATOM 3006 CA LEU C 101 6.840 -3.039 12.735 1.00 16.36 C ATOM 3007 C LEU C 101 5.601 -2.598 13.484 1.00 14.90 C ATOM 3008 O LEU C 101 5.400 -2.982 14.611 1.00 15.35 O ATOM 3009 CB LEU C 101 8.032 -2.082 12.953 1.00 16.13 C ATOM 3010 CG LEU C 101 8.347 -1.745 14.444 1.00 16.39 C ATOM 3011 CD1 LEU C 101 8.636 -2.993 15.268 1.00 16.60 C ATOM 3012 CD2 LEU C 101 9.522 -0.766 14.593 1.00 17.65 C ATOM 0 H LEU C 101 6.847 -2.692 10.765 1.00 16.94 H new ATOM 0 HA LEU C 101 7.147 -3.887 13.093 1.00 16.36 H new ATOM 0 HB2 LEU C 101 8.822 -2.475 12.551 1.00 16.13 H new ATOM 0 HB3 LEU C 101 7.855 -1.254 12.479 1.00 16.13 H new ATOM 0 HG LEU C 101 7.544 -1.320 14.783 1.00 16.39 H new ATOM 0 HD11 LEU C 101 8.826 -2.739 16.185 1.00 16.60 H new ATOM 0 HD12 LEU C 101 7.864 -3.580 15.249 1.00 16.60 H new ATOM 0 HD13 LEU C 101 9.403 -3.456 14.896 1.00 16.60 H new ATOM 0 HD21 LEU C 101 9.678 -0.588 15.534 1.00 17.65 H new ATOM 0 HD22 LEU C 101 10.319 -1.155 14.201 1.00 17.65 H new ATOM 0 HD23 LEU C 101 9.311 0.065 14.138 1.00 17.65 H new ATOM 3013 N SER C 102 4.768 -1.779 12.861 1.00 15.94 N ATOM 3014 CA SER C 102 3.559 -1.251 13.527 1.00 15.09 C ATOM 3015 C SER C 102 2.643 -2.430 13.897 1.00 14.00 C ATOM 3016 O SER C 102 2.079 -2.517 15.010 1.00 12.89 O ATOM 3017 CB SER C 102 2.834 -0.229 12.619 1.00 16.70 C ATOM 3018 OG SER C 102 3.639 0.981 12.490 1.00 17.19 O ATOM 0 H SER C 102 4.875 -1.510 12.051 1.00 15.94 H new ATOM 0 HA SER C 102 3.809 -0.780 14.337 1.00 15.09 H new ATOM 0 HB2 SER C 102 2.676 -0.617 11.744 1.00 16.70 H new ATOM 0 HB3 SER C 102 1.966 -0.011 12.993 1.00 16.70 H new ATOM 0 HG SER C 102 4.239 0.859 11.915 1.00 17.19 H new ATOM 3019 N HIS C 103 2.514 -3.359 12.963 1.00 12.83 N ATOM 3020 CA HIS C 103 1.703 -4.526 13.194 1.00 12.91 C ATOM 3021 C HIS C 103 2.272 -5.318 14.392 1.00 12.18 C ATOM 3022 O HIS C 103 1.534 -5.712 15.290 1.00 11.86 O ATOM 3023 CB HIS C 103 1.642 -5.364 11.893 1.00 14.00 C ATOM 3024 CG HIS C 103 1.205 -6.767 12.119 1.00 12.31 C ATOM 3025 ND1 HIS C 103 -0.094 -7.082 12.456 1.00 13.02 N ATOM 3026 CD2 HIS C 103 1.882 -7.938 12.056 1.00 13.14 C ATOM 3027 CE1 HIS C 103 -0.211 -8.401 12.537 1.00 13.53 C ATOM 3028 NE2 HIS C 103 0.980 -8.942 12.329 1.00 11.13 N ATOM 0 H HIS C 103 2.890 -3.327 12.190 1.00 12.83 H new ATOM 0 HA HIS C 103 0.794 -4.278 13.423 1.00 12.91 H new ATOM 0 HB2 HIS C 103 1.033 -4.938 11.269 1.00 14.00 H new ATOM 0 HB3 HIS C 103 2.518 -5.368 11.476 1.00 14.00 H new ATOM 0 HD2 HIS C 103 2.786 -8.044 11.864 1.00 13.14 H new ATOM 0 HE1 HIS C 103 -0.997 -8.867 12.711 1.00 13.53 H new ATOM 0 HE2 HIS C 103 1.160 -9.782 12.359 1.00 11.13 H new ATOM 3029 N CYS C 104 3.600 -5.523 14.419 1.00 13.59 N ATOM 3030 CA CYS C 104 4.250 -6.281 15.540 1.00 13.66 C ATOM 3031 C CYS C 104 4.105 -5.593 16.903 1.00 13.12 C ATOM 3032 O CYS C 104 3.980 -6.251 17.904 1.00 13.55 O ATOM 3033 CB CYS C 104 5.724 -6.603 15.245 1.00 13.25 C ATOM 3034 SG CYS C 104 5.845 -7.738 13.873 1.00 15.13 S ATOM 0 H CYS C 104 4.144 -5.242 13.815 1.00 13.59 H new ATOM 0 HA CYS C 104 3.764 -7.119 15.596 1.00 13.66 H new ATOM 0 HB2 CYS C 104 6.206 -5.786 15.041 1.00 13.25 H new ATOM 0 HB3 CYS C 104 6.141 -6.990 16.031 1.00 13.25 H new ATOM 0 HG CYS C 104 6.631 -7.315 13.071 1.00 15.13 H new ATOM 3035 N LEU C 105 4.071 -4.267 16.913 1.00 14.42 N ATOM 3036 CA LEU C 105 3.845 -3.541 18.131 1.00 15.15 C ATOM 3037 C LEU C 105 2.392 -3.774 18.604 1.00 15.48 C ATOM 3038 O LEU C 105 2.141 -3.927 19.792 1.00 15.74 O ATOM 3039 CB LEU C 105 4.141 -2.051 17.907 1.00 14.70 C ATOM 3040 CG LEU C 105 5.632 -1.725 17.855 1.00 17.38 C ATOM 3041 CD1 LEU C 105 5.886 -0.434 17.042 1.00 15.54 C ATOM 3042 CD2 LEU C 105 6.210 -1.621 19.320 1.00 20.54 C ATOM 0 H LEU C 105 4.178 -3.775 16.216 1.00 14.42 H new ATOM 0 HA LEU C 105 4.442 -3.859 18.827 1.00 15.15 H new ATOM 0 HB2 LEU C 105 3.727 -1.768 17.077 1.00 14.70 H new ATOM 0 HB3 LEU C 105 3.730 -1.537 18.619 1.00 14.70 H new ATOM 0 HG LEU C 105 6.098 -2.443 17.399 1.00 17.38 H new ATOM 0 HD11 LEU C 105 6.837 -0.246 17.022 1.00 15.54 H new ATOM 0 HD12 LEU C 105 5.561 -0.553 16.136 1.00 15.54 H new ATOM 0 HD13 LEU C 105 5.419 0.308 17.458 1.00 15.54 H new ATOM 0 HD21 LEU C 105 7.157 -1.414 19.281 1.00 20.54 H new ATOM 0 HD22 LEU C 105 5.746 -0.919 19.802 1.00 20.54 H new ATOM 0 HD23 LEU C 105 6.083 -2.466 19.779 1.00 20.54 H new ATOM 3043 N LEU C 106 1.438 -3.774 17.671 1.00 14.66 N ATOM 3044 CA LEU C 106 0.034 -4.020 18.051 1.00 14.48 C ATOM 3045 C LEU C 106 -0.152 -5.430 18.576 1.00 14.03 C ATOM 3046 O LEU C 106 -0.823 -5.639 19.587 1.00 14.14 O ATOM 3047 CB LEU C 106 -0.944 -3.741 16.871 1.00 14.67 C ATOM 3048 CG LEU C 106 -0.994 -2.268 16.429 1.00 17.83 C ATOM 3049 CD1 LEU C 106 -1.822 -2.176 15.198 1.00 18.83 C ATOM 3050 CD2 LEU C 106 -1.532 -1.270 17.539 1.00 19.03 C ATOM 0 H LEU C 106 1.572 -3.638 16.832 1.00 14.66 H new ATOM 0 HA LEU C 106 -0.180 -3.398 18.763 1.00 14.48 H new ATOM 0 HB2 LEU C 106 -0.684 -4.287 16.113 1.00 14.67 H new ATOM 0 HB3 LEU C 106 -1.836 -4.021 17.130 1.00 14.67 H new ATOM 0 HG LEU C 106 -0.081 -1.986 16.261 1.00 17.83 H new ATOM 0 HD11 LEU C 106 -1.864 -1.252 14.905 1.00 18.83 H new ATOM 0 HD12 LEU C 106 -1.425 -2.719 14.499 1.00 18.83 H new ATOM 0 HD13 LEU C 106 -2.718 -2.497 15.386 1.00 18.83 H new ATOM 0 HD21 LEU C 106 -1.534 -0.366 17.188 1.00 19.03 H new ATOM 0 HD22 LEU C 106 -2.435 -1.521 17.790 1.00 19.03 H new ATOM 0 HD23 LEU C 106 -0.957 -1.312 18.319 1.00 19.03 H new ATOM 3051 N VAL C 107 0.463 -6.406 17.900 1.00 11.79 N ATOM 3052 CA VAL C 107 0.432 -7.792 18.356 1.00 12.09 C ATOM 3053 C VAL C 107 0.950 -7.914 19.780 1.00 13.27 C ATOM 3054 O VAL C 107 0.402 -8.650 20.615 1.00 13.09 O ATOM 3055 CB VAL C 107 1.276 -8.671 17.407 1.00 12.00 C ATOM 3056 CG1 VAL C 107 1.526 -10.046 17.979 1.00 12.87 C ATOM 3057 CG2 VAL C 107 0.562 -8.762 16.050 1.00 10.74 C ATOM 0 H VAL C 107 0.904 -6.281 17.172 1.00 11.79 H new ATOM 0 HA VAL C 107 -0.489 -8.096 18.346 1.00 12.09 H new ATOM 0 HB VAL C 107 2.147 -8.259 17.294 1.00 12.00 H new ATOM 0 HG11 VAL C 107 2.057 -10.565 17.355 1.00 12.87 H new ATOM 0 HG12 VAL C 107 2.003 -9.965 18.820 1.00 12.87 H new ATOM 0 HG13 VAL C 107 0.678 -10.493 18.130 1.00 12.87 H new ATOM 0 HG21 VAL C 107 1.084 -9.312 15.446 1.00 10.74 H new ATOM 0 HG22 VAL C 107 -0.315 -9.158 16.171 1.00 10.74 H new ATOM 0 HG23 VAL C 107 0.465 -7.873 15.675 1.00 10.74 H new ATOM 3058 N THR C 108 2.011 -7.179 20.056 1.00 14.36 N ATOM 3059 CA THR C 108 2.674 -7.257 21.349 1.00 14.92 C ATOM 3060 C THR C 108 1.801 -6.586 22.429 1.00 15.93 C ATOM 3061 O THR C 108 1.706 -7.124 23.511 1.00 16.49 O ATOM 3062 CB THR C 108 4.092 -6.612 21.296 1.00 15.56 C ATOM 3063 OG1 THR C 108 4.934 -7.357 20.372 1.00 14.81 O ATOM 3064 CG2 THR C 108 4.742 -6.548 22.727 1.00 13.85 C ATOM 0 H THR C 108 2.368 -6.623 19.505 1.00 14.36 H new ATOM 0 HA THR C 108 2.790 -8.192 21.579 1.00 14.92 H new ATOM 0 HB THR C 108 4.007 -5.700 20.978 1.00 15.56 H new ATOM 0 HG1 THR C 108 4.765 -7.118 19.584 1.00 14.81 H new ATOM 0 HG21 THR C 108 5.621 -6.143 22.665 1.00 13.85 H new ATOM 0 HG22 THR C 108 4.182 -6.016 23.313 1.00 13.85 H new ATOM 0 HG23 THR C 108 4.824 -7.445 23.086 1.00 13.85 H new ATOM 3065 N LEU C 109 1.156 -5.445 22.131 1.00 15.66 N ATOM 3066 CA LEU C 109 0.357 -4.737 23.139 1.00 16.43 C ATOM 3067 C LEU C 109 -0.914 -5.488 23.477 1.00 17.06 C ATOM 3068 O LEU C 109 -1.363 -5.510 24.635 1.00 18.56 O ATOM 3069 CB LEU C 109 -0.011 -3.323 22.669 1.00 16.24 C ATOM 3070 CG LEU C 109 1.116 -2.278 22.624 1.00 19.00 C ATOM 3071 CD1 LEU C 109 0.515 -1.071 21.989 1.00 23.34 C ATOM 3072 CD2 LEU C 109 1.653 -1.899 24.030 1.00 22.10 C ATOM 0 H LEU C 109 1.170 -5.070 21.357 1.00 15.66 H new ATOM 0 HA LEU C 109 0.910 -4.678 23.934 1.00 16.43 H new ATOM 0 HB2 LEU C 109 -0.392 -3.392 21.779 1.00 16.24 H new ATOM 0 HB3 LEU C 109 -0.710 -2.986 23.251 1.00 16.24 H new ATOM 0 HG LEU C 109 1.874 -2.637 22.136 1.00 19.00 H new ATOM 0 HD11 LEU C 109 1.182 -0.369 21.931 1.00 23.34 H new ATOM 0 HD12 LEU C 109 0.204 -1.295 21.098 1.00 23.34 H new ATOM 0 HD13 LEU C 109 -0.233 -0.762 22.524 1.00 23.34 H new ATOM 0 HD21 LEU C 109 2.359 -1.240 23.940 1.00 22.10 H new ATOM 0 HD22 LEU C 109 0.932 -1.530 24.563 1.00 22.10 H new ATOM 0 HD23 LEU C 109 2.005 -2.691 24.467 1.00 22.10 H new ATOM 3073 N ALA C 110 -1.519 -6.070 22.455 1.00 16.54 N ATOM 3074 CA ALA C 110 -2.667 -6.958 22.639 1.00 16.60 C ATOM 3075 C ALA C 110 -2.315 -8.204 23.469 1.00 16.32 C ATOM 3076 O ALA C 110 -3.145 -8.691 24.262 1.00 16.31 O ATOM 3077 CB ALA C 110 -3.238 -7.372 21.301 1.00 14.54 C ATOM 0 H ALA C 110 -1.281 -5.965 21.635 1.00 16.54 H new ATOM 0 HA ALA C 110 -3.335 -6.457 23.133 1.00 16.60 H new ATOM 0 HB1 ALA C 110 -3.997 -7.960 21.441 1.00 14.54 H new ATOM 0 HB2 ALA C 110 -3.525 -6.584 20.814 1.00 14.54 H new ATOM 0 HB3 ALA C 110 -2.559 -7.838 20.789 1.00 14.54 H new ATOM 3078 N ASN C 111 -1.093 -8.677 23.331 1.00 16.61 N ATOM 3079 CA ASN C 111 -0.632 -9.864 24.032 1.00 18.24 C ATOM 3080 C ASN C 111 -0.531 -9.625 25.568 1.00 19.25 C ATOM 3081 O ASN C 111 -0.893 -10.496 26.341 1.00 20.00 O ATOM 3082 CB ASN C 111 0.726 -10.304 23.430 1.00 17.48 C ATOM 3083 CG ASN C 111 1.036 -11.770 23.666 1.00 20.58 C ATOM 3084 OD1 ASN C 111 1.525 -12.082 24.860 1.00 19.43 O flip ATOM 3085 ND2 ASN C 111 0.844 -12.626 22.765 1.00 16.19 N flip ATOM 0 H ASN C 111 -0.499 -8.317 22.824 1.00 16.61 H new ATOM 0 HA ASN C 111 -1.280 -10.576 23.912 1.00 18.24 H new ATOM 0 HB2 ASN C 111 0.722 -10.130 22.476 1.00 17.48 H new ATOM 0 HB3 ASN C 111 1.434 -9.764 23.814 1.00 17.48 H new ATOM 0 HD21 ASN C 111 0.525 -12.385 22.004 1.00 16.19 H new ATOM 0 HD22 ASN C 111 1.031 -13.453 22.910 1.00 16.19 H new ATOM 3086 N HIS C 112 -0.080 -8.450 25.982 1.00 20.12 N ATOM 3087 CA HIS C 112 0.158 -8.112 27.411 1.00 20.97 C ATOM 3088 C HIS C 112 -0.971 -7.322 28.096 1.00 22.02 C ATOM 3089 O HIS C 112 -1.094 -7.358 29.331 1.00 21.36 O ATOM 3090 CB HIS C 112 1.464 -7.323 27.535 1.00 19.42 C ATOM 3091 CG HIS C 112 2.661 -8.134 27.142 1.00 22.31 C ATOM 3092 ND1 HIS C 112 3.268 -9.022 28.008 1.00 25.63 N ATOM 3093 CD2 HIS C 112 3.304 -8.267 25.955 1.00 21.07 C ATOM 3094 CE1 HIS C 112 4.261 -9.635 27.381 1.00 29.03 C ATOM 3095 NE2 HIS C 112 4.305 -9.193 26.136 1.00 24.95 N ATOM 0 H HIS C 112 0.104 -7.805 25.444 1.00 20.12 H new ATOM 0 HA HIS C 112 0.201 -8.964 27.873 1.00 20.97 H new ATOM 0 HB2 HIS C 112 1.415 -6.532 26.976 1.00 19.42 H new ATOM 0 HB3 HIS C 112 1.569 -7.018 28.450 1.00 19.42 H new ATOM 0 HD2 HIS C 112 3.105 -7.816 25.166 1.00 21.07 H new ATOM 0 HE1 HIS C 112 4.831 -10.269 27.754 1.00 29.03 H new ATOM 0 HE2 HIS C 112 4.868 -9.444 25.536 1.00 24.95 H new ATOM 3096 N HIS C 113 -1.804 -6.643 27.298 1.00 21.47 N ATOM 3097 CA HIS C 113 -2.843 -5.760 27.837 1.00 22.40 C ATOM 3098 C HIS C 113 -4.172 -6.004 27.231 1.00 21.37 C ATOM 3099 O HIS C 113 -4.797 -5.064 26.757 1.00 22.21 O ATOM 3100 CB HIS C 113 -2.426 -4.312 27.677 1.00 22.68 C ATOM 3101 CG HIS C 113 -1.154 -4.018 28.396 1.00 27.27 C ATOM 3102 ND1 HIS C 113 -1.073 -4.016 29.771 1.00 32.18 N ATOM 3103 CD2 HIS C 113 0.105 -3.814 27.941 1.00 30.82 C ATOM 3104 CE1 HIS C 113 0.177 -3.785 30.135 1.00 32.37 C ATOM 3105 NE2 HIS C 113 0.910 -3.649 29.046 1.00 32.81 N ATOM 0 H HIS C 113 -1.782 -6.681 26.439 1.00 21.47 H new ATOM 0 HA HIS C 113 -2.935 -5.962 28.781 1.00 22.40 H new ATOM 0 HB2 HIS C 113 -2.319 -4.109 26.735 1.00 22.68 H new ATOM 0 HB3 HIS C 113 -3.129 -3.734 28.014 1.00 22.68 H new ATOM 0 HD2 HIS C 113 0.375 -3.790 27.051 1.00 30.82 H new ATOM 0 HE1 HIS C 113 0.487 -3.728 31.010 1.00 32.37 H new ATOM 0 HE2 HIS C 113 1.754 -3.484 29.029 1.00 32.81 H new ATOM 3106 N PRO C 114 -4.618 -7.274 27.250 1.00 21.61 N ATOM 3107 CA PRO C 114 -5.830 -7.630 26.545 1.00 21.56 C ATOM 3108 C PRO C 114 -7.018 -6.794 26.984 1.00 22.85 C ATOM 3109 O PRO C 114 -7.837 -6.420 26.145 1.00 21.90 O ATOM 3110 CB PRO C 114 -6.048 -9.111 26.903 1.00 21.87 C ATOM 3111 CG PRO C 114 -4.940 -9.541 27.759 1.00 20.55 C ATOM 3112 CD PRO C 114 -4.033 -8.398 28.004 1.00 20.60 C ATOM 0 HA PRO C 114 -5.748 -7.474 25.591 1.00 21.56 H new ATOM 0 HB2 PRO C 114 -6.895 -9.227 27.361 1.00 21.87 H new ATOM 0 HB3 PRO C 114 -6.084 -9.652 26.099 1.00 21.87 H new ATOM 0 HG2 PRO C 114 -5.282 -9.881 28.601 1.00 20.55 H new ATOM 0 HG3 PRO C 114 -4.455 -10.267 27.336 1.00 20.55 H new ATOM 0 HD2 PRO C 114 -3.975 -8.193 28.950 1.00 20.60 H new ATOM 0 HD3 PRO C 114 -3.133 -8.593 27.700 1.00 20.60 H new ATOM 3113 N SER C 115 -7.129 -6.444 28.268 1.00 24.35 N ATOM 3114 CA SER C 115 -8.358 -5.760 28.658 1.00 25.92 C ATOM 3115 C SER C 115 -8.360 -4.285 28.299 1.00 26.75 C ATOM 3116 O SER C 115 -9.419 -3.706 28.180 1.00 28.13 O ATOM 3117 CB SER C 115 -8.744 -5.999 30.124 1.00 26.75 C ATOM 3118 OG SER C 115 -7.793 -5.411 30.956 1.00 28.79 O ATOM 0 H SER C 115 -6.549 -6.581 28.888 1.00 24.35 H new ATOM 0 HA SER C 115 -9.055 -6.171 28.124 1.00 25.92 H new ATOM 0 HB2 SER C 115 -9.621 -5.624 30.303 1.00 26.75 H new ATOM 0 HB3 SER C 115 -8.800 -6.951 30.303 1.00 26.75 H new ATOM 0 HG SER C 115 -7.029 -5.692 30.751 1.00 28.79 H new ATOM 3119 N GLU C 116 -7.187 -3.694 28.088 1.00 26.08 N ATOM 3120 CA GLU C 116 -7.110 -2.311 27.644 1.00 26.66 C ATOM 3121 C GLU C 116 -7.168 -2.159 26.116 1.00 24.64 C ATOM 3122 O GLU C 116 -7.403 -1.073 25.608 1.00 23.63 O ATOM 3123 CB GLU C 116 -5.852 -1.629 28.205 1.00 27.74 C ATOM 3124 CG GLU C 116 -5.901 -1.410 29.787 1.00 32.92 C ATOM 3125 CD GLU C 116 -5.475 -2.655 30.570 1.00 40.28 C ATOM 3126 OE1 GLU C 116 -4.668 -3.469 30.030 1.00 41.73 O ATOM 3127 OE2 GLU C 116 -5.956 -2.833 31.725 1.00 42.98 O ATOM 0 H GLU C 116 -6.426 -4.079 28.197 1.00 26.08 H new ATOM 0 HA GLU C 116 -7.899 -1.869 27.995 1.00 26.66 H new ATOM 0 HB2 GLU C 116 -5.075 -2.166 27.983 1.00 27.74 H new ATOM 0 HB3 GLU C 116 -5.737 -0.770 27.770 1.00 27.74 H new ATOM 0 HG2 GLU C 116 -5.322 -0.669 30.025 1.00 32.92 H new ATOM 0 HG3 GLU C 116 -6.802 -1.161 30.047 1.00 32.92 H new ATOM 3128 N PHE C 117 -6.977 -3.260 25.400 1.00 23.20 N ATOM 3129 CA PHE C 117 -6.816 -3.222 23.964 1.00 20.69 C ATOM 3130 C PHE C 117 -8.165 -3.518 23.347 1.00 20.30 C ATOM 3131 O PHE C 117 -8.367 -4.557 22.654 1.00 19.67 O ATOM 3132 CB PHE C 117 -5.787 -4.272 23.536 1.00 21.42 C ATOM 3133 CG PHE C 117 -5.295 -4.091 22.116 1.00 21.36 C ATOM 3134 CD1 PHE C 117 -4.324 -3.122 21.829 1.00 21.07 C ATOM 3135 CD2 PHE C 117 -5.759 -4.902 21.100 1.00 19.44 C ATOM 3136 CE1 PHE C 117 -3.842 -2.941 20.540 1.00 18.62 C ATOM 3137 CE2 PHE C 117 -5.271 -4.736 19.801 1.00 20.29 C ATOM 3138 CZ PHE C 117 -4.302 -3.721 19.544 1.00 18.16 C ATOM 0 H PHE C 117 -6.938 -4.049 25.739 1.00 23.20 H new ATOM 0 HA PHE C 117 -6.499 -2.353 23.671 1.00 20.69 H new ATOM 0 HB2 PHE C 117 -5.029 -4.237 24.140 1.00 21.42 H new ATOM 0 HB3 PHE C 117 -6.180 -5.154 23.625 1.00 21.42 H new ATOM 0 HD1 PHE C 117 -3.996 -2.589 22.517 1.00 21.07 H new ATOM 0 HD2 PHE C 117 -6.394 -5.557 21.279 1.00 19.44 H new ATOM 0 HE1 PHE C 117 -3.206 -2.285 20.366 1.00 18.62 H new ATOM 0 HE2 PHE C 117 -5.575 -5.281 19.112 1.00 20.29 H new ATOM 0 HZ PHE C 117 -3.985 -3.597 18.679 1.00 18.16 H new ATOM 3139 N THR C 118 -9.103 -2.612 23.620 1.00 19.45 N ATOM 3140 CA THR C 118 -10.476 -2.712 23.126 1.00 18.47 C ATOM 3141 C THR C 118 -10.487 -2.373 21.667 1.00 17.00 C ATOM 3142 O THR C 118 -9.500 -1.850 21.149 1.00 15.70 O ATOM 3143 CB THR C 118 -11.395 -1.734 23.862 1.00 18.87 C ATOM 3144 OG1 THR C 118 -10.959 -0.396 23.579 1.00 18.31 O ATOM 3145 CG2 THR C 118 -11.360 -1.993 25.367 1.00 18.75 C ATOM 0 H THR C 118 -8.958 -1.915 24.102 1.00 19.45 H new ATOM 0 HA THR C 118 -10.796 -3.615 23.276 1.00 18.47 H new ATOM 0 HB THR C 118 -12.308 -1.856 23.559 1.00 18.87 H new ATOM 0 HG1 THR C 118 -11.247 0.124 24.173 1.00 18.31 H new ATOM 0 HG21 THR C 118 -11.947 -1.366 25.817 1.00 18.75 H new ATOM 0 HG22 THR C 118 -11.657 -2.899 25.547 1.00 18.75 H new ATOM 0 HG23 THR C 118 -10.454 -1.879 25.694 1.00 18.75 H new ATOM 3146 N PRO C 119 -11.583 -2.685 20.961 1.00 17.56 N ATOM 3147 CA PRO C 119 -11.574 -2.285 19.537 1.00 17.30 C ATOM 3148 C PRO C 119 -11.342 -0.778 19.273 1.00 16.38 C ATOM 3149 O PRO C 119 -10.675 -0.399 18.295 1.00 13.56 O ATOM 3150 CB PRO C 119 -12.958 -2.715 19.055 1.00 17.44 C ATOM 3151 CG PRO C 119 -13.248 -3.894 19.868 1.00 17.80 C ATOM 3152 CD PRO C 119 -12.781 -3.497 21.274 1.00 18.00 C ATOM 0 HA PRO C 119 -10.829 -2.697 19.072 1.00 17.30 H new ATOM 0 HB2 PRO C 119 -13.617 -2.016 19.191 1.00 17.44 H new ATOM 0 HB3 PRO C 119 -12.958 -2.925 18.108 1.00 17.44 H new ATOM 0 HG2 PRO C 119 -14.193 -4.111 19.855 1.00 17.80 H new ATOM 0 HG3 PRO C 119 -12.774 -4.675 19.543 1.00 17.80 H new ATOM 0 HD2 PRO C 119 -13.453 -2.988 21.753 1.00 18.00 H new ATOM 0 HD3 PRO C 119 -12.567 -4.269 21.821 1.00 18.00 H new ATOM 3153 N ALA C 120 -11.874 0.081 20.131 1.00 16.24 N ATOM 3154 CA ALA C 120 -11.663 1.516 19.900 1.00 16.68 C ATOM 3155 C ALA C 120 -10.205 1.992 20.154 1.00 16.31 C ATOM 3156 O ALA C 120 -9.661 2.838 19.426 1.00 15.83 O ATOM 3157 CB ALA C 120 -12.669 2.332 20.774 1.00 17.73 C ATOM 0 H ALA C 120 -12.340 -0.125 20.824 1.00 16.24 H new ATOM 0 HA ALA C 120 -11.824 1.675 18.957 1.00 16.68 H new ATOM 0 HB1 ALA C 120 -12.533 3.281 20.624 1.00 17.73 H new ATOM 0 HB2 ALA C 120 -13.577 2.094 20.530 1.00 17.73 H new ATOM 0 HB3 ALA C 120 -12.523 2.129 21.711 1.00 17.73 H new ATOM 3158 N VAL C 121 -9.576 1.466 21.189 1.00 16.71 N ATOM 3159 CA VAL C 121 -8.163 1.779 21.467 1.00 17.22 C ATOM 3160 C VAL C 121 -7.212 1.184 20.347 1.00 16.83 C ATOM 3161 O VAL C 121 -6.266 1.802 19.870 1.00 18.27 O ATOM 3162 CB VAL C 121 -7.823 1.238 22.862 1.00 16.28 C ATOM 3163 CG1 VAL C 121 -6.310 1.279 23.152 1.00 17.12 C ATOM 3164 CG2 VAL C 121 -8.613 1.990 23.932 1.00 19.92 C ATOM 0 H VAL C 121 -9.939 0.924 21.750 1.00 16.71 H new ATOM 0 HA VAL C 121 -8.023 2.739 21.453 1.00 17.22 H new ATOM 0 HB VAL C 121 -8.084 0.304 22.884 1.00 16.28 H new ATOM 0 HG11 VAL C 121 -6.141 0.929 24.041 1.00 17.12 H new ATOM 0 HG12 VAL C 121 -5.840 0.739 22.498 1.00 17.12 H new ATOM 0 HG13 VAL C 121 -5.995 2.195 23.100 1.00 17.12 H new ATOM 0 HG21 VAL C 121 -8.388 1.638 24.808 1.00 19.92 H new ATOM 0 HG22 VAL C 121 -8.390 2.933 23.896 1.00 19.92 H new ATOM 0 HG23 VAL C 121 -9.563 1.877 23.772 1.00 19.92 H new ATOM 3165 N HIS C 122 -7.492 -0.027 19.911 1.00 17.34 N ATOM 3166 CA HIS C 122 -6.792 -0.623 18.717 1.00 15.16 C ATOM 3167 C HIS C 122 -6.859 0.318 17.519 1.00 15.56 C ATOM 3168 O HIS C 122 -5.841 0.652 16.920 1.00 17.26 O ATOM 3169 CB HIS C 122 -7.502 -1.925 18.437 1.00 14.23 C ATOM 3170 CG HIS C 122 -6.975 -2.719 17.284 1.00 13.63 C ATOM 3171 ND1 HIS C 122 -7.461 -3.986 17.004 1.00 13.86 N ATOM 3172 CD2 HIS C 122 -6.064 -2.446 16.326 1.00 15.72 C ATOM 3173 CE1 HIS C 122 -6.854 -4.462 15.928 1.00 14.31 C ATOM 3174 NE2 HIS C 122 -6.021 -3.542 15.486 1.00 14.67 N ATOM 0 H HIS C 122 -8.078 -0.542 20.272 1.00 17.34 H new ATOM 0 HA HIS C 122 -5.848 -0.767 18.889 1.00 15.16 H new ATOM 0 HB2 HIS C 122 -7.458 -2.476 19.234 1.00 14.23 H new ATOM 0 HB3 HIS C 122 -8.439 -1.735 18.275 1.00 14.23 H new ATOM 0 HD2 HIS C 122 -5.561 -1.668 16.247 1.00 15.72 H new ATOM 0 HE1 HIS C 122 -6.992 -5.300 15.550 1.00 14.31 H new ATOM 0 HE2 HIS C 122 -5.528 -3.613 14.785 1.00 14.67 H new ATOM 3175 N ALA C 123 -8.048 0.797 17.179 1.00 15.38 N ATOM 3176 CA ALA C 123 -8.205 1.762 16.102 1.00 14.33 C ATOM 3177 C ALA C 123 -7.309 3.025 16.259 1.00 15.49 C ATOM 3178 O ALA C 123 -6.652 3.467 15.274 1.00 14.01 O ATOM 3179 CB ALA C 123 -9.655 2.139 15.979 1.00 15.06 C ATOM 0 H ALA C 123 -8.783 0.573 17.564 1.00 15.38 H new ATOM 0 HA ALA C 123 -7.903 1.333 15.286 1.00 14.33 H new ATOM 0 HB1 ALA C 123 -9.762 2.783 15.261 1.00 15.06 H new ATOM 0 HB2 ALA C 123 -10.180 1.347 15.784 1.00 15.06 H new ATOM 0 HB3 ALA C 123 -9.959 2.531 16.812 1.00 15.06 H new ATOM 3180 N SER C 124 -7.282 3.579 17.489 1.00 14.40 N ATOM 3181 CA SER C 124 -6.547 4.818 17.740 1.00 15.38 C ATOM 3182 C SER C 124 -5.032 4.569 17.724 1.00 15.58 C ATOM 3183 O SER C 124 -4.269 5.408 17.218 1.00 15.80 O ATOM 3184 CB SER C 124 -6.976 5.411 19.069 1.00 13.94 C ATOM 3185 OG SER C 124 -8.387 5.659 19.059 1.00 16.66 O ATOM 0 H SER C 124 -7.680 3.251 18.177 1.00 14.40 H new ATOM 0 HA SER C 124 -6.752 5.449 17.032 1.00 15.38 H new ATOM 0 HB2 SER C 124 -6.751 4.803 19.791 1.00 13.94 H new ATOM 0 HB3 SER C 124 -6.495 6.237 19.234 1.00 13.94 H new ATOM 0 HG SER C 124 -8.565 6.240 18.479 1.00 16.66 H new ATOM 3186 N LEU C 125 -4.612 3.399 18.239 1.00 16.56 N ATOM 3187 CA LEU C 125 -3.182 3.044 18.200 1.00 17.28 C ATOM 3188 C LEU C 125 -2.692 2.801 16.776 1.00 18.31 C ATOM 3189 O LEU C 125 -1.615 3.279 16.395 1.00 18.20 O ATOM 3190 CB LEU C 125 -2.879 1.855 19.093 1.00 17.71 C ATOM 3191 CG LEU C 125 -2.942 2.058 20.628 1.00 19.49 C ATOM 3192 CD1 LEU C 125 -2.643 0.745 21.328 1.00 21.45 C ATOM 3193 CD2 LEU C 125 -2.002 3.125 21.180 1.00 21.05 C ATOM 0 H LEU C 125 -5.124 2.813 18.605 1.00 16.56 H new ATOM 0 HA LEU C 125 -2.694 3.807 18.546 1.00 17.28 H new ATOM 0 HB2 LEU C 125 -3.499 1.145 18.862 1.00 17.71 H new ATOM 0 HB3 LEU C 125 -1.989 1.538 18.872 1.00 17.71 H new ATOM 0 HG LEU C 125 -3.843 2.371 20.805 1.00 19.49 H new ATOM 0 HD11 LEU C 125 -2.683 0.874 22.289 1.00 21.45 H new ATOM 0 HD12 LEU C 125 -3.299 0.081 21.064 1.00 21.45 H new ATOM 0 HD13 LEU C 125 -1.756 0.440 21.080 1.00 21.45 H new ATOM 0 HD21 LEU C 125 -2.108 3.184 22.142 1.00 21.05 H new ATOM 0 HD22 LEU C 125 -1.085 2.889 20.970 1.00 21.05 H new ATOM 0 HD23 LEU C 125 -2.214 3.982 20.779 1.00 21.05 H new ATOM 3194 N ASP C 126 -3.489 2.094 15.967 1.00 17.79 N ATOM 3195 CA ASP C 126 -3.139 1.902 14.555 1.00 18.66 C ATOM 3196 C ASP C 126 -2.919 3.257 13.828 1.00 18.94 C ATOM 3197 O ASP C 126 -1.912 3.462 13.148 1.00 16.93 O ATOM 3198 CB ASP C 126 -4.194 1.034 13.853 1.00 18.20 C ATOM 3199 CG ASP C 126 -3.768 0.604 12.445 1.00 20.16 C ATOM 3200 OD1 ASP C 126 -4.027 1.343 11.512 1.00 21.60 O ATOM 3201 OD2 ASP C 126 -3.266 -0.523 12.248 1.00 26.39 O ATOM 0 H ASP C 126 -4.225 1.723 16.211 1.00 17.79 H new ATOM 0 HA ASP C 126 -2.293 1.429 14.515 1.00 18.66 H new ATOM 0 HB2 ASP C 126 -4.366 0.244 14.390 1.00 18.20 H new ATOM 0 HB3 ASP C 126 -5.028 1.527 13.798 1.00 18.20 H new ATOM 3202 N LYS C 127 -3.858 4.188 14.007 1.00 20.32 N ATOM 3203 CA LYS C 127 -3.713 5.511 13.434 1.00 21.43 C ATOM 3204 C LYS C 127 -2.463 6.233 13.985 1.00 20.78 C ATOM 3205 O LYS C 127 -1.759 6.896 13.214 1.00 20.15 O ATOM 3206 CB LYS C 127 -4.957 6.356 13.720 1.00 21.54 C ATOM 3207 CG LYS C 127 -6.159 6.094 12.796 1.00 24.64 C ATOM 3208 CD LYS C 127 -7.317 7.096 13.081 1.00 25.32 C ATOM 3209 CE LYS C 127 -6.989 8.516 12.656 1.00 28.07 C ATOM 3210 NZ LYS C 127 -8.211 9.383 12.716 1.00 29.79 N ATOM 0 H LYS C 127 -4.581 4.067 14.456 1.00 20.32 H new ATOM 0 HA LYS C 127 -3.607 5.403 12.476 1.00 21.43 H new ATOM 0 HB2 LYS C 127 -5.233 6.199 14.637 1.00 21.54 H new ATOM 0 HB3 LYS C 127 -4.715 7.293 13.653 1.00 21.54 H new ATOM 0 HG2 LYS C 127 -5.881 6.172 11.870 1.00 24.64 H new ATOM 0 HG3 LYS C 127 -6.475 5.186 12.922 1.00 24.64 H new ATOM 0 HD2 LYS C 127 -8.116 6.801 12.616 1.00 25.32 H new ATOM 0 HD3 LYS C 127 -7.521 7.086 14.029 1.00 25.32 H new ATOM 0 HE2 LYS C 127 -6.300 8.880 13.233 1.00 28.07 H new ATOM 0 HE3 LYS C 127 -6.632 8.514 11.754 1.00 28.07 H new ATOM 0 HZ1 LYS C 127 -8.022 10.186 12.382 1.00 29.79 H new ATOM 0 HZ2 LYS C 127 -8.864 9.010 12.239 1.00 29.79 H new ATOM 0 HZ3 LYS C 127 -8.474 9.468 13.562 1.00 29.79 H new ATOM 3211 N PHE C 128 -2.233 6.136 15.307 1.00 20.13 N ATOM 3212 CA PHE C 128 -1.049 6.732 15.938 1.00 18.75 C ATOM 3213 C PHE C 128 0.238 6.256 15.231 1.00 18.02 C ATOM 3214 O PHE C 128 1.070 7.065 14.836 1.00 16.05 O ATOM 3215 CB PHE C 128 -1.026 6.342 17.397 1.00 17.48 C ATOM 3216 CG PHE C 128 0.264 6.697 18.142 1.00 18.90 C ATOM 3217 CD1 PHE C 128 0.752 8.007 18.170 1.00 18.24 C ATOM 3218 CD2 PHE C 128 0.948 5.716 18.847 1.00 18.13 C ATOM 3219 CE1 PHE C 128 1.955 8.325 18.862 1.00 20.15 C ATOM 3220 CE2 PHE C 128 2.131 6.019 19.560 1.00 21.91 C ATOM 3221 CZ PHE C 128 2.633 7.322 19.549 1.00 18.00 C ATOM 0 H PHE C 128 -2.756 5.727 15.854 1.00 20.13 H new ATOM 0 HA PHE C 128 -1.091 7.698 15.860 1.00 18.75 H new ATOM 0 HB2 PHE C 128 -1.771 6.773 17.845 1.00 17.48 H new ATOM 0 HB3 PHE C 128 -1.169 5.385 17.464 1.00 17.48 H new ATOM 0 HD1 PHE C 128 0.284 8.680 17.730 1.00 18.24 H new ATOM 0 HD2 PHE C 128 0.623 4.845 18.850 1.00 18.13 H new ATOM 0 HE1 PHE C 128 2.285 9.195 18.855 1.00 20.15 H new ATOM 0 HE2 PHE C 128 2.573 5.353 20.035 1.00 21.91 H new ATOM 0 HZ PHE C 128 3.421 7.520 20.001 1.00 18.00 H new ATOM 3222 N LEU C 129 0.387 4.937 15.087 1.00 17.25 N ATOM 3223 CA LEU C 129 1.551 4.355 14.440 1.00 17.52 C ATOM 3224 C LEU C 129 1.610 4.732 12.974 1.00 18.87 C ATOM 3225 O LEU C 129 2.708 4.983 12.468 1.00 20.00 O ATOM 3226 CB LEU C 129 1.670 2.817 14.676 1.00 16.87 C ATOM 3227 CG LEU C 129 1.878 2.406 16.153 1.00 18.10 C ATOM 3228 CD1 LEU C 129 1.758 0.918 16.406 1.00 14.43 C ATOM 3229 CD2 LEU C 129 3.167 2.905 16.756 1.00 23.28 C ATOM 0 H LEU C 129 -0.187 4.360 15.364 1.00 17.25 H new ATOM 0 HA LEU C 129 2.334 4.739 14.864 1.00 17.52 H new ATOM 0 HB2 LEU C 129 0.866 2.388 14.343 1.00 16.87 H new ATOM 0 HB3 LEU C 129 2.411 2.478 14.151 1.00 16.87 H new ATOM 0 HG LEU C 129 1.140 2.850 16.599 1.00 