USER MOD reduce.3.24.130724 H: found=0, std=0, add=3793, rem=0, adj=100 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER GLYCOPROTEIN 13-JUN-96 1HFZ TITLE ALPHA-LACTALBUMIN COMPND MOL_ID: 1; COMPND 2 MOLECULE: ALPHA-LACTALBUMIN; COMPND 3 CHAIN: A, B, C, D; COMPND 4 EC: 2.4.1.22; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; SOURCE 3 ORGANISM_COMMON: CATTLE; SOURCE 4 ORGANISM_TAXID: 9913; SOURCE 5 GENE: BOVINE ALPHA-LACTALBUMIN CDNA; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: T7; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET3A; SOURCE 0 EXPRESSION_SYSTEM_GENE: BOVINE ALPHA-LACTALBUMIN CDNA; SOURCE 1 OTHER_DETAILS: T7 RNA POLYMERASE KEYWDS LACTOSE SYNTHASE COMPONENT, CALCIUM BINDING METALLOPROTEIN, KEYWDS 2 LACTOSE, GLYCOPROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR A.C.W.PIKE,K.BREW,K.R.ACHARYA REVDAT 2 24-FEB-09 1HFZ 1 VERSN REVDAT 1 29-JUL-97 1HFZ 0 JRNL AUTH A.C.PIKE,K.BREW,K.R.ACHARYA JRNL TITL CRYSTAL STRUCTURES OF GUINEA-PIG, GOAT AND BOVINE JRNL TITL 2 ALPHA-LACTALBUMIN HIGHLIGHT THE ENHANCED JRNL TITL 3 CONFORMATIONAL FLEXIBILITY OF REGIONS THAT ARE JRNL TITL 4 SIGNIFICANT FOR ITS ACTION IN LACTOSE SYNTHASE. JRNL REF STRUCTURE V. 4 691 1996 JRNL REFN ISSN 0969-2126 JRNL PMID 8805552 JRNL DOI 10.1016/S0969-2126(96)00075-5 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH J.A.GROBLER,M.WANG,A.C.PIKE,K.BREW REMARK 1 TITL STUDY BY MUTAGENESIS OF THE ROLES OF TWO AROMATIC REMARK 1 TITL 2 CLUSTERS OF ALPHA-LACTALBUMIN IN ASPECTS OF ITS REMARK 1 TITL 3 ACTION IN THE LACTOSE SYNTHASE SYSTEM REMARK 1 REF J.BIOL.CHEM. V. 269 5106 1994 REMARK 1 REFN ISSN 0021-9258 REMARK 1 REFERENCE 2 REMARK 1 AUTH K.R.ACHARYA,J.S.REN,D.I.STUART,D.C.PHILLIPS, REMARK 1 AUTH 2 R.E.FENNA REMARK 1 TITL CRYSTAL STRUCTURE OF HUMAN ALPHA-LACTALBUMIN AT REMARK 1 TITL 2 1.7 A RESOLUTION REMARK 1 REF J.MOL.BIOL. V. 221 571 1991 REMARK 1 REFN ISSN 0022-2836 REMARK 1 REFERENCE 3 REMARK 1 AUTH K.R.ACHARYA,D.I.STUART,N.P.WALKER,M.LEWIS, REMARK 1 AUTH 2 D.C.PHILLIPS REMARK 1 TITL REFINED STRUCTURE OF BABOON ALPHA-LACTALBUMIN AT REMARK 1 TITL 2 1.7 A RESOLUTION. COMPARISON WITH C-TYPE LYSOZYME REMARK 1 REF J.MOL.BIOL. V. 208 99 1989 REMARK 1 REFN ISSN 0022-2836 REMARK 2 REMARK 2 RESOLUTION. 2.30 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.30 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 8.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 NUMBER OF REFLECTIONS : 18605 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING SET) : 0.208 REMARK 3 FREE R VALUE : 0.303 REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3958 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 4 REMARK 3 SOLVENT ATOMS : 60 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 48.39 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.011 REMARK 3 BOND ANGLES (DEGREES) : 1.73 REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL REMARK 3 IMPROPER ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 1.500 ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.000 ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : 1.500 ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : 2.000 ; NULL REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : NULL REMARK 3 TOPOLOGY FILE 1 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: CHAINS C AND D ARE GENERALLY POORLY REMARK 3 DEFINED IN THE ELECTRON DENSITY DUE TO PACKING DISORDER WITHIN REMARK 3 THE CRYSTAL. THIS IS REFLECTED IN THE RELATIVELY HIGH OVERALL REMARK 3 TEMPERATURE FACTOR OBSERVED FOR THESE CHAINS. REMARK 4 REMARK 4 1HFZ COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 24-NOV-94 REMARK 200 TEMPERATURE (KELVIN) : 298 REMARK 200 PH : 8.0 REMARK 200 NUMBER OF CRYSTALS USED : 8 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SRS REMARK 200 BEAMLINE : PX9.6 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.87 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 : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 18629 REMARK 200 RESOLUTION RANGE HIGH (A) : NULL REMARK 200 RESOLUTION RANGE LOW (A) : NULL REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 80.0 REMARK 200 DATA REDUNDANCY : 2.800 REMARK 200 R MERGE (I) : 0.07800 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: NULL REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: X-PLOR 3.1 REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 47.00 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.36 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PH 8.0 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y+1/2,-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 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 30.06500 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2, 3, 4 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 300 REMARK: REMARK 300 THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT CONTAINS TWO DIMERS REMARK 300 (CHAINS A AND B AND CHAINS C AND D). THE ADDITIONAL REMARK 300 N-TERMINAL METHIONINE OF EACH CHAIN, INTRODUCED BY THE REMARK 300 CLONING PROCEDURE, HAS BEEN NUMBERED 1X SO THAT THE REMARK 300 REMAINING RESIDUES (1 - 123) HAVE A NUMBERING SCHEME THAT REMARK 300 IS IDENTICAL TO OTHER ALPHA-LACTALBUMIN STRUCTURES. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: B 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 350 REMARK 350 BIOMOLECULE: 3 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: C 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 350 REMARK 350 BIOMOLECULE: 4 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 LEU A 123 REMARK 465 LYS B 122 REMARK 465 LEU B 123 REMARK 465 LYS C 122 REMARK 465 LEU C 123 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 GLU D 121 N - CA - C ANGL. DEV. = 16.5 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 GLU A 1 90.02 -168.76 REMARK 500 ASN A 44 -56.23 -122.94 REMARK 500 ASN A 45 -86.15 -145.18 REMARK 500 ASN A 66 88.24 -159.54 REMARK 500 GLU A 121 59.79 -111.96 REMARK 500 ASN B 45 -90.60 -125.22 REMARK 500 LEU B 110 -17.53 -142.34 REMARK 500 LYS B 114 83.03 27.75 REMARK 500 LYS C 13 -32.43 -37.90 REMARK 500 ALA C 40 131.23 -15.26 REMARK 500 ASN C 44 -121.17 -116.52 REMARK 500 ASN C 45 -93.82 -87.25 REMARK 500 ASP C 46 42.43 -103.13 REMARK 500 TRP C 60 -70.15 -84.12 REMARK 500 ASN C 66 91.95 -162.15 REMARK 500 ASN C 74 70.52 47.96 REMARK 500 ASP C 83 8.60 -69.70 REMARK 500 LEU D 3 -156.41 -94.58 REMARK 500 TYR D 36 1.95 82.07 REMARK 500 ASP D 64 1.78 -69.02 REMARK 500 PRO D 67 48.76 -77.23 REMARK 500 HIS D 68 14.18 -144.88 REMARK 500 ASN D 74 75.11 58.40 REMARK 500 CYS D 77 -9.47 -55.47 REMARK 500 ASN D 102 4.07 -68.95 REMARK 500 CYS D 120 -70.58 -131.73 REMARK 500 GLU D 121 -13.55 -20.77 REMARK 500 LYS D 122 178.55 177.92 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: MAIN CHAIN PLANARITY REMARK 500 REMARK 500 THE FOLLOWING RESIDUES HAVE A PSEUDO PLANARITY REMARK 500 TORSION, C(I) - CA(I) - N(I+1) - O(I), GREATER REMARK 500 10.0 DEGREES. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 500 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 500 I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI ANGLE REMARK 500 ASP A 63 11.45 REMARK 500 ASP D 63 18.77 REMARK 500 ASN D 66 17.39 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 CA A 124 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 LYS A 79 O REMARK 620 2 ASP A 84 O 167.8 REMARK 620 3 ASP A 82 OD1 89.3 78.7 REMARK 620 4 ASP A 88 OD1 108.3 82.4 138.0 REMARK 620 5 ASP A 87 OD1 96.6 93.0 149.0 68.4 REMARK 620 6 HOH A 149 O 77.7 97.7 77.8 142.1 73.8 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA B 124 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 LYS B 79 O REMARK 620 2 ASP B 82 OD1 105.4 REMARK 620 3 ASP B 84 O 161.8 68.4 REMARK 620 4 ASP B 82 OD2 81.6 39.6 100.9 REMARK 620 5 ASP B 88 OD1 85.6 143.9 90.4 166.8 REMARK 620 6 HOH B 140 O 85.9 74.8 76.0 104.1 71.8 REMARK 620 7 HOH B 139 O 92.5 81.4 103.1 50.8 133.3 154.7 REMARK 620 8 ASP B 87 OD1 84.3 149.1 109.9 116.8 64.6 135.8 68.8 REMARK 620 N 1 2 3 4 5 6 7 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA C 124 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 LYS C 79 O REMARK 620 2 ASP C 84 O 158.7 REMARK 620 3 ASP C 82 OD1 97.1 74.1 REMARK 620 4 ASP C 82 OD2 56.5 108.2 43.4 REMARK 620 5 ASP C 87 OD1 94.9 70.4 108.0 95.0 REMARK 620 6 ASP C 88 OD1 101.8 91.4 158.2 157.7 81.2 REMARK 620 7 ASP C 82 O 105.1 86.2 55.7 84.3 155.1 108.2 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA D 124 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASP D 84 O REMARK 620 2 ASP D 87 OD1 89.2 REMARK 620 3 ASP D 87 OD2 90.8 39.9 REMARK 620 4 ASP D 82 OD1 124.1 116.6 83.1 REMARK 620 5 ASP D 82 O 79.3 165.1 148.4 78.0 REMARK 620 6 ASP D 82 OD2 80.2 119.3 80.4 43.9 68.4 REMARK 620 7 ASP D 88 OD1 89.5 65.1 105.0 145.7 104.9 168.5 REMARK 620 8 LYS D 79 O 156.3 70.5 65.9 59.8 122.6 98.8 92.6 REMARK 620 N 1 2 3 4 5 6 7 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 124 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA B 124 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA C 124 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA D 124 DBREF 1HFZ A 1 123 UNP P00711 LALBA_BOVIN 20 142 DBREF 1HFZ B 1 123 UNP P00711 LALBA_BOVIN 20 142 DBREF 1HFZ C 1 123 UNP P00711 LALBA_BOVIN 20 142 DBREF 1HFZ D 1 123 UNP P00711 LALBA_BOVIN 20 142 SEQADV 1HFZ VAL A 90 UNP P00711 MET 109 ENGINEERED SEQADV 1HFZ VAL B 90 UNP P00711 MET 109 ENGINEERED SEQADV 1HFZ VAL C 90 UNP P00711 MET 109 ENGINEERED SEQADV 1HFZ VAL D 90 UNP P00711 MET 109 ENGINEERED SEQRES 1 A 124 MET GLU GLN LEU THR LYS CYS GLU VAL PHE ARG GLU LEU SEQRES 2 A 124 LYS ASP LEU LYS GLY TYR GLY GLY VAL SER LEU PRO GLU SEQRES 3 A 124 TRP VAL CYS THR THR PHE HIS THR SER GLY TYR ASP THR SEQRES 4 A 124 GLN ALA ILE VAL GLN ASN ASN ASP SER THR GLU TYR GLY SEQRES 5 A 124 LEU PHE GLN ILE ASN ASN LYS ILE TRP CYS LYS ASP ASP SEQRES 6 A 124 GLN ASN PRO HIS SER SER ASN ILE CYS ASN ILE SER CYS SEQRES 7 A 124 ASP LYS PHE LEU ASP ASP ASP LEU THR ASP ASP ILE VAL SEQRES 8 A 124 CYS VAL LYS LYS ILE LEU ASP LYS VAL GLY ILE ASN TYR SEQRES 9 A 124 TRP LEU ALA HIS LYS ALA LEU CYS SER GLU LYS LEU ASP SEQRES 10 A 124 GLN TRP LEU CYS GLU LYS LEU SEQRES 1 B 124 MET GLU GLN LEU THR LYS CYS GLU VAL PHE ARG GLU LEU SEQRES 2 B 124 LYS ASP LEU LYS GLY TYR GLY GLY VAL SER LEU PRO GLU SEQRES 3 B 124 TRP VAL CYS THR THR PHE HIS THR SER GLY TYR ASP THR SEQRES 4 B 124 GLN ALA ILE VAL GLN ASN ASN ASP SER THR GLU TYR GLY SEQRES 5 B 124 LEU PHE GLN ILE ASN ASN LYS ILE TRP CYS LYS ASP ASP SEQRES 6 B 124 GLN ASN PRO HIS SER SER ASN ILE CYS ASN ILE SER CYS SEQRES 7 B 124 ASP LYS PHE LEU ASP ASP ASP LEU THR ASP ASP ILE VAL SEQRES 8 B 124 CYS VAL LYS LYS ILE LEU ASP LYS VAL GLY ILE ASN TYR SEQRES 9 B 124 TRP LEU ALA HIS LYS ALA LEU CYS SER GLU LYS LEU ASP SEQRES 10 B 124 GLN TRP LEU CYS GLU LYS LEU SEQRES 1 C 124 MET GLU GLN LEU THR LYS CYS GLU VAL PHE ARG GLU LEU SEQRES 2 C 124 LYS ASP LEU LYS GLY TYR GLY GLY VAL SER LEU PRO GLU SEQRES 3 C 124 TRP VAL CYS THR THR PHE HIS THR SER GLY TYR ASP THR SEQRES 4 C 124 GLN ALA ILE VAL GLN ASN ASN ASP SER THR GLU TYR GLY SEQRES 5 C 124 LEU PHE GLN ILE ASN ASN LYS ILE TRP CYS LYS ASP ASP SEQRES 6 C 124 GLN ASN PRO HIS SER SER ASN ILE CYS ASN ILE SER CYS SEQRES 7 C 124 ASP LYS PHE LEU ASP ASP ASP LEU THR ASP ASP ILE VAL SEQRES 8 C 124 CYS VAL LYS LYS ILE LEU ASP LYS VAL GLY ILE ASN TYR SEQRES 9 C 124 TRP LEU ALA HIS LYS ALA LEU CYS SER GLU LYS LEU ASP SEQRES 10 C 124 GLN TRP LEU CYS GLU LYS LEU SEQRES 1 D 124 MET GLU GLN LEU THR LYS CYS GLU VAL PHE ARG GLU LEU SEQRES 2 D 124 LYS ASP LEU LYS GLY TYR GLY GLY VAL SER LEU PRO GLU SEQRES 3 D 124 TRP VAL CYS THR THR PHE HIS THR SER GLY TYR ASP THR SEQRES 4 D 124 GLN ALA ILE VAL GLN ASN ASN ASP SER THR GLU TYR GLY SEQRES 5 D 124 LEU PHE GLN ILE ASN ASN LYS ILE TRP CYS LYS ASP ASP SEQRES 6 D 124 GLN ASN PRO HIS SER SER ASN ILE CYS ASN ILE SER CYS SEQRES 7 D 124 ASP LYS PHE LEU ASP ASP ASP LEU THR ASP ASP ILE VAL SEQRES 8 D 124 CYS VAL LYS LYS ILE LEU ASP LYS VAL GLY ILE ASN TYR SEQRES 9 D 124 TRP LEU ALA HIS LYS ALA LEU CYS SER GLU LYS LEU ASP SEQRES 10 D 124 GLN TRP LEU CYS GLU LYS LEU HET CA A 124 1 HET CA B 124 1 HET CA C 124 1 HET CA D 124 1 HETNAM CA