18.10 H new ATOM 0 HD11 LEU C 129 1.900 0.737 17.348 1.00 14.43 H new ATOM 0 HD12 LEU C 129 0.873 0.616 16.149 1.00 14.43 H new ATOM 0 HD13 LEU C 129 2.425 0.446 15.883 1.00 14.43 H new ATOM 0 HD21 LEU C 129 3.228 2.611 17.678 1.00 23.28 H new ATOM 0 HD22 LEU C 129 3.918 2.552 16.253 1.00 23.28 H new ATOM 0 HD23 LEU C 129 3.185 3.874 16.725 1.00 23.28 H new ATOM 3230 N ALA C 130 0.469 4.836 12.283 1.00 18.36 N ATOM 3231 CA ALA C 130 0.553 5.221 10.895 1.00 18.68 C ATOM 3232 C ALA C 130 1.089 6.669 10.793 1.00 19.45 C ATOM 3233 O ALA C 130 1.854 7.008 9.896 1.00 18.34 O ATOM 3234 CB ALA C 130 -0.825 5.126 10.202 1.00 18.74 C ATOM 0 H ALA C 130 -0.321 4.694 12.590 1.00 18.36 H new ATOM 0 HA ALA C 130 1.159 4.611 10.446 1.00 18.68 H new ATOM 0 HB1 ALA C 130 -0.739 5.390 9.273 1.00 18.74 H new ATOM 0 HB2 ALA C 130 -1.149 4.213 10.250 1.00 18.74 H new ATOM 0 HB3 ALA C 130 -1.453 5.715 10.648 1.00 18.74 H new ATOM 3235 N ASN C 131 0.622 7.530 11.691 1.00 20.22 N ATOM 3236 CA ASN C 131 1.044 8.914 11.682 1.00 21.47 C ATOM 3237 C ASN C 131 2.540 9.011 11.962 1.00 20.79 C ATOM 3238 O ASN C 131 3.238 9.786 11.331 1.00 22.46 O ATOM 3239 CB ASN C 131 0.297 9.677 12.775 1.00 22.65 C ATOM 3240 CG ASN C 131 -0.950 10.343 12.279 1.00 29.44 C ATOM 3241 OD1 ASN C 131 -1.870 9.688 11.731 1.00 34.10 O ATOM 3242 ND2 ASN C 131 -1.027 11.668 12.495 1.00 31.73 N ATOM 0 H ASN C 131 0.061 7.328 12.311 1.00 20.22 H new ATOM 0 HA ASN C 131 0.851 9.293 10.810 1.00 21.47 H new ATOM 0 HB2 ASN C 131 0.067 9.064 13.491 1.00 22.65 H new ATOM 0 HB3 ASN C 131 0.886 10.348 13.154 1.00 22.65 H new ATOM 0 HD21 ASN C 131 -1.729 12.103 12.254 1.00 31.73 H new ATOM 0 HD22 ASN C 131 -0.374 12.081 12.874 1.00 31.73 H new ATOM 3243 N VAL C 132 3.013 8.258 12.951 1.00 20.00 N ATOM 3244 CA VAL C 132 4.399 8.252 13.322 1.00 20.08 C ATOM 3245 C VAL C 132 5.192 7.744 12.118 1.00 19.67 C ATOM 3246 O VAL C 132 6.212 8.340 11.762 1.00 18.77 O ATOM 3247 CB VAL C 132 4.643 7.403 14.633 1.00 19.65 C ATOM 3248 CG1 VAL C 132 6.130 6.953 14.805 1.00 20.65 C ATOM 3249 CG2 VAL C 132 4.169 8.194 15.916 1.00 22.82 C ATOM 0 H VAL C 132 2.522 7.734 13.424 1.00 20.00 H new ATOM 0 HA VAL C 132 4.702 9.146 13.546 1.00 20.08 H new ATOM 0 HB VAL C 132 4.110 6.599 14.534 1.00 19.65 H new ATOM 0 HG11 VAL C 132 6.220 6.438 15.622 1.00 20.65 H new ATOM 0 HG12 VAL C 132 6.392 6.406 14.048 1.00 20.65 H new ATOM 0 HG13 VAL C 132 6.702 7.735 14.852 1.00 20.65 H new ATOM 0 HG21 VAL C 132 4.328 7.654 16.706 1.00 22.82 H new ATOM 0 HG22 VAL C 132 4.666 9.024 15.986 1.00 22.82 H new ATOM 0 HG23 VAL C 132 3.222 8.390 15.844 1.00 22.82 H new ATOM 3250 N SER C 133 4.734 6.648 11.493 1.00 18.48 N ATOM 3251 CA SER C 133 5.442 6.111 10.348 1.00 18.50 C ATOM 3252 C SER C 133 5.608 7.114 9.183 1.00 19.43 C ATOM 3253 O SER C 133 6.647 7.129 8.519 1.00 19.44 O ATOM 3254 CB SER C 133 4.735 4.833 9.865 1.00 18.50 C ATOM 3255 OG SER C 133 4.712 3.873 10.929 1.00 16.04 O ATOM 0 H SER C 133 4.026 6.215 11.720 1.00 18.48 H new ATOM 0 HA SER C 133 6.343 5.909 10.645 1.00 18.50 H new ATOM 0 HB2 SER C 133 3.830 5.039 9.582 1.00 18.50 H new ATOM 0 HB3 SER C 133 5.197 4.467 9.095 1.00 18.50 H new ATOM 0 HG SER C 133 4.138 4.100 11.499 1.00 16.04 H new ATOM 3256 N THR C 134 4.571 7.915 8.886 1.00 20.18 N ATOM 3257 CA THR C 134 4.634 8.905 7.782 1.00 20.81 C ATOM 3258 C THR C 134 5.759 9.904 8.020 1.00 20.35 C ATOM 3259 O THR C 134 6.593 10.191 7.119 1.00 20.58 O ATOM 3260 CB THR C 134 3.293 9.693 7.644 1.00 20.96 C ATOM 3261 OG1 THR C 134 2.256 8.774 7.286 1.00 23.68 O ATOM 3262 CG2 THR C 134 3.374 10.767 6.549 1.00 22.45 C ATOM 0 H THR C 134 3.822 7.904 9.308 1.00 20.18 H new ATOM 0 HA THR C 134 4.798 8.408 6.965 1.00 20.81 H new ATOM 0 HB THR C 134 3.112 10.127 8.492 1.00 20.96 H new ATOM 0 HG1 THR C 134 2.009 8.351 7.968 1.00 23.68 H new ATOM 0 HG21 THR C 134 2.526 11.235 6.491 1.00 22.45 H new ATOM 0 HG22 THR C 134 4.077 11.399 6.766 1.00 22.45 H new ATOM 0 HG23 THR C 134 3.569 10.347 5.697 1.00 22.45 H new ATOM 3263 N VAL C 135 5.797 10.406 9.252 1.00 20.64 N ATOM 3264 CA VAL C 135 6.813 11.359 9.654 1.00 19.88 C ATOM 3265 C VAL C 135 8.240 10.793 9.490 1.00 20.06 C ATOM 3266 O VAL C 135 9.134 11.488 8.948 1.00 19.77 O ATOM 3267 CB VAL C 135 6.556 11.794 11.074 1.00 20.35 C ATOM 3268 CG1 VAL C 135 7.755 12.516 11.610 1.00 22.23 C ATOM 3269 CG2 VAL C 135 5.318 12.686 11.106 1.00 21.48 C ATOM 0 H VAL C 135 5.236 10.202 9.871 1.00 20.64 H new ATOM 0 HA VAL C 135 6.757 12.130 9.068 1.00 19.88 H new ATOM 0 HB VAL C 135 6.397 11.019 11.636 1.00 20.35 H new ATOM 0 HG11 VAL C 135 7.584 12.794 12.524 1.00 22.23 H new ATOM 0 HG12 VAL C 135 8.524 11.925 11.590 1.00 22.23 H new ATOM 0 HG13 VAL C 135 7.934 13.297 11.063 1.00 22.23 H new ATOM 0 HG21 VAL C 135 5.147 12.970 12.018 1.00 21.48 H new ATOM 0 HG22 VAL C 135 5.466 13.465 10.548 1.00 21.48 H new ATOM 0 HG23 VAL C 135 4.553 12.191 10.773 1.00 21.48 H new ATOM 3270 N LEU C 136 8.461 9.534 9.936 1.00 19.12 N ATOM 3271 CA LEU C 136 9.787 8.959 9.893 1.00 19.39 C ATOM 3272 C LEU C 136 10.180 8.517 8.459 1.00 20.19 C ATOM 3273 O LEU C 136 11.347 8.256 8.199 1.00 21.29 O ATOM 3274 CB LEU C 136 9.934 7.798 10.900 1.00 19.56 C ATOM 3275 CG LEU C 136 9.679 7.994 12.419 1.00 21.35 C ATOM 3276 CD1 LEU C 136 10.273 6.811 13.223 1.00 21.75 C ATOM 3277 CD2 LEU C 136 10.109 9.334 13.012 1.00 22.35 C ATOM 0 H LEU C 136 7.853 9.018 10.259 1.00 19.12 H new ATOM 0 HA LEU C 136 10.407 9.656 10.158 1.00 19.39 H new ATOM 0 HB2 LEU C 136 9.337 7.093 10.604 1.00 19.56 H new ATOM 0 HB3 LEU C 136 10.839 7.461 10.809 1.00 19.56 H new ATOM 0 HG LEU C 136 8.713 8.009 12.502 1.00 21.35 H new ATOM 0 HD11 LEU C 136 10.107 6.946 14.169 1.00 21.75 H new ATOM 0 HD12 LEU C 136 9.856 5.983 12.937 1.00 21.75 H new ATOM 0 HD13 LEU C 136 11.229 6.761 13.067 1.00 21.75 H new ATOM 0 HD21 LEU C 136 9.905 9.349 13.960 1.00 22.35 H new ATOM 0 HD22 LEU C 136 11.063 9.453 12.885 1.00 22.35 H new ATOM 0 HD23 LEU C 136 9.632 10.053 12.568 1.00 22.35 H new ATOM 3278 N THR C 137 9.231 8.470 7.522 1.00 20.08 N ATOM 3279 CA THR C 137 9.579 8.168 6.127 1.00 22.47 C ATOM 3280 C THR C 137 9.561 9.402 5.238 1.00 23.22 C ATOM 3281 O THR C 137 9.728 9.296 4.043 1.00 23.84 O ATOM 3282 CB THR C 137 8.632 7.097 5.479 1.00 22.07 C ATOM 3283 OG1 THR C 137 7.270 7.498 5.645 1.00 21.38 O ATOM 3284 CG2 THR C 137 8.870 5.713 6.099 1.00 23.73 C ATOM 0 H THR C 137 8.394 8.607 7.667 1.00 20.08 H new ATOM 0 HA THR C 137 10.481 7.814 6.178 1.00 22.47 H new ATOM 0 HB THR C 137 8.830 7.035 4.531 1.00 22.07 H new ATOM 0 HG1 THR C 137 7.052 7.422 6.453 1.00 21.38 H new ATOM 0 HG21 THR C 137 8.276 5.067 5.686 1.00 23.73 H new ATOM 0 HG22 THR C 137 9.791 5.446 5.951 1.00 23.73 H new ATOM 0 HG23 THR C 137 8.693 5.750 7.052 1.00 23.73 H new ATOM 3285 N SER C 138 9.311 10.566 5.811 1.00 25.69 N ATOM 3286 CA SER C 138 9.206 11.776 5.008 1.00 27.11 C ATOM 3287 C SER C 138 10.449 12.616 5.174 1.00 28.36 C ATOM 3288 O SER C 138 10.975 12.731 6.280 1.00 27.97 O ATOM 3289 CB SER C 138 7.965 12.570 5.388 1.00 27.69 C ATOM 3290 OG SER C 138 6.816 11.866 4.923 1.00 30.47 O ATOM 0 H SER C 138 9.199 10.680 6.656 1.00 25.69 H new ATOM 0 HA SER C 138 9.124 11.523 4.075 1.00 27.11 H new ATOM 0 HB2 SER C 138 7.922 12.687 6.350 1.00 27.69 H new ATOM 0 HB3 SER C 138 7.999 13.456 4.995 1.00 27.69 H new ATOM 0 HG SER C 138 6.594 11.286 5.489 1.00 30.47 H new ATOM 3291 N LYS C 139 10.939 13.164 4.065 1.00 29.09 N ATOM 3292 CA LYS C 139 11.995 14.160 4.136 1.00 31.35 C ATOM 3293 C LYS C 139 11.314 15.536 4.171 1.00 31.45 C ATOM 3294 O LYS C 139 10.674 15.965 3.190 1.00 30.85 O ATOM 3295 CB LYS C 139 12.971 14.036 2.962 1.00 31.62 C ATOM 3296 CG LYS C 139 13.761 12.709 2.893 1.00 34.08 C ATOM 3297 CD LYS C 139 14.889 12.702 1.801 1.00 33.89 C ATOM 3298 CE LYS C 139 14.356 12.911 0.353 1.00 39.48 C ATOM 3299 NZ LYS C 139 15.352 12.595 -0.796 1.00 40.36 N ATOM 0 H LYS C 139 10.674 12.973 3.269 1.00 29.09 H new ATOM 0 HA LYS C 139 12.531 14.029 4.934 1.00 31.35 H new ATOM 0 HB2 LYS C 139 12.474 14.142 2.136 1.00 31.62 H new ATOM 0 HB3 LYS C 139 13.604 14.769 3.009 1.00 31.62 H new ATOM 0 HG2 LYS C 139 14.160 12.534 3.760 1.00 34.08 H new ATOM 0 HG3 LYS C 139 13.143 11.983 2.713 1.00 34.08 H new ATOM 0 HD2 LYS C 139 15.531 13.400 2.005 1.00 33.89 H new ATOM 0 HD3 LYS C 139 15.365 11.858 1.844 1.00 33.89 H new ATOM 0 HE2 LYS C 139 13.569 12.357 0.235 1.00 39.48 H new ATOM 0 HE3 LYS C 139 14.070 13.834 0.264 1.00 39.48 H new ATOM 0 HZ1 LYS C 139 14.933 12.660 -1.579 1.00 40.36 H new ATOM 0 HZ2 LYS C 139 16.027 13.175 -0.772 1.00 40.36 H new ATOM 0 HZ3 LYS C 139 15.668 11.769 -0.697 1.00 40.36 H new ATOM 3300 N TYR C 140 11.398 16.187 5.319 1.00 31.42 N ATOM 3301 CA TYR C 140 10.799 17.502 5.468 1.00 32.85 C ATOM 3302 C TYR C 140 11.766 18.545 6.025 1.00 34.57 C ATOM 3303 O TYR C 140 11.372 19.670 6.341 1.00 35.29 O ATOM 3304 CB TYR C 140 9.500 17.452 6.258 1.00 31.10 C ATOM 3305 CG TYR C 140 9.641 16.917 7.668 1.00 30.90 C ATOM 3306 CD1 TYR C 140 9.612 15.530 7.916 1.00 27.81 C ATOM 3307 CD2 TYR C 140 9.775 17.801 8.764 1.00 27.35 C ATOM 3308 CE1 TYR C 140 9.748 15.017 9.229 1.00 27.11 C ATOM 3309 CE2 TYR C 140 9.894 17.310 10.076 1.00 29.34 C ATOM 3310 CZ TYR C 140 9.866 15.916 10.297 1.00 28.64 C ATOM 3311 OH TYR C 140 9.987 15.431 11.568 1.00 28.18 O ATOM 0 H TYR C 140 11.795 15.888 6.021 1.00 31.42 H new ATOM 0 HA TYR C 140 10.579 17.795 4.570 1.00 32.85 H new ATOM 0 HB2 TYR C 140 9.126 18.346 6.300 1.00 31.10 H new ATOM 0 HB3 TYR C 140 8.864 16.900 5.777 1.00 31.10 H new ATOM 0 HD1 TYR C 140 9.502 14.941 7.205 1.00 27.81 H new ATOM 0 HD2 TYR C 140 9.785 18.719 8.615 1.00 27.35 H new ATOM 0 HE1 TYR C 140 9.759 14.099 9.380 1.00 27.11 H new ATOM 0 HE2 TYR C 140 9.990 17.897 10.791 1.00 29.34 H new ATOM 0 HH TYR C 140 9.787 16.033 12.118 1.00 28.18 H new ATOM 3312 N ARG C 141 13.035 18.176 6.138 1.00 36.97 N ATOM 3313 CA ARG C 141 14.089 19.199 6.327 1.00 39.32 C ATOM 3314 C ARG C 141 15.450 18.773 5.767 1.00 39.84 C ATOM 3315 O ARG C 141 15.535 17.862 4.916 1.00 39.45 O ATOM 3316 CB ARG C 141 14.180 19.684 7.774 1.00 39.54 C ATOM 3317 CG ARG C 141 14.380 18.595 8.795 1.00 43.55 C ATOM 3318 CD ARG C 141 13.480 18.820 9.986 1.00 49.37 C ATOM 3319 NE ARG C 141 13.775 20.077 10.665 1.00 53.54 N ATOM 3320 CZ ARG C 141 12.937 20.686 11.499 1.00 56.83 C ATOM 3321 NH1 ARG C 141 11.739 20.152 11.751 1.00 56.42 N ATOM 3322 NH2 ARG C 141 13.292 21.843 12.067 1.00 58.19 N ATOM 3323 OXT ARG C 141 16.477 19.363 6.157 1.00 40.97 O ATOM 0 H ARG C 141 13.314 17.363 6.111 1.00 36.97 H new ATOM 0 HA ARG C 141 13.812 19.962 5.796 1.00 39.32 H new ATOM 0 HB2 ARG C 141 14.914 20.315 7.845 1.00 39.54 H new ATOM 0 HB3 ARG C 141 13.368 20.168 7.991 1.00 39.54 H new ATOM 0 HG2 ARG C 141 14.190 17.731 8.397 1.00 43.55 H new ATOM 0 HG3 ARG C 141 15.307 18.578 9.081 1.00 43.55 H new ATOM 0 HD2 ARG C 141 12.555 18.820 9.695 1.00 49.37 H new ATOM 0 HD3 ARG C 141 13.581 18.085 10.610 1.00 49.37 H new ATOM 0 HE ARG C 141 14.537 20.447 10.517 1.00 53.54 H new ATOM 0 HH11 ARG C 141 11.509 19.414 11.374 1.00 56.42 H new ATOM 0 HH12 ARG C 141 11.197 20.546 12.290 1.00 56.42 H new ATOM 0 HH21 ARG C 141 14.059 22.190 11.892 1.00 58.19 H new ATOM 0 HH22 ARG C 141 12.753 22.240 12.607 1.00 58.19 H new TER 3324 ARG C 141 ATOM 3325 N VAL D 1 1.828 -22.646 0.246 1.00 38.81 N ATOM 3326 CA VAL D 1 2.760 -22.155 1.301 1.00 39.36 C ATOM 3327 C VAL D 1 3.525 -23.330 1.878 1.00 39.67 C ATOM 3328 O VAL D 1 2.975 -24.417 2.065 1.00 39.76 O ATOM 3329 CB VAL D 1 2.050 -21.282 2.425 1.00 39.40 C ATOM 3330 CG1 VAL D 1 0.556 -21.379 2.347 1.00 38.45 C ATOM 3331 CG2 VAL D 1 2.533 -21.635 3.834 1.00 38.56 C ATOM 0 H1 VAL D 1 1.398 -21.956 -0.115 1.00 38.81 H new ATOM 0 H2 VAL D 1 2.291 -23.070 -0.385 1.00 38.81 H new ATOM 0 H3 VAL D 1 1.238 -23.206 0.608 1.00 38.81 H new ATOM 0 HA VAL D 1 3.385 -21.543 0.882 1.00 39.36 H new ATOM 0 HB VAL D 1 2.305 -20.363 2.249 1.00 39.40 H new ATOM 0 HG11 VAL D 1 0.159 -20.835 3.046 1.00 38.45 H new ATOM 0 HG12 VAL D 1 0.256 -21.062 1.481 1.00 38.45 H new ATOM 0 HG13 VAL D 1 0.285 -22.303 2.464 1.00 38.45 H new ATOM 0 HG21 VAL D 1 2.074 -21.079 4.483 1.00 38.56 H new ATOM 0 HG22 VAL D 1 2.343 -22.568 4.017 1.00 38.56 H new ATOM 0 HG23 VAL D 1 3.489 -21.482 3.897 1.00 38.56 H new ATOM 3332 N HIS D 2 4.803 -23.123 2.142 1.00 40.19 N ATOM 3333 CA HIS D 2 5.590 -24.244 2.613 1.00 41.27 C ATOM 3334 C HIS D 2 6.090 -24.091 4.023 1.00 39.82 C ATOM 3335 O HIS D 2 6.944 -23.240 4.322 1.00 39.99 O ATOM 3336 CB HIS D 2 6.715 -24.604 1.656 1.00 42.47 C ATOM 3337 CG HIS D 2 6.818 -26.070 1.429 1.00 45.77 C ATOM 3338 ND1 HIS D 2 6.876 -26.623 0.168 1.00 49.17 N ATOM 3339 CD2 HIS D 2 6.806 -27.107 2.303 1.00 48.30 C ATOM 3340 CE1 HIS D 2 6.929 -27.940 0.278 1.00 50.52 C ATOM 3341 NE2 HIS D 2 6.889 -28.259 1.562 1.00 50.20 N ATOM 0 H HIS D 2 5.220 -22.375 2.060 1.00 40.19 H new ATOM 0 HA HIS D 2 4.971 -24.991 2.633 1.00 41.27 H new ATOM 0 HB2 HIS D 2 6.570 -24.157 0.807 1.00 42.47 H new ATOM 0 HB3 HIS D 2 7.556 -24.274 2.010 1.00 42.47 H new ATOM 0 HD2 HIS D 2 6.752 -27.048 3.230 1.00 48.30 H new ATOM 0 HE1 HIS D 2 6.985 -28.542 -0.429 1.00 50.52 H new ATOM 0 HE2 HIS D 2 6.911 -29.058 1.880 1.00 50.20 H new ATOM 3342 N LEU D 3 5.515 -24.915 4.887 1.00 37.92 N ATOM 3343 CA LEU D 3 5.841 -24.873 6.290 1.00 37.14 C ATOM 3344 C LEU D 3 6.660 -26.122 6.579 1.00 36.83 C ATOM 3345 O LEU D 3 6.407 -27.168 5.995 1.00 36.44 O ATOM 3346 CB LEU D 3 4.559 -24.866 7.143 1.00 36.34 C ATOM 3347 CG LEU D 3 3.537 -23.754 6.912 1.00 35.18 C ATOM 3348 CD1 LEU D 3 2.281 -24.041 7.691 1.00 33.62 C ATOM 3349 CD2 LEU D 3 4.114 -22.402 7.257 1.00 34.60 C ATOM 0 H LEU D 3 4.930 -25.508 4.673 1.00 37.92 H new ATOM 0 HA LEU D 3 6.336 -24.068 6.509 1.00 37.14 H new ATOM 0 HB2 LEU D 3 4.109 -25.714 7.006 1.00 36.34 H new ATOM 0 HB3 LEU D 3 4.825 -24.834 8.075 1.00 36.34 H new ATOM 0 HG LEU D 3 3.309 -23.730 5.969 1.00 35.18 H new ATOM 0 HD11 LEU D 3 1.637 -23.332 7.540 1.00 33.62 H new ATOM 0 HD12 LEU D 3 1.905 -24.886 7.399 1.00 33.62 H new ATOM 0 HD13 LEU D 3 2.491 -24.091 8.637 1.00 33.62 H new ATOM 0 HD21 LEU D 3 3.446 -21.716 7.102 1.00 34.60 H new ATOM 0 HD22 LEU D 3 4.377 -22.391 8.191 1.00 34.60 H new ATOM 0 HD23 LEU D 3 4.890 -22.229 6.701 1.00 34.60 H new ATOM 3350 N SER D 4 7.631 -26.002 7.476 1.00 36.92 N ATOM 3351 CA SER D 4 8.279 -27.180 8.041 1.00 37.77 C ATOM 3352 C SER D 4 7.254 -27.890 8.931 1.00 38.41 C ATOM 3353 O SER D 4 6.245 -27.290 9.311 1.00 38.81 O ATOM 3354 CB SER D 4 9.462 -26.746 8.877 1.00 37.42 C ATOM 3355 OG SER D 4 9.005 -26.023 9.995 1.00 37.93 O ATOM 0 H SER D 4 7.929 -25.251 7.770 1.00 36.92 H new ATOM 0 HA SER D 4 8.590 -27.773 7.340 1.00 37.77 H new ATOM 0 HB2 SER D 4 9.968 -27.521 9.166 1.00 37.42 H new ATOM 0 HB3 SER D 4 10.061 -26.197 8.347 1.00 37.42 H new ATOM 0 HG SER D 4 9.661 -25.783 10.461 1.00 37.93 H new ATOM 3356 N SER D 5 7.470 -29.169 9.232 1.00 38.90 N ATOM 3357 CA SER D 5 6.628 -29.886 10.207 1.00 38.88 C ATOM 3358 C SER D 5 6.537 -29.123 11.535 1.00 38.25 C ATOM 3359 O SER D 5 5.480 -29.078 12.130 1.00 39.05 O ATOM 3360 CB SER D 5 7.207 -31.270 10.463 1.00 39.40 C ATOM 3361 OG SER D 5 8.618 -31.175 10.495 1.00 40.72 O ATOM 0 H SER D 5 8.097 -29.645 8.886 1.00 38.90 H new ATOM 0 HA SER D 5 5.735 -29.960 9.834 1.00 38.88 H new ATOM 0 HB2 SER D 5 6.875 -31.623 11.303 1.00 39.40 H new ATOM 0 HB3 SER D 5 6.927 -31.885 9.767 1.00 39.40 H new ATOM 0 HG SER D 5 8.947 -31.935 10.637 1.00 40.72 H new ATOM 3362 N GLU D 6 7.640 -28.524 11.981 1.00 37.47 N ATOM 3363 CA GLU D 6 7.656 -27.689 13.177 1.00 37.74 C ATOM 3364 C GLU D 6 6.625 -26.572 13.078 1.00 35.59 C ATOM 3365 O GLU D 6 5.804 -26.420 13.987 1.00 35.35 O ATOM 3366 CB GLU D 6 9.047 -27.117 13.461 1.00 37.64 C ATOM 3367 CG GLU D 6 10.043 -28.144 14.111 1.00 41.29 C ATOM 3368 CD GLU D 6 11.147 -27.484 14.984 1.00 42.14 C ATOM 3369 OE1 GLU D 6 11.018 -26.275 15.339 1.00 48.43 O ATOM 3370 OE2 GLU D 6 12.131 -28.190 15.345 1.00 48.85 O ATOM 0 H GLU D 6 8.405 -28.592 11.594 1.00 37.47 H new ATOM 0 HA GLU D 6 7.420 -28.260 13.924 1.00 37.74 H new ATOM 0 HB2 GLU D 6 9.429 -26.793 12.630 1.00 37.64 H new ATOM 0 HB3 GLU D 6 8.957 -26.351 14.050 1.00 37.64 H new ATOM 0 HG2 GLU D 6 9.540 -28.767 14.658 1.00 41.29 H new ATOM 0 HG3 GLU D 6 10.465 -28.661 13.407 1.00 41.29 H new ATOM 3371 N GLU D 7 6.625 -25.842 11.960 1.00 32.55 N ATOM 3372 CA GLU D 7 5.669 -24.742 11.773 1.00 30.77 C ATOM 3373 C GLU D 7 4.217 -25.232 11.708 1.00 29.38 C ATOM 3374 O GLU D 7 3.310 -24.627 12.295 1.00 26.35 O ATOM 3375 CB GLU D 7 6.030 -23.883 10.572 1.00 30.72 C ATOM 3376 CG GLU D 7 7.309 -23.056 10.763 1.00 31.58 C ATOM 3377 CD GLU D 7 7.828 -22.475 9.450 1.00 32.80 C ATOM 3378 OE1 GLU D 7 7.732 -23.148 8.396 1.00 28.94 O ATOM 3379 OE2 GLU D 7 8.363 -21.348 9.471 1.00 36.00 O ATOM 0 H GLU D 7 7.165 -25.965 11.302 1.00 32.55 H new ATOM 0 HA GLU D 7 5.734 -24.180 12.561 1.00 30.77 H new ATOM 0 HB2 GLU D 7 6.138 -24.455 9.796 1.00 30.72 H new ATOM 0 HB3 GLU D 7 5.292 -23.283 10.381 1.00 30.72 H new ATOM 0 HG2 GLU D 7 7.134 -22.334 11.387 1.00 31.58 H new ATOM 0 HG3 GLU D 7 7.996 -23.614 11.161 1.00 31.58 H new ATOM 3380 N LYS D 8 4.018 -26.374 11.069 1.00 27.43 N ATOM 3381 CA LYS D 8 2.666 -26.859 10.803 1.00 28.89 C ATOM 3382 C LYS D 8 2.030 -27.383 12.083 1.00 28.28 C ATOM 3383 O LYS D 8 0.820 -27.236 12.301 1.00 27.37 O ATOM 3384 CB LYS D 8 2.684 -27.933 9.699 1.00 29.30 C ATOM 3385 CG LYS D 8 1.349 -28.240 9.099 1.00 33.61 C ATOM 3386 CD LYS D 8 1.519 -28.898 7.743 1.00 40.42 C ATOM 3387 CE LYS D 8 0.168 -29.273 7.147 1.00 42.00 C ATOM 3388 NZ LYS D 8 -0.328 -30.508 7.801 1.00 46.04 N ATOM 0 H LYS D 8 4.647 -26.884 10.780 1.00 27.43 H new ATOM 0 HA LYS D 8 2.125 -26.120 10.484 1.00 28.89 H new ATOM 0 HB2 LYS D 8 3.283 -27.643 8.993 1.00 29.30 H new ATOM 0 HB3 LYS D 8 3.055 -28.750 10.067 1.00 29.30 H new ATOM 0 HG2 LYS D 8 0.849 -28.826 9.689 1.00 33.61 H new ATOM 0 HG3 LYS D 8 0.834 -27.423 9.007 1.00 33.61 H new ATOM 0 HD2 LYS D 8 1.985 -28.295 7.143 1.00 40.42 H new ATOM 0 HD3 LYS D 8 2.069 -29.692 7.831 1.00 40.42 H new ATOM 0 HE2 LYS D 8 -0.466 -28.550 7.274 1.00 42.00 H new ATOM 0 HE3 LYS D 8 0.252 -29.412 6.191 1.00 42.00 H new ATOM 0 HZ1 LYS D 8 -1.089 -30.763 7.416 1.00 46.04 H new ATOM 0 HZ2 LYS D 8 0.278 -31.154 7.715 1.00 46.04 H new ATOM 0 HZ3 LYS D 8 -0.472 -30.349 8.665 1.00 46.04 H new ATOM 3389 N SER D 9 2.856 -28.021 12.911 1.00 27.79 N ATOM 3390 CA SER D 9 2.392 -28.551 14.169 1.00 28.01 C ATOM 3391 C SER D 9 1.931 -27.419 15.051 1.00 26.11 C ATOM 3392 O SER D 9 0.863 -27.512 15.643 1.00 27.12 O ATOM 3393 CB SER D 9 3.499 -29.345 14.874 1.00 28.84 C ATOM 3394 OG SER D 9 3.666 -30.585 14.203 1.00 34.18 O ATOM 0 H SER D 9 3.691 -28.153 12.753 1.00 27.79 H new ATOM 0 HA SER D 9 1.652 -29.154 13.996 1.00 28.01 H new ATOM 0 HB2 SER D 9 4.329 -28.844 14.866 1.00 28.84 H new ATOM 0 HB3 SER D 9 3.266 -29.494 15.804 1.00 28.84 H new ATOM 0 HG SER D 9 4.159 -30.476 13.532 1.00 34.18 H new ATOM 3395 N ALA D 10 2.759 -26.393 15.148 1.00 23.75 N ATOM 3396 CA ALA D 10 2.444 -25.181 15.879 1.00 24.37 C ATOM 3397 C ALA D 10 1.144 -24.481 15.441 1.00 22.45 C ATOM 3398 O ALA D 10 0.371 -24.060 16.297 1.00 24.52 O ATOM 3399 CB ALA D 10 3.619 -24.192 15.794 1.00 24.60 C ATOM 0 H ALA D 10 3.537 -26.382 14.782 1.00 23.75 H new ATOM 0 HA ALA D 10 2.295 -25.465 16.795 1.00 24.37 H new ATOM 0 HB1 ALA D 10 3.399 -23.385 16.285 1.00 24.60 H new ATOM 0 HB2 ALA D 10 4.412 -24.598 16.178 1.00 24.60 H new ATOM 0 HB3 ALA D 10 3.788 -23.969 14.865 1.00 24.60 H new ATOM 3400 N VAL D 11 0.935 -24.294 14.142 1.00 20.20 N ATOM 3401 CA VAL D 11 -0.278 -23.631 13.629 1.00 19.77 C ATOM 3402 C VAL D 11 -1.527 -24.468 14.041 1.00 20.32 C ATOM 3403 O VAL D 11 -2.499 -23.919 14.589 1.00 19.42 O ATOM 3404 CB VAL D 11 -0.178 -23.461 12.087 1.00 20.51 C ATOM 3405 CG1 VAL D 11 -1.475 -23.056 11.433 1.00 19.57 C ATOM 3406 CG2 VAL D 11 0.943 -22.503 11.707 1.00 22.37 C ATOM 0 H VAL D 11 1.485 -24.544 13.530 1.00 20.20 H new ATOM 0 HA VAL D 11 -0.365 -22.744 14.013 1.00 19.77 H new ATOM 0 HB VAL D 11 0.033 -24.343 11.742 1.00 20.51 H new ATOM 0 HG11 VAL D 11 -1.342 -22.968 10.476 1.00 19.57 H new ATOM 0 HG12 VAL D 11 -2.149 -23.732 11.604 1.00 19.57 H new ATOM 0 HG13 VAL D 11 -1.770 -22.207 11.797 1.00 19.57 H new ATOM 0 HG21 VAL D 11 0.982 -22.417 10.742 1.00 22.37 H new ATOM 0 HG22 VAL D 11 0.774 -21.634 12.103 1.00 22.37 H new ATOM 0 HG23 VAL D 11 1.788 -22.848 12.034 1.00 22.37 H new ATOM 3407 N THR D 12 -1.439 -25.788 13.808 1.00 18.49 N ATOM 3408 CA THR D 12 -2.503 -26.785 13.983 1.00 20.34 C ATOM 3409 C THR D 12 -2.897 -26.946 15.461 1.00 19.58 C ATOM 3410 O THR D 12 -4.098 -26.918 15.810 1.00 19.11 O ATOM 3411 CB THR D 12 -2.019 -28.111 13.306 1.00 20.86 C ATOM 3412 OG1 THR D 12 -2.083 -27.924 11.874 1.00 25.49 O ATOM 3413 CG2 THR D 12 -2.837 -29.307 13.668 1.00 26.92 C ATOM 0 H THR D 12 -0.709 -26.144 13.526 1.00 18.49 H new ATOM 0 HA THR D 12 -3.323 -26.497 13.551 1.00 20.34 H new ATOM 0 HB THR D 12 -1.119 -28.286 13.622 1.00 20.86 H new ATOM 0 HG1 THR D 12 -1.326 -27.701 11.586 1.00 25.49 H new ATOM 0 HG21 THR D 12 -2.484 -30.089 13.216 1.00 26.92 H new ATOM 0 HG22 THR D 12 -2.802 -29.445 14.628 1.00 26.92 H new ATOM 0 HG23 THR D 12 -3.757 -29.165 13.396 1.00 26.92 H new ATOM 3414 N ALA D 13 -1.885 -27.074 16.320 1.00 18.46 N ATOM 3415 CA ALA D 13 -2.087 -27.142 17.753 1.00 18.84 C ATOM 3416 C ALA D 13 -2.861 -25.911 18.290 1.00 18.13 C ATOM 3417 O ALA D 13 -3.814 -26.061 19.040 1.00 19.42 O ATOM 3418 CB ALA D 13 -0.758 -27.287 18.460 1.00 18.34 C ATOM 0 H ALA D 13 -1.061 -27.123 16.080 1.00 18.46 H new ATOM 0 HA ALA D 13 -2.631 -27.924 17.937 1.00 18.84 H new ATOM 0 HB1 ALA D 13 -0.904 -27.332 19.418 1.00 18.34 H new ATOM 0 HB2 ALA D 13 -0.320 -28.099 18.162 1.00 18.34 H new ATOM 0 HB3 ALA D 13 -0.197 -26.523 18.254 1.00 18.34 H new ATOM 3419 N LEU D 14 -2.469 -24.716 17.889 1.00 17.72 N ATOM 3420 CA LEU D 14 -3.149 -23.501 18.328 1.00 17.17 C ATOM 3421 C LEU D 14 -4.566 -23.432 17.732 1.00 17.49 C ATOM 3422 O LEU D 14 -5.522 -23.088 18.429 1.00 16.37 O ATOM 3423 CB LEU D 14 -2.360 -22.259 17.908 1.00 17.70 C ATOM 3424 CG LEU D 14 -2.708 -20.970 18.712 1.00 19.10 C ATOM 3425 CD1 LEU D 14 -1.914 -20.782 19.948 1.00 22.60 C ATOM 3426 CD2 LEU D 14 -2.494 -19.795 17.844 1.00 20.98 C ATOM 0 H LEU D 14 -1.806 -24.581 17.358 1.00 17.72 H new ATOM 0 HA LEU D 14 -3.210 -23.525 19.296 1.00 17.17 H new ATOM 0 HB2 LEU D 14 -1.413 -22.443 18.007 1.00 17.70 H new ATOM 0 HB3 LEU D 14 -2.519 -22.092 16.966 1.00 17.70 H new ATOM 0 HG LEU D 14 -3.633 -21.068 18.987 1.00 19.10 H new ATOM 0 HD11 LEU D 14 -2.189 -19.962 20.388 1.00 22.60 H new ATOM 0 HD12 LEU D 14 -2.060 -21.533 20.544 1.00 22.60 H new ATOM 0 HD13 LEU D 14 -0.972 -20.727 19.723 1.00 22.60 H new ATOM 0 HD21 LEU D 14 -2.708 -18.986 18.335 1.00 20.98 H new ATOM 0 HD22 LEU D 14 -1.566 -19.766 17.562 1.00 20.98 H new ATOM 0 HD23 LEU D 14 -3.067 -19.860 17.064 1.00 20.98 H new ATOM 3427 N TRP D 15 -4.682 -23.797 16.452 1.00 16.83 N ATOM 3428 CA TRP D 15 -5.926 -23.659 15.720 1.00 17.74 C ATOM 3429 C TRP D 15 -7.029 -24.539 16.330 1.00 18.26 C ATOM 3430 O TRP D 15 -8.213 -24.115 16.356 1.00 18.46 O ATOM 3431 CB TRP D 15 -5.754 -23.971 14.231 1.00 17.89 C ATOM 3432 CG TRP D 15 -6.916 -23.420 13.446 1.00 18.99 C ATOM 3433 CD1 TRP D 15 -7.977 -24.124 12.904 1.00 19.72 C ATOM 3434 CD2 TRP D 15 -7.174 -22.023 13.186 1.00 19.46 C ATOM 3435 NE1 TRP D 15 -8.859 -23.240 12.306 1.00 22.26 N ATOM 3436 CE2 TRP D 15 -8.397 -21.948 12.477 1.00 21.01 C ATOM 3437 CE3 TRP D 15 -6.484 -20.826 13.499 1.00 18.51 C ATOM 3438 CZ2 TRP D 15 -8.931 -20.731 12.046 1.00 21.72 C ATOM 3439 CZ3 TRP D 15 -7.023 -19.611 13.095 1.00 20.10 C ATOM 3440 CH2 TRP D 15 -8.230 -19.569 12.356 1.00 21.05 C ATOM 0 H TRP D 15 -4.037 -24.131 15.991 1.00 16.83 H new ATOM 0 HA TRP D 15 -6.195 -22.730 15.796 1.00 17.74 H new ATOM 0 HB2 TRP D 15 -4.925 -23.586 13.907 1.00 17.89 H new ATOM 0 HB3 TRP D 15 -5.692 -24.930 14.100 1.00 17.89 H new ATOM 0 HD1 TRP D 15 -8.081 -25.048 12.936 1.00 19.72 H new ATOM 0 HE1 TRP D 15 -9.581 -23.460 11.893 1.00 22.26 H new ATOM 0 HE3 TRP D 15 -5.682 -20.853 13.968 1.00 18.51 H new ATOM 0 HZ2 TRP D 15 -9.728 -20.698 11.568 1.00 21.72 H new ATOM 0 HZ3 TRP D 15 -6.587 -18.818 13.312 1.00 20.10 H new ATOM 0 HH2 TRP D 15 -8.561 -18.748 12.072 1.00 21.05 H new ATOM 3441 N GLY D 16 -6.646 -25.702 16.869 1.00 18.02 N ATOM 3442 CA GLY D 16 -7.605 -26.612 17.551 1.00 19.17 C ATOM 3443 C GLY D 16 -8.221 -26.017 18.823 1.00 20.42 C ATOM 3444 O GLY D 16 -9.245 -26.499 19.300 1.00 20.90 O ATOM 0 H GLY D 16 -5.836 -25.991 16.855 1.00 18.02 H new ATOM 0 HA2 GLY D 16 -8.317 -26.841 16.933 1.00 19.17 H new ATOM 0 HA3 GLY D 16 -7.150 -27.438 17.778 1.00 19.17 H new ATOM 3445 N LYS D 17 -7.612 -24.962 19.368 1.00 18.91 N ATOM 3446 CA LYS D 17 -8.140 -24.308 20.567 1.00 19.68 C ATOM 3447 C LYS D 17 -9.045 -23.114 20.226 1.00 20.24 C ATOM 3448 O LYS D 17 -9.647 -22.545 21.117 1.00 19.96 O ATOM 3449 CB LYS D 17 -6.997 -23.803 21.417 1.00 17.75 C ATOM 3450 CG LYS D 17 -6.092 -24.895 21.842 1.00 18.95 C ATOM 3451 CD LYS D 17 -4.991 -24.365 22.757 1.00 21.35 C ATOM 3452 CE LYS D 17 -4.160 -25.538 23.304 1.00 20.32 C ATOM 3453 NZ LYS D 17 -3.073 -24.977 24.193 1.00 18.71 N ATOM 0 H LYS D 17 -6.891 -24.610 19.058 1.00 18.91 H new ATOM 0 HA LYS D 17 -8.666 -24.970 21.043 1.00 19.68 H new ATOM 0 HB2 LYS D 17 -6.492 -23.142 20.918 1.00 17.75 H new ATOM 0 HB3 LYS D 17 -7.352 -23.356 22.201 1.00 17.75 H new ATOM 0 HG2 LYS D 17 -6.600 -25.580 22.304 1.00 18.95 H new ATOM 0 HG3 LYS D 17 -5.696 -25.314 21.062 1.00 18.95 H new ATOM 0 HD2 LYS D 17 -4.419 -23.753 22.268 1.00 21.35 H new ATOM 0 HD3 LYS D 17 -5.381 -23.864 23.490 1.00 21.35 H new ATOM 0 HE2 LYS D 17 -4.725 -26.147 23.805 1.00 20.32 H new ATOM 0 HE3 LYS D 17 -3.771 -26.046 22.575 1.00 20.32 H new ATOM 0 HZ1 LYS D 17 -2.600 -25.645 24.542 1.00 18.71 H new ATOM 0 HZ2 LYS D 17 -2.537 -24.454 23.713 1.00 18.71 H new ATOM 0 HZ3 LYS D 17 -3.442 -24.501 24.849 1.00 18.71 H new ATOM 3454 N VAL D 18 -9.115 -22.744 18.954 1.00 21.01 N ATOM 3455 CA VAL D 18 -9.842 -21.538 18.538 1.00 23.42 C ATOM 3456 C VAL D 18 -11.395 -21.707 18.631 1.00 25.81 C ATOM 3457 O VAL D 18 -11.975 -22.585 18.016 1.00 26.86 O ATOM 3458 CB VAL D 18 -9.401 -21.047 17.117 1.00 23.13 C ATOM 3459 CG1 VAL D 18 -10.397 -20.003 16.562 1.00 23.76 C ATOM 3460 CG2 VAL D 18 -7.877 -20.450 17.085 1.00 19.13 C ATOM 0 H VAL D 18 -8.748 -23.177 18.308 1.00 21.01 H new ATOM 0 HA VAL D 18 -9.599 -20.845 19.172 1.00 23.42 H new ATOM 0 HB VAL D 18 -9.407 -21.831 16.547 1.00 23.13 H new ATOM 0 HG11 VAL D 18 -10.106 -19.713 15.683 1.00 23.76 H new ATOM 0 HG12 VAL D 18 -11.279 -20.401 16.495 1.00 23.76 H new ATOM 0 HG13 VAL D 18 -10.432 -19.239 17.159 1.00 23.76 H new ATOM 0 HG21 VAL D 18 -7.660 -20.163 16.184 1.00 19.13 H new ATOM 0 HG22 VAL D 18 -7.813 -19.694 17.689 1.00 19.13 H new ATOM 0 HG23 VAL D 18 -7.253 -21.139 17.363 1.00 19.13 H new ATOM 3461 N ASN D 19 -12.057 -20.825 19.352 1.00 27.95 N ATOM 3462 CA ASN D 19 -13.500 -20.714 19.266 1.00 30.25 C ATOM 3463 C ASN D 19 -13.925 -19.900 18.023 1.00 31.32 C ATOM 3464 O ASN D 19 -13.846 -18.686 18.023 1.00 30.01 O ATOM 3465 CB ASN D 19 -14.014 -20.065 20.562 1.00 31.23 C ATOM 3466 CG ASN D 19 -15.546 -19.838 20.565 1.00 34.15 C ATOM 3467 OD1 ASN D 19 -16.280 -20.279 19.663 1.00 36.13 O ATOM 3468 ND2 ASN D 19 -16.019 -19.131 21.584 1.00 36.31 N ATOM 0 H ASN D 19 -11.688 -20.276 19.902 1.00 27.95 H new ATOM 0 HA ASN D 19 -13.891 -21.596 19.167 1.00 30.25 H new ATOM 0 HB2 ASN D 19 -13.775 -20.627 21.315 1.00 31.23 H new ATOM 0 HB3 ASN D 19 -13.567 -19.214 20.690 1.00 31.23 H new ATOM 0 HD21 ASN D 19 -16.861 -18.963 21.637 1.00 36.31 H new ATOM 0 HD22 ASN D 19 -15.484 -18.841 22.191 1.00 36.31 H new ATOM 3469 N VAL D 20 -14.422 -20.577 16.997 1.00 33.17 N ATOM 3470 CA VAL D 20 -14.661 -19.969 15.661 1.00 36.46 C ATOM 3471 C VAL D 20 -15.801 -18.900 15.587 1.00 37.38 C ATOM 3472 O VAL D 20 -15.665 -17.850 14.888 1.00 37.30 O ATOM 3473 CB VAL D 20 -14.823 -21.090 14.635 1.00 37.24 C ATOM 3474 CG1 VAL D 20 -15.522 -22.298 15.320 1.00 36.92 C ATOM 3475 CG2 VAL D 20 -15.514 -20.621 13.347 1.00 37.24 C ATOM 0 H VAL D 20 -14.636 -21.409 17.042 1.00 33.17 H new ATOM 0 HA VAL D 20 -13.878 -19.436 15.452 1.00 36.46 H new ATOM 0 HB VAL D 20 -13.947 -21.379 14.334 1.00 37.24 H new ATOM 0 HG11 VAL D 20 -15.630 -23.016 14.677 1.00 36.92 H new ATOM 0 HG12 VAL D 20 -14.980 -22.608 16.062 1.00 36.92 H new ATOM 0 HG13 VAL D 20 -16.393 -22.025 15.648 1.00 36.92 H new ATOM 0 HG21 VAL D 20 -15.592 -21.367 12.732 1.00 37.24 H new ATOM 0 HG22 VAL D 20 -16.398 -20.283 13.559 1.00 37.24 H new ATOM 0 HG23 VAL D 20 -14.989 -19.917 12.936 1.00 37.24 H new ATOM 3476 N GLU D 21 -16.877 -19.168 16.343 1.00 38.79 N ATOM 3477 CA GLU D 21 -17.955 -18.201 16.652 1.00 39.29 C ATOM 3478 C GLU D 21 -17.316 -16.900 17.087 1.00 37.50 C ATOM 3479 O GLU D 21 -17.428 -15.873 16.419 1.00 38.65 O ATOM 3480 CB GLU D 21 -18.808 -18.709 17.828 1.00 40.85 C ATOM 3481 CG GLU D 21 -19.268 -20.214 17.819 1.00 45.98 C ATOM 3482 CD GLU D 21 -20.728 -20.400 17.330 1.00 48.87 C ATOM 3483 OE1 GLU D 21 -21.634 -19.658 17.803 1.00 48.14 O ATOM 3484 OE2 GLU D 21 -20.954 -21.280 16.458 1.00 49.78 O ATOM 0 H GLU D 21 -17.006 -19.939 16.702 1.00 38.79 H new ATOM 0 HA GLU D 21 -18.511 -18.086 15.866 1.00 39.29 H new ATOM 0 HB2 GLU D 21 -18.307 -18.557 18.645 1.00 40.85 H new ATOM 0 HB3 GLU D 21 -19.604 -18.156 17.877 1.00 40.85 H new ATOM 0 HG2 GLU D 21 -18.674 -20.725 17.248 1.00 45.98 H new ATOM 0 HG3 GLU D 21 -19.183 -20.578 18.714 1.00 45.98 H new ATOM 3485 N GLU D 22 -16.594 -16.982 18.198 1.00 35.18 N ATOM 3486 CA GLU D 22 -16.002 -15.840 18.877 1.00 33.37 C ATOM 3487 C GLU D 22 -14.915 -15.164 18.086 1.00 30.04 C ATOM 3488 O GLU D 22 -14.884 -13.948 17.998 1.00 29.38 O ATOM 3489 CB GLU D 22 -15.366 -16.295 20.195 1.00 34.21 C ATOM 3490 CG GLU D 22 -16.062 -15.865 21.470 1.00 39.55 C ATOM 3491 CD GLU D 22 -15.096 -15.859 22.662 1.00 46.47 C ATOM 3492 OE1 GLU D 22 -14.365 -16.877 22.857 1.00 48.81 O ATOM 3493 OE2 GLU D 22 -15.057 -14.832 23.393 1.00 48.43 O ATOM 0 H GLU D 22 -16.430 -17.730 18.590 1.00 35.18 H new ATOM 0 HA GLU D 22 -16.728 -15.211 19.009 1.00 33.37 H new ATOM 0 HB2 GLU D 22 -15.317 -17.264 20.189 1.00 34.21 H new ATOM 0 HB3 GLU D 22 -14.454 -15.965 20.221 1.00 34.21 H new ATOM 0 HG2 GLU D 22 -16.438 -14.979 21.352 1.00 39.55 H new ATOM 0 HG3 GLU D 22 -16.802 -16.465 21.654 1.00 39.55 H new ATOM 3494 N VAL D 23 -13.963 -15.938 17.569 1.00 26.71 N ATOM 3495 CA VAL D 23 -12.733 -15.318 17.010 1.00 23.31 C ATOM 3496 C VAL D 23 -13.031 -14.591 15.682 1.00 22.51 C ATOM 3497 O VAL D 23 -12.584 -13.450 15.481 1.00 21.40 O ATOM 3498 CB VAL D 23 -11.549 -16.342 16.978 1.00 23.31 C ATOM 3499 CG1 VAL D 23 -10.381 -15.835 16.130 1.00 21.13 C ATOM 3500 CG2 VAL D 23 -11.092 -16.605 18.423 1.00 24.17 C ATOM 0 H VAL D 23 -13.995 -16.796 17.527 1.00 26.71 H new ATOM 0 HA VAL D 23 -12.423 -14.615 17.602 1.00 23.31 H new ATOM 0 HB VAL D 23 -11.857 -17.165 16.568 1.00 23.31 H new ATOM 0 HG11 VAL D 23 -9.669 -16.493 16.133 1.00 21.13 H new ATOM 0 HG12 VAL D 23 -10.681 -15.689 15.219 1.00 21.13 H new ATOM 0 HG13 VAL D 23 -10.051 -15.001 16.499 1.00 21.13 H new ATOM 0 HG21 VAL D 23 -10.358 -17.239 18.420 1.00 24.17 H new ATOM 0 HG22 VAL D 23 -10.799 -15.773 18.826 1.00 24.17 H new ATOM 0 HG23 VAL D 23 -11.831 -16.969 18.935 1.00 24.17 H new ATOM 3501 N GLY D 24 -13.827 -15.235 14.820 1.00 20.79 N ATOM 3502 CA GLY D 24 -14.216 -14.699 13.517 1.00 20.17 C ATOM 3503 C GLY D 24 -14.997 -13.381 13.672 1.00 20.44 C ATOM 3504 O GLY D 24 -14.758 -12.420 12.949 1.00 20.30 O ATOM 0 H GLY D 24 -14.160 -16.011 14.983 1.00 20.79 H new ATOM 0 HA2 GLY D 24 -13.425 -14.548 12.976 1.00 20.17 H new ATOM 0 HA3 GLY D 24 -14.761 -15.348 13.046 1.00 20.17 H new ATOM 3505 N GLY D 25 -15.906 -13.338 14.646 1.00 19.61 N ATOM 3506 CA GLY D 25 -16.702 -12.126 14.913 1.00 18.02 C ATOM 3507 C GLY D 25 -15.818 -10.991 15.401 1.00 16.87 C ATOM 3508 O GLY D 25 -15.998 -9.823 14.983 1.00 14.49 O ATOM 0 H GLY D 25 -16.081 -13.999 15.168 1.00 19.61 H new ATOM 0 HA2 GLY D 25 -17.166 -11.855 14.105 1.00 18.02 H new ATOM 0 HA3 GLY D 25 -17.381 -12.321 15.578 1.00 18.02 H new ATOM 3509 N GLU D 26 -14.871 -11.318 16.281 1.00 14.62 N ATOM 3510 CA GLU D 26 -13.943 -10.312 16.802 1.00 16.96 C ATOM 3511 C GLU D 26 -12.966 -9.825 15.709 1.00 15.48 C ATOM 3512 O GLU D 26 -12.647 -8.633 15.643 1.00 14.59 O ATOM 3513 CB GLU D 26 -13.251 -10.869 18.054 1.00 17.60 C ATOM 3514 CG GLU D 26 -12.292 -9.912 18.758 1.00 24.66 C ATOM 3515 CD GLU D 26 -12.957 -8.997 19.730 1.00 26.48 C ATOM 3516 OE1 GLU D 26 -13.963 -9.422 20.327 1.00 27.82 O ATOM 3517 OE2 GLU D 26 -12.485 -7.847 19.880 1.00 26.11 O ATOM 0 H GLU D 26 -14.749 -12.112 16.588 1.00 14.62 H new ATOM 0 HA GLU D 26 -14.430 -9.517 17.070 1.00 16.96 H new ATOM 0 HB2 GLU D 26 -13.934 -11.141 18.687 1.00 17.60 H new ATOM 0 HB3 GLU D 26 -12.760 -11.668 17.805 1.00 17.60 H new ATOM 0 HG2 GLU D 26 -11.617 -10.429 19.224 1.00 24.66 H new ATOM 0 HG3 GLU D 26 -11.831 -9.381 18.090 1.00 24.66 H new ATOM 3518 N ALA D 27 -12.532 -10.714 14.815 1.00 12.27 N ATOM 3519 CA ALA D 27 -11.656 -10.321 13.721 1.00 12.89 C ATOM 3520 C ALA D 27 -12.398 -9.423 12.682 1.00 13.78 C ATOM 3521 O ALA D 27 -11.897 -8.335 12.302 1.00 13.29 O ATOM 3522 CB ALA D 27 -11.099 -11.559 13.043 1.00 13.82 C ATOM 0 H ALA D 27 -12.736 -11.549 14.828 1.00 12.27 H new ATOM 0 HA ALA D 27 -10.928 -9.798 14.091 1.00 12.89 H new ATOM 0 HB1 ALA D 27 -10.516 -11.294 12.314 1.00 13.82 H new ATOM 0 HB2 ALA D 27 -10.595 -12.082 13.686 1.00 13.82 H new ATOM 0 HB3 ALA D 27 -11.829 -12.093 12.694 1.00 13.82 H new ATOM 3523 N LEU D 28 -13.592 -9.850 12.252 1.00 12.98 N ATOM 3524 CA LEU D 28 -14.336 -9.091 11.262 1.00 14.49 C ATOM 3525 C LEU D 28 -14.774 -7.757 11.868 1.00 14.29 C ATOM 3526 O LEU D 28 -14.698 -6.722 11.197 1.00 15.11 O ATOM 3527 CB LEU D 28 -15.543 -9.874 10.726 1.00 15.50 C ATOM 3528 CG LEU D 28 -16.273 -9.190 9.534 1.00 16.47 C ATOM 3529 CD1 LEU D 28 -15.391 -9.022 8.303 1.00 21.52 C ATOM 3530 CD2 LEU D 28 -17.552 -9.949 9.209 1.00 17.08 C ATOM 0 H LEU D 28 -13.978 -10.569 12.522 1.00 12.98 H new ATOM 0 HA LEU D 28 -13.754 -8.924 10.504 1.00 14.49 H new ATOM 0 HB2 LEU D 28 -15.246 -10.754 10.447 1.00 15.50 H new ATOM 0 HB3 LEU D 28 -16.177 -10.004 11.448 1.00 15.50 H new ATOM 0 HG LEU D 28 -16.499 -8.289 9.812 1.00 16.47 H new ATOM 0 HD11 LEU D 28 -15.899 -8.592 7.597 1.00 21.52 H new ATOM 0 HD12 LEU D 28 -14.623 -8.474 8.528 1.00 21.52 H new ATOM 0 HD13 LEU D 28 -15.089 -9.893 8.000 1.00 21.52 H new ATOM 0 HD21 LEU D 28 -18.004 -9.519 8.466 1.00 17.08 H new ATOM 0 HD22 LEU D 28 -17.334 -10.863 8.969 1.00 17.08 H new ATOM 0 HD23 LEU D 28 -18.135 -9.949 9.985 1.00 17.08 H new ATOM 3531 N GLY D 29 -15.187 -7.795 13.130 1.00 15.09 N ATOM 3532 CA GLY D 29 -15.640 -6.597 13.873 1.00 14.51 C ATOM 3533 C GLY D 29 -14.522 -5.579 13.970 1.00 15.07 C ATOM 3534 O GLY D 29 -14.745 -4.375 13.699 1.00 15.58 O ATOM 0 H GLY D 29 -15.216 -8.519 13.593 1.00 15.09 H new ATOM 0 HA2 GLY D 29 -16.406 -6.203 13.426 1.00 14.51 H new ATOM 0 HA3 GLY D 29 -15.931 -6.852 14.763 1.00 14.51 H new ATOM 3535 N ARG D 30 -13.312 -6.023 14.359 1.00 14.01 N ATOM 3536 CA ARG D 30 -12.140 -5.098 14.453 1.00 14.18 C ATOM 3537 C ARG D 30 -11.717 -4.549 13.088 1.00 14.68 C ATOM 3538 O ARG D 30 -11.359 -3.381 12.983 1.00 16.07 O ATOM 3539 CB ARG D 30 -10.950 -5.760 15.170 1.00 14.81 C ATOM 3540 CG ARG D 30 -11.165 -6.026 16.693 1.00 15.19 C ATOM 3541 CD ARG D 30 -9.938 -6.720 17.378 1.00 12.95 C ATOM 3542 NE ARG D 30 -10.226 -6.853 18.816 1.00 14.82 N ATOM 3543 CZ ARG D 30 -9.811 -6.038 19.771 1.00 13.76 C ATOM 3544 NH1 ARG D 30 -9.026 -4.995 19.467 1.00 14.33 N ATOM 3545 NH2 ARG D 30 -10.177 -6.275 21.057 1.00 12.31 N ATOM 0 H ARG D 30 -13.142 -6.839 14.571 1.00 14.01 H new ATOM 0 HA ARG D 30 -12.431 -4.343 14.988 1.00 14.18 H new ATOM 0 HB2 ARG D 30 -10.754 -6.603 14.732 1.00 14.81 H new ATOM 0 HB3 ARG D 30 -10.169 -5.195 15.061 1.00 14.81 H new ATOM 0 HG2 ARG D 30 -11.344 -5.184 17.140 1.00 15.19 H new ATOM 0 HG3 ARG D 30 -11.951 -6.582 16.810 1.00 15.19 H new ATOM 0 HD2 ARG D 30 -9.779 -7.592 16.983 1.00 12.95 H new ATOM 0 HD3 ARG D 30 -9.133 -6.196 17.242 1.00 12.95 H new ATOM 0 HE ARG D 30 -10.709 -7.523 19.057 1.00 14.82 H new ATOM 0 HH11 ARG D 30 -8.792 -4.856 18.651 1.00 14.33 H new ATOM 0 HH12 ARG D 30 -8.756 -4.465 20.088 1.00 14.33 H new ATOM 0 HH21 ARG D 30 -10.675 -6.951 21.245 1.00 12.31 H new ATOM 0 HH22 ARG D 30 -9.911 -5.749 21.684 1.00 12.31 H new ATOM 3546 N LEU D 31 -11.766 -5.372 12.043 1.00 13.71 N ATOM 3547 CA LEU D 31 -11.532 -4.923 10.661 1.00 14.13 C ATOM 3548 C LEU D 31 -12.390 -3.681 10.369 1.00 14.89 C ATOM 3549 O LEU D 31 -11.863 -2.640 9.896 1.00 14.25 O ATOM 3550 CB LEU D 31 -11.871 -6.036 9.605 1.00 13.36 C ATOM 3551 CG LEU D 31 -11.740 -5.601 8.119 1.00 14.55 C ATOM 3552 CD1 LEU D 31 -10.280 -5.427 7.660 1.00 15.26 C ATOM 3553 CD2 LEU D 31 -12.494 -6.477 7.132 1.00 12.85 C ATOM 0 H LEU D 31 -11.937 -6.212 12.111 1.00 13.71 H new ATOM 0 HA LEU D 31 -10.588 -4.715 10.583 1.00 14.13 H new ATOM 0 HB2 LEU D 31 -11.287 -6.795 9.757 1.00 13.36 H new ATOM 0 HB3 LEU D 31 -12.779 -6.342 9.759 1.00 13.36 H new ATOM 0 HG LEU D 31 -12.170 -4.731 8.109 1.00 14.55 H new ATOM 0 HD11 LEU D 31 -10.263 -5.156 6.729 1.00 15.26 H new ATOM 0 HD12 LEU D 31 -9.849 -4.747 8.202 1.00 15.26 H new ATOM 0 HD13 LEU D 31 -9.807 -6.268 7.760 1.00 15.26 H new ATOM 0 HD21 LEU D 31 -12.361 -6.139 6.232 1.00 12.85 H new ATOM 0 HD22 LEU D 31 -12.163 -7.387 7.188 1.00 12.85 H new ATOM 0 HD23 LEU D 31 -13.440 -6.464 7.345 1.00 12.85 H new ATOM 3554 N LEU D 32 -13.691 -3.792 10.663 1.00 13.39 N ATOM 3555 CA LEU D 32 -14.636 -2.740 10.309 1.00 14.22 C ATOM 3556 C LEU D 32 -14.455 -1.461 11.146 1.00 13.23 C ATOM 3557 O LEU D 32 -14.739 -0.401 10.658 1.00 13.60 O ATOM 3558 CB LEU D 32 -16.115 -3.246 10.425 1.00 14.78 C ATOM 3559 CG LEU D 32 -16.526 -4.523 9.627 1.00 17.48 C ATOM 3560 CD1 LEU D 32 -17.960 -4.893 9.883 1.00 17.02 C ATOM 3561 CD2 LEU D 32 -16.354 -4.290 8.159 1.00 16.80 C ATOM 0 H LEU D 32 -14.040 -4.467 11.065 1.00 13.39 H new ATOM 0 HA LEU D 32 -14.445 -2.511 9.386 1.00 14.22 H new ATOM 0 HB2 LEU D 32 -16.298 -3.412 11.363 1.00 14.78 H new ATOM 0 HB3 LEU D 32 -16.698 -2.523 10.146 1.00 14.78 H new ATOM 0 HG LEU D 32 -15.953 -5.247 9.925 1.00 17.48 H new ATOM 0 HD11 LEU D 32 -18.185 -5.688 9.375 1.00 17.02 H new ATOM 0 HD12 LEU D 32 -18.085 -5.068 10.829 1.00 17.02 H new ATOM 0 HD13 LEU D 32 -18.537 -4.162 9.611 1.00 17.02 H new ATOM 0 HD21 LEU D 32 -16.612 -5.088 7.672 1.00 16.80 H new ATOM 0 HD22 LEU D 32 -16.913 -3.548 7.881 1.00 16.80 H new ATOM 0 HD23 LEU D 32 -15.425 -4.083 7.971 1.00 16.80 H new ATOM 3562 N VAL D 33 -13.989 -1.615 12.373 1.00 13.97 N ATOM 3563 CA VAL D 33 -13.661 -0.506 13.317 1.00 14.92 C ATOM 3564 C VAL D 33 -12.318 0.176 12.975 1.00 15.01 C ATOM 3565 O VAL D 33 -12.266 1.403 12.778 1.00 14.43 O ATOM 3566 CB VAL D 33 -13.758 -0.994 14.807 1.00 13.85 C ATOM 3567 CG1 VAL D 33 -13.271 0.102 15.885 1.00 15.54 C ATOM 3568 CG2 VAL D 33 -15.210 -1.416 15.135 1.00 17.66 C ATOM 0 H VAL D 33 -13.842 -2.392 12.711 1.00 13.97 H new ATOM 0 HA VAL D 33 -14.329 0.189 13.209 1.00 14.92 H new ATOM 0 HB VAL D 33 -13.153 -1.749 14.879 1.00 13.85 H new ATOM 0 HG11 VAL D 33 -13.357 -0.263 16.780 1.00 15.54 H new ATOM 0 HG12 VAL D 33 -12.343 0.331 15.718 1.00 15.54 H new ATOM 0 HG13 VAL D 33 -13.819 0.898 15.807 1.00 15.54 H new ATOM 0 HG21 VAL D 33 -15.260 -1.716 16.056 1.00 17.66 H new ATOM 0 HG22 VAL D 33 -15.803 -0.659 15.009 1.00 17.66 H new ATOM 0 HG23 VAL D 33 -15.478 -2.138 14.546 1.00 17.66 H new ATOM 3569 N VAL D 34 -11.253 -0.618 12.829 1.00 14.61 N ATOM 3570 CA VAL D 34 -9.902 -0.080 12.616 1.00 14.81 C ATOM 3571 C VAL D 34 -9.743 0.490 11.192 1.00 16.03 C ATOM 3572 O VAL D 34 -9.085 1.523 11.018 1.00 15.79 O ATOM 3573 CB VAL D 34 -8.800 -1.156 12.967 1.00 15.86 C ATOM 3574 CG1 VAL D 34 -7.325 -0.630 12.834 1.00 12.55 C ATOM 3575 CG2 VAL D 34 -9.040 -1.712 14.369 1.00 13.41 C ATOM 0 H VAL D 34 -11.291 -1.477 12.850 1.00 14.61 H new ATOM 0 HA VAL D 34 -9.772 0.663 13.226 1.00 14.81 H new ATOM 0 HB VAL D 34 -8.891 -1.860 12.306 1.00 15.86 H new ATOM 0 HG11 VAL D 34 -6.706 -1.341 13.064 1.00 12.55 H new ATOM 0 HG12 VAL D 34 -7.164 -0.344 11.921 1.00 12.55 H new ATOM 0 HG13 VAL D 34 -7.193 0.120 13.435 1.00 12.55 H new ATOM 0 HG21 VAL D 34 -8.360 -2.371 14.577 1.00 13.41 H new ATOM 0 HG22 VAL D 34 -8.998 -0.990 15.015 1.00 13.41 H new ATOM 0 HG23 VAL D 34 -9.915 -2.128 14.407 1.00 13.41 H new ATOM 3576 N TYR D 35 -10.351 -0.173 10.188 1.00 15.97 N ATOM 3577 CA TYR D 35 -10.259 0.247 8.786 1.00 15.54 C ATOM 3578 C TYR D 35 -11.631 0.619 8.229 1.00 15.55 C ATOM 3579 O TYR D 35 -12.247 -0.170 7.483 1.00 14.38 O ATOM 3580 CB TYR D 35 -9.558 -0.868 7.933 1.00 13.77 C ATOM 3581 CG TYR D 35 -8.242 -1.265 8.566 1.00 15.83 C ATOM 3582 CD1 TYR D 35 -7.187 -0.330 8.680 1.00 15.60 C ATOM 3583 CD2 TYR D 35 -8.074 -2.523 9.141 1.00 16.74 C ATOM 3584 CE1 TYR D 35 -5.995 -0.684 9.274 1.00 16.95 C ATOM 3585 CE2 TYR D 35 -6.858 -2.881 9.774 1.00 18.13 C ATOM 3586 CZ TYR D 35 -5.833 -1.950 9.796 1.00 17.37 C ATOM 3587 OH TYR D 35 -4.655 -2.261 10.420 1.00 17.93 O ATOM 0 H TYR D 35 -10.827 -0.879 10.309 1.00 15.97 H new ATOM 0 HA TYR D 35 -9.713 1.047 8.735 1.00 15.54 H new ATOM 0 HB2 TYR D 35 -10.137 -1.643 7.864 1.00 13.77 H new ATOM 0 HB3 TYR D 35 -9.406 -0.546 7.031 1.00 13.77 H new ATOM 0 HD1 TYR D 35 -7.299 0.533 8.351 1.00 15.60 H new ATOM 0 HD2 TYR D 35 -8.771 -3.138 9.109 1.00 16.74 H new ATOM 0 HE1 TYR D 35 -5.299 -0.069 9.323 1.00 16.95 H new ATOM 0 HE2 TYR D 35 -6.751 -3.718 10.164 1.00 18.13 H new ATOM 0 HH TYR D 35 -4.419 -1.620 10.909 1.00 17.93 H new ATOM 3588 N PRO D 36 -12.120 1.828 8.584 1.00 15.73 N ATOM 3589 CA PRO D 36 -13.568 2.081 8.418 1.00 16.54 C ATOM 3590 C PRO D 36 -14.114 2.116 7.002 1.00 16.68 C ATOM 3591 O PRO D 36 -15.304 1.937 6.846 1.00 17.27 O ATOM 3592 CB PRO D 36 -13.822 3.419 9.148 1.00 16.62 C ATOM 3593 CG PRO D 36 -12.442 3.980 9.509 1.00 18.31 C ATOM 3594 CD PRO D 36 -11.374 2.972 9.150 1.00 16.64 C ATOM 0 HA PRO D 36 -14.048 1.323 8.786 1.00 16.54 H new ATOM 0 HB2 PRO D 36 -14.309 4.036 8.580 1.00 16.62 H new ATOM 0 HB3 PRO D 36 -14.359 3.282 9.944 1.00 16.62 H new ATOM 0 HG2 PRO D 36 -12.287 4.812 9.035 1.00 18.31 H new ATOM 0 HG3 PRO D 36 -12.403 4.182 10.457 1.00 18.31 H new ATOM 0 HD2 PRO D 36 -10.746 3.337 8.507 1.00 16.64 H new ATOM 0 HD3 PRO D 36 -10.861 2.708 9.930 1.00 16.64 H new ATOM 3595 N TRP D 37 -13.275 2.260 5.970 1.00 16.40 N ATOM 3596 CA TRP D 37 -13.766 2.147 4.580 1.00 16.59 C ATOM 3597 C TRP D 37 -14.308 0.755 4.287 1.00 16.68 C ATOM 3598 O TRP D 37 -15.136 0.582 3.399 1.00 17.43 O ATOM 3599 CB TRP D 37 -12.696 2.514 3.518 1.00 16.10 C ATOM 3600 CG TRP D 37 -11.455 1.698 3.610 1.00 14.95 C ATOM 3601 CD1 TRP D 37 -11.158 0.569 2.915 1.00 15.64 C ATOM 3602 CD2 TRP D 37 -10.353 1.924 4.499 1.00 17.48 C ATOM 3603 NE1 TRP D 37 -9.924 0.079 3.292 1.00 14.17 N ATOM 3604 CE2 TRP D 37 -9.409 0.884 4.270 1.00 17.82 C ATOM 3605 CE3 TRP D 37 -10.048 2.923 5.417 1.00 18.08 C ATOM 3606 CZ2 TRP D 37 -8.172 0.826 4.923 1.00 19.38 C ATOM 3607 CZ3 TRP D 37 -8.802 2.858 6.078 1.00 19.31 C ATOM 3608 CH2 TRP D 37 -7.902 1.821 5.837 1.00 18.10 C ATOM 0 H TRP D 37 -12.433 2.420 6.045 1.00 16.40 H new ATOM 0 HA TRP D 37 -14.484 2.796 4.512 1.00 16.59 H new ATOM 0 HB2 TRP D 37 -13.080 2.406 2.634 1.00 16.10 H new ATOM 0 HB3 TRP D 37 -12.465 3.451 3.614 1.00 16.10 H new ATOM 0 HD1 TRP D 37 -11.709 0.181 2.275 1.00 15.64 H new ATOM 0 HE1 TRP D 37 -9.542 -0.619 2.965 1.00 14.17 H new ATOM 0 HE3 TRP D 37 -10.647 3.613 5.590 1.00 18.08 H new ATOM 0 HZ2 TRP D 37 -7.561 0.147 4.748 1.00 19.38 H new ATOM 0 HZ3 TRP D 37 -8.576 3.522 6.688 1.00 19.31 H new ATOM 0 HH2 TRP D 37 -7.099 1.800 6.305 1.00 18.10 H new ATOM 3609 N THR D 38 -13.825 -0.249 5.003 1.00 17.72 N ATOM 3610 CA THR D 38 -14.350 -1.611 4.783 1.00 18.07 C ATOM 3611 C THR D 38 -15.870 -1.751 5.087 1.00 18.27 C ATOM 3612 O THR D 38 -16.539 -2.632 4.513 1.00 17.26 O ATOM 3613 CB THR D 38 -13.501 -2.719 5.460 1.00 19.11 C ATOM 3614 OG1 THR D 38 -13.582 -2.594 6.886 1.00 17.31 O ATOM 3615 CG2 THR D 38 -12.023 -2.682 4.996 1.00 13.84 C ATOM 0 H THR D 38 -13.214 -0.180 5.604 1.00 17.72 H new ATOM 0 HA THR D 38 -14.260 -1.756 3.828 1.00 18.07 H new ATOM 0 HB THR D 38 -13.865 -3.577 5.191 1.00 19.11 H new ATOM 0 HG1 THR D 38 -13.198 -1.887 7.128 1.00 17.31 H new ATOM 0 HG21 THR D 38 -11.527 -3.387 5.440 1.00 13.84 H new ATOM 0 HG22 THR D 38 -11.982 -2.813 4.036 1.00 13.84 H new ATOM 0 HG23 THR D 38 -11.634 -1.822 5.222 1.00 13.84 H new ATOM 3616 N GLN D 39 -16.419 -0.882 5.939 1.00 18.26 N ATOM 3617 CA GLN D 39 -17.875 -0.889 6.214 1.00 19.05 C ATOM 3618 C GLN D 39 -18.728 -0.715 4.962 1.00 19.28 C ATOM 3619 O GLN D 39 -19.872 -1.140 4.925 1.00 19.82 O ATOM 3620 CB GLN D 39 -18.268 0.209 7.211 1.00 18.79 C ATOM 3621 CG GLN D 39 -17.451 0.134 8.528 1.00 19.52 C ATOM 3622 CD GLN D 39 -17.569 1.398 9.347 1.00 24.27 C ATOM 3623 OE1 GLN D 39 -18.555 2.224 9.015 1.00 23.98 O flip ATOM 3624 NE2 GLN D 39 -16.805 1.620 10.290 1.00 24.29 N flip ATOM 0 H GLN D 39 -15.977 -0.282 6.368 1.00 18.26 H new ATOM 0 HA GLN D 39 -18.051 -1.766 6.589 1.00 19.05 H new ATOM 0 HB2 GLN D 39 -18.135 1.078 6.800 1.00 18.79 H new ATOM 0 HB3 GLN D 39 -19.213 0.133 7.415 1.00 18.79 H new ATOM 0 HG2 GLN D 39 -17.758 -0.620 9.055 1.00 19.52 H new ATOM 0 HG3 GLN D 39 -16.518 -0.028 8.319 1.00 19.52 H new ATOM 0 HE21 GLN D 39 -16.178 1.062 10.476 1.00 24.29 H new ATOM 0 HE22 GLN D 39 -16.900 2.333 10.762 1.00 24.29 H new ATOM 3625 N ARG D 40 -18.183 -0.072 3.937 1.00 20.34 N ATOM 3626 CA ARG D 40 -18.936 0.108 2.697 1.00 21.31 C ATOM 3627 C ARG D 40 -19.390 -1.223 2.066 1.00 20.60 C ATOM 3628 O ARG D 40 -20.432 -1.273 1.408 1.00 19.76 O ATOM 3629 CB ARG D 40 -18.102 0.887 1.662 1.00 20.50 C ATOM 3630 CG ARG D 40 -18.937 1.524 0.510 1.00 23.63 C ATOM 3631 CD ARG D 40 -18.051 2.232 -0.515 1.00 24.39 C ATOM 3632 NE ARG D 40 -18.795 2.658 -1.695 1.00 29.16 N ATOM 3633 CZ ARG D 40 -18.873 1.943 -2.810 1.00 37.72 C ATOM 3634 NH1 ARG D 40 -18.260 0.759 -2.899 1.00 38.34 N ATOM 3635 NH2 ARG D 40 -19.565 2.414 -3.841 1.00 39.48 N ATOM 0 H ARG D 40 -17.391 0.264 3.935 1.00 20.34 H new ATOM 0 HA ARG D 40 -19.730 0.609 2.940 1.00 21.31 H new ATOM 0 HB2 ARG D 40 -17.613 1.589 2.119 1.00 20.50 H new ATOM 0 HB3 ARG D 40 -17.444 0.288 1.276 1.00 20.50 H new ATOM 0 HG2 ARG D 40 -19.455 0.834 0.067 1.00 23.63 H new ATOM 0 HG3 ARG D 40 -19.570 2.158 0.882 1.00 23.63 H new ATOM 0 HD2 ARG D 40 -17.636 3.005 -0.101 1.00 24.39 H new ATOM 0 HD3 ARG D 40 -17.335 1.637 -0.785 1.00 24.39 H new ATOM 0 HE ARG D 40 -19.205 3.413 -1.667 1.00 29.16 H new ATOM 0 HH11 ARG D 40 -17.811 0.456 -2.231 1.00 38.34 H new ATOM 0 HH12 ARG D 40 -18.314 0.300 -3.624 1.00 38.34 H new ATOM 0 HH21 ARG D 40 -19.958 3.177 -3.783 1.00 39.48 H new ATOM 0 HH22 ARG D 40 -19.620 1.956 -4.567 1.00 39.48 H new ATOM 3636 N PHE D 41 -18.576 -2.268 2.225 1.00 19.72 N ATOM 3637 CA PHE D 41 -18.842 -3.560 1.559 1.00 20.05 C ATOM 3638 C PHE D 41 -19.950 -4.296 2.313 1.00 19.69 C ATOM 3639 O PHE D 41 -20.581 -5.223 1.792 1.00 18.75 O ATOM 3640 CB PHE D 41 -17.571 -4.392 1.560 1.00 19.52 C ATOM 3641 CG PHE D 41 -16.503 -3.864 0.631 1.00 20.37 C ATOM 3642 CD1 PHE D 41 -16.606 -4.070 -0.737 1.00 20.74 C ATOM 3643 CD2 PHE D 41 -15.409 -3.168 1.124 1.00 20.06 C ATOM 3644 CE1 PHE D 41 -15.614 -3.586 -1.626 1.00 19.22 C ATOM 3645 CE2 PHE D 41 -14.416 -2.657 0.252 1.00 20.45 C ATOM 3646 CZ PHE D 41 -14.524 -2.885 -1.119 1.00 20.30 C ATOM 0 H PHE D 41 -17.866 -2.256 2.711 1.00 19.72 H new ATOM 0 HA PHE D 41 -19.125 -3.410 0.643 1.00 20.05 H new ATOM 0 HB2 PHE D 41 -17.216 -4.426 2.462 1.00 19.52 H new ATOM 0 HB3 PHE D 41 -17.789 -5.302 1.306 1.00 19.52 H new ATOM 0 HD1 PHE D 41 -17.338 -4.533 -1.076 1.00 20.74 H new ATOM 0 HD2 PHE D 41 -15.326 -3.035 2.041 1.00 20.06 H new ATOM 0 HE1 PHE D 41 -15.691 -3.736 -2.541 1.00 19.22 H new ATOM 0 HE2 PHE D 41 -13.698 -2.173 0.592 1.00 20.45 H new ATOM 0 HZ PHE D 41 -13.867 -2.568 -1.696 1.00 20.30 H new ATOM 3647 N PHE D 42 -20.176 -3.861 3.545 1.00 20.44 N ATOM 3648 CA PHE D 42 -21.134 -4.538 4.463 1.00 22.35 C ATOM 3649 C PHE D 42 -22.327 -3.671 4.861 1.00 23.59 C ATOM 3650 O PHE D 42 -22.995 -3.942 5.840 1.00 23.42 O ATOM 3651 CB PHE D 42 -20.428 -5.046 5.720 1.00 21.23 C ATOM 3652 CG PHE D 42 -19.352 -6.075 5.441 1.00 19.91 C ATOM 3653 CD1 PHE D 42 -19.672 -7.418 5.270 1.00 22.19 C ATOM 3654 CD2 PHE D 42 -18.014 -5.691 5.366 1.00 19.53 C ATOM 3655 CE1 PHE D 42 -18.659 -8.356 4.993 1.00 22.30 C ATOM 3656 CE2 PHE D 42 -17.003 -6.622 5.095 1.00 18.49 C ATOM 3657 CZ PHE D 42 -17.341 -7.953 4.928 1.00 18.11 C ATOM 0 H PHE D 42 -19.790 -3.172 3.885 1.00 20.44 H new ATOM 0 HA PHE D 42 -21.486 -5.287 3.956 1.00 22.35 H new ATOM 0 HB2 PHE D 42 -20.031 -4.293 6.185 1.00 21.23 H new ATOM 0 HB3 PHE D 42 -21.087 -5.433 6.317 1.00 21.23 H new ATOM 0 HD1 PHE D 42 -20.557 -7.697 5.339 1.00 22.19 H new ATOM 0 HD2 PHE D 42 -17.788 -4.799 5.499 1.00 19.53 H new ATOM 0 HE1 PHE D 42 -18.879 -9.249 4.854 1.00 22.30 H new ATOM 0 HE2 PHE D 42 -16.116 -6.349 5.028 1.00 18.49 H new ATOM 0 HZ PHE D 42 -16.674 -8.582 4.771 1.00 18.11 H new ATOM 3658 N GLU D 43 -22.605 -2.651 4.060 1.00 26.85 N ATOM 3659 CA GLU D 43 -23.748 -1.757 4.257 1.00 29.77 C ATOM 3660 C GLU D 43 -25.064 -2.479 4.520 1.00 29.34 C ATOM 3661 O GLU D 43 -25.879 -2.008 5.286 1.00 30.58 O ATOM 3662 CB GLU D 43 -23.931 -0.919 3.004 1.00 30.91 C ATOM 3663 CG GLU D 43 -23.487 0.508 3.131 1.00 36.85 C ATOM 3664 CD GLU D 43 -23.304 1.104 1.758 1.00 43.13 C ATOM 3665 OE1 GLU D 43 -22.225 1.679 1.526 1.00 45.36 O ATOM 3666 OE2 GLU D 43 -24.210 0.918 0.893 1.00 44.59 O ATOM 0 H GLU D 43 -22.128 -2.452 3.373 1.00 26.85 H new ATOM 0 HA GLU D 43 -23.545 -1.226 5.043 1.00 29.77 H new ATOM 0 HB2 GLU D 43 -23.439 -1.334 2.278 1.00 30.91 H new ATOM 0 HB3 GLU D 43 -24.869 -0.932 2.756 1.00 30.91 H new ATOM 0 HG2 GLU D 43 -24.144 1.018 3.630 1.00 36.85 H new ATOM 0 HG3 GLU D 43 -22.655 0.555 3.628 1.00 36.85 H new ATOM 3667 N SER D 44 -25.297 -3.616 3.876 1.00 29.50 N ATOM 3668 CA SER D 44 -26.563 -4.288 4.095 1.00 29.17 C ATOM 3669 C SER D 44 -26.727 -4.817 5.561 1.00 28.46 C ATOM 3670 O SER D 44 -27.833 -5.175 5.946 1.00 28.74 O ATOM 3671 CB SER D 44 -26.755 -5.415 3.067 1.00 30.09 