CALCIUM ION FORMUL 5 CA 4(CA 2+) FORMUL 9 HOH *60(H2 O) HELIX 1 1 LYS A 5 GLU A 11 1 7 HELIX 2 2 LYS A 13 LEU A 15 5 3 HELIX 3 3 TYR A 18 GLY A 20 5 3 HELIX 4 4 LEU A 23 SER A 34 1 12 HELIX 5 5 CYS A 77 PHE A 80 5 4 HELIX 6 6 THR A 86 LYS A 98 1 13 HELIX 7 7 ILE A 101 TYR A 103 5 3 HELIX 8 8 LEU A 105 LEU A 110 1 6 HELIX 9 9 LEU A 115 TRP A 118 5 4 HELIX 10 10 LYS B 5 LEU B 15 1 11 HELIX 11 11 TYR B 18 GLY B 20 5 3 HELIX 12 12 LEU B 23 SER B 34 1 12 HELIX 13 13 CYS B 77 PHE B 80 5 4 HELIX 14 14 THR B 86 LYS B 98 1 13 HELIX 15 15 ILE B 101 TYR B 103 5 3 HELIX 16 16 LEU B 105 LEU B 110 1 6 HELIX 17 17 ASP B 116 TRP B 118 5 3 HELIX 18 18 LYS C 5 GLU C 11 1 7 HELIX 19 19 LYS C 13 LEU C 15 5 3 HELIX 20 20 TYR C 18 GLY C 20 5 3 HELIX 21 21 LEU C 23 SER C 34 1 12 HELIX 22 22 CYS C 77 PHE C 80 5 4 HELIX 23 23 LEU C 85 LYS C 98 5 14 HELIX 24 24 ILE C 101 TYR C 103 5 3 HELIX 25 25 ALA C 106 LEU C 110 1 5 HELIX 26 26 LEU C 115 TRP C 118 5 4 HELIX 27 27 LYS D 5 GLU D 11 1 7 HELIX 28 28 LYS D 13 LEU D 15 5 3 HELIX 29 29 TYR D 18 GLY D 20 5 3 HELIX 30 30 LEU D 23 SER D 34 1 12 HELIX 31 31 CYS D 77 PHE D 80 5 4 HELIX 32 32 THR D 86 LYS D 98 1 13 HELIX 33 33 ILE D 101 TYR D 103 5 3 HELIX 34 34 ALA D 106 LEU D 110 1 5 HELIX 35 35 LEU D 115 TRP D 118 5 4 SHEET 1 A 2 ILE A 41 GLN A 43 0 SHEET 2 A 2 THR A 48 TYR A 50 -1 N GLU A 49 O VAL A 42 SHEET 1 B 2 ILE B 41 GLN B 43 0 SHEET 2 B 2 THR B 48 TYR B 50 -1 N GLU B 49 O VAL B 42 SHEET 1 C 2 ILE C 41 GLN C 43 0 SHEET 2 C 2 THR C 48 TYR C 50 -1 N GLU C 49 O VAL C 42 SHEET 1 D 2 ILE D 41 GLN D 43 0 SHEET 2 D 2 THR D 48 TYR D 50 -1 N GLU D 49 O VAL D 42 SSBOND *** CYS A 6 CYS A 120 1555 1555 2.03 SSBOND *** CYS A 28 CYS A 111 1555 1555 2.02 SSBOND *** CYS A 61 CYS A 77 1555 1555 2.03 SSBOND *** CYS A 73 CYS A 91 1555 1555 2.03 SSBOND *** CYS B 6 CYS B 120 1555 1555 2.04 SSBOND *** CYS B 28 CYS B 111 1555 1555 2.02 SSBOND *** CYS B 61 CYS B 77 1555 1555 2.03 SSBOND *** CYS B 73 CYS B 91 1555 1555 2.02 SSBOND *** CYS C 6 CYS C 120 1555 1555 2.03 SSBOND *** CYS C 28 CYS C 111 1555 1555 2.01 SSBOND *** CYS C 61 CYS C 77 1555 1555 2.04 SSBOND *** CYS C 73 CYS C 91 1555 1555 2.04 SSBOND *** CYS D 6 CYS D 120 1555 1555 2.03 SSBOND *** CYS D 28 CYS D 111 1555 1555 2.01 SSBOND *** CYS D 61 CYS D 77 1555 1555 2.03 SSBOND *** CYS D 73 CYS D 91 1555 1555 2.03 LINK CA CA A 124 O LYS A 79 1555 1555 2.15 LINK CA CA A 124 O ASP A 84 1555 1555 2.24 LINK CA CA B 124 O LYS B 79 1555 1555 2.14 LINK CA CA B 124 OD1 ASP B 82 1555 1555 2.31 LINK CA CA B 124 O ASP B 84 1555 1555 2.28 LINK CA CA C 124 O LYS C 79 1555 1555 2.37 LINK CA CA C 124 O ASP C 84 1555 1555 2.26 LINK CA CA D 124 O ASP D 84 1555 1555 2.16 LINK CA CA D 124 OD1 ASP D 87 1555 1555 2.34 LINK CA CA A 124 OD1 ASP A 82 1555 1555 2.40 LINK CA CA A 124 OD1 ASP A 88 1555 1555 2.59 LINK CA CA A 124 OD1 ASP A 87 1555 1555 2.49 LINK CA CA A 124 O HOH A 149 1555 1555 2.77 LINK CA CA B 124 OD2 ASP B 82 1555 1555 3.39 LINK CA CA B 124 OD1 ASP B 88 1555 1555 2.70 LINK CA CA B 124 O HOH B 140 1555 1555 2.22 LINK CA CA B 124 O HOH B 139 1555 1555 2.40 LINK CA CA B 124 OD1 ASP B 87 1555 1555 2.68 LINK CA CA C 124 OD1 ASP C 82 1555 1555 2.43 LINK CA CA C 124 OD2 ASP C 82 1555 1555 3.14 LINK CA CA C 124 OD1 ASP C 87 1555 1555 2.68 LINK CA CA C 124 OD1 ASP C 88 1555 1555 2.67 LINK CA CA C 124 O ASP C 82 1555 1555 3.26 LINK CA CA D 124 OD2 ASP D 87 1555 1555 3.38 LINK CA CA D 124 OD1 ASP D 82 1555 1555 2.51 LINK CA CA D 124 O ASP D 82 1555 1555 2.66 LINK CA CA D 124 OD2 ASP D 82 1555 1555 3.13 LINK CA CA D 124 OD1 ASP D 88 1555 1555 2.74 LINK CA CA D 124 O LYS D 79 1555 1555 2.55 SITE *** AC1 6 LYS A 79 ASP A 82 ASP A 84 ASP A 87 SITE *** AC1 6 ASP A 88 HOH A 149 SITE *** AC2 7 LYS B 79 ASP B 82 ASP B 84 ASP B 87 SITE *** AC2 7 ASP B 88 HOH B 139 HOH B 140 SITE *** AC3 5 LYS C 79 ASP C 82 ASP C 84 ASP C 87 SITE *** AC3 5 ASP C 88 SITE *** AC4 5 LYS D 79 ASP D 82 ASP D 84 ASP D 87 SITE *** AC4 5 ASP D 88 CRYST1 58.620 60.130 77.180 90.00 96.85 90.00 P 1 21 1 8 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 0.017059 0.000000 0.002049 0.00000 SCALE2 0.000000 0.016631 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013050 0.00000 MTRIX1 1 0.970090 -0.007170 0.242640 -4.62755 1 MTRIX2 1 -0.007080 -0.999970 -0.001240 25.96332 1 MTRIX3 1 0.242650 -0.000520 -0.970110 38.36529 1 MTRIX1 2 -0.611410 -0.679510 -0.405500 47.31558 1 MTRIX2 2 0.591760 -0.052420 -0.804410 4.81523 1 MTRIX3 2 0.525350 -0.731790 0.434160 -4.94719 1 MTRIX1 3 -0.476770 -0.837590 -0.266710 41.91967 1 MTRIX2 3 -0.570190 0.063760 0.819030 21.05887 1 MTRIX3 3 -0.669010 0.542570 -0.507990 40.44951 1 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: D 71 ASN : amide:sc= -4.61! C(o=-5.2!,f=-10!) USER MOD Set 1.2: D 74 ASN : amide:sc= -0.579 K(o=-5.2,f=-4.3) USER MOD Set 2.1: D 57 ASN : amide:sc= -4.9! C(o=-5.2!,f=-4.5!) USER MOD Set 2.2: D 65 GLN : amide:sc= -0.263 K(o=-5.2,f=-7.2!) USER MOD Set 3.1: D 1XMET N :NH3+ 176:sc= -0.0723 (180deg=-0.101) USER MOD Set 3.2: D 39 GLN : amide:sc=-4.76e-05 K(o=-0.072,f=-0.77) USER MOD Set 4.1: D 29 THR OG1 : rot 71:sc= 1.26 USER MOD Set 4.2: D 107 HIS : no HE2:sc= -3.66! C(o=-2.4!,f=-4.5!) USER MOD Set 5.1: C 66 ASN : amide:sc= -5.91! K(o=-6.5!,f=-0.79) USER MOD Set 5.2: C 68 HIS : no HD1:sc= -0.549 K(o=-6.5,f=-3.1) USER MOD Set 6.1: C 43 GLN : amide:sc=-0.00344 K(o=-4,f=1.3) USER MOD Set 6.2: C 65 GLN : amide:sc= -4.01! K(o=-4!,f=1.3) USER MOD Set 7.1: C 29 THR OG1 : rot 71:sc= 1.35 USER MOD Set 7.2: C 107 HIS : no HD1:sc= 0.461 K(o=1.8,f=0.67) USER MOD Set 8.1: C 1XMET N :NH3+ -178:sc= 0 (180deg=0) USER MOD Set 8.2: C 39 GLN : amide:sc= -0.026 X(o=-0.026,f=-0.19) USER MOD Set 9.1: B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 9.2: B 66 ASN : amide:sc= -0.0426 X(o=-0.043,f=0) USER MOD Set10.1: B 56 ASN : amide:sc= 0.291 K(o=0.57,f=-7.9!) USER MOD Set10.2: B 103 TYR OH : rot 11:sc= 0.283 USER MOD Set11.1: B 44 ASN : amide:sc= -0.382 K(o=-0.38,f=-3.5!) USER MOD Set11.2: B 47 SER OG : rot 180:sc= 0 USER MOD Set12.1: B 43 GLN : amide:sc= -1.23 K(o=-2.9,f=1.9) USER MOD Set12.2: B 48 THR OG1 : rot 148:sc= -0.198 USER MOD Set12.3: B 65 