C ATOM 3672 OG SER D 44 -25.674 -6.309 3.170 1.00 30.15 O ATOM 0 H SER D 44 -24.757 -4.001 3.329 1.00 29.50 H new ATOM 0 HA SER D 44 -27.263 -3.628 3.969 1.00 29.17 H new ATOM 0 HB2 SER D 44 -27.591 -5.879 3.229 1.00 30.09 H new ATOM 0 HB3 SER D 44 -26.803 -5.048 2.171 1.00 30.09 H new ATOM 0 HG SER D 44 -25.069 -6.080 2.635 1.00 30.15 H new ATOM 3673 N PHE D 45 -25.650 -4.875 6.361 1.00 27.14 N ATOM 3674 CA PHE D 45 -25.727 -5.424 7.735 1.00 27.48 C ATOM 3675 C PHE D 45 -26.398 -4.465 8.722 1.00 28.20 C ATOM 3676 O PHE D 45 -26.668 -4.838 9.870 1.00 28.65 O ATOM 3677 CB PHE D 45 -24.354 -5.782 8.302 1.00 25.48 C ATOM 3678 CG PHE D 45 -23.749 -7.021 7.718 1.00 24.38 C ATOM 3679 CD1 PHE D 45 -24.325 -7.674 6.633 1.00 22.17 C ATOM 3680 CD2 PHE D 45 -22.559 -7.515 8.240 1.00 23.25 C ATOM 3681 CE1 PHE D 45 -23.750 -8.819 6.098 1.00 23.09 C ATOM 3682 CE2 PHE D 45 -21.950 -8.665 7.686 1.00 22.42 C ATOM 3683 CZ PHE D 45 -22.540 -9.306 6.606 1.00 21.62 C ATOM 0 H PHE D 45 -24.867 -4.604 6.131 1.00 27.14 H new ATOM 0 HA PHE D 45 -26.265 -6.226 7.642 1.00 27.48 H new ATOM 0 HB2 PHE D 45 -23.750 -5.038 8.152 1.00 25.48 H new ATOM 0 HB3 PHE D 45 -24.432 -5.895 9.262 1.00 25.48 H new ATOM 0 HD1 PHE D 45 -25.108 -7.338 6.260 1.00 22.17 H new ATOM 0 HD2 PHE D 45 -22.159 -7.085 8.961 1.00 23.25 H new ATOM 0 HE1 PHE D 45 -24.171 -9.265 5.399 1.00 23.09 H new ATOM 0 HE2 PHE D 45 -21.156 -8.991 8.045 1.00 22.42 H new ATOM 0 HZ PHE D 45 -22.136 -10.051 6.224 1.00 21.62 H new ATOM 3684 N GLY D 46 -26.622 -3.226 8.290 1.00 29.36 N ATOM 3685 CA GLY D 46 -27.226 -2.213 9.133 1.00 31.30 C ATOM 3686 C GLY D 46 -26.251 -1.130 9.537 1.00 33.67 C ATOM 3687 O GLY D 46 -25.297 -0.823 8.821 1.00 33.53 O ATOM 0 H GLY D 46 -26.426 -2.954 7.498 1.00 29.36 H new ATOM 0 HA2 GLY D 46 -27.973 -1.811 8.663 1.00 31.30 H new ATOM 0 HA3 GLY D 46 -27.585 -2.633 9.930 1.00 31.30 H new ATOM 3688 N ASP D 47 -26.479 -0.541 10.707 1.00 35.36 N ATOM 3689 CA ASP D 47 -25.628 0.566 11.137 1.00 36.43 C ATOM 3690 C ASP D 47 -24.313 0.086 11.811 1.00 36.08 C ATOM 3691 O ASP D 47 -24.291 -0.770 12.713 1.00 35.70 O ATOM 3692 CB ASP D 47 -26.425 1.581 11.963 1.00 38.27 C ATOM 3693 CG ASP D 47 -25.637 2.151 13.105 1.00 41.40 C ATOM 3694 OD1 ASP D 47 -24.862 3.099 12.853 1.00 44.93 O ATOM 3695 OD2 ASP D 47 -25.807 1.639 14.245 1.00 43.97 O ATOM 0 H ASP D 47 -27.105 -0.759 11.255 1.00 35.36 H new ATOM 0 HA ASP D 47 -25.329 1.038 10.344 1.00 36.43 H new ATOM 0 HB2 ASP D 47 -26.717 2.303 11.385 1.00 38.27 H new ATOM 0 HB3 ASP D 47 -27.224 1.154 12.309 1.00 38.27 H new ATOM 3696 N LEU D 48 -23.221 0.616 11.269 1.00 35.54 N ATOM 3697 CA LEU D 48 -21.890 0.255 11.642 1.00 35.17 C ATOM 3698 C LEU D 48 -21.154 1.551 12.021 1.00 36.02 C ATOM 3699 O LEU D 48 -19.925 1.627 11.971 1.00 35.27 O ATOM 3700 CB LEU D 48 -21.227 -0.487 10.478 1.00 33.67 C ATOM 3701 CG LEU D 48 -21.977 -1.732 9.942 1.00 31.92 C ATOM 3702 CD1 LEU D 48 -21.602 -2.066 8.469 1.00 30.51 C ATOM 3703 CD2 LEU D 48 -21.853 -2.974 10.850 1.00 26.49 C ATOM 0 H LEU D 48 -23.251 1.216 10.653 1.00 35.54 H new ATOM 0 HA LEU D 48 -21.870 -0.345 12.404 1.00 35.17 H new ATOM 0 HB2 LEU D 48 -21.111 0.138 9.745 1.00 33.67 H new ATOM 0 HB3 LEU D 48 -20.340 -0.763 10.758 1.00 33.67 H new ATOM 0 HG LEU D 48 -22.914 -1.481 9.956 1.00 31.92 H new ATOM 0 HD11 LEU D 48 -22.095 -2.850 8.179 1.00 30.51 H new ATOM 0 HD12 LEU D 48 -21.827 -1.314 7.899 1.00 30.51 H new ATOM 0 HD13 LEU D 48 -20.650 -2.243 8.409 1.00 30.51 H new ATOM 0 HD21 LEU D 48 -22.343 -3.713 10.457 1.00 26.49 H new ATOM 0 HD22 LEU D 48 -20.918 -3.218 10.939 1.00 26.49 H new ATOM 0 HD23 LEU D 48 -22.219 -2.773 11.725 1.00 26.49 H new ATOM 3704 N SER D 49 -21.938 2.538 12.463 1.00 37.52 N ATOM 3705 CA SER D 49 -21.455 3.911 12.760 1.00 38.72 C ATOM 3706 C SER D 49 -20.759 4.039 14.107 1.00 38.86 C ATOM 3707 O SER D 49 -20.525 5.183 14.554 1.00 40.08 O ATOM 3708 CB SER D 49 -22.641 4.885 12.841 1.00 38.36 C ATOM 3709 OG SER D 49 -23.298 4.686 14.111 1.00 39.03 O ATOM 0 H SER D 49 -22.780 2.436 12.604 1.00 37.52 H new ATOM 0 HA SER D 49 -20.834 4.112 12.043 1.00 38.72 H new ATOM 0 HB2 SER D 49 -22.333 5.801 12.759 1.00 38.36 H new ATOM 0 HB3 SER D 49 -23.260 4.727 12.111 1.00 38.36 H new ATOM 0 HG SER D 49 -23.984 4.214 14.001 1.00 39.03 H new ATOM 3710 N SER D 50 -20.494 2.927 14.794 1.00 37.63 N ATOM 3711 CA SER D 50 -19.705 2.993 16.022 1.00 36.48 C ATOM 3712 C SER D 50 -19.184 1.638 16.419 1.00 35.27 C ATOM 3713 O SER D 50 -19.763 0.601 16.080 1.00 34.26 O ATOM 3714 CB SER D 50 -20.503 3.621 17.176 1.00 37.02 C ATOM 3715 OG SER D 50 -21.265 2.646 17.863 1.00 37.77 O ATOM 0 H SER D 50 -20.757 2.139 14.571 1.00 37.63 H new ATOM 0 HA SER D 50 -18.944 3.566 15.836 1.00 36.48 H new ATOM 0 HB2 SER D 50 -19.895 4.054 17.795 1.00 37.02 H new ATOM 0 HB3 SER D 50 -21.092 4.309 16.828 1.00 37.02 H new ATOM 0 HG SER D 50 -21.690 3.012 18.488 1.00 37.77 H new ATOM 3716 N ALA D 51 -18.074 1.655 17.146 1.00 34.51 N ATOM 3717 CA ALA D 51 -17.461 0.438 17.650 1.00 32.42 C ATOM 3718 C ALA D 51 -18.521 -0.452 18.292 1.00 32.68 C ATOM 3719 O ALA D 51 -18.623 -1.648 17.985 1.00 31.15 O ATOM 3720 CB ALA D 51 -16.389 0.803 18.662 1.00 32.83 C ATOM 0 H ALA D 51 -17.655 2.375 17.361 1.00 34.51 H new ATOM 0 HA ALA D 51 -17.055 -0.051 16.918 1.00 32.42 H new ATOM 0 HB1 ALA D 51 -15.976 -0.006 19.002 1.00 32.83 H new ATOM 0 HB2 ALA D 51 -15.715 1.355 18.235 1.00 32.83 H new ATOM 0 HB3 ALA D 51 -16.790 1.294 19.396 1.00 32.83 H new ATOM 3721 N ASN D 52 -19.324 0.136 19.183 1.00 31.30 N ATOM 3722 CA ASN D 52 -20.280 -0.658 19.970 1.00 31.09 C ATOM 3723 C ASN D 52 -21.389 -1.269 19.081 1.00 29.35 C ATOM 3724 O ASN D 52 -21.768 -2.411 19.274 1.00 29.28 O ATOM 3725 CB ASN D 52 -20.835 0.156 21.168 1.00 32.53 C ATOM 3726 CG ASN D 52 -19.797 1.192 21.742 1.00 38.18 C ATOM 3727 OD1 ASN D 52 -19.598 2.275 21.081 1.00 43.64 O ATOM 3728 ND2 ASN D 52 -19.187 0.946 22.841 1.00 41.63 N ATOM 0 H ASN D 52 -19.333 0.980 19.347 1.00 31.30 H new ATOM 0 HA ASN D 52 -19.802 -1.412 20.350 1.00 31.09 H new ATOM 0 HB2 ASN D 52 -21.635 0.628 20.889 1.00 32.53 H new ATOM 0 HB3 ASN D 52 -21.098 -0.455 21.874 1.00 32.53 H new ATOM 0 HD21 ASN D 52 -18.625 1.515 23.157 1.00 41.63 H new ATOM 0 HD22 ASN D 52 -19.340 0.212 23.263 1.00 41.63 H new ATOM 3729 N ALA D 53 -21.862 -0.528 18.088 1.00 27.39 N ATOM 3730 CA ALA D 53 -22.791 -1.066 17.110 1.00 27.15 C ATOM 3731 C ALA D 53 -22.177 -2.216 16.265 1.00 26.52 C ATOM 3732 O ALA D 53 -22.814 -3.229 16.034 1.00 26.14 O ATOM 3733 CB ALA D 53 -23.254 0.020 16.213 1.00 27.32 C ATOM 0 H ALA D 53 -21.654 0.297 17.964 1.00 27.39 H new ATOM 0 HA ALA D 53 -23.538 -1.441 17.602 1.00 27.15 H new ATOM 0 HB1 ALA D 53 -23.874 -0.341 15.561 1.00 27.32 H new ATOM 0 HB2 ALA D 53 -23.699 0.705 16.737 1.00 27.32 H new ATOM 0 HB3 ALA D 53 -22.492 0.408 15.754 1.00 27.32 H new ATOM 3734 N VAL D 54 -20.927 -2.061 15.846 1.00 24.70 N ATOM 3735 CA VAL D 54 -20.270 -3.060 15.053 1.00 23.90 C ATOM 3736 C VAL D 54 -20.136 -4.356 15.840 1.00 24.29 C ATOM 3737 O VAL D 54 -20.544 -5.417 15.358 1.00 22.68 O ATOM 3738 CB VAL D 54 -18.886 -2.554 14.574 1.00 24.02 C ATOM 3739 CG1 VAL D 54 -18.111 -3.694 13.915 1.00 22.19 C ATOM 3740 CG2 VAL D 54 -19.043 -1.432 13.596 1.00 21.15 C ATOM 0 H VAL D 54 -20.445 -1.370 16.019 1.00 24.70 H new ATOM 0 HA VAL D 54 -20.811 -3.237 14.267 1.00 23.90 H new ATOM 0 HB VAL D 54 -18.397 -2.232 15.347 1.00 24.02 H new ATOM 0 HG11 VAL D 54 -17.247 -3.369 13.618 1.00 22.19 H new ATOM 0 HG12 VAL D 54 -17.984 -4.412 14.555 1.00 22.19 H new ATOM 0 HG13 VAL D 54 -18.610 -4.026 13.152 1.00 22.19 H new ATOM 0 HG21 VAL D 54 -18.168 -1.129 13.308 1.00 21.15 H new ATOM 0 HG22 VAL D 54 -19.547 -1.741 12.827 1.00 21.15 H new ATOM 0 HG23 VAL D 54 -19.516 -0.698 14.018 1.00 21.15 H new ATOM 3741 N MET D 55 -19.621 -4.267 17.073 1.00 24.37 N ATOM 3742 CA MET D 55 -19.331 -5.464 17.835 1.00 26.57 C ATOM 3743 C MET D 55 -20.587 -6.087 18.448 1.00 27.75 C ATOM 3744 O MET D 55 -20.540 -7.231 18.870 1.00 28.52 O ATOM 3745 CB MET D 55 -18.246 -5.243 18.934 1.00 26.57 C ATOM 3746 CG MET D 55 -17.001 -4.473 18.464 1.00 26.40 C ATOM 3747 SD MET D 55 -15.966 -5.413 17.282 1.00 29.43 S ATOM 3748 CE MET D 55 -15.687 -6.898 18.217 1.00 21.62 C ATOM 0 H MET D 55 -19.438 -3.528 17.473 1.00 24.37 H new ATOM 0 HA MET D 55 -18.968 -6.090 17.189 1.00 26.57 H new ATOM 0 HB2 MET D 55 -18.647 -4.763 19.675 1.00 26.57 H new ATOM 0 HB3 MET D 55 -17.967 -6.108 19.274 1.00 26.57 H new ATOM 0 HG2 MET D 55 -17.281 -3.642 18.049 1.00 26.40 H new ATOM 0 HG3 MET D 55 -16.464 -4.237 19.237 1.00 26.40 H new ATOM 0 HE1 MET D 55 -14.827 -7.277 17.975 1.00 21.62 H new ATOM 0 HE2 MET D 55 -15.693 -6.690 19.164 1.00 21.62 H new ATOM 0 HE3 MET D 55 -16.389 -7.539 18.023 1.00 21.62 H new ATOM 3749 N ASN D 56 -21.715 -5.395 18.495 1.00 28.35 N ATOM 3750 CA ASN D 56 -22.930 -6.134 18.923 1.00 28.88 C ATOM 3751 C ASN D 56 -23.827 -6.665 17.775 1.00 27.98 C ATOM 3752 O ASN D 56 -24.838 -7.325 18.016 1.00 28.54 O ATOM 3753 CB ASN D 56 -23.731 -5.358 19.961 1.00 30.69 C ATOM 3754 CG ASN D 56 -24.737 -4.421 19.340 1.00 33.85 C ATOM 3755 OD1 ASN D 56 -24.375 -3.550 18.558 1.00 38.39 O ATOM 3756 ND2 ASN D 56 -26.030 -4.602 19.680 1.00 37.99 N ATOM 0 H ASN D 56 -21.814 -4.563 18.303 1.00 28.35 H new ATOM 0 HA ASN D 56 -22.584 -6.937 19.343 1.00 28.88 H new ATOM 0 HB2 ASN D 56 -24.193 -5.983 20.541 1.00 30.69 H new ATOM 0 HB3 ASN D 56 -23.122 -4.849 20.519 1.00 30.69 H new ATOM 0 HD21 ASN D 56 -26.638 -4.095 19.344 1.00 37.99 H new ATOM 0 HD22 ASN D 56 -26.246 -5.224 20.233 1.00 37.99 H new ATOM 3757 N ASN D 57 -23.413 -6.423 16.537 1.00 26.28 N ATOM 3758 CA ASN D 57 -24.232 -6.716 15.358 1.00 24.63 C ATOM 3759 C ASN D 57 -24.230 -8.223 15.001 1.00 24.67 C ATOM 3760 O ASN D 57 -23.189 -8.812 14.715 1.00 24.10 O ATOM 3761 CB ASN D 57 -23.761 -5.798 14.207 1.00 23.69 C ATOM 3762 CG ASN D 57 -24.605 -5.920 12.957 1.00 23.96 C ATOM 3763 OD1 ASN D 57 -24.862 -7.023 12.508 1.00 22.23 O ATOM 3764 ND2 ASN D 57 -25.019 -4.777 12.372 1.00 19.07 N ATOM 0 H ASN D 57 -22.645 -6.082 16.352 1.00 26.28 H new ATOM 0 HA ASN D 57 -25.165 -6.523 15.542 1.00 24.63 H new ATOM 0 HB2 ASN D 57 -23.776 -4.877 14.510 1.00 23.69 H new ATOM 0 HB3 ASN D 57 -22.840 -6.010 13.989 1.00 23.69 H new ATOM 0 HD21 ASN D 57 -25.486 -4.808 11.650 1.00 19.07 H new ATOM 0 HD22 ASN D 57 -24.816 -4.018 12.721 1.00 19.07 H new ATOM 3765 N PRO D 58 -25.410 -8.869 15.012 1.00 24.64 N ATOM 3766 CA PRO D 58 -25.437 -10.326 14.769 1.00 23.98 C ATOM 3767 C PRO D 58 -24.998 -10.775 13.366 1.00 24.19 C ATOM 3768 O PRO D 58 -24.469 -11.889 13.222 1.00 23.50 O ATOM 3769 CB PRO D 58 -26.906 -10.702 14.977 1.00 24.95 C ATOM 3770 CG PRO D 58 -27.568 -9.489 15.580 1.00 25.38 C ATOM 3771 CD PRO D 58 -26.752 -8.290 15.221 1.00 24.65 C ATOM 0 HA PRO D 58 -24.803 -10.760 15.361 1.00 23.98 H new ATOM 0 HB2 PRO D 58 -27.325 -10.943 14.136 1.00 24.95 H new ATOM 0 HB3 PRO D 58 -26.988 -11.469 15.565 1.00 24.95 H new ATOM 0 HG2 PRO D 58 -28.474 -9.395 15.245 1.00 25.38 H new ATOM 0 HG3 PRO D 58 -27.630 -9.581 16.544 1.00 25.38 H new ATOM 0 HD2 PRO D 58 -27.085 -7.852 14.422 1.00 24.65 H new ATOM 0 HD3 PRO D 58 -26.753 -7.627 15.929 1.00 24.65 H new ATOM 3772 N LYS D 59 -25.247 -9.966 12.328 1.00 23.45 N ATOM 3773 CA LYS D 59 -24.776 -10.333 10.986 1.00 23.84 C ATOM 3774 C LYS D 59 -23.229 -10.325 10.877 1.00 22.07 C ATOM 3775 O LYS D 59 -22.643 -11.137 10.172 1.00 20.15 O ATOM 3776 CB LYS D 59 -25.423 -9.452 9.901 1.00 24.96 C ATOM 3777 CG LYS D 59 -26.872 -9.861 9.554 1.00 25.41 C ATOM 3778 CD LYS D 59 -27.439 -8.987 8.451 1.00 27.65 C ATOM 3779 CE LYS D 59 -28.830 -9.458 7.985 1.00 31.93 C ATOM 3780 NZ LYS D 59 -28.802 -10.970 7.823 1.00 35.77 N ATOM 0 H LYS D 59 -25.674 -9.221 12.376 1.00 23.45 H new ATOM 0 HA LYS D 59 -25.060 -11.248 10.832 1.00 23.84 H new ATOM 0 HB2 LYS D 59 -25.418 -8.529 10.199 1.00 24.96 H new ATOM 0 HB3 LYS D 59 -24.882 -9.493 9.097 1.00 24.96 H new ATOM 0 HG2 LYS D 59 -26.891 -10.790 9.276 1.00 25.41 H new ATOM 0 HG3 LYS D 59 -27.429 -9.790 10.345 1.00 25.41 H new ATOM 0 HD2 LYS D 59 -27.499 -8.071 8.766 1.00 27.65 H new ATOM 0 HD3 LYS D 59 -26.830 -8.988 7.696 1.00 27.65 H new ATOM 0 HE2 LYS D 59 -29.506 -9.201 8.631 1.00 31.93 H new ATOM 0 HE3 LYS D 59 -29.065 -9.034 7.145 1.00 31.93 H new ATOM 0 HZ1 LYS D 59 -29.453 -11.222 7.271 1.00 35.77 H new ATOM 0 HZ2 LYS D 59 -28.016 -11.218 7.486 1.00 35.77 H new ATOM 0 HZ3 LYS D 59 -28.920 -11.356 8.616 1.00 35.77 H new ATOM 3781 N VAL D 60 -22.592 -9.389 11.571 1.00 21.26 N ATOM 3782 CA VAL D 60 -21.133 -9.350 11.691 1.00 20.97 C ATOM 3783 C VAL D 60 -20.596 -10.611 12.389 1.00 21.84 C ATOM 3784 O VAL D 60 -19.681 -11.248 11.865 1.00 19.72 O ATOM 3785 CB VAL D 60 -20.656 -8.073 12.407 1.00 21.30 C ATOM 3786 CG1 VAL D 60 -19.172 -8.139 12.687 1.00 19.56 C ATOM 3787 CG2 VAL D 60 -21.019 -6.787 11.562 1.00 22.36 C ATOM 0 H VAL D 60 -22.993 -8.754 11.989 1.00 21.26 H new ATOM 0 HA VAL D 60 -20.770 -9.332 10.792 1.00 20.97 H new ATOM 0 HB VAL D 60 -21.118 -8.011 13.258 1.00 21.30 H new ATOM 0 HG11 VAL D 60 -18.891 -7.327 13.137 1.00 19.56 H new ATOM 0 HG12 VAL D 60 -18.983 -8.904 13.253 1.00 19.56 H new ATOM 0 HG13 VAL D 60 -18.688 -8.228 11.851 1.00 19.56 H new ATOM 0 HG21 VAL D 60 -20.711 -5.995 12.029 1.00 22.36 H new ATOM 0 HG22 VAL D 60 -20.589 -6.838 10.694 1.00 22.36 H new ATOM 0 HG23 VAL D 60 -21.980 -6.738 11.444 1.00 22.36 H new ATOM 3788 N LYS D 61 -21.181 -11.026 13.527 1.00 22.13 N ATOM 3789 CA LYS D 61 -20.718 -12.303 14.140 1.00 23.42 C ATOM 3790 C LYS D 61 -20.918 -13.502 13.211 1.00 22.31 C ATOM 3791 O LYS D 61 -20.064 -14.383 13.139 1.00 21.16 O ATOM 3792 CB LYS D 61 -21.366 -12.644 15.496 1.00 23.45 C ATOM 3793 CG LYS D 61 -21.137 -11.629 16.649 1.00 26.35 C ATOM 3794 CD LYS D 61 -21.808 -12.167 17.956 1.00 27.82 C ATOM 3795 CE LYS D 61 -21.459 -11.282 19.206 1.00 32.89 C ATOM 3796 NZ LYS D 61 -21.383 -9.825 18.842 1.00 34.39 N ATOM 0 H LYS D 61 -21.811 -10.616 13.944 1.00 22.13 H new ATOM 0 HA LYS D 61 -19.774 -12.141 14.292 1.00 23.42 H new ATOM 0 HB2 LYS D 61 -22.322 -12.739 15.360 1.00 23.45 H new ATOM 0 HB3 LYS D 61 -21.033 -13.509 15.782 1.00 23.45 H new ATOM 0 HG2 LYS D 61 -20.187 -11.496 16.792 1.00 26.35 H new ATOM 0 HG3 LYS D 61 -21.512 -10.766 16.413 1.00 26.35 H new ATOM 0 HD2 LYS D 61 -22.770 -12.192 17.837 1.00 27.82 H new ATOM 0 HD3 LYS D 61 -21.518 -13.079 18.115 1.00 27.82 H new ATOM 0 HE2 LYS D 61 -22.131 -11.411 19.894 1.00 32.89 H new ATOM 0 HE3 LYS D 61 -20.611 -11.568 19.581 1.00 32.89 H new ATOM 0 HZ1 LYS D 61 -21.388 -9.333 19.584 1.00 34.39 H new ATOM 0 HZ2 LYS D 61 -20.633 -9.671 18.389 1.00 34.39 H new ATOM 0 HZ3 LYS D 61 -22.084 -9.608 18.338 1.00 34.39 H new ATOM 3797 N ALA D 62 -22.067 -13.561 12.542 1.00 22.12 N ATOM 3798 CA ALA D 62 -22.402 -14.743 11.730 1.00 22.04 C ATOM 3799 C ALA D 62 -21.494 -14.763 10.533 1.00 21.83 C ATOM 3800 O ALA D 62 -21.073 -15.837 10.077 1.00 22.61 O ATOM 3801 CB ALA D 62 -23.860 -14.725 11.291 1.00 21.41 C ATOM 0 H ALA D 62 -22.662 -12.940 12.541 1.00 22.12 H new ATOM 0 HA ALA D 62 -22.276 -15.544 12.263 1.00 22.04 H new ATOM 0 HB1 ALA D 62 -24.048 -15.514 10.760 1.00 21.41 H new ATOM 0 HB2 ALA D 62 -24.434 -14.718 12.073 1.00 21.41 H new ATOM 0 HB3 ALA D 62 -24.029 -13.931 10.760 1.00 21.41 H new ATOM 3802 N HIS D 63 -21.191 -13.585 10.005 1.00 20.42 N ATOM 3803 CA HIS D 63 -20.294 -13.519 8.859 1.00 19.19 C ATOM 3804 C HIS D 63 -18.839 -13.885 9.222 1.00 17.75 C ATOM 3805 O HIS D 63 -18.163 -14.599 8.471 1.00 17.07 O ATOM 3806 CB HIS D 63 -20.341 -12.164 8.142 1.00 20.05 C ATOM 3807 CG HIS D 63 -19.676 -12.225 6.802 1.00 19.74 C ATOM 3808 ND1 HIS D 63 -20.222 -12.918 5.742 1.00 21.42 N ATOM 3809 CD2 HIS D 63 -18.466 -11.792 6.389 1.00 19.45 C ATOM 3810 CE1 HIS D 63 -19.389 -12.868 4.716 1.00 22.46 C ATOM 3811 NE2 HIS D 63 -18.305 -12.212 5.091 1.00 20.01 N ATOM 0 H HIS D 63 -21.486 -12.828 10.287 1.00 20.42 H new ATOM 0 HA HIS D 63 -20.624 -14.189 8.241 1.00 19.19 H new ATOM 0 HB2 HIS D 63 -21.264 -11.887 8.033 1.00 20.05 H new ATOM 0 HB3 HIS D 63 -19.906 -11.492 8.690 1.00 20.05 H new ATOM 0 HD2 HIS D 63 -17.855 -11.301 6.890 1.00 19.45 H new ATOM 0 HE1 HIS D 63 -19.540 -13.233 3.874 1.00 22.46 H new ATOM 0 HE2 HIS D 63 -17.612 -12.071 4.602 1.00 20.01 H new ATOM 3812 N GLY D 64 -18.387 -13.417 10.384 1.00 16.99 N ATOM 3813 CA GLY D 64 -17.044 -13.728 10.944 1.00 16.08 C ATOM 3814 C GLY D 64 -16.856 -15.229 11.079 1.00 17.03 C ATOM 3815 O GLY D 64 -15.797 -15.782 10.835 1.00 16.15 O ATOM 0 H GLY D 64 -18.853 -12.899 10.888 1.00 16.99 H new ATOM 0 HA2 GLY D 64 -16.355 -13.361 10.368 1.00 16.08 H new ATOM 0 HA3 GLY D 64 -16.944 -13.305 11.811 1.00 16.08 H new ATOM 3816 N LYS D 65 -17.921 -15.898 11.441 1.00 17.28 N ATOM 3817 CA LYS D 65 -17.915 -17.322 11.531 1.00 19.28 C ATOM 3818 C LYS D 65 -17.679 -17.985 10.151 1.00 18.63 C ATOM 3819 O LYS D 65 -16.928 -18.966 10.076 1.00 20.05 O ATOM 3820 CB LYS D 65 -19.245 -17.810 12.109 1.00 18.88 C ATOM 3821 CG LYS D 65 -19.291 -19.282 12.238 1.00 19.16 C ATOM 3822 CD LYS D 65 -20.581 -19.779 12.969 1.00 21.59 C ATOM 3823 CE LYS D 65 -20.528 -21.323 13.035 1.00 26.95 C ATOM 3824 NZ LYS D 65 -21.266 -21.970 14.165 1.00 29.38 N ATOM 0 H LYS D 65 -18.673 -15.532 11.642 1.00 17.28 H new ATOM 0 HA LYS D 65 -17.184 -17.577 12.115 1.00 19.28 H new ATOM 0 HB2 LYS D 65 -19.385 -17.406 12.980 1.00 18.88 H new ATOM 0 HB3 LYS D 65 -19.972 -17.514 11.539 1.00 18.88 H new ATOM 0 HG2 LYS D 65 -19.248 -19.683 11.356 1.00 19.16 H new ATOM 0 HG3 LYS D 65 -18.509 -19.586 12.725 1.00 19.16 H new ATOM 0 HD2 LYS D 65 -20.631 -19.403 13.862 1.00 21.59 H new ATOM 0 HD3 LYS D 65 -21.374 -19.487 12.493 1.00 21.59 H new ATOM 0 HE2 LYS D 65 -20.880 -21.675 12.202 1.00 26.95 H new ATOM 0 HE3 LYS D 65 -19.598 -21.593 13.086 1.00 26.95 H new ATOM 0 HZ1 LYS D 65 -21.025 -22.824 14.227 1.00 29.38 H new ATOM 0 HZ2 LYS D 65 -21.071 -21.551 14.926 1.00 29.38 H new ATOM 0 HZ3 LYS D 65 -22.142 -21.920 14.015 1.00 29.38 H new ATOM 3825 N LYS D 66 -18.339 -17.482 9.108 1.00 17.59 N ATOM 3826 CA LYS D 66 -18.191 -18.014 7.751 1.00 19.39 C ATOM 3827 C LYS D 66 -16.755 -17.795 7.205 1.00 17.82 C ATOM 3828 O LYS D 66 -16.134 -18.719 6.627 1.00 14.72 O ATOM 3829 CB LYS D 66 -19.248 -17.399 6.814 1.00 18.30 C ATOM 3830 CG LYS D 66 -20.710 -17.738 7.186 1.00 22.89 C ATOM 3831 CD LYS D 66 -21.726 -17.366 6.016 1.00 23.91 C ATOM 3832 CE LYS D 66 -22.863 -16.424 6.497 1.00 31.62 C ATOM 3833 NZ LYS D 66 -23.799 -15.946 5.366 1.00 28.88 N ATOM 0 H LYS D 66 -18.886 -16.821 9.167 1.00 17.59 H new ATOM 0 HA LYS D 66 -18.338 -18.972 7.787 1.00 19.39 H new ATOM 0 HB2 LYS D 66 -19.142 -16.435 6.814 1.00 18.30 H new ATOM 0 HB3 LYS D 66 -19.078 -17.703 5.909 1.00 18.30 H new ATOM 0 HG2 LYS D 66 -20.781 -18.685 7.386 1.00 22.89 H new ATOM 0 HG3 LYS D 66 -20.957 -17.259 7.992 1.00 22.89 H new ATOM 0 HD2 LYS D 66 -21.240 -16.940 5.293 1.00 23.91 H new ATOM 0 HD3 LYS D 66 -22.114 -18.179 5.657 1.00 23.91 H new ATOM 0 HE2 LYS D 66 -23.390 -16.884 7.168 1.00 31.62 H new ATOM 0 HE3 LYS D 66 -22.469 -15.649 6.928 1.00 31.62 H new ATOM 0 HZ1 LYS D 66 -24.426 -15.412 5.705 1.00 28.88 H new ATOM 0 HZ2 LYS D 66 -23.327 -15.499 4.758 1.00 28.88 H new ATOM 0 HZ3 LYS D 66 -24.185 -16.650 4.982 1.00 28.88 H new ATOM 3834 N VAL D 67 -16.230 -16.584 7.420 1.00 14.97 N ATOM 3835 CA VAL D 67 -14.826 -16.225 7.092 1.00 16.38 C ATOM 3836 C VAL D 67 -13.803 -17.162 7.771 1.00 17.08 C ATOM 3837 O VAL D 67 -12.912 -17.691 7.104 1.00 17.63 O ATOM 3838 CB VAL D 67 -14.494 -14.749 7.513 1.00 16.24 C ATOM 3839 CG1 VAL D 67 -12.994 -14.377 7.246 1.00 18.01 C ATOM 3840 CG2 VAL D 67 -15.425 -13.789 6.802 1.00 17.61 C ATOM 0 H VAL D 67 -16.678 -15.935 7.764 1.00 14.97 H new ATOM 0 HA VAL D 67 -14.752 -16.320 6.129 1.00 16.38 H new ATOM 0 HB VAL D 67 -14.631 -14.676 8.470 1.00 16.24 H new ATOM 0 HG11 VAL D 67 -12.834 -13.460 7.520 1.00 18.01 H new ATOM 0 HG12 VAL D 67 -12.418 -14.970 7.753 1.00 18.01 H new ATOM 0 HG13 VAL D 67 -12.801 -14.470 6.300 1.00 18.01 H new ATOM 0 HG21 VAL D 67 -15.215 -12.879 7.066 1.00 17.61 H new ATOM 0 HG22 VAL D 67 -15.314 -13.881 5.843 1.00 17.61 H new ATOM 0 HG23 VAL D 67 -16.343 -13.991 7.041 1.00 17.61 H new ATOM 3841 N LEU D 68 -13.920 -17.357 9.084 1.00 18.12 N ATOM 3842 CA LEU D 68 -12.997 -18.258 9.818 1.00 19.80 C ATOM 3843 C LEU D 68 -13.144 -19.718 9.374 1.00 19.20 C ATOM 3844 O LEU D 68 -12.154 -20.444 9.378 1.00 18.74 O ATOM 3845 CB LEU D 68 -13.260 -18.226 11.333 1.00 21.25 C ATOM 3846 CG LEU D 68 -12.320 -17.335 12.175 1.00 28.96 C ATOM 3847 CD1 LEU D 68 -11.209 -18.160 12.830 1.00 29.78 C ATOM 3848 CD2 LEU D 68 -11.789 -16.127 11.355 1.00 31.41 C ATOM 0 H LEU D 68 -14.520 -16.984 9.575 1.00 18.12 H new ATOM 0 HA LEU D 68 -12.106 -17.933 9.617 1.00 19.80 H new ATOM 0 HB2 LEU D 68 -14.172 -17.927 11.477 1.00 21.25 H new ATOM 0 HB3 LEU D 68 -13.202 -19.133 11.671 1.00 21.25 H new ATOM 0 HG LEU D 68 -12.837 -16.954 12.902 1.00 28.96 H new ATOM 0 HD11 LEU D 68 -10.636 -17.576 13.351 1.00 29.78 H new ATOM 0 HD12 LEU D 68 -11.603 -18.829 13.412 1.00 29.78 H new ATOM 0 HD13 LEU D 68 -10.684 -18.599 12.143 1.00 29.78 H new ATOM 0 HD21 LEU D 68 -11.204 -15.590 11.912 1.00 31.41 H new ATOM 0 HD22 LEU D 68 -11.295 -16.450 10.585 1.00 31.41 H new ATOM 0 HD23 LEU D 68 -12.536 -15.586 11.055 1.00 31.41 H new ATOM 3849 N ALA D 69 -14.382 -20.152 9.084 1.00 17.72 N ATOM 3850 CA ALA D 69 -14.606 -21.537 8.591 1.00 19.23 C ATOM 3851 C ALA D 69 -13.869 -21.730 7.279 1.00 19.10 C ATOM 3852 O ALA D 69 -13.236 -22.767 7.065 1.00 18.75 O ATOM 3853 CB ALA D 69 -16.149 -21.851 8.424 1.00 18.31 C ATOM 0 H ALA D 69 -15.094 -19.677 9.162 1.00 17.72 H new ATOM 0 HA ALA D 69 -14.258 -22.160 9.248 1.00 19.23 H new ATOM 0 HB1 ALA D 69 -16.262 -22.759 8.102 1.00 18.31 H new ATOM 0 HB2 ALA D 69 -16.594 -21.755 9.281 1.00 18.31 H new ATOM 0 HB3 ALA D 69 -16.538 -21.232 7.787 1.00 18.31 H new ATOM 3854 N ALA D 70 -13.928 -20.726 6.398 1.00 19.45 N ATOM 3855 CA ALA D 70 -13.164 -20.753 5.161 1.00 19.73 C ATOM 3856 C ALA D 70 -11.628 -20.791 5.405 1.00 20.66 C ATOM 3857 O ALA D 70 -10.901 -21.546 4.726 1.00 19.04 O ATOM 3858 CB ALA D 70 -13.581 -19.574 4.222 1.00 20.55 C ATOM 0 H ALA D 70 -14.408 -20.021 6.504 1.00 19.45 H new ATOM 0 HA ALA D 70 -13.381 -21.583 4.709 1.00 19.73 H new ATOM 0 HB1 ALA D 70 -13.060 -19.611 3.405 1.00 20.55 H new ATOM 0 HB2 ALA D 70 -14.524 -19.649 4.008 1.00 20.55 H new ATOM 0 HB3 ALA D 70 -13.418 -18.730 4.671 1.00 20.55 H new ATOM 3859 N PHE D 71 -11.145 -20.015 6.383 1.00 20.12 N ATOM 3860 CA PHE D 71 -9.724 -20.055 6.821 1.00 21.27 C ATOM 3861 C PHE D 71 -9.298 -21.438 7.291 1.00 21.02 C ATOM 3862 O PHE D 71 -8.198 -21.897 6.930 1.00 20.73 O ATOM 3863 CB PHE D 71 -9.459 -19.057 7.990 1.00 23.02 C ATOM 3864 CG PHE D 71 -8.653 -17.855 7.605 1.00 25.58 C ATOM 3865 CD1 PHE D 71 -7.280 -17.951 7.432 1.00 29.31 C ATOM 3866 CD2 PHE D 71 -9.266 -16.600 7.445 1.00 31.13 C ATOM 3867 CE1 PHE D 71 -6.512 -16.836 7.074 1.00 29.21 C ATOM 3868 CE2 PHE D 71 -8.507 -15.461 7.095 1.00 33.18 C ATOM 3869 CZ PHE D 71 -7.111 -15.593 6.903 1.00 30.48 C ATOM 0 H PHE D 71 -11.625 -19.448 6.816 1.00 20.12 H new ATOM 0 HA PHE D 71 -9.207 -19.807 6.039 1.00 21.27 H new ATOM 0 HB2 PHE D 71 -10.311 -18.761 8.348 1.00 23.02 H new ATOM 0 HB3 PHE D 71 -8.999 -19.526 8.704 1.00 23.02 H new ATOM 0 HD1 PHE D 71 -6.861 -18.772 7.556 1.00 29.31 H new ATOM 0 HD2 PHE D 71 -10.184 -16.518 7.571 1.00 31.13 H new ATOM 0 HE1 PHE D 71 -5.595 -16.928 6.950 1.00 29.21 H new ATOM 0 HE2 PHE D 71 -8.920 -14.634 6.992 1.00 33.18 H new ATOM 0 HZ PHE D 71 -6.599 -14.854 6.664 1.00 30.48 H new ATOM 3870 N SER D 72 -10.138 -22.076 8.124 1.00 20.21 N ATOM 3871 CA SER D 72 -9.896 -23.468 8.613 1.00 22.26 C ATOM 3872 C SER D 72 -9.748 -24.417 7.478 1.00 21.01 C ATOM 3873 O SER D 72 -8.888 -25.288 7.509 1.00 21.94 O ATOM 3874 CB SER D 72 -11.026 -24.028 9.481 1.00 21.98 C ATOM 3875 OG SER D 72 -11.165 -23.241 10.640 1.00 28.19 O ATOM 0 H SER D 72 -10.862 -21.724 8.425 1.00 20.21 H new ATOM 0 HA SER D 72 -9.087 -23.394 9.142 1.00 22.26 H new ATOM 0 HB2 SER D 72 -11.857 -24.034 8.981 1.00 21.98 H new ATOM 0 HB3 SER D 72 -10.834 -24.947 9.724 1.00 21.98 H new ATOM 0 HG SER D 72 -11.411 -22.467 10.426 1.00 28.19 H new ATOM 3876 N GLU D 73 -10.596 -24.261 6.480 1.00 20.19 N ATOM 3877 CA GLU D 73 -10.497 -25.109 5.277 1.00 19.64 C ATOM 3878 C GLU D 73 -9.172 -24.939 4.516 1.00 19.21 C ATOM 3879 O GLU D 73 -8.561 -25.927 4.076 1.00 19.01 O ATOM 3880 CB GLU D 73 -11.699 -24.902 4.363 1.00 18.82 C ATOM 3881 CG GLU D 73 -11.691 -25.930 3.188 1.00 20.22 C ATOM 3882 CD GLU D 73 -12.959 -25.925 2.343 1.00 20.27 C ATOM 3883 OE1 GLU D 73 -13.614 -24.880 2.278 1.00 22.23 O ATOM 3884 OE2 GLU D 73 -13.291 -26.974 1.733 1.00 23.79 O ATOM 0 H GLU D 73 -11.232 -23.682 6.466 1.00 20.19 H new ATOM 0 HA GLU D 73 -10.504 -26.027 5.589 1.00 19.64 H new ATOM 0 HB2 GLU D 73 -12.518 -24.996 4.874 1.00 18.82 H new ATOM 0 HB3 GLU D 73 -11.688 -23.999 4.008 1.00 18.82 H new ATOM 0 HG2 GLU D 73 -10.932 -25.744 2.614 1.00 20.22 H new ATOM 0 HG3 GLU D 73 -11.560 -26.820 3.551 1.00 20.22 H new ATOM 3885 N GLY D 74 -8.740 -23.697 4.363 1.00 19.22 N ATOM 3886 CA GLY D 74 -7.457 -23.344 3.786 1.00 21.81 C ATOM 3887 C GLY D 74 -6.287 -23.988 4.503 1.00 25.48 C ATOM 3888 O GLY D 74 -5.355 -24.481 3.839 1.00 25.46 O ATOM 0 H GLY D 74 -9.203 -23.013 4.601 1.00 19.22 H new ATOM 0 HA2 GLY D 74 -7.444 -23.609 2.853 1.00 21.81 H new ATOM 0 HA3 GLY D 74 -7.352 -22.380 3.808 1.00 21.81 H new ATOM 3889 N LEU D 75 -6.357 -24.013 5.841 1.00 27.74 N ATOM 3890 CA LEU D 75 -5.405 -24.741 6.689 1.00 31.14 C ATOM 3891 C LEU D 75 -5.207 -26.212 6.429 1.00 32.75 C ATOM 3892 O LEU D 75 -4.072 -26.660 6.601 1.00 33.92 O ATOM 3893 CB LEU D 75 -5.685 -24.564 8.178 1.00 31.64 C ATOM 3894 CG LEU D 75 -5.138 -23.283 8.799 1.00 34.06 C ATOM 3895 CD1 LEU D 75 -5.687 -23.148 10.207 1.00 35.77 C ATOM 3896 CD2 LEU D 75 -3.612 -23.300 8.797 1.00 33.54 C ATOM 0 H LEU D 75 -6.967 -23.602 6.286 1.00 27.74 H new ATOM 0 HA LEU D 75 -4.578 -24.311 6.422 1.00 31.14 H new ATOM 0 HB2 LEU D 75 -6.645 -24.588 8.316 1.00 31.64 H new ATOM 0 HB3 LEU D 75 -5.311 -25.322 8.654 1.00 31.64 H new ATOM 0 HG LEU D 75 -5.419 -22.516 8.276 1.00 34.06 H new ATOM 0 HD11 LEU D 75 -5.345 -22.335 10.611 1.00 35.77 H new ATOM 0 HD12 LEU D 75 -6.656 -23.109 10.175 1.00 35.77 H new ATOM 0 HD13 LEU D 75 -5.412 -23.913 10.736 1.00 35.77 H new ATOM 0 HD21 LEU D 75 -3.279 -22.480 9.194 1.00 33.54 H new ATOM 0 HD22 LEU D 75 -3.296 -24.060 9.311 1.00 33.54 H new ATOM 0 HD23 LEU D 75 -3.290 -23.371 7.885 1.00 33.54 H new ATOM 3897 N SER D 76 -6.231 -26.996 6.069 1.00 33.59 N ATOM 3898 CA SER D 76 -5.886 -28.377 5.687 1.00 35.27 C ATOM 3899 C SER D 76 -5.640 -28.558 4.201 1.00 35.41 C ATOM 3900 O SER D 76 -5.413 -29.662 3.738 1.00 36.23 O ATOM 3901 CB SER D 76 -6.663 -29.544 6.424 1.00 36.84 C ATOM 3902 OG SER D 76 -8.033 -29.759 6.073 1.00 39.90 O ATOM 0 H SER D 76 -7.062 -26.777 6.038 1.00 33.59 H new ATOM 0 HA SER D 76 -5.010 -28.503 6.084 1.00 35.27 H new ATOM 0 HB2 SER D 76 -6.181 -30.370 6.264 1.00 36.84 H new ATOM 0 HB3 SER D 76 -6.623 -29.373 7.378 1.00 36.84 H new ATOM 0 HG SER D 76 -8.340 -30.399 6.522 1.00 39.90 H new ATOM 3903 N HIS D 77 -5.611 -27.452 3.458 1.00 35.36 N ATOM 3904 CA HIS D 77 -5.345 -27.506 2.009 1.00 34.85 C ATOM 3905 C HIS D 77 -4.228 -26.576 1.589 1.00 33.33 C ATOM 3906 O HIS D 77 -4.258 -26.033 0.497 1.00 32.26 O ATOM 3907 CB HIS D 77 -6.607 -27.182 1.206 1.00 35.88 C ATOM 3908 CG HIS D 77 -7.586 -28.306 1.172 1.00 39.96 C ATOM 3909 ND1 HIS D 77 -8.514 -28.513 2.174 1.00 44.75 N ATOM 3910 CD2 HIS D 77 -7.763 -29.310 0.275 1.00 43.76 C ATOM 3911 CE1 HIS D 77 -9.227 -29.593 1.888 1.00 46.83 C ATOM 3912 NE2 HIS D 77 -8.791 -30.096 0.744 1.00 45.18 N ATOM 0 H HIS D 77 -5.742 -26.660 3.767 1.00 35.36 H new ATOM 0 HA HIS D 77 -5.064 -28.415 1.819 1.00 34.85 H new ATOM 0 HB2 HIS D 77 -7.035 -26.400 1.588 1.00 35.88 H new ATOM 0 HB3 HIS D 77 -6.355 -26.952 0.298 1.00 35.88 H new ATOM 0 HD1 HIS D 77 -8.613 -28.020 2.872 1.00 44.75 H new ATOM 0 HD2 HIS D 77 -7.280 -29.442 -0.509 1.00 43.76 H new ATOM 0 HE1 HIS D 77 -9.918 -29.940 2.405 1.00 46.83 H new ATOM 3913 N LEU D 78 -3.231 -26.400 2.454 1.00 33.60 N ATOM 3914 CA LEU D 78 -2.165 -25.408 2.226 1.00 33.37 C ATOM 3915 C LEU D 78 -1.392 -25.571 0.938 1.00 33.88 C ATOM 3916 O LEU D 78 -0.841 -24.608 0.424 1.00 34.11 O ATOM 3917 CB LEU D 78 -1.172 -25.399 3.389 1.00 34.38 C ATOM 3918 CG LEU D 78 -1.680 -24.851 4.728 1.00 31.86 C ATOM 3919 CD1 LEU D 78 -0.578 -24.973 5.695 1.00 33.02 C ATOM 3920 CD2 LEU D 78 -2.081 -23.456 4.623 1.00 31.49 C ATOM 0 H LEU D 78 -3.148 -26.845 3.185 1.00 33.60 H new ATOM 0 HA LEU D 78 -2.641 -24.565 2.158 1.00 33.37 H new ATOM 0 HB2 LEU D 78 -0.865 -26.308 3.531 1.00 34.38 H new ATOM 0 HB3 LEU D 78 -0.399 -24.877 3.122 1.00 34.38 H new ATOM 0 HG LEU D 78 -2.461 -25.354 5.008 1.00 31.86 H new ATOM 0 HD11 LEU D 78 -0.865 -24.634 6.557 1.00 33.02 H new ATOM 0 HD12 LEU D 78 -0.325 -25.905 5.782 1.00 33.02 H new ATOM 0 HD13 LEU D 78 0.184 -24.460 5.384 1.00 33.02 H new ATOM 0 HD21 LEU D 78 -2.396 -23.144 5.486 1.00 31.49 H new ATOM 0 HD22 LEU D 78 -1.322 -22.921 4.343 1.00 31.49 H new ATOM 0 HD23 LEU D 78 -2.793 -23.372 3.970 1.00 31.49 H new ATOM 3921 N ASP D 79 -1.326 -26.781 0.413 1.00 34.61 N ATOM 3922 CA ASP D 79 -0.589 -26.963 -0.832 1.00 36.47 C ATOM 3923 C ASP D 79 -1.488 -26.802 -2.078 1.00 36.44 C ATOM 3924 O ASP D 79 -1.019 -26.917 -3.215 1.00 37.13 O ATOM 3925 CB ASP D 79 0.163 -28.296 -0.803 1.00 37.23 C ATOM 3926 CG ASP D 79 -0.757 -29.471 -0.951 1.00 40.68 C ATOM 3927 OD1 ASP D 79 -1.738 -29.583 -0.172 1.00 45.00 O ATOM 3928 OD2 ASP D 79 -0.502 -30.291 -1.865 1.00 47.33 O ATOM 0 H ASP D 79 -1.685 -27.489 0.743 1.00 34.61 H new ATOM 0 HA ASP D 79 0.069 -26.254 -0.905 1.00 36.47 H new ATOM 0 HB2 ASP D 79 0.820 -28.310 -1.517 1.00 37.23 H new ATOM 0 HB3 ASP D 79 0.650 -28.372 0.032 1.00 37.23 H new ATOM 3929 N ASN D 80 -2.777 -26.561 -1.862 1.00 35.80 N ATOM 3930 CA ASN D 80 -3.682 -26.261 -2.966 1.00 35.23 C ATOM 3931 C ASN D 80 -4.581 -25.062 -2.686 1.00 34.01 C ATOM 3932 O ASN D 80 -5.787 -25.114 -2.975 1.00 33.77 O ATOM 3933 CB ASN D 80 -4.574 -27.471 -3.287 1.00 35.60 C ATOM 3934 CG ASN D 80 -5.399 -27.261 -4.562 1.00 36.55 C ATOM 3935 OD1 ASN D 80 -4.919 -26.685 -5.530 1.00 40.04 O ATOM 3936 ND2 ASN D 80 -6.649 -27.678 -4.537 1.00 37.96 N ATOM 0 H ASN D 80 -3.147 -26.566 -1.086 1.00 35.80 H new ATOM 0 HA ASN D 80 -3.114 -26.048 -3.723 1.00 35.23 H new ATOM 0 HB2 ASN D 80 -4.020 -28.261 -3.389 1.00 35.60 H new ATOM 0 HB3 ASN D 80 -5.171 -27.637 -2.541 1.00 35.60 H new ATOM 0 HD21 ASN D 80 -7.159 -27.549 -5.217 1.00 37.96 H new ATOM 0 HD22 ASN D 80 -6.955 -28.079 -3.841 1.00 37.96 H new ATOM 3937 N LEU D 81 -4.030 -23.987 -2.119 1.00 33.54 N ATOM 3938 CA LEU D 81 -4.864 -22.812 -1.777 1.00 32.09 C ATOM 3939 C LEU D 81 -5.649 -22.253 -2.984 1.00 32.33 C ATOM 3940 O LEU D 81 -6.858 -21.970 -2.898 1.00 31.11 O ATOM 3941 CB LEU D 81 -4.055 -21.731 -1.061 1.00 32.01 C ATOM 3942 CG LEU D 81 -3.678 -22.045 0.394 1.00 32.27 C ATOM 3943 CD1 LEU D 81 -2.775 -20.985 1.039 1.00 31.02 C ATOM 3944 CD2 LEU D 81 -4.899 -22.246 1.257 1.00 30.84 C ATOM 0 H LEU D 81 -3.196 -23.910 -1.925 1.00 33.54 H new ATOM 0 HA LEU D 81 -5.535 -23.129 -1.152 1.00 32.09 H new ATOM 0 HB2 LEU D 81 -3.240 -21.572 -1.563 1.00 32.01 H new ATOM 0 HB3 LEU D 81 -4.563 -20.905 -1.076 1.00 32.01 H new ATOM 0 HG LEU D 81 -3.172 -22.871 0.345 1.00 32.27 H new ATOM 0 HD11 LEU D 81 -2.575 -21.242 1.953 1.00 31.02 H new ATOM 0 HD12 LEU D 81 -1.949 -20.914 0.536 1.00 31.02 H new ATOM 0 HD13 LEU D 81 -3.229 -20.128 1.037 1.00 31.02 H new ATOM 0 HD21 LEU D 81 -4.624 -22.442 2.166 1.00 30.84 H new ATOM 0 HD22 LEU D 81 -5.437 -21.439 1.249 1.00 30.84 H new ATOM 0 HD23 LEU D 81 -5.422 -22.986 0.911 1.00 30.84 H new ATOM 3945 N LYS D 82 -4.964 -22.153 -4.122 1.00 32.56 N ATOM 3946 CA LYS D 82 -5.537 -21.575 -5.334 1.00 34.09 C ATOM 3947 C LYS D 82 -6.768 -22.316 -5.820 1.00 33.95 C ATOM 3948 O LYS D 82 -7.773 -21.689 -6.156 1.00 33.79 O ATOM 3949 CB LYS D 82 -4.477 -21.477 -6.456 1.00 34.83 C ATOM 3950 CG LYS D 82 -3.664 -20.181 -6.365 1.00 37.46 C ATOM 3951 CD LYS D 82 -2.227 -20.369 -6.861 1.00 41.92 C ATOM 3952 CE LYS D 82 -1.335 -19.211 -6.443 1.00 43.83 C ATOM 3953 NZ LYS D 82 -1.326 -19.059 -4.955 1.00 46.30 N ATOM 0 H LYS D 82 -4.151 -22.420 -4.212 1.00 32.56 H new ATOM 0 HA LYS D 82 -5.827 -20.680 -5.099 1.00 34.09 H new ATOM 0 HB2 LYS D 82 -3.878 -22.238 -6.402 1.00 34.83 H new ATOM 0 HB3 LYS D 82 -4.916 -21.523 -7.320 1.00 34.83 H new ATOM 0 HG2 LYS D 82 -4.098 -19.490 -6.889 1.00 37.46 H new ATOM 0 HG3 LYS D 82 -3.650 -19.873 -5.445 1.00 37.46 H new ATOM 0 HD2 LYS D 82 -1.868 -21.198 -6.509 1.00 41.92 H new ATOM 0 HD3 LYS D 82 -2.225 -20.447 -7.828 1.00 41.92 H new ATOM 0 HE2 LYS D 82 -0.432 -19.361 -6.763 1.00 43.83 H new ATOM 0 HE3 LYS D 82 -1.649 -18.390 -6.854 1.00 43.83 H new ATOM 0 HZ1 LYS D 82 -0.499 -18.880 -4.680 1.00 46.30 H new ATOM 0 HZ2 LYS D 82 -1.867 -18.392 -4.721 1.00 46.30 H new ATOM 0 HZ3 LYS D 82 -1.607 -19.814 -4.577 1.00 46.30 H new ATOM 3954 N GLY D 83 -6.701 -23.647 -5.858 1.00 33.76 N ATOM 3955 CA GLY D 83 -7.855 -24.450 -6.312 1.00 32.38 C ATOM 3956 C GLY D 83 -8.994 -24.423 -5.303 1.00 32.11 C ATOM 3957 O GLY D 83 -10.173 -24.279 -5.661 1.00 32.17 O ATOM 0 H GLY D 83 -6.010 -24.105 -5.630 1.00 33.76 H new ATOM 0 HA2 GLY D 83 -8.170 -24.111 -7.164 1.00 32.38 H new ATOM 0 HA3 GLY D 83 -7.574 -25.367 -6.458 1.00 32.38 H new ATOM 3958 N THR D 84 -8.635 -24.531 -4.034 1.00 31.15 N ATOM 3959 CA THR D 84 -9.597 -24.465 -2.957 1.00 31.89 C ATOM 3960 C THR D 84 -10.356 -23.116 -2.988 1.00 30.73 C ATOM 3961 O THR D 84 -11.570 -23.142 -2.947 1.00 31.32 O ATOM 3962 CB THR D 84 -8.908 -24.743 -1.572 1.00 33.30 C ATOM 3963 OG1 THR D 84 -8.671 -26.160 -1.448 1.00 35.83 O ATOM 3964 CG2 THR D 84 -9.740 -24.248 -0.388 1.00 32.79 C ATOM 0 H THR D 84 -7.823 -24.645 -3.775 1.00 31.15 H new ATOM 0 HA THR D 84 -10.258 -25.164 -3.082 1.00 31.89 H new ATOM 0 HB THR D 84 -8.073 -24.251 -1.550 1.00 33.30 H new ATOM 0 HG1 THR D 84 -7.919 -26.348 -1.771 1.00 35.83 H new ATOM 0 HG21 THR D 84 -9.273 -24.443 0.440 1.00 32.79 H new ATOM 0 HG22 THR D 84 -9.875 -23.291 -0.465 1.00 32.79 H new ATOM 0 HG23 THR D 84 -10.600 -24.696 -0.387 1.00 32.79 H new ATOM 3965 N PHE D 85 -9.640 -21.988 -3.107 1.00 28.42 N ATOM 3966 CA PHE D 85 -10.237 -20.633 -3.067 1.00 27.36 C ATOM 3967 C PHE D 85 -10.701 -20.011 -4.427 1.00 26.13 C ATOM 3968 O PHE D 85 -11.013 -18.831 -4.481 1.00 25.30 O ATOM 3969 CB PHE D 85 -9.291 -19.650 -2.312 1.00 27.31 C ATOM 3970 CG PHE D 85 -9.258 -19.832 -0.785 1.00 30.34 C ATOM 3971 CD1 PHE D 85 -10.379 -19.586 -0.005 1.00 31.48 C ATOM 3972 CD2 PHE D 85 -8.077 -20.163 -0.135 1.00 32.71 C ATOM 3973 CE1 PHE D 85 -10.350 -19.749 1.403 1.00 33.87 C ATOM 3974 CE2 PHE D 85 -8.033 -20.310 1.279 1.00 35.16 C ATOM 3975 CZ PHE D 85 -9.171 -20.103 2.045 1.00 32.52 C ATOM 0 H PHE D 85 -8.787 -21.984 -3.214 1.00 28.42 H new ATOM 0 HA PHE D 85 -11.070 -20.765 -2.587 1.00 27.36 H new ATOM 0 HB2 PHE D 85 -8.391 -19.758 -2.657 1.00 27.31 H new ATOM 0 HB3 PHE D 85 -9.564 -18.741 -2.511 1.00 27.31 H new ATOM 0 HD1 PHE D 85 -11.166 -19.308 -0.415 1.00 31.48 H new ATOM 0 HD2 PHE D 85 -7.302 -20.291 -0.632 1.00 32.71 H new ATOM 0 HE1 PHE D 85 -11.125 -19.618 1.900 1.00 33.87 H new ATOM 0 HE2 PHE D 85 -7.235 -20.547 1.693 1.00 35.16 H new ATOM 0 HZ PHE D 85 -9.145 -20.199 2.970 1.00 32.52 H new ATOM 3976 N ALA D 86 -10.777 -20.801 -5.511 1.00 25.67 N ATOM 3977 CA ALA D 86 -10.975 -20.279 -6.865 1.00 24.41 C ATOM 3978 C ALA D 86 -12.263 -19.499 -7.003 1.00 23.42 C ATOM 3979 O ALA D 86 -12.268 -18.365 -7.492 1.00 24.39 O ATOM 3980 CB ALA D 86 -10.955 -21.465 -7.920 1.00 24.89 C ATOM 0 H ALA D 86 -10.714 -21.658 -5.475 1.00 25.67 H new ATOM 0 HA ALA D 86 -10.243 -19.668 -7.040 1.00 24.41 H new ATOM 0 HB1 ALA D 86 -11.087 -21.107 -8.812 1.00 24.89 H new ATOM 0 HB2 ALA D 86 -10.100 -21.921 -7.878 1.00 24.89 H new ATOM 0 HB3 ALA D 86 -11.666 -22.092 -7.715 1.00 24.89 H new ATOM 3981 N LYS D 87 -13.363 -20.085 -6.562 1.00 22.13 N ATOM 3982 CA LYS D 87 -14.656 -19.423 -6.697 1.00 22.75 C ATOM 3983 C LYS D 87 -14.793 -18.255 -5.742 1.00 22.35 C ATOM 3984 O LYS D 87 -15.487 -17.285 -6.021 1.00 22.64 O ATOM 3985 CB LYS D 87 -15.820 -20.403 -6.519 1.00 22.39 C ATOM 3986 CG LYS D 87 -15.922 -21.446 -7.647 1.00 25.30 C ATOM 3987 CD LYS D 87 -16.313 -20.776 -8.933 1.00 30.94 C ATOM 3988 CE LYS D 87 -16.450 -21.768 -10.100 1.00 36.70 C ATOM 3989 NZ LYS D 87 -16.136 -21.016 -11.375 1.00 39.58 N ATOM 0 H LYS D 87 -13.387 -20.858 -6.185 1.00 22.13 H new ATOM 0 HA LYS D 87 -14.695 -19.075 -7.602 1.00 22.75 H new ATOM 0 HB2 LYS D 87 -15.719 -20.863 -5.671 1.00 22.39 H new ATOM 0 HB3 LYS D 87 -16.650 -19.903 -6.474 1.00 22.39 H new ATOM 0 HG2 LYS D 87 -15.072 -21.900 -7.756 1.00 25.30 H new ATOM 0 HG3 LYS D 87 -16.577 -22.122 -7.414 1.00 25.30 H new ATOM 0 HD2 LYS D 87 -17.155 -20.311 -8.808 1.00 30.94 H new ATOM 0 HD3 LYS D 87 -15.649 -20.106 -9.159 1.00 30.94 H new ATOM 0 HE2 LYS D 87 -15.842 -22.515 -9.986 1.00 36.70 H new ATOM 0 HE3 LYS D 87 -17.347 -22.135 -10.132 1.00 36.70 H new ATOM 0 HZ1 LYS D 87 -16.208 -21.567 -12.070 1.00 39.58 H new ATOM 0 HZ2 LYS D 87 -16.709 -20.342 -11.471 1.00 39.58 H new ATOM 0 HZ3 LYS D 87 -15.306 -20.696 -11.335 1.00 39.58 H new ATOM 3990 N LEU D 88 -14.133 -18.373 -4.608 1.00 22.60 N ATOM 3991 CA LEU D 88 -14.182 -17.339 -3.587 1.00 21.45 C ATOM 3992 C LEU D 88 -13.399 -16.111 -4.079 1.00 20.63 C ATOM 3993 O LEU D 88 -13.864 -14.997 -3.954 1.00 21.79 O ATOM 3994 CB LEU D 88 -13.654 -17.929 -2.272 1.00 21.03 C ATOM 3995 CG LEU D 88 -13.918 -17.105 -1.023 1.00 22.80 C ATOM 3996 CD1 LEU D 88 -15.433 -16.969 -0.761 1.00 21.67 C ATOM 3997 CD2 LEU D 88 -13.187 -17.661 0.175 1.00 22.07 C ATOM 0 H LEU D 88 -13.644 -19.051 -4.405 1.00 22.60 H new ATOM 0 HA LEU D 88 -15.088 -17.036 -3.418 1.00 21.45 H new ATOM 0 HB2 LEU D 88 -14.049 -18.806 -2.149 1.00 21.03 H new ATOM 0 HB3 LEU D 88 -12.696 -18.058 -2.357 1.00 21.03 H new ATOM 0 HG LEU D 88 -13.567 -16.214 -1.176 1.00 22.80 H new ATOM 0 HD11 LEU D 88 -15.577 -16.440 0.039 1.00 21.67 H new ATOM 0 HD12 LEU D 88 -15.854 -16.531 -1.517 1.00 21.67 H new ATOM 0 HD13 LEU D 88 -15.821 -17.850 -0.640 1.00 21.67 H new ATOM 0 HD21 LEU D 88 -13.377 -17.113 0.953 1.00 22.07 H new ATOM 0 HD22 LEU D 88 -13.481 -18.570 0.341 1.00 22.07 H new ATOM 0 HD23 LEU D 88 -12.232 -17.657 0.002 1.00 22.07 H new ATOM 3998 N SER D 89 -12.246 -16.332 -4.703 1.00 20.19 N ATOM 3999 CA SER D 89 -11.483 -15.269 -5.349 1.00 20.81 C ATOM 4000 C SER D 89 -12.261 -14.560 -6.475 1.00 21.43 C ATOM 4001 O SER D 89 -12.301 -13.305 -6.537 1.00 19.60 O ATOM 4002 CB SER D 89 -10.177 -15.828 -5.902 1.00 20.41 C ATOM 4003 OG SER D 89 -9.483 -14.853 -6.597 1.00 20.27 O ATOM 0 H SER D 89 -11.882 -17.109 -4.764 1.00 20.19 H new ATOM 0 HA SER D 89 -11.304 -14.603 -4.667 1.00 20.81 H new ATOM 0 HB2 SER D 89 -9.630 -16.164 -5.175 1.00 20.41 H new ATOM 0 HB3 SER D 89 -10.363 -16.578 -6.488 1.00 20.41 H new ATOM 0 HG SER D 89 -9.183 -14.283 -6.057 1.00 20.27 H new ATOM 4004 N GLU D 90 -12.873 -15.360 -7.366 1.00 22.06 N ATOM 4005 CA GLU D 90 -13.813 -14.807 -8.356 1.00 23.07 C ATOM 4006 C GLU D 90 -14.889 -13.885 -7.738 1.00 22.23 C ATOM 4007 O GLU D 90 -15.125 -12.797 -8.250 1.00 21.92 O ATOM 4008 CB GLU D 90 -14.497 -15.919 -9.162 1.00 22.89 C ATOM 4009 CG GLU D 90 -13.601 -16.502 -10.198 1.00 29.20 C ATOM 4010 CD GLU D 90 -14.364 -17.393 -11.201 1.00 37.54 C ATOM 4011 OE1 GLU D 90 -15.572 -17.706 -10.968 1.00 38.40 O ATOM 4012 OE2 GLU D 90 -13.743 -17.740 -12.230 1.00 40.93 O ATOM 0 H GLU D 90 -12.759 -16.211 -7.413 1.00 22.06 H new ATOM 0 HA GLU D 90 -13.269 -14.263 -8.946 1.00 23.07 H new ATOM 0 HB2 GLU D 90 -14.788 -16.620 -8.558 1.00 22.89 H new ATOM 0 HB3 GLU D 90 -15.292 -15.563 -9.589 1.00 22.89 H new ATOM 0 HG2 GLU D 90 -13.157 -15.786 -10.678 1.00 29.20 H new ATOM 0 HG3 GLU D 90 -12.908 -17.026 -9.766 1.00 29.20 H new ATOM 4013 N LEU D 91 -15.524 -14.316 -6.651 1.00 21.97 N ATOM 4014 CA LEU D 91 -16.570 -13.499 -6.000 1.00 22.32 C ATOM 4015 C LEU D 91 -16.034 -12.181 -5.439 1.00 21.63 C ATOM 4016 O LEU D 91 -16.630 -11.129 -5.691 1.00 20.52 O ATOM 4017 CB LEU D 91 -17.279 -14.247 -4.879 1.00 22.47 C ATOM 4018 CG LEU D 91 -18.184 -13.463 -3.917 1.00 23.16 C ATOM 4019 CD1 LEU D 91 -19.594 -13.272 -4.515 1.00 25.71 C ATOM 4020 CD2 LEU D 91 -18.235 -14.178 -2.569 1.00 29.37 C ATOM 0 H LEU D 91 -15.372 -15.072 -6.271 1.00 21.97 H new ATOM 0 HA LEU D 91 -17.203 -13.304 -6.708 1.00 22.32 H new ATOM 0 HB2 LEU D 91 -17.818 -14.943 -5.286 1.00 22.47 H new ATOM 0 HB3 LEU D 91 -16.600 -14.690 -4.347 1.00 22.47 H new ATOM 0 HG LEU D 91 -17.813 -12.577 -3.781 1.00 23.16 H new ATOM 0 HD11 LEU D 91 -20.146 -12.775 -3.891 1.00 25.71 H new ATOM 0 HD12 LEU D 91 -19.528 -12.781 -5.349 1.00 25.71 H new ATOM 0 HD13 LEU D 91 -19.995 -14.139 -4.682 1.00 25.71 H new ATOM 0 HD21 LEU D 91 -18.806 -13.683 -1.961 1.00 29.37 H new ATOM 0 HD22 LEU D 91 -18.590 -15.072 -2.690 1.00 29.37 H new ATOM 0 HD23 LEU D 91 -17.341 -14.234 -2.198 1.00 29.37 H new ATOM 4021 N HIS D 92 -14.943 -12.248 -4.674 1.00 21.73 N ATOM 4022 CA HIS D 92 -14.366 -11.034 -4.110 1.00 23.72 C ATOM 4023 C HIS D 92 -13.760 -10.092 -5.142 1.00 24.88 C ATOM 4024 O HIS D 92 -13.889 -8.871 -5.004 1.00 24.74 O ATOM 4025 CB HIS D 92 -13.284 -11.368 -3.106 1.00 23.02 C ATOM 4026 CG HIS D 92 -13.799 -11.961 -1.844 1.00 22.20 C ATOM 4027 ND1 HIS D 92 -14.095 -13.301 -1.717 1.00 18.01 N ATOM 4028 CD2 HIS D 92 -14.063 -11.395 -0.647 1.00 19.74 C ATOM 4029 CE1 HIS D 92 -14.522 -13.531 -0.492 1.00 20.03 C ATOM 4030 NE2 HIS D 92 -14.496 -12.395 0.185 1.00 22.53 N ATOM 0 H HIS D 92 -14.530 -12.975 -4.474 1.00 21.73 H new ATOM 0 HA HIS D 92 -15.114 -10.580 -3.691 1.00 23.72 H new ATOM 0 HB2 HIS D 92 -12.657 -11.987 -3.512 1.00 23.02 H new ATOM 0 HB3 HIS D 92 -12.789 -10.561 -2.896 1.00 23.02 H new ATOM 0 HD1 HIS D 92 -14.014 -13.891 -2.337 1.00 18.01 H new ATOM 0 HD2 HIS D 92 -13.969 -10.496 -0.428 1.00 19.74 H new ATOM 0 HE1 HIS D 92 -14.796 -14.355 -0.159 1.00 20.03 H new ATOM 4031 N CYS D 93 -13.059 -10.655 -6.135 1.00 27.31 N ATOM 4032 CA CYS D 93 -12.411 -9.859 -7.181 1.00 29.97 C ATOM 4033 C CYS D 93 -13.405 -9.394 -8.279 1.00 31.27 C ATOM 4034 O CYS D 93 -13.510 -8.198 -8.554 1.00 30.79 O ATOM 4035 CB CYS D 93 -11.172 -10.587 -7.750 1.00 31.21 C ATOM 4036 SG CYS D 93 -9.857 -11.131 -6.476 1.00 33.08 S ATOM 0 H CYS D 93 -12.948 -11.504 -6.219 1.00 27.31 H new ATOM 0 HA CYS D 93 -12.090 -9.042 -6.768 1.00 29.97 H new ATOM 0 HB2 CYS D 93 -11.474 -11.373 -8.231 1.00 31.21 H new ATOM 0 HB3 CYS D 93 -10.746 -10.004 -8.398 1.00 31.21 H new ATOM 0 HG CYS D 93 -9.066 -10.243 -6.313 1.00 33.08 H new ATOM 4037 N ASP D 94 -14.170 -10.316 -8.865 1.00 32.32 N ATOM 4038 CA ASP D 94 -15.058 -9.964 -10.003 1.00 34.19 C ATOM 4039 C ASP D 94 -16.375 -9.304 -9.633 1.00 34.08 C ATOM 4040 O ASP D 94 -16.808 -8.364 -10.290 1.00 35.62 O ATOM 4041 CB ASP D 94 -15.331 -11.191 -10.902 1.00 35.04 C ATOM 4042 CG ASP D 94 -14.089 -11.621 -11.671 1.00 37.61 C ATOM 4043 OD1 ASP D 94 -13.272 -10.736 -11.982 1.00 40.11 O ATOM 4044 OD2 ASP D 94 -13.919 -12.831 -11.971 1.00 41.82 O ATOM 0 H ASP D 94 -14.197 -11.143 -8.630 1.00 32.32 H new ATOM 0 HA ASP D 94 -14.554 -9.290 -10.486 1.00 34.19 H new ATOM 0 HB2 ASP D 94 -15.644 -11.929 -10.355 1.00 35.04 H new ATOM 0 HB3 ASP D 94 -16.042 -10.981 -11.528 1.00 35.04 H new ATOM 4045 N LYS D 95 -17.003 -9.776 -8.576 1.00 32.87 N ATOM 4046 CA LYS D 95 -18.307 -9.310 -8.227 1.00 32.84 C ATOM 4047 C LYS D 95 -18.295 -8.220 -7.144 1.00 32.26 C ATOM 4048 O LYS D 95 -19.179 -7.354 -7.117 1.00 33.29 O ATOM 4049 CB LYS D 95 -19.149 -10.495 -7.777 1.00 32.87 C ATOM 4050 CG LYS D 95 -20.549 -10.102 -7.353 1.00 36.52 C ATOM 4051 CD LYS D 95 -21.468 -11.325 -7.316 1.00 43.50 C ATOM 4052 CE LYS D 95 -22.818 -11.011 -6.686 1.00 46.06 C ATOM 4053 NZ LYS D 95 -23.632 -12.276 -6.547 1.00 47.08 N ATOM 0 H LYS D 95 -16.681 -10.373 -8.047 1.00 32.87 H new ATOM 0 HA LYS D 95 -18.691 -8.897 -9.016 1.00 32.84 H new ATOM 0 HB2 LYS D 95 -19.205 -11.139 -8.501 1.00 32.87 H new ATOM 0 HB3 LYS D 95 -18.705 -10.938 -7.037 1.00 32.87 H new ATOM 0 HG2 LYS D 95 -20.522 -9.686 -6.477 1.00 36.52 H new ATOM 0 HG3 LYS D 95 -20.905 -9.443 -7.969 1.00 36.52 H new ATOM 0 HD2 LYS D 95 -21.603 -11.654 -8.219 1.00 43.50 H new ATOM 0 HD3 LYS D 95 -21.037 -12.036 -6.816 1.00 43.50 H new ATOM 0 HE2 LYS D 95 -22.690 -10.603 -5.815 1.00 46.06 H new ATOM 0 HE3 LYS D 95 -23.297 -10.368 -7.233 1.00 46.06 H new ATOM 0 HZ1 LYS D 95 -24.419 -12.084 -6.178 1.00 47.08 H new ATOM 0 HZ2 LYS D 95 -23.761 -12.636 -7.351 1.00 47.08 H new ATOM 0 HZ3 LYS D 95 -23.196 -12.855 -6.030 1.00 47.08 H new ATOM 4054 N LEU D 96 -17.325 -8.259 -6.239 1.00 30.30 N ATOM 4055 CA LEU D 96 -17.374 -7.344 -5.100 1.00 28.95 C ATOM 4056 C LEU D 96 -16.351 -6.209 -5.242 1.00 28.29 C ATOM 4057 O LEU D 96 -16.462 -5.203 -4.548 1.00 28.29 O ATOM 4058 CB LEU D 96 -17.180 -8.122 -3.778 1.00 28.35 C ATOM 4059 CG LEU D 96 -18.230 -9.128 -3.269 1.00 26.47 C ATOM 4060 CD1 LEU D 96 -17.615 -10.078 -2.258 1.00 22.73 C ATOM 4061 CD2 LEU D 96 -19.476 -8.429 -2.633 1.00 24.36 C ATOM 0 H LEU D 96 -16.648 -8.789 -6.260 1.00 30.30 H new ATOM 0 HA LEU D 96 -18.251 -6.930 -5.082 1.00 28.95 H new ATOM 0 HB2 LEU D 96 -16.343 -8.605 -3.857 1.00 28.35 H new ATOM 0 HB3 LEU D 96 -17.061 -7.461 -3.078 1.00 28.35 H new ATOM 0 HG LEU D 96 -18.533 -9.624 -4.046 1.00 26.47 H new ATOM 0 HD11 LEU D 96 -18.289 -10.703 -1.949 1.00 22.73 H new ATOM 0 HD12 LEU D 96 -16.888 -10.567 -2.674 1.00 22.73 H new ATOM 0 HD13 LEU D 96 -17.274 -9.572 -1.504 1.00 22.73 H new ATOM 0 HD21 LEU D 96 -20.105 -9.102 -2.329 1.00 24.36 H new ATOM 0 HD22 LEU D 96 -19.194 -7.887 -1.879 1.00 24.36 H new ATOM 0 HD23 LEU D 96 -19.903 -7.863 -3.295 1.00 24.36 H new ATOM 4062 N HIS D 97 -15.381 -6.390 -6.143 1.00 27.77 N ATOM 4063 CA HIS D 97 -14.294 -5.406 -6.421 1.00 28.78 C ATOM 4064 C HIS D 97 -13.459 -5.054 -5.174 1.00 27.13 C ATOM 4065 O HIS D 97 -13.127 -3.881 -4.956 1.00 26.30 O ATOM 4066 CB HIS D 97 -14.844 -4.092 -7.063 1.00 29.37 C ATOM 4067 CG HIS D 97 -15.762 -4.325 -8.234 1.00 34.76 C ATOM 4068 ND1 HIS D 97 -15.365 -5.014 -9.367 1.00 36.68 N ATOM 4069 CD2 HIS D 97 -17.059 -3.975 -8.438 1.00 37.23 C ATOM 4070 CE1 HIS D 97 -16.378 -5.076 -10.215 1.00 39.02 C ATOM 4071 NE2 HIS D 97 -17.418 -4.454 -9.674 1.00 38.33 N ATOM 0 H HIS D 97 -15.325 -7.099 -6.626 1.00 27.77 H new ATOM 0 HA HIS D 97 -13.710 -5.851 -7.055 1.00 28.78 H new ATOM 0 HB2 HIS D 97 -15.319 -3.586 -6.386 1.00 29.37 H new ATOM 0 HB3 HIS D 97 -14.096 -3.546 -7.353 1.00 29.37 H new ATOM 0 HD2 HIS D 97 -17.602 -3.500 -7.851 1.00 37.23 H new ATOM 0 HE1 HIS D 97 -16.364 -5.486 -11.050 1.00 39.02 H new ATOM 0 HE2 HIS D 97 -18.192 -4.365 -10.039 1.00 38.33 H new ATOM 4072 N VAL D 98 -13.116 -6.064 -4.363 1.00 25.11 N ATOM 4073 CA VAL D 98 -12.375 -5.790 -3.129 1.00 22.42 C ATOM 4074 C VAL D 98 -10.885 -5.658 -3.451 1.00 22.45 C ATOM 4075 O VAL D 98 -10.263 -6.609 -3.935 1.00 20.91 O ATOM 4076 CB VAL D 98 -12.592 -6.869 -2.026 1.00 21.90 C ATOM 4077 CG1 VAL D 98 -11.687 -6.548 -0.813 1.00 16.75 C ATOM 4078 CG2 VAL D 98 -14.038 -6.936 -1.633 1.00 20.74 C ATOM 0 H VAL D 98 -13.298 -6.892 -4.505 1.00 25.11 H new ATOM 0 HA VAL D 98 -12.720 -4.958 -2.768 1.00 22.42 H new ATOM 0 HB VAL D 98 -12.347 -7.742 -2.371 1.00 21.90 H new ATOM 0 HG11 VAL D 98 -11.819 -7.218 -0.124 1.00 16.75 H new ATOM 0 HG12 VAL D 98 -10.758 -6.551 -1.092 1.00 16.75 H new ATOM 0 HG13 VAL D 98 -11.915 -5.673 -0.461 1.00 16.75 H new ATOM 0 HG21 VAL D 98 -14.156 -7.611 -0.947 1.00 20.74 H new ATOM 0 HG22 VAL D 98 -14.321 -6.074 -1.290 1.00 20.74 H new ATOM 0 HG23 VAL D 98 -14.574 -7.166 -2.408 1.00 20.74 H new ATOM 4079 N ASP D 99 -10.310 -4.487 -3.175 1.00 21.45 N ATOM 4080 CA ASP D 99 -8.905 -4.315 -3.464 1.00 22.09 C ATOM 4081 C ASP D 99 -8.086 -5.301 -2.615 1.00 21.34 C ATOM 4082 O ASP D 99 -8.398 -5.500 -1.469 1.00 22.07 O ATOM 4083 CB ASP D 99 -8.428 -2.865 -3.227 1.00 21.43 C ATOM 4084 CG ASP D 99 -7.002 -2.679 -3.651 1.00 23.93 C ATOM 4085 OD1 ASP D 99 -6.796 -2.451 -4.860 1.00 22.43 O ATOM 4086 OD2 ASP D 99 -6.082 -2.821 -2.799 1.00 25.53 O ATOM 0 H ASP D 99 -10.707 -3.806 -2.832 1.00 21.45 H new ATOM 0 HA ASP D 99 -8.769 -4.501 -4.406 1.00 22.09 H new ATOM 0 HB2 ASP D 99 -8.996 -2.252 -3.720 1.00 21.43 H new ATOM 0 HB3 ASP D 99 -8.519 -2.643 -2.287 1.00 21.43 H new ATOM 4087 N PRO D 100 -7.077 -5.957 -3.200 1.00 21.86 N ATOM 4088 CA PRO D 100 -6.269 -7.002 -2.547 1.00 22.52 C ATOM 4089 C PRO D 100 -5.607 -6.582 -1.268 1.00 21.23 C ATOM 4090 O PRO D 100 -5.340 -7.410 -0.407 1.00 20.37 O ATOM 4091 CB PRO D 100 -5.169 -7.275 -3.564 1.00 22.90 C ATOM 4092 CG PRO D 100 -5.795 -7.016 -4.839 1.00 24.88 C ATOM 4093 CD PRO D 100 -6.731 -5.842 -4.630 1.00 23.50 C ATOM 0 HA PRO D 100 -6.838 -7.751 -2.308 1.00 22.52 H new ATOM 0 HB2 PRO D 100 -4.403 -6.697 -3.421 1.00 22.90 H new ATOM 0 HB3 PRO D 100 -4.850 -8.189 -3.505 1.00 22.90 H new ATOM 0 HG2 PRO D 100 -5.130 -6.811 -5.515 1.00 24.88 H new ATOM 0 HG3 PRO D 100 -6.283 -7.795 -5.149 1.00 24.88 H new ATOM 0 HD2 PRO D 100 -6.300 -4.997 -4.830 1.00 23.50 H new ATOM 0 HD3 PRO D 100 -7.516 -5.901 -5.197 1.00 23.50 H new ATOM 4094 N GLU D 101 -5.299 -5.303 -1.155 1.00 20.72 N ATOM 4095 CA GLU D 101 -4.641 -4.828 0.067 1.00 20.94 C ATOM 4096 C GLU D 101 -5.566 -5.079 1.297 1.00 18.19 C ATOM 4097 O GLU D 101 -5.095 -5.353 2.388 1.00 17.98 O ATOM 4098 CB GLU D 101 -4.251 -3.360 -0.104 1.00 22.46 C ATOM 4099 CG GLU D 101 -4.217 -2.544 1.173 1.00 28.86 C ATOM 4100 CD GLU D 101 -2.896 -2.682 1.927 1.00 39.52 C ATOM 4101 OE1 GLU D 101 -2.036 -3.512 1.498 1.00 42.39 O ATOM 4102 OE2 GLU D 101 -2.715 -1.950 2.952 1.00 43.02 O ATOM 0 H GLU D 101 -5.453 -4.702 -1.751 1.00 20.72 H new ATOM 0 HA GLU D 101 -3.823 -5.323 0.229 1.00 20.94 H new ATOM 0 HB2 GLU D 101 -3.375 -3.320 -0.519 1.00 22.46 H new ATOM 0 HB3 GLU D 101 -4.876 -2.945 -0.719 1.00 22.46 H new ATOM 0 HG2 GLU D 101 -4.367 -1.610 0.959 1.00 28.86 H new ATOM 0 HG3 GLU D 101 -4.945 -2.823 1.750 1.00 28.86 H new ATOM 4103 N ASN D 102 -6.880 -5.067 1.096 1.00 17.25 N ATOM 4104 CA ASN D 102 -7.831 -5.382 2.197 1.00 15.73 C ATOM 4105 C ASN D 102 -7.773 -6.848 2.652 1.00 15.59 C ATOM 4106 O ASN D 102 -8.104 -7.154 3.837 1.00 14.93 O ATOM 4107 CB ASN D 102 -9.247 -5.016 1.796 1.00 15.27 C ATOM 4108 CG ASN D 102 -9.409 -3.551 1.549 1.00 17.34 C ATOM 4109 OD1 ASN D 102 -9.183 -2.692 2.459 1.00 18.97 O ATOM 4110 ND2 ASN D 102 -9.799 -3.218 0.329 1.00 17.02 N ATOM 0 H ASN D 102 -7.252 -4.883 0.343 1.00 17.25 H new ATOM 0 HA ASN D 102 -7.555 -4.844 2.956 1.00 15.73 H new ATOM 0 HB2 ASN D 102 -9.490 -5.505 0.995 1.00 15.27 H new ATOM 0 HB3 ASN D 102 -9.860 -5.293 2.495 1.00 15.27 H new ATOM 0 HD21 ASN D 102 -9.910 -2.390 0.124 1.00 17.02 H new ATOM 0 HD22 ASN D 102 -9.942 -3.829 -0.259 1.00 17.02 H new ATOM 4111 N PHE D 103 -7.371 -7.768 1.755 1.00 15.59 N ATOM 4112 CA PHE D 103 -7.177 -9.142 2.190 1.00 15.16 C ATOM 4113 C PHE D 103 -5.988 -9.199 3.173 1.00 16.05 C ATOM 4114 O PHE D 103 -6.026 -9.932 4.146 1.00 15.03 O ATOM 4115 CB PHE D 103 -6.921 -10.090 1.012 1.00 16.05 C ATOM 4116 CG PHE D 103 -7.993 -10.058 -0.047 1.00 18.11 C ATOM 4117 CD1 PHE D 103 -9.343 -10.026 0.303 1.00 22.10 C ATOM 4118 CD2 PHE D 103 -7.651 -10.101 -1.370 1.00 20.18 C ATOM 4119 CE1 PHE D 103 -10.335 -9.989 -0.672 1.00 24.00 C ATOM 4120 CE2 PHE D 103 -8.616 -10.081 -2.348 1.00 22.97 C ATOM 4121 CZ PHE D 103 -9.966 -10.043 -1.991 1.00 21.07 C ATOM 0 H PHE D 103 -7.213 -7.615 0.924 1.00 15.59 H new ATOM 0 HA PHE D 103 -7.992 -9.436 2.627 1.00 15.16 H new ATOM 0 HB2 PHE D 103 -6.071 -9.862 0.605 1.00 16.05 H new ATOM 0 HB3 PHE D 103 -6.840 -10.996 1.350 1.00 16.05 H new ATOM 0 HD1 PHE D 103 -9.584 -10.029 1.201 1.00 22.10 H new ATOM 0 HD2 PHE D 103 -6.754 -10.144 -1.611 1.00 20.18 H new ATOM 0 HE1 PHE D 103 -11.232 -9.929 -0.433 1.00 24.00 H new ATOM 0 HE2 PHE D 103 -8.371 -10.093 -3.245 1.00 22.97 H new ATOM 0 HZ PHE D 103 -10.619 -10.054 -2.653 1.00 21.07 H new ATOM 4122 N ARG D 104 -4.928 -8.432 2.917 1.00 16.97 N ATOM 4123 CA ARG D 104 -3.788 -8.432 3.820 1.00 17.81 C ATOM 4124 C ARG D 104 -4.153 -7.871 5.206 1.00 17.53 C ATOM 4125 O ARG D 104 -3.667 -8.371 6.224 1.00 17.87 O ATOM 4126 CB ARG D 104 -2.621 -7.610 3.257 1.00 18.22 C ATOM 4127 CG ARG D 104 -1.314 -7.826 4.066 1.00 22.45 C ATOM 4128 CD ARG D 104 -0.826 -6.537 4.805 1.00 35.26 C ATOM 4129 NE ARG D 104 -0.650 -5.382 3.922 1.00 36.16 N ATOM 4130 CZ ARG D 104 -0.606 -4.111 4.339 1.00 38.42 C ATOM 4131 NH1 ARG D 104 -0.705 -3.801 5.637 1.00 34.52 N ATOM 4132 NH2 ARG D 104 -0.467 -3.132 3.442 1.00 39.43 N ATOM 0 H ARG D 104 -4.853 -7.913 2.235 1.00 16.97 H new ATOM 0 HA ARG D 104 -3.520 -9.360 3.910 1.00 17.81 H new ATOM 0 HB2 ARG D 104 -2.471 -7.855 2.331 1.00 18.22 H new ATOM 0 HB3 ARG D 104 -2.855 -6.669 3.267 1.00 18.22 H new ATOM 0 HG2 ARG D 104 -1.456 -8.531 4.717 1.00 22.45 H new ATOM 0 HG3 ARG D 104 -0.616 -8.131 3.466 1.00 22.45 H new ATOM 0 HD2 ARG D 104 -1.466 -6.310 5.498 1.00 35.26 H new ATOM 0 HD3 ARG D 104 0.016 -6.727 5.247 1.00 35.26 H new ATOM 0 HE ARG D 104 -0.569 -5.530 3.079 1.00 36.16 H new ATOM 0 HH11 ARG D 104 -0.799 -4.424 6.222 1.00 34.52 H new ATOM 0 HH12 ARG D 104 -0.675 -2.978 5.886 1.00 34.52 H new ATOM 0 HH21 ARG D 104 -0.407 -3.321 2.605 1.00 39.43 H new ATOM 0 HH22 ARG D 104 -0.438 -2.312 3.701 1.00 39.43 H new ATOM 4133 N LEU D 105 -4.957 -6.827 5.223 1.00 15.48 N ATOM 4134 CA LEU D 105 -5.371 -6.183 6.476 1.00 16.59 C ATOM 4135 C LEU D 105 -6.197 -7.139 7.325 1.00 15.70 C ATOM 4136 O LEU D 105 -6.006 -7.204 8.528 1.00 16.35 O ATOM 4137 CB LEU D 105 -6.184 -4.913 6.179 1.00 16.12 C ATOM 4138 CG LEU D 105 -5.387 -3.729 5.580 1.00 16.40 C ATOM 4139 CD1 LEU D 105 -6.296 -2.588 5.316 1.00 14.90 C ATOM 4140 CD2 LEU D 105 -4.200 -3.243 6.468 1.00 22.25 C ATOM 0 H LEU D 105 -5.284 -6.464 4.515 1.00 15.48 H new ATOM 0 HA LEU D 105 -4.573 -5.940 6.970 1.00 16.59 H new ATOM 0 HB2 LEU D 105 -6.899 -5.143 5.565 1.00 16.12 H new ATOM 0 HB3 LEU D 105 -6.601 -4.616 7.003 1.00 16.12 H new ATOM 0 HG LEU D 105 -4.998 -4.064 4.757 1.00 16.40 H new ATOM 0 HD11 LEU D 105 -5.790 -1.851 4.941 1.00 14.90 H new ATOM 0 HD12 LEU D 105 -6.983 -2.860 4.688 1.00 14.90 H new ATOM 0 HD13 LEU D 105 -6.711 -2.306 6.146 1.00 14.90 H new ATOM 0 HD21 LEU D 105 -3.750 -2.503 6.031 1.00 22.25 H new ATOM 0 HD22 LEU D 105 -4.538 -2.952 7.329 1.00 22.25 H new ATOM 0 HD23 LEU D 105 -3.573 -3.972 6.597 1.00 22.25 H new ATOM 4141 N LEU D 106 -7.111 -7.875 6.703 1.00 14.93 N ATOM 4142 CA LEU D 106 -7.936 -8.826 7.489 1.00 15.97 C ATOM 4143 C LEU D 106 -7.050 -9.971 8.082 1.00 15.31 C ATOM 4144 O LEU D 106 -7.270 -10.413 9.201 1.00 15.47 O ATOM 4145 CB LEU D 106 -9.142 -9.369 6.683 1.00 13.97 C ATOM 4146 CG LEU D 106 -10.052 -10.345 7.422 1.00 15.33 C ATOM 4147 CD1 LEU D 106 -10.543 -9.740 8.782 1.00 21.73 C ATOM 4148 CD2 LEU D 106 -11.231 -10.724 6.554 1.00 17.35 C ATOM 0 H LEU D 106 -7.275 -7.852 5.859 1.00 14.93 H new ATOM 0 HA LEU D 106 -8.317 -8.336 8.234 1.00 15.97 H new ATOM 0 HB2 LEU D 106 -9.677 -8.616 6.387 1.00 13.97 H new ATOM 0 HB3 LEU D 106 -8.805 -9.808 5.886 1.00 13.97 H new ATOM 0 HG LEU D 106 -9.540 -11.145 7.619 1.00 15.33 H new ATOM 0 HD11 LEU D 106 -11.119 -10.378 9.231 1.00 21.73 H new ATOM 0 HD12 LEU D 106 -9.777 -9.544 9.344 1.00 21.73 H new ATOM 0 HD13 LEU D 106 -11.037 -8.923 8.613 1.00 21.73 H new ATOM 0 HD21 LEU D 106 -11.801 -11.344 7.035 1.00 17.35 H new ATOM 0 HD22 LEU D 106 -11.737 -9.928 6.330 1.00 17.35 H new ATOM 0 HD23 LEU D 106 -10.912 -11.144 5.740 1.00 17.35 H new ATOM 4149 N GLY D 107 -6.072 -10.447 7.299 1.00 16.07 N ATOM 4150 CA GLY D 107 -5.082 -11.446 7.788 1.00 16.21 C ATOM 4151 C GLY D 107 -4.324 -10.893 8.992 1.00 16.34 C ATOM 4152 O GLY D 107 -4.140 -11.578 9.966 1.00 17.09 O ATOM 0 H GLY D 107 -5.958 -10.209 6.480 1.00 16.07 H new ATOM 0 HA2 GLY D 107 -5.536 -12.268 8.033 1.00 16.21 H new ATOM 0 HA3 GLY D 107 -4.458 -11.667 7.079 1.00 16.21 H new ATOM 4153 N ASN D 108 -3.875 -9.649 8.932 1.00 15.14 N ATOM 4154 CA ASN D 108 -3.102 -9.115 10.057 1.00 15.06 C ATOM 4155 C ASN D 108 -3.962 -8.906 11.312 1.00 14.01 C ATOM 4156 O ASN D 108 -3.531 -9.187 12.427 1.00 14.75 O ATOM 4157 CB ASN D 108 -2.346 -7.852 9.635 1.00 14.35 C ATOM 4158 CG ASN D 108 -1.054 -8.179 8.918 1.00 18.68 C ATOM 4159 OD1 ASN D 108 -0.559 -9.331 8.934 1.00 18.28 O ATOM 4160 ND2 ASN D 108 -0.503 -7.178 8.277 1.00 22.20 N ATOM 0 H ASN D 108 -3.998 -9.108 8.275 1.00 15.14 H new ATOM 0 HA ASN D 108 -2.441 -9.779 10.308 1.00 15.06 H new ATOM 0 HB2 ASN D 108 -2.910 -7.317 9.055 1.00 14.35 H new ATOM 0 HB3 ASN D 108 -2.153 -7.314 10.419 1.00 14.35 H new ATOM 0 HD21 ASN D 108 0.230 -7.297 7.843 1.00 22.20 H new ATOM 0 HD22 ASN D 108 -0.874 -6.402 8.290 1.00 22.20 H new ATOM 4161 N VAL D 109 -5.187 -8.445 11.104 1.00 12.96 N ATOM 4162 CA VAL D 109 -6.157 -8.295 12.211 1.00 14.38 C ATOM 4163 C VAL D 109 -6.414 -9.651 12.860 1.00 13.52 C ATOM 4164 O VAL D 109 -6.476 -9.695 14.056 1.00 13.67 O ATOM 4165 CB VAL D 109 -7.455 -7.619 11.750 1.00 14.37 C ATOM 4166 CG1 VAL D 109 -8.556 -7.632 12.882 1.00 15.70 C ATOM 4167 CG2 VAL D 109 -7.133 -6.179 11.340 1.00 14.09 C ATOM 0 H VAL D 109 -5.488 -8.210 10.333 1.00 12.96 H new ATOM 0 HA VAL D 109 -5.773 -7.706 12.879 1.00 14.38 H new ATOM 0 HB VAL D 109 -7.816 -8.113 10.997 1.00 14.37 H new ATOM 0 HG11 VAL D 109 -9.360 -7.198 12.557 1.00 15.70 H new ATOM 0 HG12 VAL D 109 -8.760 -8.549 13.125 1.00 15.70 H new ATOM 0 HG13 VAL D 109 -8.225 -7.157 13.661 1.00 15.70 H new ATOM 0 HG21 VAL D 109 -7.945 -5.737 11.045 1.00 14.09 H new ATOM 0 HG22 VAL D 109 -6.762 -5.702 12.099 1.00 14.09 H new ATOM 0 HG23 VAL D 109 -6.488 -6.185 10.616 1.00 14.09 H new ATOM 4168 N LEU D 110 -6.572 -10.729 12.079 1.00 12.46 N ATOM 4169 CA LEU D 110 -6.734 -12.059 12.653 1.00 13.19 C ATOM 4170 C LEU D 110 -5.507 -12.412 13.483 1.00 12.80 C ATOM 4171 O LEU D 110 -5.644 -12.995 14.549 1.00 13.01 O ATOM 4172 CB LEU D 110 -6.892 -13.114 11.571 1.00 12.38 C ATOM 4173 CG LEU D 110 -6.963 -14.556 12.083 1.00 15.67 C ATOM 4174 CD1 LEU D 110 -8.102 -14.734 13.107 1.00 18.51 C ATOM 4175 CD2 LEU D 110 -7.112 -15.604 10.932 1.00 12.79 C ATOM 0 H LEU D 110 -6.587 -10.705 11.219 1.00 12.46 H new ATOM 0 HA LEU D 110 -7.532 -12.046 13.204 1.00 13.19 H new ATOM 0 HB2 LEU D 110 -7.698 -12.923 11.067 1.00 12.38 H new ATOM 0 HB3 LEU D 110 -6.147 -13.040 10.954 1.00 12.38 H new ATOM 0 HG LEU D 110 -6.114 -14.724 12.521 1.00 15.67 H new ATOM 0 HD11 LEU D 110 -8.122 -15.654 13.412 1.00 18.51 H new ATOM 0 HD12 LEU D 110 -7.952 -14.146 13.864 1.00 18.51 H new ATOM 0 HD13 LEU D 110 -8.950 -14.514 12.690 1.00 18.51 H new ATOM 0 HD21 LEU D 110 -7.152 -16.496 11.310 1.00 12.79 H new ATOM 0 HD22 LEU D 110 -7.926 -15.427 10.436 1.00 12.79 H new ATOM 0 HD23 LEU D 110 -6.350 -15.540 10.335 1.00 12.79 H new ATOM 4176 N VAL D 111 -4.304 -12.062 13.012 1.00 12.72 N ATOM 4177 CA VAL D 111 -3.114 -12.315 13.864 1.00 11.95 C ATOM 4178 C VAL D 111 -3.200 -11.494 15.153 1.00 12.21 C ATOM 4179 O VAL D 111 -2.834 -12.003 16.186 1.00 13.63 O ATOM 4180 CB VAL D 111 -1.812 -12.097 13.126 1.00 13.04 C ATOM 4181 CG1 VAL D 111 -0.624 -12.159 14.080 1.00 9.31 C ATOM 4182 CG2 VAL D 111 -1.683 -13.198 12.032 1.00 14.75 C ATOM 0 H VAL D 111 -4.151 -11.697 12.248 1.00 12.72 H new ATOM 0 HA VAL D 111 -3.118 -13.254 14.106 1.00 11.95 H new ATOM 0 HB VAL D 111 -1.813 -11.216 12.720 1.00 13.04 H new ATOM 0 HG11 VAL D 111 0.197 -12.017 13.584 1.00 9.31 H new ATOM 0 HG12 VAL D 111 -0.716 -11.470 14.757 1.00 9.31 H new ATOM 0 HG13 VAL D 111 -0.597 -13.030 14.507 1.00 9.31 H new ATOM 0 HG21 VAL D 111 -0.853 -13.076 11.546 1.00 14.75 H new ATOM 0 HG22 VAL D 111 -1.686 -14.073 12.451 1.00 14.75 H new ATOM 0 HG23 VAL D 111 -2.430 -13.132 11.417 1.00 14.75 H new ATOM 4183 N ILE D 112 -3.754 -10.269 15.113 1.00 12.06 N ATOM 4184 CA ILE D 112 -3.824 -9.444 16.343 1.00 13.54 C ATOM 4185 C ILE D 112 -4.746 -10.140 17.343 1.00 14.18 C ATOM 4186 O ILE D 112 -4.455 -10.202 18.559 1.00 15.18 O ATOM 4187 CB ILE D 112 -4.302 -7.966 16.081 1.00 13.15 C ATOM 4188 CG1 ILE D 112 -3.309 -7.259 15.177 1.00 15.71 C ATOM 4189 CG2 ILE D 112 -4.522 -7.149 17.392 1.00 12.41 C ATOM 4190 CD1 ILE D 112 -2.019 -7.044 15.771 1.00 23.23 C ATOM 0 H ILE D 112 -4.086 -9.904 14.409 1.00 12.06 H new ATOM 0 HA ILE D 112 -2.925 -9.367 16.700 1.00 13.54 H new ATOM 0 HB ILE D 112 -5.167 -8.020 15.646 1.00 13.15 H new ATOM 0 HG12 ILE D 112 -3.198 -7.780 14.366 1.00 15.71 H new ATOM 0 HG13 ILE D 112 -3.680 -6.402 14.915 1.00 15.71 H new ATOM 0 HG21 ILE D 112 -4.814 -6.251 17.169 1.00 12.41 H new ATOM 0 HG22 ILE D 112 -5.199 -7.583 17.935 1.00 12.41 H new ATOM 0 HG23 ILE D 112 -3.690 -7.104 17.889 1.00 12.41 H new ATOM 0 HD11 ILE D 112 -1.442 -6.590 15.137 1.00 23.23 H new ATOM 0 HD12 ILE D 112 -2.116 -6.499 16.567 1.00 23.23 H new ATOM 0 HD13 ILE D 112 -1.626 -7.898 16.011 1.00 23.23 H new ATOM 4191 N VAL D 113 -5.858 -10.637 16.817 1.00 14.09 N ATOM 4192 CA VAL D 113 -6.913 -11.245 17.623 1.00 13.87 C ATOM 4193 C VAL D 113 -6.388 -12.543 18.234 1.00 13.05 C ATOM 4194 O VAL D 113 -6.599 -12.777 19.422 1.00 12.66 O ATOM 4195 CB VAL D 113 -8.234 -11.461 16.834 1.00 12.69 C ATOM 4196 CG1 VAL D 113 -9.223 -12.329 17.646 1.00 14.72 C ATOM 4197 CG2 VAL D 113 -8.833 -10.096 16.397 1.00 14.46 C ATOM 0 H VAL D 113 -6.025 -10.632 15.973 1.00 14.09 H new ATOM 0 HA VAL D 113 -7.146 -10.628 18.334 1.00 13.87 H new ATOM 0 HB VAL D 113 -8.045 -11.955 16.021 1.00 12.69 H new ATOM 0 HG11 VAL D 113 -10.040 -12.452 17.137 1.00 14.72 H new ATOM 0 HG12 VAL D 113 -8.822 -13.194 17.827 1.00 14.72 H new ATOM 0 HG13 VAL D 113 -9.429 -11.887 18.485 1.00 14.72 H new ATOM 0 HG21 VAL D 113 -9.656 -10.246 15.906 1.00 14.46 H new ATOM 0 HG22 VAL D 113 -9.019 -9.558 17.182 1.00 14.46 H new ATOM 0 HG23 VAL D 113 -8.199 -9.631 15.829 1.00 14.46 H new ATOM 4198 N LEU D 114 -5.675 -13.367 17.460 1.00 12.96 N ATOM 4199 CA LEU D 114 -5.036 -14.536 18.073 1.00 13.70 C ATOM 4200 C LEU D 114 -4.117 -14.129 19.259 1.00 13.52 C ATOM 4201 O LEU D 114 -4.116 -14.781 20.311 1.00 14.74 O ATOM 4202 CB LEU D 114 -4.238 -15.361 17.055 1.00 11.74 C ATOM 4203 CG LEU D 114 -5.038 -16.027 15.916 1.00 11.18 C ATOM 4204 CD1 LEU D 114 -4.161 -16.784 14.968 1.00 15.79 C ATOM 4205 CD2 LEU D 114 -6.162 -16.937 16.397 1.00 16.82 C ATOM 0 H LEU D 114 -5.552 -13.274 16.614 1.00 12.96 H new ATOM 0 HA LEU D 114 -5.755 -15.091 18.412 1.00 13.70 H new ATOM 0 HB2 LEU D 114 -3.569 -14.783 16.656 1.00 11.74 H new ATOM 0 HB3 LEU D 114 -3.762 -16.056 17.536 1.00 11.74 H new ATOM 0 HG LEU D 114 -5.446 -15.281 15.449 1.00 11.18 H new ATOM 0 HD11 LEU D 114 -4.706 -17.184 14.272 1.00 15.79 H new ATOM 0 HD12 LEU D 114 -3.518 -16.178 14.567 1.00 15.79 H new ATOM 0 HD13 LEU D 114 -3.690 -17.482 15.450 1.00 15.79 H new ATOM 0 HD21 LEU D 114 -6.619 -17.319 15.632 1.00 16.82 H new ATOM 0 HD22 LEU D 114 -5.791 -17.650 16.941 1.00 16.82 H new ATOM 0 HD23 LEU D 114 -6.792 -16.422 16.925 1.00 16.82 H new ATOM 4206 N SER D 115 -3.292 -13.111 19.069 1.00 14.35 N ATOM 4207 CA SER D 115 -2.400 -12.656 20.146 1.00 13.82 C ATOM 4208 C SER D 115 -3.239 -12.222 21.358 1.00 13.31 C ATOM 4209 O SER D 115 -2.947 -12.579 22.526 1.00 13.70 O ATOM 4210 CB SER D 115 -1.523 -11.511 19.655 1.00 14.40 C ATOM 4211 OG SER D 115 -0.536 -11.193 20.608 1.00 16.40 O ATOM 0 H SER D 115 -3.227 -12.668 18.335 1.00 14.35 H new ATOM 0 HA SER D 115 -1.819 -13.385 20.414 1.00 13.82 H new ATOM 0 HB2 SER D 115 -1.102 -11.757 18.817 1.00 14.40 H new ATOM 0 HB3 SER D 115 -2.071 -10.731 19.478 1.00 14.40 H new ATOM 0 HG SER D 115 -0.355 -10.374 20.561 1.00 16.40 H new ATOM 4212 N HIS D 116 -4.309 -11.486 21.077 1.00 13.91 N ATOM 4213 CA HIS D 116 -5.196 -10.941 22.134 1.00 15.51 C ATOM 4214 C HIS D 116 -5.782 -12.118 22.959 1.00 16.12 C ATOM 4215 O HIS D 116 -5.850 -12.094 24.209 1.00 14.48 O ATOM 4216 CB HIS D 116 -6.367 -10.161 21.487 1.00 16.34 C ATOM 4217 CG HIS D 116 -7.300 -9.498 22.469 1.00 18.98 C ATOM 4218 ND1 HIS D 116 -8.550 -9.813 22.872 1.00 24.53 N flip ATOM 4219 CD2 HIS D 116 -6.965 -8.343 23.152 1.00 23.72 C flip ATOM 4220 CE1 HIS D 116 -8.947 -8.843 23.774 1.00 22.87 C flip ATOM 4221 NE2 HIS D 116 -7.972 -7.976 23.926 1.00 26.03 N flip ATOM 0 H HIS D 116 -4.550 -11.283 20.277 1.00 13.91 H new ATOM 0 HA HIS D 116 -4.684 -10.347 22.706 1.00 15.51 H new ATOM 0 HB2 HIS D 116 -6.001 -9.483 20.898 1.00 16.34 H new ATOM 0 HB3 HIS D 116 -6.879 -10.771 20.934 1.00 16.34 H new ATOM 0 HD2 HIS D 116 -6.155 -7.893 23.078 1.00 23.72 H new ATOM 0 HE1 HIS D 116 -9.771 -8.810 24.204 1.00 22.87 H new ATOM 0 HE2 HIS D 116 -7.986 -7.287 24.441 1.00 26.03 H new ATOM 4222 N HIS D 117 -6.226 -13.149 22.252 1.00 16.64 N ATOM 4223 CA HIS D 117 -6.888 -14.263 22.908 1.00 18.08 C ATOM 4224 C HIS D 117 -5.957 -15.163 23.682 1.00 16.71 C ATOM 4225 O HIS D 117 -6.314 -15.644 24.764 1.00 15.21 O ATOM 4226 CB HIS D 117 -7.682 -15.127 21.895 1.00 19.56 C ATOM 4227 CG HIS D 117 -9.080 -14.653 21.693 1.00 28.42 C ATOM 4228 ND1 HIS D 117 -10.176 -15.403 22.076 1.00 33.98 N ATOM 4229 CD2 HIS D 117 -9.565 -13.475 21.223 1.00 32.86 C ATOM 4230 CE1 HIS D 117 -11.281 -14.719 21.810 1.00 34.21 C ATOM 4231 NE2 HIS D 117 -10.939 -13.545 21.294 1.00 33.92 N ATOM 0 H HIS D 117 -6.154 -13.222 21.398 1.00 16.64 H new ATOM 0 HA HIS D 117 -7.491 -13.847 23.544 1.00 18.08 H new ATOM 0 HB2 HIS D 117 -7.219 -15.124 21.043 1.00 19.56 H new ATOM 0 HB3 HIS D 117 -7.699 -16.046 22.205 1.00 19.56 H new ATOM 0 HD2 HIS D 117 -9.064 -12.756 20.912 1.00 32.86 H new ATOM 0 HE1 HIS D 117 -12.150 -15.013 21.960 1.00 34.21 H new ATOM 0 HE2 HIS D 117 -11.485 -12.929 21.045 1.00 33.92 H new ATOM 4232 N PHE D 118 -4.790 -15.441 23.108 1.00 16.39 N ATOM 4233 CA PHE D 118 -3.915 -16.551 23.597 1.00 15.09 C ATOM 4234 C PHE D 118 -2.780 -16.155 24.501 1.00 16.76 C ATOM 4235 O PHE D 118 -2.228 -17.019 25.207 1.00 17.90 O ATOM 4236 CB PHE D 118 -3.367 -17.360 22.419 1.00 15.79 C ATOM 4237 CG PHE D 118 -4.385 -18.348 21.861 1.00 16.21 C ATOM 4238 CD1 PHE D 118 -4.745 -19.477 22.588 1.00 18.59 C ATOM 4239 CD2 PHE D 118 -5.035 -18.093 20.661 1.00 17.67 C ATOM 4240 CE1 PHE D 118 -5.717 -20.393 22.101 1.00 19.54 C ATOM 4241 CE2 PHE D 118 -6.014 -18.988 20.149 1.00 20.50 C ATOM 4242 CZ PHE D 118 -6.348 -20.149 20.880 1.00 19.45 C ATOM 0 H PHE D 118 -4.472 -15.010 22.435 1.00 16.39 H new ATOM 0 HA PHE D 118 -4.505 -17.085 24.152 1.00 15.09 H new ATOM 0 HB2 PHE D 118 -3.091 -16.753 21.715 1.00 15.79 H new ATOM 0 HB3 PHE D 118 -2.575 -17.843 22.703 1.00 15.79 H new ATOM 0 HD1 PHE D 118 -4.341 -19.636 23.411 1.00 18.59 H new ATOM 0 HD2 PHE D 118 -4.826 -17.323 20.183 1.00 17.67 H new ATOM 0 HE1 PHE D 118 -5.932 -21.152 22.594 1.00 19.54 H new ATOM 0 HE2 PHE D 118 -6.432 -18.810 19.338 1.00 20.50 H new ATOM 0 HZ PHE D 118 -6.982 -20.745 20.551 1.00 19.45 H new ATOM 4243 N GLY D 119 -2.434 -14.866 24.494 1.00 16.72 N ATOM 4244 CA GLY D 119 -1.377 -14.311 25.366 1.00 16.96 C ATOM 4245 C GLY D 119 -0.070 -14.977 25.037 1.00 17.62 C ATOM 4246 O GLY D 119 0.241 -15.188 23.853 1.00 15.25 O ATOM 0 H GLY D 119 -2.804 -14.281 23.983 1.00 16.72 H new ATOM 0 HA2 GLY D 119 -1.306 -13.352 25.237 1.00 16.96 H new ATOM 0 HA3 GLY D 119 -1.602 -14.456 26.298 1.00 16.96 H new ATOM 4247 N LYS D 120 0.642 -15.377 26.094 1.00 17.09 N ATOM 4248 CA LYS D 120 2.004 -15.931 26.068 1.00 18.97 C ATOM 4249 C LYS D 120 2.177 -17.094 25.099 1.00 16.75 C ATOM 4250 O LYS D 120 3.230 -17.239 24.429 1.00 17.72 O ATOM 4251 CB LYS D 120 2.306 -16.456 27.487 1.00 20.01 C ATOM 4252 CG LYS D 120 3.676 -16.150 28.021 1.00 25.70 C ATOM 4253 CD LYS D 120 3.808 -16.568 29.464 1.00 27.06 C ATOM 4254 CE LYS D 120 3.347 -15.456 30.415 1.00 33.93 C ATOM 4255 NZ LYS D 120 3.312 -15.957 31.822 1.00 34.98 N ATOM 0 H LYS D 120 0.326 -15.330 26.892 1.00 17.09 H new ATOM 0 HA LYS D 120 2.602 -15.226 25.776 1.00 18.97 H new ATOM 0 HB2 LYS D 120 1.650 -16.085 28.097 1.00 20.01 H new ATOM 0 HB3 LYS D 120 2.184 -17.418 27.490 1.00 20.01 H new ATOM 0 HG2 LYS D 120 4.343 -16.609 27.487 1.00 25.70 H new ATOM 0 HG3 LYS D 120 3.852 -15.200 27.940 1.00 25.70 H new ATOM 0 HD2 LYS D 120 3.282 -17.368 29.620 1.00 27.06 H new ATOM 0 HD3 LYS D 120 4.732 -16.795 29.653 1.00 27.06 H new ATOM 0 HE2 LYS D 120 3.948 -14.697 30.350 1.00 33.93 H new ATOM 0 HE3 LYS D 120 2.466 -15.144 30.154 1.00 33.93 H new ATOM 0 HZ1 LYS D 120 3.630 -15.331 32.368 1.00 34.98 H new ATOM 0 HZ2 LYS D 120 2.473 -16.149 32.048 1.00 34.98 H new ATOM 0 HZ3 LYS D 120 3.812 -16.690 31.889 1.00 34.98 H new ATOM 4256 N GLU D 121 1.138 -17.907 25.011 1.00 15.54 N ATOM 4257 CA GLU D 121 1.132 -19.052 24.105 1.00 15.57 C ATOM 4258 C GLU D 121 1.372 -18.646 22.623 1.00 16.33 C ATOM 4259 O GLU D 121 1.962 -19.429 21.822 1.00 15.83 O ATOM 4260 CB GLU D 121 -0.180 -19.864 24.300 1.00 15.76 C ATOM 4261 CG GLU D 121 -0.383 -20.966 23.293 1.00 13.95 C ATOM 4262 CD GLU D 121 -1.545 -21.839 23.650 1.00 17.92 C ATOM 4263 OE1 GLU D 121 -2.352 -21.389 24.507 1.00 16.83 O ATOM 4264 OE2 GLU D 121 -1.638 -23.004 23.127 1.00 13.86 O ATOM 0 H GLU D 121 0.417 -17.815 25.471 1.00 15.54 H new ATOM 0 HA GLU D 121 1.882 -19.624 24.332 1.00 15.57 H new ATOM 0 HB2 GLU D 121 -0.180 -20.250 25.190 1.00 15.76 H new ATOM 0 HB3 GLU D 121 -0.934 -19.256 24.254 1.00 15.76 H new ATOM 0 HG2 GLU D 121 -0.527 -20.579 22.415 1.00 13.95 H new ATOM 0 HG3 GLU D 121 0.421 -21.505 23.237 1.00 13.95 H new ATOM 4265 N PHE D 122 0.887 -17.452 22.234 1.00 15.75 N ATOM 4266 CA PHE D 122 1.149 -16.969 20.864 1.00 16.05 C ATOM 4267 C PHE D 122 2.562 -16.394 20.817 1.00 15.55 C ATOM 4268 O PHE D 122 2.738 -15.188 20.806 1.00 15.99 O ATOM 4269 CB PHE D 122 0.077 -15.936 20.415 1.00 16.30 C ATOM 4270 CG PHE D 122 -0.027 -15.766 18.924 1.00 17.56 C ATOM 4271 CD1 PHE D 122 -0.513 -16.796 18.117 1.00 19.02 C ATOM 4272 CD2 PHE D 122 0.368 -14.569 18.323 1.00 15.11 C ATOM 4273 CE1 PHE D 122 -0.606 -16.629 16.741 1.00 18.34 C ATOM 4274 CE2 PHE D 122 0.226 -14.371 16.950 1.00 13.22 C ATOM 4275 CZ PHE D 122 -0.214 -15.421 16.154 1.00 17.51 C ATOM 0 H PHE D 122 0.421 -16.924 22.728 1.00 15.75 H new ATOM 0 HA PHE D 122 1.088 -17.706 20.236 1.00 16.05 H new ATOM 0 HB2 PHE D 122 -0.787 -16.210 20.760 1.00 16.30 H new ATOM 0 HB3 PHE D 122 0.283 -15.077 20.815 1.00 16.30 H new ATOM 0 HD1 PHE D 122 -0.776 -17.600 18.503 1.00 19.02 H new ATOM 0 HD2 PHE D 122 0.732 -13.893 18.847 1.00 15.11 H new ATOM 0 HE1 PHE D 122 -0.929 -17.321 16.210 1.00 18.34 H new ATOM 0 HE2 PHE D 122 0.424 -13.545 16.571 1.00 13.22 H new ATOM 0 HZ PHE D 122 -0.248 -15.321 15.230 1.00 17.51 H new ATOM 4276 N THR D 123 3.579 -17.266 20.817 1.00 15.86 N ATOM 4277 CA THR D 123 4.974 -16.799 20.877 1.00 16.85 C ATOM 4278 C THR D 123 5.419 -16.122 19.580 1.00 17.22 C ATOM 4279 O THR D 123 4.685 -16.195 18.556 1.00 17.10 O ATOM 4280 CB THR D 123 5.947 -17.942 21.122 1.00 16.67 C ATOM 4281 OG1 THR D 123 5.847 -18.877 20.035 1.00 13.80 O ATOM 4282 CG2 THR D 123 5.689 -18.603 22.501 1.00 18.14 C ATOM 0 H THR D 123 3.486 -18.120 20.783 1.00 15.86 H new ATOM 0 HA THR D 123 4.991 -16.167 21.612 1.00 16.85 H new ATOM 0 HB THR D 123 6.856 -17.604 21.151 1.00 16.67 H new ATOM 0 HG1 THR D 123 6.270 -19.577 20.227 1.00 13.80 H new ATOM 0 HG21 THR D 123 6.320 -19.328 22.636 1.00 18.14 H new ATOM 0 HG22 THR D 123 5.801 -17.943 23.203 1.00 18.14 H new ATOM 0 HG23 THR D 123 4.785 -18.953 22.528 1.00 18.14 H new ATOM 4283 N PRO D 124 6.583 -15.390 19.605 1.00 17.52 N ATOM 4284 CA PRO D 124 7.065 -14.902 18.296 1.00 15.90 C ATOM 4285 C PRO D 124 7.172 -15.984 17.212 1.00 16.00 C ATOM 4286 O PRO D 124 6.946 -15.698 16.025 1.00 14.23 O ATOM 4287 CB PRO D 124 8.439 -14.330 18.622 1.00 16.26 C ATOM 4288 CG PRO D 124 8.306 -13.816 20.052 1.00 16.21 C ATOM 4289 CD PRO D 124 7.433 -14.898 20.717 1.00 17.63 C ATOM 0 HA PRO D 124 6.441 -14.264 17.915 1.00 15.90 H new ATOM 0 HB2 PRO D 124 9.130 -15.008 18.553 1.00 16.26 H new ATOM 0 HB3 PRO D 124 8.679 -13.616 18.011 1.00 16.26 H new ATOM 0 HG2 PRO D 124 9.169 -13.731 20.487 1.00 16.21 H new ATOM 0 HG3 PRO D 124 7.885 -12.943 20.084 1.00 16.21 H new ATOM 0 HD2 PRO D 124 7.973 -15.609 21.096 1.00 17.63 H new ATOM 0 HD3 PRO D 124 6.899 -14.532 21.439 1.00 17.63 H new ATOM 4290 N GLN D 125 7.528 -17.198 17.618 1.00 16.63 N ATOM 4291 CA GLN D 125 7.717 -18.305 16.650 1.00 18.16 C ATOM 4292 C GLN D 125 6.380 -18.771 16.075 1.00 17.53 C ATOM 4293 O GLN D 125 6.279 -19.117 14.898 1.00 17.93 O ATOM 4294 CB GLN D 125 8.458 -19.489 17.292 1.00 18.72 C ATOM 4295 CG GLN D 125 9.940 -19.191 17.626 1.00 23.44 C ATOM 4296 CD GLN D 125 10.161 -18.451 18.969 1.00 28.67 C ATOM 4297 OE1 GLN D 125 9.253 -18.340 19.838 1.00 27.65 O ATOM 4298 NE2 GLN D 125 11.390 -17.955 19.146 1.00 31.98 N ATOM 0 H GLN D 125 7.667 -17.412 18.439 1.00 16.63 H new ATOM 0 HA GLN D 125 8.261 -17.962 15.924 1.00 18.16 H new ATOM 0 HB2 GLN D 125 7.997 -19.745 18.106 1.00 18.72 H new ATOM 0 HB3 GLN D 125 8.417 -20.250 16.691 1.00 18.72 H new ATOM 0 HG2 GLN D 125 10.429 -20.028 17.647 1.00 23.44 H new ATOM 0 HG3 GLN D 125 10.320 -18.658 16.910 1.00 23.44 H new ATOM 0 HE21 GLN D 125 11.984 -18.049 18.532 1.00 31.98 H new ATOM 0 HE22 GLN D 125 11.586 -17.542 19.874 1.00 31.98 H new ATOM 4299 N VAL D 126 5.356 -18.838 16.918 1.00 17.12 N ATOM 4300 CA VAL D 126 4.027 -19.232 16.435 1.00 15.91 C ATOM 4301 C VAL D 126 3.513 -18.133 15.514 1.00 14.48 C ATOM 4302 O VAL D 126 2.968 -18.413 14.447 1.00 15.53 O ATOM 4303 CB VAL D 126 3.069 -19.505 17.616 1.00 16.28 C ATOM 4304 CG1 VAL D 126 1.584 -19.663 17.150 1.00 14.16 C ATOM 4305 CG2 VAL D 126 3.577 -20.795 18.437 1.00 16.04 C ATOM 0 H VAL D 126 5.402 -18.664 17.759 1.00 17.12 H new ATOM 0 HA VAL D 126 4.080 -20.062 15.936 1.00 15.91 H new ATOM 0 HB VAL D 126 3.084 -18.734 18.204 1.00 16.28 H new ATOM 0 HG11 VAL D 126 1.019 -19.833 17.920 1.00 14.16 H new ATOM 0 HG12 VAL D 126 1.294 -18.848 16.710 1.00 14.16 H new ATOM 0 HG13 VAL D 126 1.516 -20.406 16.530 1.00 14.16 H new ATOM 0 HG21 VAL D 126 2.975 -20.965 19.178 1.00 16.04 H new ATOM 0 HG22 VAL D 126 3.593 -21.567 17.850 1.00 16.04 H new ATOM 0 HG23 VAL D 126 4.470 -20.631 18.778 1.00 16.04 H new ATOM 4306 N GLN D 127 3.716 -16.869 15.912 1.00 12.26 N ATOM 4307 CA GLN D 127 3.332 -15.774 15.054 1.00 11.90 C ATOM 4308 C GLN D 127 3.948 -15.878 13.647 1.00 12.97 C ATOM 4309 O GLN D 127 3.290 -15.653 12.626 1.00 11.80 O ATOM 4310 CB GLN D 127 3.699 -14.412 15.675 1.00 11.62 C ATOM 4311 CG GLN D 127 3.296 -13.315 14.685 1.00 12.42 C ATOM 4312 CD GLN D 127 3.699 -11.937 15.150 1.00 16.31 C ATOM 4313 OE1 GLN D 127 4.140 -11.772 16.276 1.00 15.88 O ATOM 4314 NE2 GLN D 127 3.525 -10.938 14.289 1.00 15.39 N ATOM 0 H GLN D 127 4.069 -16.641 16.662 1.00 12.26 H new ATOM 0 HA GLN D 127 2.368 -15.835 14.965 1.00 11.90 H new ATOM 0 HB2 GLN D 127 3.240 -14.290 16.521 1.00 11.62 H new ATOM 0 HB3 GLN D 127 4.650 -14.369 15.860 1.00 11.62 H new ATOM 0 HG2 GLN D 127 3.705 -13.495 13.824 1.00 12.42 H new ATOM 0 HG3 GLN D 127 2.335 -13.340 14.553 1.00 12.42 H new ATOM 0 HE21 GLN D 127 3.211 -11.097 13.504 1.00 15.39 H new ATOM 0 HE22 GLN D 127 3.726 -10.134 14.517 1.00 15.39 H new ATOM 4315 N ALA D 128 5.245 -16.161 13.600 1.00 14.57 N ATOM 4316 CA ALA D 128 5.946 -16.209 12.332 1.00 15.30 C ATOM 4317 C ALA D 128 5.338 -17.230 11.365 1.00 15.62 C ATOM 4318 O ALA D 128 5.195 -16.940 10.155 1.00 16.34 O ATOM 4319 CB ALA D 128 7.476 -16.467 12.573 1.00 15.49 C ATOM 0 H ALA D 128 5.732 -16.327 14.289 1.00 14.57 H new ATOM 0 HA ALA D 128 5.844 -15.345 11.902 1.00 15.30 H new ATOM 0 HB1 ALA D 128 7.937 -16.498 11.720 1.00 15.49 H new ATOM 0 HB2 ALA D 128 7.844 -15.751 13.114 1.00 