GLN : amide:sc= -1.46 K(o=-2.9,f=0.4!) USER MOD Set13.1: A 107 HIS : no HD1:sc= 0.0169 K(o=0.017,f=-2.4) USER MOD Set13.2: A 112 SER OG : rot 180:sc= 0 USER MOD Set14.1: A 56 ASN : amide:sc= 0.42 K(o=0.61,f=-5.9!) USER MOD Set14.2: A 103 TYR OH : rot 17:sc= 0.195 USER MOD Set15.1: A 44 ASN : amide:sc= -8.53! K(o=-8.5!,f=-0.36) USER MOD Set15.2: A 47 SER OG : rot 180:sc= 0 USER MOD Set16.1: A 43 GLN : amide:sc= 1.11 K(o=2.2,f=-2.8) USER MOD Set16.2: A 48 THR OG1 : rot -59:sc= 1.28 USER MOD Set16.3: A 57 ASN : amide:sc= 0.15 K(o=2.2,f=-3.5!) USER MOD Set16.4: A 65 GLN : amide:sc= -0.327 K(o=2.2,f=-0.46!) USER MOD Single : A 1XMET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1XMET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= 2.02 K(o=2,f=0.63) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 166:sc= 1.22 (180deg=1.1) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ -159:sc= -0.185 (180deg=-0.552) USER MOD Single : A 18 TYR OH : rot 12:sc= 0.00659 USER MOD Single : A 22 SER OG : rot 180:sc= -1.57! USER MOD Single : A 29 THR OG1 : rot 75:sc= 1.27 USER MOD Single : A 30 THR OG1 : rot -77:sc= 1.39 USER MOD Single : A 32 HIS : no HD1:sc= -0.183 X(o=-0.18,f=-0.18) USER MOD Single : A 33 THR OG1 : rot 71:sc= 1.39 USER MOD Single : A 34 SER OG : rot -112:sc= 1.28 USER MOD Single : A 36 TYR OH : rot 7:sc= 0.368 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.0144 USER MOD Single : A 39 GLN : amide:sc=-0.00345 X(o=-0.0035,f=-0.49) USER MOD Single : A 45 ASN : amide:sc= -0.123 X(o=-0.12,f=0) USER MOD Single : A 50 TYR OH : rot 3:sc= 0.0078 USER MOD Single : A 54 GLN : amide:sc= 0.191 X(o=0.19,f=-0.19) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ -147:sc= -0.417! (180deg=-2.1!) USER MOD Single : A 66 ASN : amide:sc= 0.013 K(o=0.013,f=-0.72) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 69 SER OG : rot 167:sc= 0.763 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -1.79 K(o=-1.8,f=-6.1!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot -135:sc= -0.118 USER MOD Single : A 79 LYS NZ :NH3+ 146:sc= 0 (180deg=-0.56) USER MOD Single : A 86 THR OG1 : rot 86:sc= 0.645 USER MOD Single : A 93 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00422) USER MOD Single : A 94 LYS NZ :NH3+ 149:sc= -0.284 (180deg=-1.5) USER MOD Single : A 98 LYS NZ :NH3+ 141:sc= -0.249 (180deg=-0.94) USER MOD Single : A 102 ASN : amide:sc= 0.828 K(o=0.83,f=0.25) USER MOD Single : A 108 LYS NZ :NH3+ -156:sc= 1.32 (180deg=1.24) USER MOD Single : A 114 LYS NZ :NH3+ -141:sc= -0.0788 (180deg=-0.327) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1XMET CE :methyl 175:sc= 0 (180deg=-0.0116) USER MOD Single : B 1XMET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= 2.19 K(o=2.2,f=0.48) USER MOD Single : B 4 THR OG1 : rot 180:sc= -3.06! USER MOD Single : B 5 LYS NZ :NH3+ -176:sc= 0.387 (180deg=0.38) USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 TYR OH : rot 167:sc= 0.237 USER MOD Single : B 22 SER OG : rot 180:sc= -0.586 USER MOD Single : B 29 THR OG1 : rot 80:sc= 0.865 USER MOD Single : B 30 THR OG1 : rot -75:sc= 0.69 USER MOD Single : B 32 HIS : no HD1:sc= -2.13 X(o=-2.1,f=-2.4!) USER MOD Single : B 33 THR OG1 : rot 83:sc= 1.59 USER MOD Single : B 34 SER OG : rot -125:sc= 0.91 USER MOD Single : B 36 TYR OH : rot 11:sc= 1.04 USER MOD Single : B 38 THR OG1 : rot -57:sc= 0.346 USER MOD Single : B 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 45 ASN : amide:sc= -1.25 X(o=-1.2,f=-1.5) USER MOD Single : B 50 TYR OH : rot 35:sc= 1.27 USER MOD Single : B 54 GLN : amide:sc= -1.35 K(o=-1.3,f=-6.1!) USER MOD Single : B 57 ASN : amide:sc= -0.842 K(o=-0.84,f=-8.8!) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 HIS : no HD1:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : B 69 SER OG : rot 167:sc= 0.464 USER MOD Single : B 70 SER OG : rot 180:sc= 0.0354 USER MOD Single : B 71 ASN : amide:sc= -3.7! C(o=-3.7!,f=-7.9!) USER MOD Single : B 74 ASN : amide:sc= -0.271 X(o=-0.27,f=0) USER MOD Single : B 76 SER OG : rot -133:sc= 1.33 USER MOD Single : B 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 THR OG1 : rot 69:sc= 1.09 USER MOD Single : B 93 LYS NZ :NH3+ 144:sc= 0.713 (180deg=0.134) USER MOD Single : B 94 LYS NZ :NH3+ -139:sc= -0.33 (180deg=-1.11!) USER MOD Single : B 98 LYS NZ :NH3+ -164:sc= -0.0904 (180deg=-0.406) USER MOD Single : B 102 ASN : amide:sc= 0.914 K(o=0.91,f=-0.34) USER MOD Single : B 107 HIS : no HD1:sc= 1.28 K(o=1.3,f=-1.7) USER MOD Single : B 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 SER OG : rot 73:sc=0.000799 USER MOD Single : B 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 117 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.043) USER MOD Single : C 1XMET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 2 GLN : amide:sc= 0.288 X(o=0.29,f=0) USER MOD Single : C 4 THR OG1 : rot -150:sc= -1.43 USER MOD Single : C 5 LYS NZ :NH3+ 164:sc= 0.0999 (180deg=0.0577) USER MOD Single : C 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 18 TYR OH : rot -6:sc= 0.17 USER MOD Single : C 22 SER OG : rot 180:sc= -0.111 USER MOD Single : C 30 THR OG1 : rot -75:sc= 0.634 USER MOD Single : C 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 33 THR OG1 : rot 81:sc= 1.14 USER MOD Single : C 34 SER OG : rot -106:sc= 1.26 USER MOD Single : C 36 TYR OH : rot 25:sc= 0.584 USER MOD Single : C 38 THR OG1 : rot 110:sc= -2.65! USER MOD Single : C 44 ASN : amide:sc= -1.53 X(o=-1.5,f=-1.1) USER MOD Single : C 45 ASN : amide:sc= -0.478 X(o=-0.48,f=-0.58) USER MOD Single : C 47 SER OG : rot 180:sc= -0.156 USER MOD Single : C 48 THR OG1 : rot 180:sc= 0 USER MOD Single : C 50 TYR OH : rot 180:sc= 0 USER MOD Single : C 54 GLN : amide:sc= 1.01 K(o=1,f=-0.79) USER MOD Single : C 56 ASN : amide:sc= -2.94 K(o=-2.9,f=-7.3!) USER MOD Single : C 57 ASN : amide:sc= -2.31! C(o=-2.3!,f=-5.1!) USER MOD Single : C 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 62 LYS NZ :NH3+ -170:sc= -0.0115 (180deg=-0.0509) USER MOD Single : C 69 SER OG : rot 155:sc= 0.736 USER MOD Single : C 70 SER OG : rot 180:sc= 0 USER MOD Single : C 71 ASN : amide:sc= -3.97! C(o=-4!,f=-7.7!) USER MOD Single : C 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 76 SER OG : rot 180:sc= 0 USER MOD Single : C 79 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.111) USER MOD Single : C 86 THR OG1 : rot 89:sc= 0.844 USER MOD Single : C 93 LYS NZ :NH3+ -114:sc= -0.0769 (180deg=-0.296) USER MOD Single : C 94 LYS NZ :NH3+ 151:sc= -0.955 (180deg=-2.4!) USER MOD Single : C 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 102 ASN : amide:sc= -0.0288 X(o=-0.029,f=-0.16) USER MOD Single : C 103 TYR OH : rot -153:sc= 0.475 USER MOD Single : C 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 112 SER OG : rot 128:sc= 1.24 USER MOD Single : C 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 117 GLN : amide:sc=-0.00207 K(o=-0.0021,f=-0.79) USER MOD Single : D 1XMET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 4 THR OG1 : rot -77:sc= -2.12! USER MOD Single : D 5 LYS NZ :NH3+ 147:sc= -0.316 (180deg=-1.67!) USER MOD Single : D 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 18 TYR OH : rot 10:sc= 0.0107 USER MOD Single : D 22 SER OG : rot 180:sc= -0.0361 USER MOD Single : D 30 THR OG1 : rot -74:sc= 0.459 USER MOD Single : D 32 HIS : no HE2:sc= 1.25 K(o=1.2,f=-2!) USER MOD Single : D 33 THR OG1 : rot 81:sc= 1.24 USER MOD Single : D 34 SER OG : rot -110:sc= 1.16 USER MOD Single : D 36 TYR OH : rot 36:sc= 0.962 USER MOD Single : D 38 THR OG1 : rot -90:sc= 0.0337 USER MOD Single : D 43 GLN : amide:sc= -3.65! C(o=-3.6!,f=-0.81!) USER MOD Single : D 44 ASN : amide:sc= -0.0415 X(o=-0.042,f=0) USER MOD Single : D 45 ASN : amide:sc= -0.167 X(o=-0.17,f=-0.45) USER MOD Single : D 47 SER OG : rot -82:sc= 0.564 USER MOD Single : D 48 THR OG1 : rot 180:sc= 0 USER MOD Single : D 50 TYR OH : rot 21:sc= 0.988 USER MOD Single : D 54 GLN : amide:sc= -0.89 K(o=-0.89,f=-3.2!) USER MOD Single : D 56 ASN : amide:sc= -3.59! C(o=-3.6!,f=-6.7!) USER MOD Single : D 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 66 ASN : amide:sc= -0.0509 X(o=-0.051,f=-0.22) USER MOD Single : D 68 HIS : no HD1:sc= -0.403 X(o=-0.4,f=-0.81) USER MOD Single : D 69 SER OG : rot 34:sc= 0.0735 USER MOD Single : D 70 SER OG : rot 180:sc= 0.0939 USER MOD Single : D 76 SER OG : rot 180:sc= 0 USER MOD Single : D 79 LYS NZ :NH3+ 180:sc= -0.267 (180deg=-0.267) USER MOD Single : D 86 THR OG1 : rot 96:sc= 0.478 USER MOD Single : D 93 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00524) USER MOD Single : D 94 LYS NZ :NH3+ -138:sc= -0.245 (180deg=-0.387) USER MOD Single : D 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 102 ASN : amide:sc= 0.492 K(o=0.49,f=-3.1!) USER MOD Single : D 103 TYR OH : rot -140:sc= -0.379 USER MOD Single : D 108 LYS NZ :NH3+ 169:sc=-0.00248 (180deg=-0.178) USER MOD Single : D 112 SER OG : rot 107:sc= 1.19 USER MOD Single : D 114 LYS NZ :NH3+ 171:sc= -0.0383 (180deg=-0.0815) USER MOD Single : D 117 GLN : amide:sc= -1.36! K(o=-1.4!,f=-0.3) USER MOD Single : D 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1X -4.670 8.559 14.977 1.00 58.59 N ATOM 2 CA MET A 1X -4.756 8.703 13.497 1.00 57.99 C ATOM 3 C MET A 1X -4.009 9.945 13.012 1.00 56.71 C ATOM 4 O MET A 1X -4.170 11.024 13.575 1.00 61.37 O ATOM 5 CB MET A 1X -6.215 8.796 13.075 1.00 57.93 C ATOM 6 CG MET A 1X -6.403 8.983 11.606 1.00 59.93 C ATOM 7 SD MET A 1X -6.228 7.453 10.768 1.00 64.51 S ATOM 8 CE MET A 1X -7.974 6.957 10.654 1.00 61.07 C ATOM 0 H1 MET A 1X -5.112 7.830 15.231 1.00 58.59 H new ATOM 0 H2 MET A 1X -3.817 8.487 15.219 1.00 58.59 H new ATOM 0 H3 MET A 1X -5.029 9.274 15.366 1.00 58.59 H new ATOM 0 HA MET A 1X -4.342 7.923 13.096 1.00 57.99 H new ATOM 0 HB2 MET A 1X -6.676 7.989 13.352 1.00 57.93 H new ATOM 0 HB3 MET A 1X -6.633 9.536 13.543 1.00 57.93 H new ATOM 0 HG2 MET A 1X -7.281 9.356 11.431 1.00 59.93 H new ATOM 0 HG3 MET A 1X -5.753 9.619 11.269 1.00 59.93 H new ATOM 0 HE1 MET A 1X -8.039 6.102 10.200 1.00 61.07 H new ATOM 0 HE2 MET A 1X -8.347 6.878 11.546 1.00 61.07 H new ATOM 0 HE3 MET A 1X -8.469 7.626 10.155 1.00 61.07 H new ATOM 9 N GLU A 1 -3.175 9.773 11.989 1.00 54.89 N ATOM 10 CA GLU A 1 -2.393 10.859 11.399 1.00 48.90 C ATOM 11 C GLU A 1 -1.781 10.351 10.092 1.00 41.70 C ATOM 12 O GLU A 1 -0.707 9.751 10.095 1.00 40.34 O ATOM 13 CB GLU A 1 -1.313 11.335 12.362 1.00 51.96 C ATOM 14 CG GLU A 1 -0.875 12.780 12.125 1.00 62.75 C ATOM 15 CD GLU A 1 -2.057 13.724 11.972 1.00 69.41 C ATOM 16 OE1 GLU A 1 -2.965 13.703 12.831 1.00 74.76 O ATOM 17 OE2 GLU A 1 -2.079 14.484 10.983 1.00 72.31 O ATOM 0 H GLU A 1 -3.045 9.011 11.612 1.00 54.89 H new ATOM 0 HA GLU A 1 -2.967 11.620 11.218 1.00 48.90 H new ATOM 0 HB2 GLU A 1 -1.640 11.249 13.271 1.00 51.96 H new ATOM 0 HB3 GLU A 1 -0.541 10.754 12.283 1.00 51.96 H new ATOM 0 HG2 GLU A 1 -0.323 13.074 12.866 1.00 62.75 H new ATOM 0 HG3 GLU A 1 -0.325 12.822 11.327 1.00 62.75 H new ATOM 18 N GLN A 2 -2.520 10.533 9.001 1.00 33.00 N ATOM 19 CA GLN A 2 -2.108 10.072 7.690 1.00 32.57 C ATOM 20 C GLN A 2 -1.368 11.096 6.866 1.00 34.11 C ATOM 21 O GLN A 2 -1.543 12.300 7.035 1.00 33.43 O ATOM 22 CB GLN A 2 -3.311 9.675 6.836 1.00 33.17 C ATOM 23 CG GLN A 2 -4.047 8.420 7.199 1.00 29.59 C ATOM 24 CD GLN A 2 -5.214 8.179 6.248 1.00 22.51 C ATOM 25 OE1 GLN A 2 -6.311 8.688 6.458 1.00 26.37 O ATOM 26 NE2 GLN A 2 -4.978 7.403 5.201 1.00 24.84 N ATOM 0 H GLN A 2 -3.282 10.932 9.006 1.00 33.00 H new ATOM 0 HA GLN A 2 -1.521 9.327 7.893 1.00 32.57 H new ATOM 0 HB2 GLN A 2 -3.945 10.408 6.857 1.00 33.17 H new ATOM 0 HB3 GLN A 2 -3.009 9.588 5.919 1.00 33.17 H new ATOM 0 HG2 GLN A 2 -3.440 7.664 7.169 1.00 29.59 H new ATOM 0 HG3 GLN A 2 -4.375 8.485 8.110 1.00 29.59 H new ATOM 0 HE21 GLN A 2 -4.197 7.063 5.085 1.00 24.84 H new ATOM 0 HE22 GLN A 2 -5.606 7.239 4.637 1.00 24.84 H new ATOM 27 N LEU A 3 -0.589 10.583 5.919 1.00 28.61 N ATOM 28 CA LEU A 3 0.155 11.393 5.001 1.00 22.87 C ATOM 29 C LEU A 3 -0.583 11.096 3.723 1.00 25.98 C ATOM 30 O LEU A 3 -1.386 10.171 3.693 1.00 27.31 O ATOM 31 CB LEU A 3 1.583 10.865 4.840 1.00 25.46 C ATOM 32 CG LEU A 3 2.671 10.852 5.916 1.00 24.05 C ATOM 33 CD1 LEU A 3 4.052 10.896 5.290 1.00 19.30 C ATOM 34 CD2 LEU A 