15.49 H new ATOM 0 HB3 ALA D 128 7.593 -17.312 13.034 1.00 15.49 H new ATOM 4320 N ALA D 129 4.980 -18.409 11.882 1.00 15.30 N ATOM 4321 CA ALA D 129 4.301 -19.396 11.070 1.00 14.17 C ATOM 4322 C ALA D 129 2.901 -18.906 10.620 1.00 14.46 C ATOM 4323 O ALA D 129 2.505 -19.138 9.471 1.00 14.75 O ATOM 4324 CB ALA D 129 4.169 -20.676 11.825 1.00 14.29 C ATOM 0 H ALA D 129 5.124 -18.647 12.696 1.00 15.30 H new ATOM 0 HA ALA D 129 4.836 -19.540 10.274 1.00 14.17 H new ATOM 0 HB1 ALA D 129 3.713 -21.331 11.274 1.00 14.29 H new ATOM 0 HB2 ALA D 129 5.051 -21.007 12.058 1.00 14.29 H new ATOM 0 HB3 ALA D 129 3.657 -20.523 12.635 1.00 14.29 H new ATOM 4325 N TYR D 130 2.153 -18.228 11.492 1.00 13.91 N ATOM 4326 CA TYR D 130 0.848 -17.718 11.073 1.00 15.15 C ATOM 4327 C TYR D 130 0.938 -16.662 9.978 1.00 15.85 C ATOM 4328 O TYR D 130 0.055 -16.617 9.066 1.00 15.13 O ATOM 4329 CB TYR D 130 -0.034 -17.233 12.276 1.00 15.80 C ATOM 4330 CG TYR D 130 -0.917 -18.339 12.817 1.00 17.88 C ATOM 4331 CD1 TYR D 130 -2.178 -18.589 12.249 1.00 20.38 C ATOM 4332 CD2 TYR D 130 -0.480 -19.178 13.823 1.00 19.68 C ATOM 4333 CE1 TYR D 130 -2.984 -19.615 12.718 1.00 21.43 C ATOM 4334 CE2 TYR D 130 -1.282 -20.215 14.301 1.00 20.07 C ATOM 4335 CZ TYR D 130 -2.524 -20.433 13.727 1.00 21.74 C ATOM 4336 OH TYR D 130 -3.326 -21.458 14.194 1.00 22.00 O ATOM 0 H TYR D 130 2.374 -18.057 12.305 1.00 13.91 H new ATOM 0 HA TYR D 130 0.394 -18.481 10.682 1.00 15.15 H new ATOM 0 HB2 TYR D 130 0.541 -16.904 12.985 1.00 15.80 H new ATOM 0 HB3 TYR D 130 -0.587 -16.489 11.991 1.00 15.80 H new ATOM 0 HD1 TYR D 130 -2.477 -18.057 11.547 1.00 20.38 H new ATOM 0 HD2 TYR D 130 0.365 -19.049 14.189 1.00 19.68 H new ATOM 0 HE1 TYR D 130 -3.829 -19.750 12.354 1.00 21.43 H new ATOM 0 HE2 TYR D 130 -0.986 -20.755 14.998 1.00 20.07 H new ATOM 0 HH TYR D 130 -2.874 -22.164 14.250 1.00 22.00 H new ATOM 4337 N GLN D 131 1.964 -15.797 10.059 1.00 15.31 N ATOM 4338 CA GLN D 131 2.199 -14.815 8.967 1.00 15.63 C ATOM 4339 C GLN D 131 2.349 -15.489 7.575 1.00 15.94 C ATOM 4340 O GLN D 131 1.852 -14.974 6.570 1.00 14.08 O ATOM 4341 CB GLN D 131 3.418 -13.923 9.249 1.00 14.78 C ATOM 4342 CG GLN D 131 3.297 -13.107 10.553 1.00 15.39 C ATOM 4343 CD GLN D 131 2.267 -11.984 10.469 1.00 14.57 C ATOM 4344 OE1 GLN D 131 1.950 -11.411 11.612 1.00 17.13 O flip ATOM 4345 NE2 GLN D 131 1.767 -11.633 9.383 1.00 10.92 N flip ATOM 0 H GLN D 131 2.521 -15.757 10.713 1.00 15.31 H new ATOM 0 HA GLN D 131 1.405 -14.258 8.943 1.00 15.63 H new ATOM 0 HB2 GLN D 131 4.212 -14.478 9.296 1.00 14.78 H new ATOM 0 HB3 GLN D 131 3.542 -13.313 8.505 1.00 14.78 H new ATOM 0 HG2 GLN D 131 3.057 -13.704 11.279 1.00 15.39 H new ATOM 0 HG3 GLN D 131 4.163 -12.728 10.771 1.00 15.39 H new ATOM 0 HE21 GLN D 131 1.997 -12.030 8.655 1.00 10.92 H new ATOM 0 HE22 GLN D 131 1.192 -10.994 9.361 1.00 10.92 H new ATOM 4346 N LYS D 132 3.046 -16.628 7.530 1.00 17.94 N ATOM 4347 CA LYS D 132 3.196 -17.382 6.282 1.00 18.87 C ATOM 4348 C LYS D 132 1.842 -17.815 5.844 1.00 18.32 C ATOM 4349 O LYS D 132 1.487 -17.624 4.684 1.00 19.36 O ATOM 4350 CB LYS D 132 4.087 -18.617 6.477 1.00 20.51 C ATOM 4351 CG LYS D 132 5.580 -18.285 6.607 1.00 21.71 C ATOM 4352 CD LYS D 132 6.429 -19.563 6.921 1.00 21.52 C ATOM 4353 CE LYS D 132 7.901 -19.163 7.014 1.00 28.36 C ATOM 4354 NZ LYS D 132 8.857 -20.268 6.605 1.00 31.59 N ATOM 0 H LYS D 132 3.439 -16.980 8.209 1.00 17.94 H new ATOM 0 HA LYS D 132 3.617 -16.816 5.616 1.00 18.87 H new ATOM 0 HB2 LYS D 132 3.799 -19.092 7.272 1.00 20.51 H new ATOM 0 HB3 LYS D 132 3.962 -19.218 5.726 1.00 20.51 H new ATOM 0 HG2 LYS D 132 5.895 -17.880 5.784 1.00 21.71 H new ATOM 0 HG3 LYS D 132 5.707 -17.630 7.311 1.00 21.71 H new ATOM 0 HD2 LYS D 132 6.136 -19.965 7.754 1.00 21.52 H new ATOM 0 HD3 LYS D 132 6.305 -20.228 6.226 1.00 21.52 H new ATOM 0 HE2 LYS D 132 8.054 -18.388 6.451 1.00 28.36 H new ATOM 0 HE3 LYS D 132 8.099 -18.895 7.925 1.00 28.36 H new ATOM 0 HZ1 LYS D 132 9.648 -19.915 6.399 1.00 31.59 H new ATOM 0 HZ2 LYS D 132 8.955 -20.841 7.279 1.00 31.59 H new ATOM 0 HZ3 LYS D 132 8.530 -20.697 5.897 1.00 31.59 H new ATOM 4355 N VAL D 133 1.066 -18.385 6.766 1.00 17.88 N ATOM 4356 CA VAL D 133 -0.324 -18.788 6.475 1.00 18.31 C ATOM 4357 C VAL D 133 -1.262 -17.645 6.003 1.00 17.53 C ATOM 4358 O VAL D 133 -1.945 -17.764 4.947 1.00 16.28 O ATOM 4359 CB VAL D 133 -0.986 -19.506 7.688 1.00 19.26 C ATOM 4360 CG1 VAL D 133 -2.427 -19.869 7.344 1.00 22.25 C ATOM 4361 CG2 VAL D 133 -0.177 -20.773 8.093 1.00 18.65 C ATOM 0 H VAL D 133 1.321 -18.550 7.571 1.00 17.88 H new ATOM 0 HA VAL D 133 -0.226 -19.398 5.727 1.00 18.31 H new ATOM 0 HB VAL D 133 -0.986 -18.903 8.448 1.00 19.26 H new ATOM 0 HG11 VAL D 133 -2.838 -20.316 8.101 1.00 22.25 H new ATOM 0 HG12 VAL D 133 -2.924 -19.062 7.137 1.00 22.25 H new ATOM 0 HG13 VAL D 133 -2.437 -20.460 6.575 1.00 22.25 H new ATOM 0 HG21 VAL D 133 -0.606 -21.203 8.849 1.00 18.65 H new ATOM 0 HG22 VAL D 133 -0.146 -21.390 7.345 1.00 18.65 H new ATOM 0 HG23 VAL D 133 0.726 -20.516 8.338 1.00 18.65 H new ATOM 4362 N VAL D 134 -1.343 -16.532 6.747 1.00 16.54 N ATOM 4363 CA VAL D 134 -2.239 -15.475 6.246 1.00 17.68 C ATOM 4364 C VAL D 134 -1.820 -14.861 4.897 1.00 17.34 C ATOM 4365 O VAL D 134 -2.651 -14.483 4.079 1.00 15.97 O ATOM 4366 CB VAL D 134 -2.584 -14.365 7.331 1.00 18.80 C ATOM 4367 CG1 VAL D 134 -3.294 -15.021 8.560 1.00 17.35 C ATOM 4368 CG2 VAL D 134 -1.330 -13.548 7.685 1.00 15.72 C ATOM 0 H VAL D 134 -0.927 -16.374 7.483 1.00 16.54 H new ATOM 0 HA VAL D 134 -3.066 -15.948 6.063 1.00 17.68 H new ATOM 0 HB VAL D 134 -3.215 -13.725 6.967 1.00 18.80 H new ATOM 0 HG11 VAL D 134 -3.501 -14.338 9.217 1.00 17.35 H new ATOM 0 HG12 VAL D 134 -4.115 -15.449 8.269 1.00 17.35 H new ATOM 0 HG13 VAL D 134 -2.707 -15.684 8.957 1.00 17.35 H new ATOM 0 HG21 VAL D 134 -1.557 -12.876 8.347 1.00 15.72 H new ATOM 0 HG22 VAL D 134 -0.650 -14.139 8.045 1.00 15.72 H new ATOM 0 HG23 VAL D 134 -0.991 -13.113 6.887 1.00 15.72 H new ATOM 4369 N ALA D 135 -0.526 -14.767 4.647 1.00 17.95 N ATOM 4370 CA ALA D 135 -0.064 -14.275 3.364 1.00 17.47 C ATOM 4371 C ALA D 135 -0.475 -15.281 2.256 1.00 18.42 C ATOM 4372 O ALA D 135 -0.870 -14.865 1.160 1.00 18.42 O ATOM 4373 CB ALA D 135 1.493 -14.085 3.379 1.00 17.13 C ATOM 0 H ALA D 135 0.096 -14.981 5.201 1.00 17.95 H new ATOM 0 HA ALA D 135 -0.471 -13.413 3.184 1.00 17.47 H new ATOM 0 HB1 ALA D 135 1.787 -13.756 2.515 1.00 17.13 H new ATOM 0 HB2 ALA D 135 1.735 -13.446 4.068 1.00 17.13 H new ATOM 0 HB3 ALA D 135 1.921 -14.936 3.563 1.00 17.13 H new ATOM 4374 N GLY D 136 -0.356 -16.570 2.532 1.00 19.75 N ATOM 4375 CA GLY D 136 -0.794 -17.636 1.578 1.00 19.63 C ATOM 4376 C GLY D 136 -2.275 -17.474 1.239 1.00 20.26 C ATOM 4377 O GLY D 136 -2.680 -17.502 0.061 1.00 20.00 O ATOM 0 H GLY D 136 -0.024 -16.871 3.266 1.00 19.75 H new ATOM 0 HA2 GLY D 136 -0.264 -17.590 0.767 1.00 19.63 H new ATOM 0 HA3 GLY D 136 -0.640 -18.510 1.968 1.00 19.63 H new ATOM 4378 N VAL D 137 -3.104 -17.256 2.264 1.00 20.16 N ATOM 4379 CA VAL D 137 -4.550 -17.123 2.071 1.00 19.12 C ATOM 4380 C VAL D 137 -4.863 -15.816 1.309 1.00 20.06 C ATOM 4381 O VAL D 137 -5.685 -15.813 0.367 1.00 19.46 O ATOM 4382 CB VAL D 137 -5.303 -17.207 3.437 1.00 20.01 C ATOM 4383 CG1 VAL D 137 -6.779 -16.808 3.339 1.00 17.55 C ATOM 4384 CG2 VAL D 137 -5.255 -18.605 3.933 1.00 19.05 C ATOM 0 H VAL D 137 -2.847 -17.182 3.081 1.00 20.16 H new ATOM 0 HA VAL D 137 -4.869 -17.862 1.530 1.00 19.12 H new ATOM 0 HB VAL D 137 -4.859 -16.586 4.035 1.00 20.01 H new ATOM 0 HG11 VAL D 137 -7.192 -16.879 4.214 1.00 17.55 H new ATOM 0 HG12 VAL D 137 -6.847 -15.893 3.023 1.00 17.55 H new ATOM 0 HG13 VAL D 137 -7.233 -17.398 2.718 1.00 17.55 H new ATOM 0 HG21 VAL D 137 -5.721 -18.664 4.782 1.00 19.05 H new ATOM 0 HG22 VAL D 137 -5.681 -19.192 3.289 1.00 19.05 H new ATOM 0 HG23 VAL D 137 -4.331 -18.874 4.053 1.00 19.05 H new ATOM 4385 N ALA D 138 -4.167 -14.726 1.649 1.00 20.31 N ATOM 4386 CA ALA D 138 -4.418 -13.426 0.990 1.00 21.43 C ATOM 4387 C ALA D 138 -4.097 -13.543 -0.500 1.00 22.16 C ATOM 4388 O ALA D 138 -4.836 -13.031 -1.376 1.00 22.04 O ATOM 4389 CB ALA D 138 -3.541 -12.325 1.619 1.00 20.86 C ATOM 0 H ALA D 138 -3.552 -14.712 2.250 1.00 20.31 H new ATOM 0 HA ALA D 138 -5.351 -13.189 1.109 1.00 21.43 H new ATOM 0 HB1 ALA D 138 -3.716 -11.479 1.177 1.00 20.86 H new ATOM 0 HB2 ALA D 138 -3.749 -12.245 2.563 1.00 20.86 H new ATOM 0 HB3 ALA D 138 -2.605 -12.557 1.513 1.00 20.86 H new ATOM 4390 N ASN D 139 -2.964 -14.189 -0.781 1.00 23.84 N ATOM 4391 CA ASN D 139 -2.500 -14.444 -2.163 1.00 24.92 C ATOM 4392 C ASN D 139 -3.552 -15.227 -2.961 1.00 24.19 C ATOM 4393 O ASN D 139 -3.823 -14.875 -4.102 1.00 23.43 O ATOM 4394 CB ASN D 139 -1.144 -15.201 -2.184 1.00 26.08 C ATOM 4395 CG ASN D 139 0.059 -14.276 -2.010 1.00 31.41 C ATOM 4396 OD1 ASN D 139 -0.030 -13.069 -2.307 1.00 35.49 O ATOM 4397 ND2 ASN D 139 1.199 -14.827 -1.523 1.00 33.08 N ATOM 0 H ASN D 139 -2.435 -14.496 -0.177 1.00 23.84 H new ATOM 0 HA ASN D 139 -2.368 -13.579 -2.583 1.00 24.92 H new ATOM 0 HB2 ASN D 139 -1.139 -15.866 -1.477 1.00 26.08 H new ATOM 0 HB3 ASN D 139 -1.059 -15.679 -3.024 1.00 26.08 H new ATOM 0 HD21 ASN D 139 1.898 -14.339 -1.408 1.00 33.08 H new ATOM 0 HD22 ASN D 139 1.223 -15.664 -1.329 1.00 33.08 H new ATOM 4398 N ALA D 140 -4.135 -16.265 -2.339 1.00 23.54 N ATOM 4399 CA ALA D 140 -5.127 -17.137 -2.979 1.00 23.53 C ATOM 4400 C ALA D 140 -6.409 -16.378 -3.328 1.00 23.49 C ATOM 4401 O ALA D 140 -6.927 -16.499 -4.436 1.00 23.52 O ATOM 4402 CB ALA D 140 -5.449 -18.322 -2.114 1.00 22.52 C ATOM 0 H ALA D 140 -3.961 -16.482 -1.525 1.00 23.54 H new ATOM 0 HA ALA D 140 -4.730 -17.455 -3.805 1.00 23.53 H new ATOM 0 HB1 ALA D 140 -6.105 -18.880 -2.560 1.00 22.52 H new ATOM 0 HB2 ALA D 140 -4.642 -18.836 -1.956 1.00 22.52 H new ATOM 0 HB3 ALA D 140 -5.808 -18.016 -1.266 1.00 22.52 H new ATOM 4403 N LEU D 141 -6.893 -15.570 -2.392 1.00 23.61 N ATOM 4404 CA LEU D 141 -8.010 -14.672 -2.643 1.00 24.17 C ATOM 4405 C LEU D 141 -7.766 -13.663 -3.751 1.00 24.65 C ATOM 4406 O LEU D 141 -8.711 -13.255 -4.418 1.00 25.00 O ATOM 4407 CB LEU D 141 -8.422 -13.935 -1.364 1.00 24.58 C ATOM 4408 CG LEU D 141 -9.691 -14.425 -0.661 1.00 24.68 C ATOM 4409 CD1 LEU D 141 -10.717 -15.045 -1.612 1.00 25.39 C ATOM 4410 CD2 LEU D 141 -9.320 -15.420 0.357 1.00 26.85 C ATOM 0 H LEU D 141 -6.581 -15.528 -1.592 1.00 23.61 H new ATOM 0 HA LEU D 141 -8.729 -15.248 -2.945 1.00 24.17 H new ATOM 0 HB2 LEU D 141 -7.687 -13.990 -0.733 1.00 24.58 H new ATOM 0 HB3 LEU D 141 -8.540 -12.997 -1.581 1.00 24.58 H new ATOM 0 HG LEU D 141 -10.111 -13.646 -0.264 1.00 24.68 H new ATOM 0 HD11 LEU D 141 -11.493 -15.334 -1.107 1.00 25.39 H new ATOM 0 HD12 LEU D 141 -10.987 -14.386 -2.271 1.00 25.39 H new ATOM 0 HD13 LEU D 141 -10.322 -15.808 -2.062 1.00 25.39 H new ATOM 0 HD21 LEU D 141 -10.119 -15.736 0.807 1.00 26.85 H new ATOM 0 HD22 LEU D 141 -8.873 -16.168 -0.069 1.00 26.85 H new ATOM 0 HD23 LEU D 141 -8.723 -15.013 1.005 1.00 26.85 H new ATOM 4411 N ALA D 142 -6.518 -13.218 -3.920 1.00 25.35 N ATOM 4412 CA ALA D 142 -6.181 -12.244 -4.978 1.00 26.11 C ATOM 4413 C ALA D 142 -5.820 -12.866 -6.349 1.00 28.04 C ATOM 4414 O ALA D 142 -5.593 -12.142 -7.297 1.00 27.21 O ATOM 4415 CB ALA D 142 -5.084 -11.300 -4.513 1.00 24.24 C ATOM 0 H ALA D 142 -5.850 -13.464 -3.437 1.00 25.35 H new ATOM 0 HA ALA D 142 -7.000 -11.748 -5.132 1.00 26.11 H new ATOM 0 HB1 ALA D 142 -4.878 -10.670 -5.221 1.00 24.24 H new ATOM 0 HB2 ALA D 142 -5.384 -10.817 -3.727 1.00 24.24 H new ATOM 0 HB3 ALA D 142 -4.289 -11.811 -4.294 1.00 24.24 H new ATOM 4416 N HIS D 143 -5.763 -14.188 -6.487 1.00 30.70 N ATOM 4417 CA HIS D 143 -5.179 -14.694 -7.737 1.00 34.66 C ATOM 4418 C HIS D 143 -5.996 -14.359 -8.999 1.00 35.79 C ATOM 4419 O HIS D 143 -5.424 -14.182 -10.064 1.00 36.09 O ATOM 4420 CB HIS D 143 -4.680 -16.149 -7.661 1.00 35.69 C ATOM 4421 CG HIS D 143 -5.739 -17.183 -7.879 1.00 39.04 C ATOM 4422 ND1 HIS D 143 -6.667 -17.513 -6.912 1.00 42.12 N ATOM 4423 CD2 HIS D 143 -5.993 -17.986 -8.943 1.00 41.67 C ATOM 4424 CE1 HIS D 143 -7.464 -18.461 -7.379 1.00 44.12 C ATOM 4425 NE2 HIS D 143 -7.078 -18.764 -8.611 1.00 43.17 N ATOM 0 H HIS D 143 -6.033 -14.775 -5.919 1.00 30.70 H new ATOM 0 HA HIS D 143 -4.365 -14.178 -7.846 1.00 34.66 H new ATOM 0 HB2 HIS D 143 -3.982 -16.274 -8.322 1.00 35.69 H new ATOM 0 HB3 HIS D 143 -4.276 -16.295 -6.791 1.00 35.69 H new ATOM 0 HD1 HIS D 143 -6.719 -17.159 -6.130 1.00 42.12 H new ATOM 0 HD2 HIS D 143 -5.523 -18.007 -9.745 1.00 41.67 H new ATOM 0 HE1 HIS D 143 -8.174 -18.849 -6.921 1.00 44.12 H new ATOM 4426 N LYS D 144 -7.310 -14.232 -8.860 1.00 38.49 N ATOM 4427 CA LYS D 144 -8.169 -13.830 -9.985 1.00 41.82 C ATOM 4428 C LYS D 144 -7.927 -12.434 -10.507 1.00 43.93 C ATOM 4429 O LYS D 144 -8.331 -12.118 -11.633 1.00 45.34 O ATOM 4430 CB LYS D 144 -9.646 -14.033 -9.683 1.00 41.97 C ATOM 4431 CG LYS D 144 -10.188 -15.340 -10.219 1.00 43.25 C ATOM 4432 CD LYS D 144 -9.268 -16.525 -9.883 1.00 45.21 C ATOM 4433 CE LYS D 144 -9.555 -17.755 -10.767 1.00 46.66 C ATOM 4434 NZ LYS D 144 -10.656 -18.654 -10.249 1.00 46.27 N ATOM 0 H LYS D 144 -7.731 -14.373 -8.124 1.00 38.49 H new ATOM 0 HA LYS D 144 -7.906 -14.430 -10.700 1.00 41.82 H new ATOM 0 HB2 LYS D 144 -9.781 -14.003 -8.723 1.00 41.97 H new ATOM 0 HB3 LYS D 144 -10.152 -13.299 -10.064 1.00 41.97 H new ATOM 0 HG2 LYS D 144 -11.070 -15.500 -9.848 1.00 43.25 H new ATOM 0 HG3 LYS D 144 -10.293 -15.276 -11.181 1.00 43.25 H new ATOM 0 HD2 LYS D 144 -8.343 -16.256 -9.996 1.00 45.21 H new ATOM 0 HD3 LYS D 144 -9.381 -16.766 -8.950 1.00 45.21 H new ATOM 0 HE2 LYS D 144 -9.792 -17.452 -11.657 1.00 46.66 H new ATOM 0 HE3 LYS D 144 -8.741 -18.275 -10.852 1.00 46.66 H new ATOM 0 HZ1 LYS D 144 -10.361 -19.493 -10.211 1.00 46.27 H new ATOM 0 HZ2 LYS D 144 -10.898 -18.388 -9.435 1.00 46.27 H new ATOM 0 HZ3 LYS D 144 -11.357 -18.610 -10.796 1.00 46.27 H new ATOM 4435 N TYR D 145 -7.265 -11.594 -9.719 1.00 45.78 N ATOM 4436 CA TYR D 145 -6.686 -10.381 -10.279 1.00 48.00 C ATOM 4437 C TYR D 145 -5.461 -10.686 -11.185 1.00 49.65 C ATOM 4438 O TYR D 145 -5.198 -9.971 -12.167 1.00 50.43 O ATOM 4439 CB TYR D 145 -6.307 -9.410 -9.167 1.00 47.94 C ATOM 4440 CG TYR D 145 -7.466 -8.722 -8.480 1.00 47.91 C ATOM 4441 CD1 TYR D 145 -8.348 -7.898 -9.185 1.00 50.13 C ATOM 4442 CD2 TYR D 145 -7.645 -8.840 -7.120 1.00 49.29 C ATOM 4443 CE1 TYR D 145 -9.400 -7.239 -8.539 1.00 48.33 C ATOM 4444 CE2 TYR D 145 -8.689 -8.189 -6.465 1.00 48.45 C ATOM 4445 CZ TYR D 145 -9.559 -7.394 -7.174 1.00 48.08 C ATOM 4446 OH TYR D 145 -10.580 -6.749 -6.512 1.00 46.18 O ATOM 0 H TYR D 145 -7.142 -11.704 -8.875 1.00 45.78 H new ATOM 0 HA TYR D 145 -7.361 -9.967 -10.840 1.00 48.00 H new ATOM 0 HB2 TYR D 145 -5.795 -9.892 -8.499 1.00 47.94 H new ATOM 0 HB3 TYR D 145 -5.722 -8.731 -9.537 1.00 47.94 H new ATOM 0 HD1 TYR D 145 -8.233 -7.786 -10.101 1.00 50.13 H new ATOM 0 HD2 TYR D 145 -7.057 -9.366 -6.628 1.00 49.29 H new ATOM 0 HE1 TYR D 145 -9.986 -6.703 -9.022 1.00 48.33 H new ATOM 0 HE2 TYR D 145 -8.797 -8.292 -5.547 1.00 48.45 H new ATOM 0 HH TYR D 145 -10.516 -6.895 -5.687 1.00 46.18 H new ATOM 4447 N HIS D 146 -4.706 -11.735 -10.869 1.00 51.28 N ATOM 4448 CA HIS D 146 -3.624 -12.164 -11.787 1.00 53.21 C ATOM 4449 C HIS D 146 -4.239 -13.060 -12.902 1.00 53.60 C ATOM 4450 O HIS D 146 -4.806 -12.548 -13.887 1.00 53.43 O ATOM 4451 CB HIS D 146 -2.443 -12.864 -11.060 1.00 53.30 C ATOM 4452 CG HIS D 146 -2.253 -12.449 -9.623 1.00 55.67 C ATOM 4453 ND1 HIS D 146 -2.079 -13.365 -8.602 1.00 57.59 N ATOM 4454 CD2 HIS D 146 -2.211 -11.225 -9.038 1.00 56.91 C ATOM 4455 CE1 HIS D 146 -1.932 -12.724 -7.453 1.00 58.30 C ATOM 4456 NE2 HIS D 146 -2.005 -11.424 -7.690 1.00 57.90 N ATOM 4457 OXT HIS D 146 -4.230 -14.309 -12.828 1.00 54.34 O ATOM 0 H HIS D 146 -4.790 -12.206 -10.154 1.00 51.28 H new ATOM 0 HA HIS D 146 -3.232 -11.372 -12.186 1.00 53.21 H new ATOM 0 HB2 HIS D 146 -2.583 -13.823 -11.091 1.00 53.30 H new ATOM 0 HB3 HIS D 146 -1.625 -12.681 -11.548 1.00 53.30 H new ATOM 0 HD2 HIS D 146 -2.304 -10.405 -9.467 1.00 56.91 H new ATOM 0 HE1 HIS D 146 -1.800 -13.120 -6.622 1.00 58.30 H new ATOM 0 HE2 HIS D 146 -1.935 -10.804 -7.098 1.00 57.90 H new TER 4458 HIS D 146 HETATM 4459 CHA HEM A 142 -17.262 14.651 -4.487 1.00 17.69 C HETATM 4460 CHB HEM A 142 -12.763 16.404 -4.166 1.00 17.78 C HETATM 4461 CHC HEM A 142 -10.956 11.944 -4.483 1.00 14.93 C HETATM 4462 CHD HEM A 142 -15.411 10.118 -5.007 1.00 14.83 C HETATM 4463 C1A HEM A 142 -16.207 15.542 -4.418 1.00 17.83 C HETATM 4464 C2A HEM A 142 -16.293 16.992 -4.467 1.00 19.83 C HETATM 4465 C3A HEM A 142 -15.040 17.465 -4.376 1.00 17.91 C HETATM 4466 C4A HEM A 142 -14.127 16.334 -4.289 1.00 18.11 C HETATM 4467 CMA HEM A 142 -14.582 18.928 -4.401 1.00 18.18 C HETATM 4468 CAA HEM A 142 -17.600 17.821 -4.605 1.00 22.67 C HETATM 4469 CBA HEM A 142 -18.080 18.198 -3.207 1.00 27.99 C HETATM 4470 CGA HEM A 142 -19.391 18.939 -3.226 1.00 31.37 C HETATM 4471 O1A HEM A 142 -20.226 18.695 -2.325 1.00 36.86 O HETATM 4472 O2A HEM A 142 -19.625 19.790 -4.108 1.00 33.87 O HETATM 4473 C1B HEM A 142 -11.874 15.350 -4.212 1.00 17.52 C HETATM 4474 C2B HEM A 142 -10.436 15.469 -4.151 1.00 15.80 C HETATM 4475 C3B HEM A 142 -9.919 14.235 -4.240 1.00 14.93 C HETATM 4476 C4B HEM A 142 -11.035 13.301 -4.337 1.00 16.37 C HETATM 4477 CMB HEM A 142 -9.686 16.839 -3.992 1.00 16.44 C HETATM 4478 CAB HEM A 142 -8.421 13.792 -4.203 1.00 17.59 C HETATM 4479 CBB HEM A 142 -7.405 14.617 -4.442 1.00 21.76 C HETATM 4480 C1C HEM A 142 -11.987 11.048 -4.721 1.00 15.34 C HETATM 4481 C2C HEM A 142 -11.875 9.642 -5.089 1.00 14.25 C HETATM 4482 C3C HEM A 142 -13.099 9.115 -5.238 1.00 12.91 C HETATM 4483 C4C HEM A 142 -14.041 10.197 -4.986 1.00 17.01 C HETATM 4484 CMC HEM A 142 -10.542 8.913 -5.211 1.00 15.59 C HETATM 4485 CAC HEM A 142 -13.476 7.664 -5.616 1.00 15.17 C HETATM 4486 CBC HEM A 142 -12.915 7.119 -6.718 1.00 11.69 C HETATM 4487 C1D HEM A 142 -16.293 11.169 -4.933 1.00 17.18 C HETATM 4488 C2D HEM A 142 -17.717 11.023 -5.131 1.00 15.62 C HETATM 4489 C3D HEM A 142 -18.304 12.418 -4.949 1.00 17.74 C HETATM 4490 C4D HEM A 142 -17.168 13.294 -4.686 1.00 18.49 C HETATM 4491 CMD HEM A 142 -18.554 9.746 -5.404 1.00 18.90 C HETATM 4492 CAD HEM A 142 -19.805 12.763 -5.061 1.00 19.45 C HETATM 4493 CBD HEM A 142 -20.087 12.950 -6.557 1.00 24.76 C HETATM 4494 CGD HEM A 142 -21.498 13.468 -6.798 1.00 28.48 C HETATM 4495 O1D HEM A 142 -22.471 12.896 -6.265 1.00 33.77 O HETATM 4496 O2D HEM A 142 -21.678 14.438 -7.559 1.00 29.48 O HETATM 4497 NA HEM A 142 -14.882 15.204 -4.324 1.00 16.38 N HETATM 4498 NB HEM A 142 -12.223 14.017 -4.310 1.00 15.81 N HETATM 4499 NC HEM A 142 -13.315 11.326 -4.672 1.00 16.37 N HETATM 4500 ND HEM A 142 -15.982 12.536 -4.673 1.00 15.40 N HETATM 4501 FE HEM A 142 -14.085 13.319 -4.512 1.00 16.92 FE HETATM 0 HMA1 HEM A 142 -13.755 19.017 -3.902 1.00 18.18 H new HETATM 0 HMA2 HEM A 142 -15.264 19.488 -3.998 1.00 18.18 H new HETATM 0 HMA3 HEM A 142 -14.437 19.206 -5.319 1.00 18.18 H new HETATM 0 HMB1 HEM A 142 -8.852 16.698 -3.517 1.00 16.44 H new HETATM 0 HMB2 HEM A 142 -10.242 17.456 -3.491 1.00 16.44 H new HETATM 0 HMB3 HEM A 142 -9.500 17.210 -4.869 1.00 16.44 H new HETATM 0 HMC1 HEM A 142 -10.664 7.976 -4.993 1.00 15.59 H new HETATM 0 HMC2 HEM A 142 -9.901 9.306 -4.598 1.00 15.59 H new HETATM 0 HMC3 HEM A 142 -10.211 8.993 -6.119 1.00 15.59 H new HETATM 0 HMD1 HEM A 142 -18.013 9.101 -5.885 1.00 18.90 H new HETATM 0 HMD2 HEM A 142 -19.332 9.976 -5.936 1.00 18.90 H new HETATM 0 HMD3 HEM A 142 -18.842 9.361 -4.561 1.00 18.90 H new HETATM 0 HBB1 HEM A 142 -6.494 14.287 -4.405 1.00 21.76 H new HETATM 0 HBB2 HEM A 142 -7.576 15.548 -4.653 1.00 21.76 H new HETATM 0 HBC1 HEM A 142 -13.136 6.210 -6.976 1.00 11.69 H new HETATM 0 HBC2 HEM A 142 -12.292 7.637 -7.251 1.00 11.69 H new HETATM 0 HBA1 HEM A 142 -17.408 18.748 -2.775 1.00 27.99 H new HETATM 0 HBA2 HEM A 142 -18.175 17.394 -2.673 1.00 27.99 H new HETATM 0 HAA1 HEM A 142 -18.279 17.306 -5.068 1.00 22.67 H new HETATM 0 HAA2 HEM A 142 -17.440 18.618 -5.133 1.00 22.67 H new HETATM 0 HBD1 HEM A 142 -19.968 12.105 -7.018 1.00 24.76 H new HETATM 0 HBD2 HEM A 142 -19.444 13.571 -6.933 1.00 24.76 H new HETATM 0 HAD1 HEM A 142 -20.013 13.570 -4.565 1.00 19.45 H new HETATM 0 HAD2 HEM A 142 -20.353 12.053 -4.691 1.00 19.45 H new HETATM 0 HHA HEM A 142 -18.117 15.003 -4.389 1.00 17.69 H new HETATM 0 HHB HEM A 142 -12.399 17.250 -4.038 1.00 17.78 H new HETATM 0 HHC HEM A 142 -10.105 11.576 -4.414 1.00 14.93 H new HETATM 0 HHD HEM A 142 -15.780 9.267 -5.079 1.00 14.83 H new HETATM 0 HAB HEM A 142 -8.221 12.866 -3.995 1.00 17.59 H new HETATM 0 HAC HEM A 142 -14.101 7.157 -5.075 1.00 15.17 H new HETATM 4502 O1 OXY A 143 -13.729 12.782 -7.024 1.00 25.53 O HETATM 4503 O2 OXY A 143 -14.045 13.511 -6.168 1.00 16.98 O HETATM 4504 CHA HEM B 147 18.134 -5.100 -12.288 1.00 20.79 C HETATM 4505 CHB HEM B 147 14.106 -4.666 -14.954 1.00 19.43 C HETATM 4506 CHC HEM B 147 11.698 -2.739 -11.164 1.00 16.73 C HETATM 4507 CHD HEM B 147 15.927 -2.684 -8.680 1.00 18.10 C HETATM 4508 C1A HEM B 147 17.260 -5.144 -13.341 1.00 22.22 C HETATM 4509 C2A HEM B 147 17.592 -5.599 -14.653 1.00 24.75 C HETATM 4510 C3A HEM B 147 16.470 -5.465 -15.406 1.00 23.33 C HETATM 4511 C4A HEM B 147 15.399 -4.911 -14.572 1.00 19.87 C HETATM 4512 CMA HEM B 147 16.278 -5.810 -16.889 1.00 22.66 C HETATM 4513 CAA HEM B 147 19.012 -6.091 -15.072 1.00 26.34 C HETATM 4514 CBA HEM B 147 19.154 -7.584 -14.828 1.00 36.56 C HETATM 4515 CGA HEM B 147 20.223 -8.113 -15.751 1.00 41.27 C HETATM 4516 O1A HEM B 147 21.430 -7.966 -15.400 1.00 44.11 O HETATM 4517 O2A HEM B 147 19.860 -8.668 -16.828 1.00 43.60 O HETATM 4518 C1B HEM B 147 13.100 -4.146 -14.136 1.00 19.36 C HETATM 4519 C2B HEM B 147 11.743 -3.990 -14.526 1.00 19.63 C HETATM 4520 C3B HEM B 147 11.073 -3.447 -13.471 1.00 20.47 C HETATM 4521 C4B HEM B 147 11.997 -3.267 -12.395 1.00 18.47 C HETATM 4522 CMB HEM B 147 11.264 -4.410 -15.960 1.00 18.35 C HETATM 4523 CAB HEM B 147 9.587 -3.064 -13.269 1.00 19.66 C HETATM 4524 CBB HEM B 147 8.903 -2.659 -14.312 1.00 25.83 C HETATM 4525 C1C HEM B 147 12.656 -2.493 -10.194 1.00 17.45 C HETATM 4526 C2C HEM B 147 12.470 -1.754 -8.974 1.00 17.94 C HETATM 4527 C3C HEM B 147 13.645 -1.744 -8.311 1.00 16.59 C HETATM 4528 C4C HEM B 147 14.610 -2.485 -9.066 1.00 18.31 C HETATM 4529 CMC HEM B 147 11.133 -1.105 -8.562 1.00 18.69 C HETATM 4530 CAC HEM B 147 14.019 -1.132 -6.955 1.00 18.91 C HETATM 4531 CBC HEM B 147 13.354 -0.092 -6.459 1.00 22.85 C HETATM 4532 C1D HEM B 147 16.899 -3.294 -9.426 1.00 19.53 C HETATM 4533 C2D HEM B 147 18.281 -3.404 -9.027 1.00 20.89 C HETATM 4534 C3D HEM B 147 18.961 -4.161 -10.145 1.00 22.61 C HETATM 4535 C4D HEM B 147 17.927 -4.427 -11.115 1.00 21.40 C HETATM 4536 CMD HEM B 147 18.952 -2.883 -7.751 1.00 22.42 C HETATM 4537 CAD HEM B 147 20.451 -4.536 -10.201 1.00 24.54 C HETATM 4538 CBD HEM B 147 21.154 -3.332 -10.808 1.00 32.21 C HETATM 4539 CGD HEM B 147 22.630 -3.597 -10.983 1.00 37.61 C HETATM 4540 O1D HEM B 147 23.246 -4.335 -10.164 1.00 39.80 O HETATM 4541 O2D HEM B 147 23.184 -3.038 -11.966 1.00 41.37 O HETATM 4542 NA HEM B 147 15.927 -4.748 -13.328 1.00 19.84 N HETATM 4543 NB HEM B 147 13.229 -3.707 -12.834 1.00 17.64 N HETATM 4544 NC HEM B 147 13.982 -2.917 -10.206 1.00 17.26 N HETATM 4545 ND HEM B 147 16.720 -3.899 -10.669 1.00 19.17 N HETATM 4546 FE HEM B 147 14.977 -3.763 -11.826 1.00 20.34 FE HETATM 0 HMA1 HEM B 147 15.355 -6.065 -17.045 1.00 22.66 H new HETATM 0 HMA2 HEM B 147 16.861 -6.547 -17.128 1.00 22.66 H new HETATM 0 HMA3 HEM B 147 16.496 -5.037 -17.432 1.00 22.66 H new HETATM 0 HMB1 HEM B 147 10.336 -4.689 -15.923 1.00 18.35 H new HETATM 0 HMB2 HEM B 147 11.809 -5.145 -16.281 1.00 18.35 H new HETATM 0 HMB3 HEM B 147 11.350 -3.656 -16.564 1.00 18.35 H new HETATM 0 HMC1 HEM B 147 11.066 -1.087 -7.594 1.00 18.69 H new HETATM 0 HMC2 HEM B 147 10.397 -1.621 -8.927 1.00 18.69 H new HETATM 0 HMC3 HEM B 147 11.094 -0.199 -8.905 1.00 18.69 H new HETATM 0 HMD1 HEM B 147 18.492 -2.085 -7.446 1.00 22.42 H new HETATM 0 HMD2 HEM B 147 19.880 -2.669 -7.937 1.00 22.42 H new HETATM 0 HMD3 HEM B 147 18.910 -3.564 -7.062 1.00 22.42 H new HETATM 0 HBB1 HEM B 147 7.970 -2.413 -14.214 1.00 25.83 H new HETATM 0 HBB2 HEM B 147 9.330 -2.606 -15.181 1.00 25.83 H new HETATM 0 HBC1 HEM B 147 13.607 0.280 -5.600 1.00 22.85 H new HETATM 0 HBC2 HEM B 147 12.616 0.294 -6.957 1.00 22.85 H new HETATM 0 HBA1 HEM B 147 18.311 -8.035 -14.993 1.00 36.56 H new HETATM 0 HBA2 HEM B 147 19.391 -7.754 -13.903 1.00 36.56 H new HETATM 0 HAA1 HEM B 147 19.688 -5.610 -14.569 1.00 26.34 H new HETATM 0 HAA2 HEM B 147 19.164 -5.896 -16.010 1.00 26.34 H new HETATM 0 HBD1 HEM B 147 21.027 -2.558 -10.238 1.00 32.21 H new HETATM 0 HBD2 HEM B 147 20.756 -3.120 -11.667 1.00 32.21 H new HETATM 0 HAD1 HEM B 147 20.591 -5.330 -10.740 1.00 24.54 H new HETATM 0 HAD2 HEM B 147 20.795 -4.731 -9.315 1.00 24.54 H new HETATM 0 HHA HEM B 147 18.934 -5.566 -12.377 1.00 20.79 H new HETATM 0 HHB HEM B 147 13.879 -4.863 -15.834 1.00 19.43 H new HETATM 0 HHC HEM B 147 10.811 -2.537 -10.972 1.00 16.73 H new HETATM 0 HHD HEM B 147 16.172 -2.375 -7.838 1.00 18.10 H new HETATM 0 HAB HEM B 147 9.173 -3.122 -12.394 1.00 