3 2.506 12.050 6.749 1.00 24.30 C ATOM 0 H LEU A 3 -0.484 9.738 5.800 1.00 28.61 H new ATOM 0 HA LEU A 3 0.220 12.324 5.264 1.00 22.87 H new ATOM 0 HB2 LEU A 3 1.489 9.943 4.553 1.00 25.46 H new ATOM 0 HB3 LEU A 3 1.960 11.357 4.094 1.00 25.46 H new ATOM 0 HG LEU A 3 2.588 10.039 6.439 1.00 24.05 H new ATOM 0 HD11 LEU A 3 4.725 10.887 5.989 1.00 19.30 H new ATOM 0 HD12 LEU A 3 4.172 10.123 4.716 1.00 19.30 H new ATOM 0 HD13 LEU A 3 4.144 11.706 4.764 1.00 19.30 H new ATOM 0 HD21 LEU A 3 3.188 12.061 7.439 1.00 24.30 H new ATOM 0 HD22 LEU A 3 2.593 12.843 6.197 1.00 24.30 H new ATOM 0 HD23 LEU A 3 1.628 12.039 7.162 1.00 24.30 H new ATOM 35 N THR A 4 -0.318 11.871 2.673 1.00 27.75 N ATOM 36 CA THR A 4 -0.917 11.619 1.371 1.00 25.67 C ATOM 37 C THR A 4 0.145 10.887 0.541 1.00 25.27 C ATOM 38 O THR A 4 1.325 10.902 0.877 1.00 30.44 O ATOM 39 CB THR A 4 -1.303 12.913 0.611 1.00 25.49 C ATOM 40 OG1 THR A 4 -0.111 13.561 0.148 1.00 30.46 O ATOM 41 CG2 THR A 4 -2.115 13.843 1.498 1.00 18.08 C ATOM 0 H THR A 4 0.209 12.550 2.697 1.00 27.75 H new ATOM 0 HA THR A 4 -1.733 11.112 1.502 1.00 25.67 H new ATOM 0 HB THR A 4 -1.857 12.681 -0.151 1.00 25.49 H new ATOM 0 HG1 THR A 4 -0.316 14.263 -0.266 1.00 30.46 H new ATOM 0 HG21 THR A 4 -2.345 14.644 1.002 1.00 18.08 H new ATOM 0 HG22 THR A 4 -2.927 13.394 1.780 1.00 18.08 H new ATOM 0 HG23 THR A 4 -1.592 14.085 2.278 1.00 18.08 H new ATOM 42 N LYS A 5 -0.277 10.246 -0.535 1.00 25.78 N ATOM 43 CA LYS A 5 0.630 9.526 -1.405 1.00 27.72 C ATOM 44 C LYS A 5 1.900 10.321 -1.716 1.00 32.14 C ATOM 45 O LYS A 5 3.017 9.815 -1.569 1.00 33.09 O ATOM 46 CB LYS A 5 -0.094 9.196 -2.711 1.00 22.71 C ATOM 47 CG LYS A 5 0.730 8.411 -3.677 1.00 26.63 C ATOM 48 CD LYS A 5 -0.116 7.915 -4.792 1.00 27.11 C ATOM 49 CE LYS A 5 -0.109 8.866 -5.909 1.00 31.09 C ATOM 50 NZ LYS A 5 -0.998 8.309 -6.957 1.00 39.38 N ATOM 0 H LYS A 5 -1.100 10.217 -0.781 1.00 25.78 H new ATOM 0 HA LYS A 5 0.902 8.717 -0.944 1.00 27.72 H new ATOM 0 HB2 LYS A 5 -0.900 8.697 -2.507 1.00 22.71 H new ATOM 0 HB3 LYS A 5 -0.372 10.023 -3.134 1.00 22.71 H new ATOM 0 HG2 LYS A 5 1.445 8.965 -4.027 1.00 26.63 H new ATOM 0 HG3 LYS A 5 1.148 7.663 -3.222 1.00 26.63 H new ATOM 0 HD2 LYS A 5 0.210 7.053 -5.093 1.00 27.11 H new ATOM 0 HD3 LYS A 5 -1.025 7.781 -4.480 1.00 27.11 H new ATOM 0 HE2 LYS A 5 -0.423 9.737 -5.620 1.00 31.09 H new ATOM 0 HE3 LYS A 5 0.791 8.987 -6.251 1.00 31.09 H new ATOM 0 HZ1 LYS A 5 -1.181 8.940 -7.557 1.00 39.38 H new ATOM 0 HZ2 LYS A 5 -0.592 7.626 -7.359 1.00 39.38 H new ATOM 0 HZ3 LYS A 5 -1.755 8.026 -6.585 1.00 39.38 H new ATOM 51 N CYS A 6 1.712 11.581 -2.118 1.00 36.29 N ATOM 52 CA CYS A 6 2.812 12.464 -2.488 1.00 37.00 C ATOM 53 C CYS A 6 3.717 12.823 -1.311 1.00 32.96 C ATOM 54 O CYS A 6 4.907 13.037 -1.492 1.00 30.32 O ATOM 55 CB CYS A 6 2.274 13.736 -3.163 1.00 47.69 C ATOM 56 SG CYS A 6 1.742 13.637 -4.910 1.00 52.48 S ATOM 0 H CYS A 6 0.936 11.946 -2.183 1.00 36.29 H new ATOM 0 HA CYS A 6 3.363 11.972 -3.117 1.00 37.00 H new ATOM 0 HB2 CYS A 6 1.519 14.050 -2.642 1.00 47.69 H new ATOM 0 HB3 CYS A 6 2.963 14.416 -3.102 1.00 47.69 H new ATOM 57 N GLU A 7 3.141 12.923 -0.114 1.00 31.98 N ATOM 58 CA GLU A 7 3.904 13.235 1.090 1.00 28.58 C ATOM 59 C GLU A 7 4.787 12.044 1.415 1.00 33.99 C ATOM 60 O GLU A 7 5.965 12.213 1.743 1.00 36.61 O ATOM 61 CB GLU A 7 2.974 13.543 2.281 1.00 29.08 C ATOM 62 CG GLU A 7 2.396 14.964 2.256 1.00 32.38 C ATOM 63 CD GLU A 7 1.196 15.200 3.184 1.00 37.03 C ATOM 64 OE1 GLU A 7 1.185 14.806 4.360 1.00 38.18 O ATOM 65 OE2 GLU A 7 0.241 15.830 2.720 1.00 46.25 O ATOM 0 H GLU A 7 2.299 12.812 0.021 1.00 31.98 H new ATOM 0 HA GLU A 7 4.443 14.026 0.930 1.00 28.58 H new ATOM 0 HB2 GLU A 7 2.244 12.905 2.285 1.00 29.08 H new ATOM 0 HB3 GLU A 7 3.466 13.416 3.107 1.00 29.08 H new ATOM 0 HG2 GLU A 7 3.099 15.588 2.496 1.00 32.38 H new ATOM 0 HG3 GLU A 7 2.129 15.173 1.347 1.00 32.38 H new ATOM 66 N VAL A 8 4.229 10.835 1.303 1.00 33.61 N ATOM 67 CA VAL A 8 4.983 9.621 1.587 1.00 31.19 C ATOM 68 C VAL A 8 6.154 9.538 0.612 1.00 31.33 C ATOM 69 O VAL A 8 7.253 9.114 0.969 1.00 34.40 O ATOM 70 CB VAL A 8 4.090 8.359 1.457 1.00 31.57 C ATOM 71 CG1 VAL A 8 4.837 7.110 1.902 1.00 28.95 C ATOM 72 CG2 VAL A 8 2.885 8.500 2.295 1.00 23.23 C ATOM 0 H VAL A 8 3.414 10.701 1.063 1.00 33.61 H new ATOM 0 HA VAL A 8 5.307 9.655 2.501 1.00 31.19 H new ATOM 0 HB VAL A 8 3.844 8.272 0.523 1.00 31.57 H new ATOM 0 HG11 VAL A 8 4.258 6.337 1.811 1.00 28.95 H new ATOM 0 HG12 VAL A 8 5.625 6.990 1.349 1.00 28.95 H new ATOM 0 HG13 VAL A 8 5.104 7.206 2.829 1.00 28.95 H new ATOM 0 HG21 VAL A 8 2.334 7.706 2.206 1.00 23.23 H new ATOM 0 HG22 VAL A 8 3.147 8.610 3.223 1.00 23.23 H new ATOM 0 HG23 VAL A 8 2.380 9.277 2.008 1.00 23.23 H new ATOM 73 N PHE A 9 5.918 9.956 -0.620 1.00 31.05 N ATOM 74 CA PHE A 9 6.942 9.942 -1.655 1.00 32.88 C ATOM 75 C PHE A 9 8.083 10.896 -1.267 1.00 36.09 C ATOM 76 O PHE A 9 9.246 10.645 -1.580 1.00 40.02 O ATOM 77 CB PHE A 9 6.303 10.410 -2.957 1.00 35.10 C ATOM 78 CG PHE A 9 6.825 9.729 -4.191 1.00 39.18 C ATOM 79 CD1 PHE A 9 8.101 9.992 -4.667 1.00 43.26 C ATOM 80 CD2 PHE A 9 6.014 8.863 -4.909 1.00 41.86 C ATOM 81 CE1 PHE A 9 8.558 9.406 -5.848 1.00 46.35 C ATOM 82 CE2 PHE A 9 6.469 8.272 -6.096 1.00 45.07 C ATOM 83 CZ PHE A 9 7.741 8.545 -6.563 1.00 46.84 C ATOM 0 H PHE A 9 5.157 10.258 -0.883 1.00 31.05 H new ATOM 0 HA PHE A 9 7.305 9.048 -1.759 1.00 32.88 H new ATOM 0 HB2 PHE A 9 5.345 10.266 -2.903 1.00 35.10 H new ATOM 0 HB3 PHE A 9 6.442 11.366 -3.046 1.00 35.10 H new ATOM 0 HD1 PHE A 9 8.659 10.566 -4.193 1.00 43.26 H new ATOM 0 HD2 PHE A 9 5.158 8.672 -4.599 1.00 41.86 H new ATOM 0 HE1 PHE A 9 9.415 9.594 -6.157 1.00 46.35 H new ATOM 0 HE2 PHE A 9 5.914 7.695 -6.570 1.00 45.07 H new ATOM 0 HZ PHE A 9 8.046 8.154 -7.350 1.00 46.84 H new ATOM 84 N ARG A 10 7.741 11.963 -0.544 1.00 38.19 N ATOM 85 CA ARG A 10 8.690 12.984 -0.105 1.00 35.20 C ATOM 86 C ARG A 10 9.424 12.547 1.128 1.00 35.74 C ATOM 87 O ARG A 10 10.634 12.716 1.234 1.00 39.99 O ATOM 88 CB ARG A 10 7.940 14.283 0.200 1.00 42.61 C ATOM 89 CG ARG A 10 8.699 15.558 -0.103 1.00 56.41 C ATOM 90 CD ARG A 10 9.450 16.065 1.104 1.00 68.10 C ATOM 91 NE ARG A 10 8.533 16.426 2.185 1.00 78.29 N ATOM 92 CZ ARG A 10 8.919 16.891 3.371 1.00 83.98 C ATOM 93 NH1 ARG A 10 10.217 17.050 3.646 1.00 85.70 N ATOM 94 NH2 ARG A 10 8.005 17.196 4.288 1.00 82.62 N ATOM 0 H ARG A 10 6.934 12.116 -0.290 1.00 38.19 H new ATOM 0 HA ARG A 10 9.333 13.124 -0.818 1.00 35.20 H new ATOM 0 HB2 ARG A 10 7.113 14.288 -0.308 1.00 42.61 H new ATOM 0 HB3 ARG A 10 7.696 14.285 1.139 1.00 42.61 H new ATOM 0 HG2 ARG A 10 9.323 15.398 -0.828 1.00 56.41 H new ATOM 0 HG3 ARG A 10 8.079 16.239 -0.407 1.00 56.41 H new ATOM 0 HD2 ARG A 10 10.067 15.384 1.414 1.00 68.10 H new ATOM 0 HD3 ARG A 10 9.982 16.837 0.856 1.00 68.10 H new ATOM 0 HE ARG A 10 7.690 16.332 2.045 1.00 78.29 H new ATOM 0 HH11 ARG A 10 10.809 16.851 3.055 1.00 85.70 H new ATOM 0 HH12 ARG A 10 10.460 17.351 4.414 1.00 85.70 H new ATOM 0 HH21 ARG A 10 7.169 17.092 4.113 1.00 82.62 H new ATOM 0 HH22 ARG A 10 8.250 17.497 5.056 1.00 82.62 H new ATOM 95 N GLU A 11 8.686 11.999 2.082 1.00 35.96 N ATOM 96 CA GLU A 11 9.296 11.543 3.311 1.00 35.33 C ATOM 97 C GLU A 11 10.028 10.192 3.313 1.00 34.57 C ATOM 98 O GLU A 11 10.744 9.904 4.253 1.00 39.00 O ATOM 99 CB GLU A 11 8.308 11.669 4.469 1.00 39.04 C ATOM 100 CG GLU A 11 8.109 13.129 4.904 1.00 45.56 C ATOM 101 CD GLU A 11 8.029 13.280 6.413 1.00 53.19 C ATOM 102 OE1 GLU A 11 8.975 12.801 7.103 1.00 55.28 O ATOM 103 OE2 GLU A 11 7.021 13.866 6.898 1.00 55.59 O ATOM 0 H GLU A 11 7.835 11.884 2.035 1.00 35.96 H new ATOM 0 HA GLU A 11 10.044 12.150 3.425 1.00 35.33 H new ATOM 0 HB2 GLU A 11 7.454 11.292 4.206 1.00 39.04 H new ATOM 0 HB3 GLU A 11 8.627 11.149 5.223 1.00 39.04 H new ATOM 0 HG2 GLU A 11 8.842 13.667 4.566 1.00 45.56 H new ATOM 0 HG3 GLU A 11 7.296 13.475 4.504 1.00 45.56 H new ATOM 104 N LEU A 12 9.890 9.377 2.273 1.00 35.09 N ATOM 105 CA LEU A 12 10.595 8.087 2.225 1.00 38.28 C ATOM 106 C LEU A 12 11.802 8.176 1.285 1.00 42.48 C ATOM 107 O LEU A 12 12.340 7.158 0.846 1.00 43.54 O ATOM 108 CB LEU A 12 9.682 6.971 1.710 1.00 31.59 C ATOM 109 CG LEU A 12 8.436 6.513 2.452 1.00 31.67 C ATOM 110 CD1 LEU A 12 8.161 5.083 2.050 1.00 19.41 C ATOM 111 CD2 LEU A 12 8.670 6.598 3.928 1.00 28.32 C ATOM 0 H LEU A 12 9.399 9.545 1.587 1.00 35.09 H new ATOM 0 HA LEU A 12 10.879 7.884 3.130 1.00 38.28 H new ATOM 0 HB2 LEU A 12 9.392 7.239 0.824 1.00 31.59 H new ATOM 0 HB3 LEU A 12 10.241 6.186 1.600 1.00 31.59 H new ATOM 0 HG LEU A 12 7.678 7.076 2.230 1.00 31.67 H new ATOM 0 HD11 LEU A 12 7.369 4.764 2.510 1.00 19.41 H new ATOM 0 HD12 LEU A 12 8.018 5.038 1.092 1.00 19.41 H new ATOM 0 HD13 LEU A 12 8.919 4.528 2.290 1.00 19.41 H new ATOM 0 HD21 LEU A 12 7.874 6.306 4.399 1.00 28.32 H new ATOM 0 HD22 LEU A 12 9.417 6.029 4.171 1.00 28.32 H new ATOM 0 HD23 LEU A 12 8.871 7.515 4.172 1.00 28.32 H new ATOM 112 N LYS A 13 12.244 9.393 0.999 1.00 50.05 N ATOM 113 CA LYS A 13 13.341 9.617 0.066 1.00 54.62 C ATOM 114 C LYS A 13 14.638 8.858 0.325 1.00 53.56 C ATOM 115 O LYS A 13 15.376 8.590 -0.612 1.00 54.94 O ATOM 116 CB LYS A 13 13.620 11.120 -0.075 1.00 63.01 C ATOM 117 CG LYS A 13 14.348 11.495 -1.362 1.00 71.05 C ATOM 118 CD LYS A 13 14.193 12.987 -1.711 1.00 78.62 C ATOM 119 CE LYS A 13 14.830 13.302 -3.081 1.00 81.42 C ATOM 120 NZ LYS A 13 14.627 14.707 -3.573 1.00 78.00 N ATOM 0 H LYS A 13 11.918 10.112 1.339 1.00 50.05 H new ATOM 0 HA LYS A 13 13.017 9.238 -0.766 1.00 54.62 H new ATOM 0 HB2 LYS A 13 12.779 11.601 -0.038 1.00 63.01 H new ATOM 0 HB3 LYS A 13 14.149 11.414 0.683 1.00 63.01 H new ATOM 0 HG2 LYS A 13 15.290 11.283 -1.271 1.00 71.05 H new ATOM 0 HG3 LYS A 13 14.005 10.957 -2.093 1.00 71.05 H new ATOM 0 HD2 LYS A 13 13.252 13.223 -1.726 1.00 78.62 H new ATOM 0 HD3 LYS A 13 14.611 13.529 -1.024 1.00 78.62 H new ATOM 0 HE2 LYS A 13 15.783 13.128 -3.026 1.00 81.42 H new ATOM 0 HE3 LYS A 13 14.467 12.689 -3.739 1.00 81.42 H new ATOM 0 HZ1 LYS A 13 15.023 14.805 -4.364 1.00 78.00 H new ATOM 0 HZ2 LYS A 13 13.756 14.870 -3.655 1.00 78.00 H new ATOM 0 HZ3 LYS A 13 14.982 15.280 -2.991 1.00 78.00 H new ATOM 121 N ASP A 14 14.918 8.496 1.572 1.00 52.65 N ATOM 122 CA ASP A 14 16.150 7.775 1.859 1.00 52.15 C ATOM 123 C ASP A 14 16.149 6.340 1.397 1.00 52.81 C ATOM 124 O ASP A 14 17.200 5.787 1.057 1.00 59.92 O ATOM 125 CB ASP A 14 16.462 7.802 3.338 1.00 54.58 C ATOM 126 CG ASP A 14 16.967 9.143 3.789 1.00 59.42 C ATOM 127 OD1 ASP A 14 18.024 9.583 3.262 1.00 55.46 O ATOM 128 OD2 ASP A 14 16.297 9.749 4.661 1.00 64.67 O ATOM 0 H ASP A 14 14.418 8.655 2.254 1.00 52.65 H new ATOM 0 HA ASP A 14 16.833 8.243 1.353 1.00 52.15 H new ATOM 0 HB2 ASP A 14 15.663 7.574 3.839 1.00 54.58 H new ATOM 0 HB3 ASP A 14 17.126 7.124 3.539 1.00 54.58 H new ATOM 129 N LEU A 15 14.967 5.737 1.390 1.00 51.16 N ATOM 130 CA LEU A 15 14.807 4.334 1.007 1.00 46.86 C ATOM 131 C LEU A 15 14.871 4.087 -0.484 1.00 42.03 C ATOM 132 O LEU A 15 14.873 2.941 -0.922 1.00 46.00 O ATOM 133 CB LEU A 15 13.487 3.781 1.577 1.00 40.91 C ATOM 134 CG LEU A 15 13.395 3.816 3.110 1.00 30.25 C ATOM 135 CD1 LEU A 15 11.951 3.772 3.501 1.00 26.04 C ATOM 136 CD2 LEU A 15 14.240 2.677 3.777 1.00 18.35 C ATOM 0 H LEU A 15 14.232 6.128 1.607 1.00 51.16 H new ATOM 0 HA LEU A 15 15.566 3.864 1.388 1.00 46.86 H new ATOM 0 HB2 LEU A 15 12.749 4.291 1.208 1.00 40.91 H new ATOM 0 HB3 LEU A 15 13.377 2.865 1.278 1.00 40.91 H new ATOM 0 HG LEU A 15 13.783 4.642 3.440 1.00 30.25 H new ATOM 0 HD11 LEU A 15 11.877 3.793 4.468 1.00 26.04 H new ATOM 0 HD12 LEU A 15 11.490 4.538 3.125 1.00 26.04 H new ATOM 0 HD13 LEU A 15 11.549 2.956 3.164 1.00 26.04 H new ATOM 0 HD21 LEU A 15 14.156 2.734 4.742 1.00 18.35 H new ATOM 0 HD22 LEU A 15 13.916 1.814 3.475 1.00 18.35 H new ATOM 0 HD23 LEU A 15 15.172 2.777 3.528 1.00 18.35 H new ATOM 137 N LYS A 16 14.892 5.159 -1.259 1.00 40.93 N ATOM 138 CA LYS A 16 14.922 5.062 -2.708 1.00 43.16 C ATOM 139 C LYS A 16 16.153 4.284 -3.168 1.00 45.96 C ATOM 140 O LYS A 16 17.276 4.747 -3.018 1.00 53.49 O ATOM 141 CB LYS A 16 14.899 6.470 -3.306 1.00 47.31 C ATOM 142 CG LYS A 16 15.115 6.572 -4.814 1.00 57.05 C ATOM 143 CD LYS A 16 13.915 6.075 -5.617 