19.66 H new HETATM 0 HAC HEM B 147 14.755 -1.511 -6.449 1.00 18.91 H new HETATM 4547 O1 OXY B 148 14.653 -0.890 -11.991 1.00 35.94 O HETATM 4548 O2 OXY B 148 15.627 -2.100 -12.502 1.00 14.83 O HETATM 4549 O1 OXY C 143 13.754 -0.156 14.914 1.00 36.73 O HETATM 4550 O2 OXY C 143 14.097 0.987 14.713 1.00 13.47 O HETATM 4551 CHA HEM C 142 17.295 3.371 14.892 1.00 18.58 C HETATM 4552 CHB HEM C 142 12.836 4.479 16.425 1.00 18.83 C HETATM 4553 CHC HEM C 142 11.007 2.037 12.672 1.00 17.50 C HETATM 4554 CHD HEM C 142 15.436 0.625 11.303 1.00 15.71 C HETATM 4555 C1A HEM C 142 16.255 3.832 15.652 1.00 19.26 C HETATM 4556 C2A HEM C 142 16.369 4.511 16.930 1.00 20.98 C HETATM 4557 C3A HEM C 142 15.149 4.802 17.342 1.00 19.09 C HETATM 4558 C4A HEM C 142 14.199 4.351 16.341 1.00 17.63 C HETATM 4559 CMA HEM C 142 14.796 5.513 18.662 1.00 19.80 C HETATM 4560 CAA HEM C 142 17.659 4.817 17.741 1.00 23.00 C HETATM 4561 CBA HEM C 142 18.259 6.169 17.370 1.00 29.48 C HETATM 4562 CGA HEM C 142 19.729 6.128 17.760 1.00 34.70 C HETATM 4563 O1A HEM C 142 20.535 5.371 17.123 1.00 38.46 O HETATM 4564 O2A HEM C 142 20.086 6.843 18.714 1.00 34.36 O HETATM 4565 C1B HEM C 142 11.934 3.929 15.532 1.00 18.87 C HETATM 4566 C2B HEM C 142 10.478 4.081 15.565 1.00 19.46 C HETATM 4567 C3B HEM C 142 9.962 3.403 14.507 1.00 18.71 C HETATM 4568 C4B HEM C 142 11.098 2.820 13.783 1.00 17.91 C HETATM 4569 CMB HEM C 142 9.729 4.922 16.633 1.00 17.86 C HETATM 4570 CAB HEM C 142 8.473 3.241 14.037 1.00 20.20 C HETATM 4571 CBB HEM C 142 7.423 2.961 14.813 1.00 21.03 C HETATM 4572 C1C HEM C 142 12.017 1.396 11.997 1.00 17.39 C HETATM 4573 C2C HEM C 142 11.863 0.443 10.926 1.00 17.04 C HETATM 4574 C3C HEM C 142 13.097 0.041 10.561 1.00 16.00 C HETATM 4575 C4C HEM C 142 14.066 0.734 11.386 1.00 17.19 C HETATM 4576 CMC HEM C 142 10.500 0.001 10.338 1.00 14.86 C HETATM 4577 CAC HEM C 142 13.509 -0.973 9.473 1.00 16.87 C HETATM 4578 CBC HEM C 142 13.013 -2.240 9.513 1.00 10.70 C HETATM 4579 C1D HEM C 142 16.348 1.200 12.148 1.00 18.89 C HETATM 4580 C2D HEM C 142 17.779 0.969 12.109 1.00 18.95 C HETATM 4581 C3D HEM C 142 18.365 1.837 13.227 1.00 20.28 C HETATM 4582 C4D HEM C 142 17.230 2.507 13.826 1.00 20.10 C HETATM 4583 CMD HEM C 142 18.546 0.037 11.143 1.00 18.51 C HETATM 4584 CAD HEM C 142 19.857 1.960 13.633 1.00 21.72 C HETATM 4585 CBD HEM C 142 20.245 0.718 14.422 1.00 25.54 C HETATM 4586 CGD HEM C 142 21.627 0.833 15.036 1.00 28.54 C HETATM 4587 O1D HEM C 142 22.596 1.363 14.439 1.00 31.00 O HETATM 4588 O2D HEM C 142 21.779 0.385 16.181 1.00 31.43 O HETATM 4589 NA HEM C 142 14.907 3.744 15.337 1.00 18.79 N HETATM 4590 NB HEM C 142 12.280 3.144 14.435 1.00 16.93 N HETATM 4591 NC HEM C 142 13.367 1.554 12.231 1.00 19.33 N HETATM 4592 ND HEM C 142 16.071 2.109 13.175 1.00 18.55 N HETATM 4593 FE HEM C 142 14.144 2.606 13.782 1.00 20.18 FE HETATM 0 HMA1 HEM C 142 13.982 6.027 18.545 1.00 19.80 H new HETATM 0 HMA2 HEM C 142 15.520 6.107 18.913 1.00 19.80 H new HETATM 0 HMA3 HEM C 142 14.663 4.853 19.360 1.00 19.80 H new HETATM 0 HMB1 HEM C 142 8.914 5.281 16.249 1.00 17.86 H new HETATM 0 HMB2 HEM C 142 10.296 5.652 16.927 1.00 17.86 H new HETATM 0 HMB3 HEM C 142 9.508 4.359 17.392 1.00 17.86 H new HETATM 0 HMC1 HEM C 142 10.611 -0.231 9.403 1.00 14.86 H new HETATM 0 HMC2 HEM C 142 9.862 0.728 10.417 1.00 14.86 H new HETATM 0 HMC3 HEM C 142 10.172 -0.771 10.826 1.00 14.86 H new HETATM 0 HMD1 HEM C 142 17.976 -0.706 10.889 1.00 18.51 H new HETATM 0 HMD2 HEM C 142 19.341 -0.302 11.583 1.00 18.51 H new HETATM 0 HMD3 HEM C 142 18.802 0.533 10.350 1.00 18.51 H new HETATM 0 HBB1 HEM C 142 6.539 2.882 14.422 1.00 21.03 H new HETATM 0 HBB2 HEM C 142 7.545 2.837 15.767 1.00 21.03 H new HETATM 0 HBC1 HEM C 142 13.268 -2.882 8.832 1.00 10.70 H new HETATM 0 HBC2 HEM C 142 12.405 -2.501 10.222 1.00 10.70 H new HETATM 0 HBA1 HEM C 142 17.801 6.887 17.835 1.00 29.48 H new HETATM 0 HBA2 HEM C 142 18.161 6.338 16.420 1.00 29.48 H new HETATM 0 HAA1 HEM C 142 18.313 4.119 17.582 1.00 23.00 H new HETATM 0 HAA2 HEM C 142 17.455 4.804 18.689 1.00 23.00 H new HETATM 0 HBD1 HEM C 142 20.217 -0.056 13.838 1.00 25.54 H new HETATM 0 HBD2 HEM C 142 19.593 0.567 15.124 1.00 25.54 H new HETATM 0 HAD1 HEM C 142 19.996 2.757 14.168 1.00 21.72 H new HETATM 0 HAD2 HEM C 142 20.415 2.047 12.844 1.00 21.72 H new HETATM 0 HHA HEM C 142 18.142 3.677 15.123 1.00 18.58 H new HETATM 0 HHB HEM C 142 12.493 4.972 17.135 1.00 18.83 H new HETATM 0 HHC HEM C 142 10.151 1.922 12.326 1.00 17.50 H new HETATM 0 HHD HEM C 142 15.775 0.111 10.606 1.00 15.71 H new HETATM 0 HAB HEM C 142 8.299 3.356 13.090 1.00 20.20 H new HETATM 0 HAC HEM C 142 14.118 -0.709 8.765 1.00 16.87 H new HETATM 4594 O1 OXY D 148 -14.470 -10.972 5.107 1.00 32.74 O HETATM 4595 O2 OXY D 148 -15.616 -11.589 4.212 1.00 13.32 O HETATM 4596 O HOH A 144 -14.512 1.179 0.576 1.00 15.07 O HETATM 4597 O HOH A 145 -11.569 -1.719 -2.358 1.00 21.47 O HETATM 4598 O HOH A 146 14.470 18.916 -10.775 1.00 20.25 O HETATM 4599 O HOH A 147 -6.656 6.178 -18.687 1.00 17.59 O HETATM 4600 O HOH A 148 11.505 18.058 -4.568 1.00 14.34 O HETATM 4601 O HOH A 149 -4.278 6.668 -0.427 1.00 32.26 O HETATM 4602 O HOH A 150 0.149 11.083 -4.748 1.00 29.63 O HETATM 4603 O HOH A 151 2.269 8.406 -10.286 1.00 15.52 O HETATM 4604 O HOH A 152 -4.284 15.601 -23.170 1.00 20.62 O HETATM 4605 O HOH A 153 -13.055 13.812 9.724 1.00 31.05 O HETATM 4606 O HOH A 154 -18.723 22.451 -11.130 1.00 31.61 O HETATM 4607 O HOH A 155 -10.062 -1.005 -12.008 1.00 39.18 O HETATM 4608 O HOH A 156 -13.950 5.775 6.056 1.00 24.57 O HETATM 4609 O HOH A 157 -16.856 4.519 8.295 1.00 32.03 O HETATM 4610 O HOH A 158 4.658 9.435 -10.011 1.00 19.08 O HETATM 4611 O HOH A 159 -7.017 -0.040 -17.737 1.00 20.53 O HETATM 4612 O HOH A 160 -15.535 0.256 -1.815 1.00 40.67 O HETATM 4613 O HOH A 161 -17.109 -0.150 -13.329 1.00 32.84 O HETATM 4614 O HOH A 162 -1.367 27.962 5.123 1.00 44.46 O HETATM 4615 O HOH A 163 -7.337 -0.301 1.141 1.00 27.27 O HETATM 4616 O HOH A 164 -20.073 16.055 -8.605 1.00 31.91 O HETATM 4617 O HOH A 165 -1.844 9.816 -3.244 1.00 29.44 O HETATM 4618 O HOH A 166 -14.873 22.234 -4.838 1.00 31.33 O HETATM 4619 O HOH A 167 -9.837 6.992 10.234 1.00 37.73 O HETATM 4620 O HOH A 168 0.967 9.419 -7.770 1.00 22.61 O HETATM 4621 O HOH A 169 -17.591 21.611 -3.466 1.00 37.94 O HETATM 4622 O HOH A 170 -1.688 9.227 1.326 1.00 33.46 O HETATM 4623 O HOH A 171 -21.064 16.912 -11.551 1.00 36.14 O HETATM 4624 O HOH A 172 -2.160 8.424 -1.195 1.00 38.58 O HETATM 4625 O HOH A 173 -0.306 27.711 1.490 1.00 34.66 O HETATM 4626 O HOH A 174 -12.241 6.702 3.324 1.00 34.00 O HETATM 4627 O HOH A 175 -13.315 21.634 2.779 1.00 40.40 O HETATM 4628 O HOH A 176 -8.606 16.786 15.123 1.00 37.97 O HETATM 4629 O HOH A 177 -7.735 19.457 -19.923 1.00 39.31 O HETATM 4630 O HOH A 178 -14.348 2.887 -18.017 1.00 34.89 O HETATM 4631 O HOH A 179 -21.087 3.092 -12.173 1.00 33.75 O HETATM 4632 O HOH A 180 -22.161 1.302 -7.873 1.00 38.19 O HETATM 4633 O HOH A 181 -9.432 -0.145 -18.936 1.00 36.22 O HETATM 4634 O HOH A 182 -10.820 0.748 -7.473 1.00 37.57 O HETATM 4635 O HOH A 183 -0.287 7.594 -6.679 1.00 25.12 O HETATM 4636 O HOH A 184 -14.570 16.194 9.227 1.00 40.71 O HETATM 4637 O HOH A 185 -13.980 21.092 -16.205 1.00 35.11 O HETATM 4638 O HOH A 186 5.144 23.452 -20.476 1.00 43.79 O HETATM 4639 O HOH A 187 -10.647 26.044 -15.377 1.00 49.62 O HETATM 4640 O HOH A 188 -10.418 18.451 -19.979 1.00 32.01 O HETATM 4641 O HOH A 189 1.938 21.165 5.385 1.00 43.41 O HETATM 4642 O HOH A 190 8.201 27.205 2.416 1.00 35.55 O HETATM 4643 O HOH A 191 12.338 22.386 -10.506 1.00 36.11 O HETATM 4644 O HOH A 192 12.001 23.149 -7.906 1.00 29.94 O HETATM 4645 O HOH A 193 13.102 24.884 -5.328 1.00 36.23 O HETATM 4646 O HOH A 194 -24.950 6.024 -14.437 1.00 36.22 O HETATM 4647 O HOH A 195 7.340 25.699 6.545 1.00 25.08 O HETATM 4648 CHA HEM D 147 -18.262 -13.031 1.431 1.00 15.47 C HETATM 4649 CHB HEM D 147 -14.286 -15.184 3.056 1.00 17.07 C HETATM 4650 CHC HEM D 147 -11.825 -10.976 2.907 1.00 15.24 C HETATM 4651 CHD HEM D 147 -15.963 -8.701 1.763 1.00 17.02 C HETATM 4652 C1A HEM D 147 -17.422 -14.006 1.909 1.00 18.16 C HETATM 4653 C2A HEM D 147 -17.748 -15.403 2.128 1.00 19.36 C HETATM 4654 C3A HEM D 147 -16.646 -16.002 2.594 1.00 18.80 C HETATM 4655 C4A HEM D 147 -15.578 -15.002 2.656 1.00 16.69 C HETATM 4656 CMA HEM D 147 -16.456 -17.493 2.981 1.00 18.30 C HETATM 4657 CAA HEM D 147 -19.152 -16.003 1.876 1.00 22.10 C HETATM 4658 CBA HEM D 147 -19.163 -16.512 0.434 1.00 29.44 C HETATM 4659 CGA HEM D 147 -20.386 -17.372 0.120 1.00 34.99 C HETATM 4660 O1A HEM D 147 -21.530 -16.838 0.240 1.00 36.06 O HETATM 4661 O2A HEM D 147 -20.213 -18.581 -0.268 1.00 37.02 O HETATM 4662 C1B HEM D 147 -13.305 -14.213 3.091 1.00 18.37 C HETATM 4663 C2B HEM D 147 -11.946 -14.522 3.378 1.00 16.97 C HETATM 4664 C3B HEM D 147 -11.231 -13.401 3.346 1.00 15.74 C HETATM 4665 C4B HEM D 147 -12.126 -12.318 3.020 1.00 18.32 C HETATM 4666 CMB HEM D 147 -11.436 -15.971 3.710 1.00 18.49 C HETATM 4667 CAB HEM D 147 -9.717 -13.430 3.681 1.00 17.69 C HETATM 4668 CBB HEM D 147 -8.775 -12.573 3.322 1.00 23.01 C HETATM 4669 C1C HEM D 147 -12.760 -10.010 2.653 1.00 15.73 C HETATM 4670 C2C HEM D 147 -12.541 -8.578 2.785 1.00 17.78 C HETATM 4671 C3C HEM D 147 -13.681 -7.935 2.453 1.00 14.60 C HETATM 4672 C4C HEM D 147 -14.676 -8.941 2.153 1.00 16.12 C HETATM 4673 CMC HEM D 147 -11.152 -8.041 3.240 1.00 19.50 C HETATM 4674 CAC HEM D 147 -14.010 -6.432 2.436 1.00 16.92 C HETATM 4675 CBC HEM D 147 -13.050 -5.524 2.580 1.00 21.11 C HETATM 4676 C1D HEM D 147 -16.949 -9.657 1.588 1.00 20.46 C HETATM 4677 C2D HEM D 147 -18.336 -9.349 1.284 1.00 19.61 C HETATM 4678 C3D HEM D 147 -19.035 -10.692 1.199 1.00 21.15 C HETATM 4679 C4D HEM D 147 -18.019 -11.689 1.436 1.00 18.72 C HETATM 4680 CMD HEM D 147 -19.025 -7.985 1.081 1.00 19.69 C HETATM 4681 CAD HEM D 147 -20.525 -10.888 0.879 1.00 22.66 C HETATM 4682 CBD HEM D 147 -21.231 -10.870 2.228 1.00 30.97 C HETATM 4683 CGD HEM D 147 -22.695 -11.043 1.945 1.00 36.84 C HETATM 4684 O1D HEM D 147 -23.451 -10.059 2.132 1.00 39.59 O HETATM 4685 O2D HEM D 147 -23.086 -12.162 1.508 1.00 41.59 O HETATM 4686 NA HEM D 147 -16.102 -13.819 2.254 1.00 18.62 N HETATM 4687 NB HEM D 147 -13.405 -12.848 2.866 1.00 16.67 N HETATM 4688 NC HEM D 147 -14.083 -10.184 2.272 1.00 16.87 N HETATM 4689 ND HEM D 147 -16.799 -11.054 1.670 1.00 16.98 N HETATM 4690 FE HEM D 147 -15.123 -11.988 2.320 1.00 18.64 FE HETATM 0 HMA1 HEM D 147 -15.541 -17.760 2.803 1.00 18.30 H new HETATM 0 HMA2 HEM D 147 -17.060 -18.043 2.458 1.00 18.30 H new HETATM 0 HMA3 HEM D 147 -16.649 -17.610 3.925 1.00 18.30 H new HETATM 0 HMB1 HEM D 147 -10.517 -16.066 3.415 1.00 18.49 H new HETATM 0 HMB2 HEM D 147 -11.991 -16.622 3.253 1.00 18.49 H new HETATM 0 HMB3 HEM D 147 -11.485 -16.120 4.667 1.00 18.49 H new HETATM 0 HMC1 HEM D 147 -10.728 -8.691 3.822 1.00 19.50 H new HETATM 0 HMC2 HEM D 147 -11.269 -7.206 3.720 1.00 19.50 H new HETATM 0 HMC3 HEM D 147 -10.592 -7.890 2.462 1.00 19.50 H new HETATM 0 HMD1 HEM D 147 -19.766 -8.085 0.463 1.00 19.69 H new HETATM 0 HMD2 HEM D 147 -18.386 -7.350 0.720 1.00 19.69 H new HETATM 0 HMD3 HEM D 147 -19.357 -7.660 1.932 1.00 19.69 H new HETATM 0 HBB1 HEM D 147 -7.858 -12.714 3.605 1.00 23.01 H new HETATM 0 HBB2 HEM D 147 -9.002 -11.804 2.776 1.00 23.01 H new HETATM 0 HBC1 HEM D 147 -13.270 -4.579 2.568 1.00 21.11 H new HETATM 0 HBC2 HEM D 147 -12.129 -5.806 2.698 1.00 21.11 H new HETATM 0 HBA1 HEM D 147 -18.359 -17.029 0.272 1.00 29.44 H new HETATM 0 HBA2 HEM D 147 -19.141 -15.755 -0.172 1.00 29.44 H new HETATM 0 HAA1 HEM D 147 -19.841 -15.334 2.010 1.00 22.10 H new HETATM 0 HAA2 HEM D 147 -19.334 -16.725 2.497 1.00 22.10 H new HETATM 0 HBD1 HEM D 147 -21.066 -10.035 2.693 1.00 30.97 H new HETATM 0 HBD2 HEM D 147 -20.903 -11.582 2.799 1.00 30.97 H new HETATM 0 HAD1 HEM D 147 -20.676 -11.727 0.416 1.00 22.66 H new HETATM 0 HAD2 HEM D 147 -20.855 -10.182 0.302 1.00 22.66 H new HETATM 0 HHA HEM D 147 -19.072 -13.312 1.070 1.00 15.47 H new HETATM 0 HHB HEM D 147 -14.044 -16.039 3.330 1.00 17.07 H new HETATM 0 HHC HEM D 147 -10.939 -10.714 3.009 1.00 15.24 H new HETATM 0 HHD HEM D 147 -16.198 -7.816 1.600 1.00 17.02 H new HETATM 0 HAB HEM D 147 -9.421 -14.176 4.226 1.00 17.69 H new HETATM 0 HAC HEM D 147 -14.929 -6.144 2.319 1.00 16.92 H new HETATM 4691 O HOH B 149 -2.490 22.134 -31.007 1.00 21.43 O HETATM 4692 O HOH B 150 -2.109 -0.169 -14.036 1.00 13.80 O HETATM 4693 O HOH B 151 10.679 9.549 -26.827 1.00 31.80 O HETATM 4694 O HOH B 152 8.315 16.809 -23.100 1.00 35.57 O HETATM 4695 O HOH B 153 13.168 -12.876 -17.174 1.00 30.93 O HETATM 4696 O HOH B 154 3.338 6.041 -9.011 1.00 38.34 O HETATM 4697 O HOH B 155 -7.098 7.427 -28.474 1.00 21.00 O HETATM 4698 O HOH B 156 0.396 7.256 -31.812 1.00 23.77 O HETATM 4699 O HOH B 157 4.881 4.117 -34.582 1.00 26.38 O HETATM 4700 O HOH B 158 -4.893 13.654 -24.983 1.00 28.23 O HETATM 4701 O HOH B 159 23.692 -0.753 -5.477 1.00 34.21 O HETATM 4702 O HOH B 160 1.252 -10.581 -15.666 1.00 30.74 O HETATM 4703 O HOH B 161 -1.154 5.343 -30.290 1.00 16.70 O HETATM 4704 O HOH B 162 17.027 -5.727 -20.506 1.00 27.62 O HETATM 4705 O HOH B 163 -0.630 -0.105 -11.540 1.00 47.31 O HETATM 4706 O HOH B 164 24.265 1.051 -14.888 1.00 33.29 O HETATM 4707 O HOH B 165 18.365 10.131 -16.649 1.00 34.18 O HETATM 4708 O HOH B 166 -8.048 1.896 -24.442 1.00 32.75 O HETATM 4709 O HOH B 167 20.649 -3.755 -4.659 1.00 37.07 O HETATM 4710 O HOH B 168 8.528 -6.521 1.447 1.00 34.74 O HETATM 4711 O HOH B 169 18.007 5.698 -20.869 1.00 34.05 O HETATM 4712 O HOH B 170 0.764 5.147 -7.850 1.00 37.95 O HETATM 4713 O HOH B 171 -9.333 11.359 -26.871 1.00 35.30 O HETATM 4714 O HOH B 172 14.378 -5.100 1.015 1.00 47.92 O HETATM 4715 O HOH B 173 0.529 18.357 -26.056 1.00 37.29 O HETATM 4716 O HOH B 174 1.803 0.393 -12.518 1.00 44.95 O HETATM 4717 O HOH B 175 12.656 -15.877 -18.124 1.00 41.58 O HETATM 4718 O HOH B 176 18.134 -20.666 -8.823 1.00 48.32 O HETATM 4719 O HOH B 177 25.611 11.855 -10.514 1.00 38.86 O HETATM 4720 O HOH B 178 16.933 9.188 -0.112 1.00 40.01 O HETATM 4721 O HOH B 179 23.695 18.016 -8.583 1.00 50.58 O HETATM 4722 O HOH B 180 16.455 -0.231 -24.294 1.00 36.33 O HETATM 4723 O HOH B 181 3.956 -20.291 -12.843 1.00 51.52 O HETATM 4724 O HOH B 182 -1.823 1.518 -9.740 1.00 34.14 O HETATM 4725 O HOH B 183 22.416 0.109 -20.882 1.00 36.61 O HETATM 4726 O HOH B 184 24.895 -0.830 -0.740 1.00 40.92 O HETATM 4727 O HOH B 185 0.378 -0.010 -34.508 1.00 48.56 O HETATM 4728 O HOH B 186 5.126 11.957 -32.118 1.00 27.77 O HETATM 4729 O HOH B 187 3.147 13.678 -29.416 1.00 16.93 O HETATM 4730 O HOH B 188 -3.116 9.348 -30.200 1.00 23.68 O HETATM 4731 O HOH B 189 0.660 6.702 -34.565 1.00 24.78 O HETATM 4732 O HOH B 190 15.594 4.250 -22.371 1.00 25.46 O HETATM 4733 O HOH B 191 0.517 15.418 -29.382 1.00 33.19 O HETATM 4734 O HOH B 192 13.715 13.422 -3.503 1.00 35.02 O HETATM 4735 O HOH B 193 -4.653 13.225 -29.517 1.00 48.43 O HETATM 4736 O HOH C 144 11.639 -2.819 -0.456 1.00 24.23 O HETATM 4737 O HOH C 145 14.574 1.070 0.809 1.00 21.09 O HETATM 4738 O HOH C 146 -14.291 -0.415 21.776 1.00 24.42 O HETATM 4739 O HOH C 147 6.649 -13.344 14.118 1.00 16.86 O HETATM 4740 O HOH C 148 4.290 -12.552 24.773 1.00 24.14 O HETATM 4741 O HOH C 149 -11.265 4.566 17.878 1.00 21.06 O HETATM 4742 O HOH C 150 -12.406 1.741 24.855 1.00 30.76 O HETATM 4743 O HOH C 151 13.065 14.914 7.306 1.00 21.78 O HETATM 4744 O HOH C 152 -0.081 1.530 11.876 1.00 28.63 O HETATM 4745 O HOH C 153 -5.334 -6.266 30.349 1.00 36.04 O HETATM 4746 O HOH C 154 6.987 -15.522 8.615 1.00 24.63 O HETATM 4747 O HOH C 155 17.163 -11.845 5.962 1.00 31.34 O HETATM 4748 O HOH C 156 7.375 0.996 -0.815 1.00 25.63 O HETATM 4749 O HOH C 157 1.232 15.835 14.645 1.00 31.46 O HETATM 4750 O HOH C 158 18.702 1.716 25.019 1.00 34.01 O HETATM 4751 O HOH C 159 19.914 0.590 18.313 1.00 25.03 O HETATM 4752 O HOH C 160 14.562 -14.509 11.222 1.00 33.93 O HETATM 4753 O HOH C 161 10.664 -6.026 4.201 1.00 36.96 O HETATM 4754 O HOH C 162 4.202 2.681 5.981 1.00 34.61 O HETATM 4755 O HOH C 163 -0.927 -2.202 12.003 1.00 31.46 O HETATM 4756 O HOH C 164 9.921 12.693 1.155 1.00 36.37 O HETATM 4757 O HOH C 165 2.046 2.026 10.335 1.00 31.39 O HETATM 4758 O HOH C 166 -13.537 3.521 17.425 1.00 35.04 O HETATM 4759 O HOH C 167 21.129 -8.962 8.599 1.00 32.60 O HETATM 4760 O HOH C 168 -9.109 0.522 27.200 1.00 32.74 O HETATM 4761 O HOH C 169 -2.176 -4.917 12.393 1.00 16.53 O HETATM 4762 O HOH C 170 2.249 3.124 7.796 1.00 27.24 O HETATM 4763 O HOH C 171 1.192 14.351 12.403 1.00 40.10 O HETATM 4764 O HOH C 172 -4.421 -4.082 13.109 1.00 24.23 O HETATM 4765 O HOH C 173 15.135 6.769 22.026 1.00 31.86 O HETATM 4766 O HOH C 174 1.909 5.731 7.492 1.00 35.70 O HETATM 4767 O HOH C 175 21.367 -1.823 20.206 1.00 28.10 O HETATM 4768 O HOH C 176 -10.313 6.149 15.698 1.00 33.74 O HETATM 4769 O HOH C 177 -8.782 -4.053 33.060 1.00 39.78 O HETATM 4770 O HOH C 178 13.319 7.738 2.130 1.00 38.96 O HETATM 4771 O HOH C 179 -2.549 1.353 9.358 1.00 28.75 O HETATM 4772 O HOH C 180 21.141 -13.837 24.134 1.00 44.99 O HETATM 4773 O HOH C 181 1.660 18.127 21.229 1.00 47.52 O HETATM 4774 O HOH C 182 6.090 0.608 24.643 1.00 48.09 O HETATM 4775 O HOH C 183 17.466 7.129 20.794 1.00 41.36 O HETATM 4776 O HOH C 184 0.144 15.076 23.549 1.00 41.90 O HETATM 4777 O HOH C 185 -2.830 -3.017 31.959 1.00 45.36 O HETATM 4778 O HOH C 186 15.729 -1.305 0.846 1.00 39.74 O HETATM 4779 O HOH C 187 10.217 -10.713 4.913 1.00 35.95 O HETATM 4780 O HOH C 188 10.817 -8.299 26.094 1.00 37.68 O HETATM 4781 O HOH C 189 13.420 12.951 17.338 1.00 36.33 O HETATM 4782 O HOH C 190 10.461 -11.957 22.548 1.00 42.22 O HETATM 4783 O HOH C 191 9.354 -16.437 8.853 1.00 54.68 O HETATM 4784 O HOH C 192 10.598 21.477 8.119 1.00 32.63 O HETATM 4785 O HOH C 193 23.040 3.118 16.324 1.00 43.83 O HETATM 4786 O HOH C 194 12.028 6.374 3.820 1.00 32.42 O HETATM 4787 O HOH C 195 12.820 -16.460 10.428 1.00 50.92 O HETATM 4788 O HOH C 196 2.494 3.269 3.577 1.00 49.31 O HETATM 4789 O HOH C 197 11.330 13.926 -0.643 1.00 34.53 O HETATM 4790 O HOH C 198 13.736 15.829 9.571 1.00 40.96 O HETATM 4791 O HOH D 149 2.525 -16.848 34.075 1.00 18.67 O HETATM 4792 O HOH D 150 -17.705 -20.318 5.091 1.00 21.29 O HETATM 4793 O HOH D 151 -10.578 -18.630 21.357 1.00 37.42 O HETATM 4794 O HOH D 152 2.004 -12.285 6.608 1.00 20.15 O HETATM 4795 O HOH D 153 -23.773 -5.016 2.056 1.00 30.60 O HETATM 4796 O HOH D 154 5.018 -15.042 24.005 1.00 22.02 O HETATM 4797 O HOH D 155 -8.075 -12.013 25.978 1.00 34.38 O HETATM 4798 O HOH D 156 -5.087 -28.154 20.138 1.00 24.49 O HETATM 4799 O HOH D 157 -20.583 -7.997 16.252 1.00 32.35 O HETATM 4800 O HOH D 158 1.213 -23.804 18.948 1.00 16.91 O HETATM 4801 O HOH D 159 -24.256 -12.287 8.138 1.00 27.66 O HETATM 4802 O HOH D 160 -8.604 -1.891 -6.404 1.00 33.69 O HETATM 4803 O HOH D 161 7.090 -21.424 20.045 1.00 29.18 O HETATM 4804 O HOH D 162 3.419 -17.500 2.460 1.00 24.47 O HETATM 4805 O HOH D 163 -8.152 -28.550 -7.359 1.00 32.80 O HETATM 4806 O HOH D 164 9.358 -18.036 22.865 1.00 34.89 O HETATM 4807 O HOH D 165 -18.276 -9.372 16.694 1.00 36.94 O HETATM 4808 O HOH D 166 5.958 -26.988 17.158 1.00 41.76 O HETATM 4809 O HOH D 167 -13.582 3.392 13.718 1.00 39.23 O HETATM 4810 O HOH D 168 -1.523 -18.691 -2.022 1.00 31.77 O HETATM 4811 O HOH D 169 -1.034 -3.951 7.971 1.00 38.02 O HETATM 4812 O HOH D 170 -14.977 -1.175 -4.582 1.00 36.91 O HETATM 4813 O HOH D 171 -1.965 -10.352 6.252 1.00 38.06 O HETATM 4814 O HOH D 172 -21.893 -13.922 -0.361 1.00 38.35 O HETATM 4815 O HOH D 173 -21.714 -9.168 21.447 1.00 43.14 O HETATM 4816 O HOH D 174 -16.716 -7.422 -12.972 1.00 35.42 O HETATM 4817 O HOH D 175 4.682 -19.422 25.863 1.00 36.91 O HETATM 4818 O HOH D 176 -12.380 -22.508 1.571 1.00 37.29 O HETATM 4819 O HOH D 177 3.411 -31.265 11.510 1.00 44.23 O HETATM 4820 O HOH D 178 8.085 -20.167 13.231 1.00 35.23 O HETATM 4821 O HOH D 179 -8.395 3.770 12.658 1.00 35.74 O HETATM 4822 O HOH D 180 -3.835 -4.897 9.542 1.00 37.02 O HETATM 4823 O HOH D 181 -10.696 -9.084 -4.906 1.00 40.99 O HETATM 4824 O HOH D 182 -2.516 -28.452 4.370 1.00 39.70 O HETATM 4825 O HOH D 183 -1.749 -32.315 -0.695 1.00 41.00 O HETATM 4826 O HOH D 184 -23.143 -13.142 5.590 1.00 46.34 O HETATM 4827 O HOH D 185 7.348 -29.813 6.051 1.00 40.30 O HETATM 4828 O HOH D 186 -2.234 -23.280 -4.916 1.00 37.60 O HETATM 4829 O HOH D 187 -25.806 2.343 17.124 1.00 40.96 O HETATM 4830 O HOH D 188 -13.826 -21.227 -3.303 1.00 30.86 O HETATM 4831 O HOH D 189 3.135 -21.781 22.511 1.00 23.91 O HETATM 4832 O HOH D 190 -3.018 -19.301 26.012 1.00 17.68 O HETATM 4833 O HOH D 191 -0.402 -24.297 21.397 1.00 21.09 O HETATM 4834 O HOH D 192 -4.922 -22.351 25.701 1.00 23.95 O HETATM 4835 O HOH D 193 -22.784 -17.913 10.159 1.00 28.95 O HETATM 4836 O HOH D 194 -2.444 -29.071 -3.580 1.00 50.95 O HETATM 4837 O HOH D 195 -8.455 -17.392 22.882 1.00 52.70 O CONECT 667 4501 CONECT 1801 4546 CONECT 2896 4593 CONECT 4030 4690 CONECT 4459 4463 4490 CONECT 4460 4466 4473 CONECT 4461 4476 4480 CONECT 4462 4483 4487 CONECT 4463 4459 4464 4497 CONECT 4464 4463 4465 4468 CONECT 4465 4464 4466 4467 CONECT 4466 4460 4465 4497 CONECT 4467 4465 CONECT 4468 4464 4469 CONECT 4469 4468 4470 CONECT 4470 4469 4471 4472 CONECT 4471 4470 CONECT 4472 4470 CONECT 4473 4460 4474 4498 CONECT 4474 4473 4475 4477 CONECT 4475 4474 4476 4478 CONECT 4476 4461 4475 4498 CONECT 4477 4474 CONECT 4478 4475 4479 CONECT 4479 4478 CONECT 4480 4461 4481 4499 CONECT 4481 4480 4482 4484 CONECT 4482 4481 4483 4485 CONECT 4483 4462 4482 4499 CONECT 4484 4481 CONECT 4485 4482 4486 CONECT 4486 4485 CONECT 4487 4462 4488 4500 CONECT 4488 4487 4489 4491 CONECT 4489 4488 4490 4492 CONECT 4490 4459 4489 4500 CONECT 4491 4488 CONECT 4492 4489 4493 CONECT 4493 4492 4494 CONECT 4494 4493 4495 4496 CONECT 4495 4494 CONECT 4496 4494 CONECT 4497 4463 4466 4501 CONECT 4498 4473 4476 4501 CONECT 4499 4480 4483 4501 CONECT 4500 4487 4490 4501 CONECT 4501 667 4497 4498 4499 CONECT 4501 4500 4503 CONECT 4502 4503 CONECT 4503 4501 4502 CONECT 4504 4508 4535 CONECT 4505 4511 4518 CONECT 4506 4521 4525 CONECT 4507 4528 4532 CONECT 4508 4504 4509 4542 CONECT 4509 4508 4510 4513 CONECT 4510 4509 4511 4512 CONECT 4511 4505 4510 4542 CONECT 4512 4510 CONECT 4513 4509 4514 CONECT 4514 4513 4515 CONECT 4515 4514 4516 4517 CONECT 4516 4515 CONECT 4517 4515 CONECT 4518 4505 4519 4543 CONECT 4519 4518 4520 4522 CONECT 4520 4519 4521 4523 CONECT 4521 4506 4520 4543 CONECT 4522 4519 CONECT 4523 4520 4524 CONECT 4524 4523 CONECT 4525 4506 4526 4544 CONECT 4526 4525 4527 4529 CONECT 4527 4526 4528 4530 CONECT 4528 4507 4527 4544 CONECT 4529 4526 CONECT 4530 4527 4531 CONECT 4531 4530 CONECT 4532 4507 4533 4545 CONECT 4533 4532 4534 4536 CONECT 4534 4533 4535 4537 CONECT 4535 4504 4534 4545 CONECT 4536 4533 CONECT 4537 4534 4538 CONECT 4538 4537 4539 CONECT 4539 4538 4540 4541 CONECT 4540 4539 CONECT 4541 4539 CONECT 4542 4508 4511 4546 CONECT 4543 4518 4521 4546 CONECT 4544 4525 4528 4546 CONECT 4545 4532 4535 4546 CONECT 4546 1801 4542 4543 4544 CONECT 4546 4545 4548 CONECT 4547 4548 CONECT 4548 4546 4547 CONECT 4549 4550 CONECT 4550 4549 4593 CONECT 4551 4555 4582 CONECT 4552 4558 4565 CONECT 4553 4568 4572 CONECT 4554 4575 4579 CONECT 4555 4551 4556 4589 CONECT 4556 4555 4557 4560 CONECT 4557 4556 4558 4559 CONECT 4558 4552 4557 4589 CONECT 4559 4557 CONECT 4560 4556 4561 CONECT 4561 4560 4562 CONECT 4562 4561 4563 4564 CONECT 4563 4562 CONECT 4564 4562 CONECT 4565 4552 4566 4590 CONECT 4566 4565 4567 4569 CONECT 4567 4566 4568 4570 CONECT 4568 4553 4567 4590 CONECT 4569 4566 CONECT 4570 4567 4571 CONECT 4571 4570 CONECT 4572 4553 4573 4591 CONECT 4573 4572 4574 4576 CONECT 4574 4573 4575 4577 CONECT 4575 4554 4574 4591 CONECT 4576 4573 CONECT 4577 4574 4578 CONECT 4578 4577 CONECT 4579 4554 4580 4592 CONECT 4580 4579 4581 4583 CONECT 4581 4580 4582 4584 CONECT 4582 4551 4581 4592 CONECT 4583 4580 CONECT 4584 4581 4585 CONECT 4585 4584 4586 CONECT 4586 4585 4587 4588 CONECT 4587 4586 CONECT 4588 4586 CONECT 4589 4555 4558 4593 CONECT 4590 4565 4568 4593 CONECT 4591 4572 4575 4593 CONECT 4592 4579 4582 4593 CONECT 4593 2896 4550 4589 4590 CONECT 4593 4591 4592 CONECT 4594 4595 CONECT 4595 4594 4690 CONECT 4648 4652 4679 CONECT 4649 4655 4662 CONECT 4650 4665 4669 CONECT 4651 4672 4676 CONECT 4652 4648 4653 4686 CONECT 4653 4652 4654 4657 CONECT 4654 4653 4655 4656 CONECT 4655 4649 4654 4686 CONECT 4656 4654 CONECT 4657 4653 4658 CONECT 4658 4657 4659 CONECT 4659 4658 4660 4661 CONECT 4660 4659 CONECT 4661 4659 CONECT 4662 4649 4663 4687 CONECT 4663 4662 4664 4666 CONECT 4664 4663 4665 4667 CONECT 4665 4650 4664 4687 CONECT 4666 4663 CONECT 4667 4664 4668 CONECT 4668 4667 CONECT 4669 4650 4670 4688 CONECT 4670 4669 4671 4673 CONECT 4671 4670 4672 4674 CONECT 4672 4651 4671 4688 CONECT 4673 4670 CONECT 4674 4671 4675 CONECT 4675 4674 CONECT 4676 4651 4677 4689 CONECT 4677 4676 4678 4680 CONECT 4678 4677 4679 4681 CONECT 4679 4648 4678 4689 CONECT 4680 4677 CONECT 4681 4678 4682 CONECT 4682 4681 4683 CONECT 4683 4682 4684 4685 CONECT 4684 4683 CONECT 4685 4683 CONECT 4686 4652 4655 4690 CONECT 4687 4662 4665 4690 CONECT 4688 4669 4672 4690 CONECT 4689 4676 4679 4690 CONECT 4690 4030 4595 4686 4687 CONECT 4690 4688 4689 END