1.00 63.26 C ATOM 144 CE LYS A 16 13.969 6.558 -7.064 1.00 68.18 C ATOM 145 NZ LYS A 16 14.104 8.053 -7.188 1.00 68.94 N ATOM 0 H LYS A 16 14.889 5.965 -0.959 1.00 40.93 H new ATOM 0 HA LYS A 16 14.141 4.578 -3.018 1.00 43.16 H new ATOM 0 HB2 LYS A 16 14.044 6.876 -3.093 1.00 47.31 H new ATOM 0 HB3 LYS A 16 15.582 6.999 -2.865 1.00 47.31 H new ATOM 0 HG2 LYS A 16 15.296 7.495 -5.049 1.00 57.05 H new ATOM 0 HG3 LYS A 16 15.899 6.057 -5.060 1.00 57.05 H new ATOM 0 HD2 LYS A 16 13.892 5.105 -5.599 1.00 63.26 H new ATOM 0 HD3 LYS A 16 13.095 6.386 -5.202 1.00 63.26 H new ATOM 0 HE2 LYS A 16 14.717 6.134 -7.512 1.00 68.18 H new ATOM 0 HE3 LYS A 16 13.164 6.273 -7.524 1.00 68.18 H new ATOM 0 HZ1 LYS A 16 13.831 8.310 -7.995 1.00 68.94 H new ATOM 0 HZ2 LYS A 16 13.605 8.449 -6.566 1.00 68.94 H new ATOM 0 HZ3 LYS A 16 14.956 8.285 -7.076 1.00 68.94 H new ATOM 146 N GLY A 17 15.944 3.081 -3.686 1.00 44.02 N ATOM 147 CA GLY A 17 17.058 2.282 -4.153 1.00 37.72 C ATOM 148 C GLY A 17 17.599 1.293 -3.132 1.00 39.90 C ATOM 149 O GLY A 17 18.091 0.242 -3.535 1.00 44.34 O ATOM 0 H GLY A 17 15.171 2.714 -3.774 1.00 44.02 H new ATOM 0 HA2 GLY A 17 16.781 1.794 -4.944 1.00 37.72 H new ATOM 0 HA3 GLY A 17 17.776 2.876 -4.423 1.00 37.72 H new ATOM 150 N TYR A 18 17.516 1.601 -1.834 1.00 41.26 N ATOM 151 CA TYR A 18 18.026 0.725 -0.764 1.00 39.86 C ATOM 152 C TYR A 18 17.397 -0.622 -0.838 1.00 43.86 C ATOM 153 O TYR A 18 16.197 -0.740 -0.620 1.00 44.26 O ATOM 154 CB TYR A 18 17.719 1.266 0.629 1.00 38.91 C ATOM 155 CG TYR A 18 18.605 0.660 1.701 1.00 46.43 C ATOM 156 CD1 TYR A 18 18.341 -0.598 2.242 1.00 48.93 C ATOM 157 CD2 TYR A 18 19.752 1.324 2.133 1.00 51.49 C ATOM 158 CE1 TYR A 18 19.210 -1.184 3.179 1.00 50.25 C ATOM 159 CE2 TYR A 18 20.620 0.753 3.060 1.00 54.78 C ATOM 160 CZ TYR A 18 20.346 -0.496 3.575 1.00 54.95 C ATOM 161 OH TYR A 18 21.249 -1.044 4.456 1.00 58.22 O ATOM 0 H TYR A 18 17.160 2.329 -1.545 1.00 41.26 H new ATOM 0 HA TYR A 18 18.985 0.681 -0.900 1.00 39.86 H new ATOM 0 HB2 TYR A 18 17.830 2.230 0.629 1.00 38.91 H new ATOM 0 HB3 TYR A 18 16.790 1.088 0.844 1.00 38.91 H new ATOM 0 HD1 TYR A 18 17.577 -1.057 1.978 1.00 48.93 H new ATOM 0 HD2 TYR A 18 19.942 2.169 1.794 1.00 51.49 H new ATOM 0 HE1 TYR A 18 19.024 -2.025 3.530 1.00 50.25 H new ATOM 0 HE2 TYR A 18 21.382 1.213 3.331 1.00 54.78 H new ATOM 0 HH TYR A 18 21.083 -1.861 4.555 1.00 58.22 H new ATOM 162 N GLY A 19 18.238 -1.632 -1.067 1.00 48.98 N ATOM 163 CA GLY A 19 17.784 -3.010 -1.177 1.00 49.33 C ATOM 164 C GLY A 19 17.186 -3.339 -2.536 1.00 53.30 C ATOM 165 O GLY A 19 16.548 -4.387 -2.694 1.00 57.60 O ATOM 0 H GLY A 19 19.087 -1.533 -1.162 1.00 48.98 H new ATOM 0 HA2 GLY A 19 18.531 -3.605 -1.007 1.00 49.33 H new ATOM 0 HA3 GLY A 19 17.122 -3.182 -0.489 1.00 49.33 H new ATOM 166 N GLY A 20 17.388 -2.440 -3.506 1.00 52.74 N ATOM 167 CA GLY A 20 16.868 -2.603 -4.859 1.00 49.78 C ATOM 168 C GLY A 20 15.429 -2.122 -5.049 1.00 50.01 C ATOM 169 O GLY A 20 14.913 -2.028 -6.183 1.00 51.05 O ATOM 0 H GLY A 20 17.835 -1.714 -3.391 1.00 52.74 H new ATOM 0 HA2 GLY A 20 17.442 -2.120 -5.474 1.00 49.78 H new ATOM 0 HA3 GLY A 20 16.918 -3.541 -5.101 1.00 49.78 H new ATOM 170 N VAL A 21 14.786 -1.787 -3.936 1.00 44.80 N ATOM 171 CA VAL A 21 13.402 -1.341 -3.951 1.00 41.60 C ATOM 172 C VAL A 21 13.225 0.136 -4.311 1.00 39.30 C ATOM 173 O VAL A 21 13.844 1.014 -3.724 1.00 41.29 O ATOM 174 CB VAL A 21 12.660 -1.751 -2.618 1.00 39.82 C ATOM 175 CG1 VAL A 21 13.475 -1.410 -1.408 1.00 42.33 C ATOM 176 CG2 VAL A 21 11.288 -1.111 -2.538 1.00 33.14 C ATOM 0 H VAL A 21 15.141 -1.812 -3.153 1.00 44.80 H new ATOM 0 HA VAL A 21 12.970 -1.811 -4.681 1.00 41.60 H new ATOM 0 HB VAL A 21 12.545 -2.714 -2.636 1.00 39.82 H new ATOM 0 HG11 VAL A 21 12.993 -1.673 -0.608 1.00 42.33 H new ATOM 0 HG12 VAL A 21 14.322 -1.881 -1.445 1.00 42.33 H new ATOM 0 HG13 VAL A 21 13.638 -0.454 -1.386 1.00 42.33 H new ATOM 0 HG21 VAL A 21 10.854 -1.378 -1.713 1.00 33.14 H new ATOM 0 HG22 VAL A 21 11.379 -0.146 -2.557 1.00 33.14 H new ATOM 0 HG23 VAL A 21 10.752 -1.400 -3.293 1.00 33.14 H new ATOM 177 N SER A 22 12.449 0.376 -5.361 1.00 37.84 N ATOM 178 CA SER A 22 12.159 1.712 -5.849 1.00 38.65 C ATOM 179 C SER A 22 11.202 2.500 -4.940 1.00 39.78 C ATOM 180 O SER A 22 10.566 1.941 -4.058 1.00 44.46 O ATOM 181 CB SER A 22 11.536 1.606 -7.244 1.00 38.77 C ATOM 182 OG SER A 22 10.265 0.980 -7.193 1.00 38.31 O ATOM 0 H SER A 22 12.070 -0.247 -5.817 1.00 37.84 H new ATOM 0 HA SER A 22 13.000 2.195 -5.866 1.00 38.65 H new ATOM 0 HB2 SER A 22 11.448 2.492 -7.629 1.00 38.77 H new ATOM 0 HB3 SER A 22 12.125 1.101 -7.826 1.00 38.77 H new ATOM 0 HG SER A 22 9.944 0.935 -7.968 1.00 38.31 H new ATOM 183 N LEU A 23 11.033 3.789 -5.196 1.00 40.70 N ATOM 184 CA LEU A 23 10.125 4.581 -4.369 1.00 39.49 C ATOM 185 C LEU A 23 8.667 4.220 -4.655 1.00 38.22 C ATOM 186 O LEU A 23 7.822 4.328 -3.761 1.00 44.58 O ATOM 187 CB LEU A 23 10.372 6.081 -4.537 1.00 34.71 C ATOM 188 CG LEU A 23 11.049 6.681 -3.320 1.00 28.21 C ATOM 189 CD1 LEU A 23 11.436 8.113 -3.640 1.00 32.83 C ATOM 190 CD2 LEU A 23 10.096 6.618 -2.133 1.00 29.10 C ATOM 0 H LEU A 23 11.424 4.220 -5.829 1.00 40.70 H new ATOM 0 HA LEU A 23 10.308 4.363 -3.442 1.00 39.49 H new ATOM 0 HB2 LEU A 23 10.923 6.232 -5.321 1.00 34.71 H new ATOM 0 HB3 LEU A 23 9.528 6.532 -4.693 1.00 34.71 H new ATOM 0 HG LEU A 23 11.850 6.184 -3.090 1.00 28.21 H new ATOM 0 HD11 LEU A 23 11.871 8.511 -2.870 1.00 32.83 H new ATOM 0 HD12 LEU A 23 12.045 8.123 -4.395 1.00 32.83 H new ATOM 0 HD13 LEU A 23 10.640 8.622 -3.860 1.00 32.83 H new ATOM 0 HD21 LEU A 23 10.526 7.001 -1.352 1.00 29.10 H new ATOM 0 HD22 LEU A 23 9.291 7.119 -2.337 1.00 29.10 H new ATOM 0 HD23 LEU A 23 9.864 5.694 -1.953 1.00 29.10 H new ATOM 191 N PRO A 24 8.326 3.916 -5.907 1.00 33.90 N ATOM 192 CA PRO A 24 6.930 3.565 -6.171 1.00 35.01 C ATOM 193 C PRO A 24 6.516 2.209 -5.516 1.00 34.78 C ATOM 194 O PRO A 24 5.329 1.961 -5.244 1.00 34.12 O ATOM 195 CB PRO A 24 6.884 3.523 -7.688 1.00 33.83 C ATOM 196 CG PRO A 24 7.835 4.606 -8.037 1.00 29.00 C ATOM 197 CD PRO A 24 8.992 4.321 -7.168 1.00 29.09 C ATOM 0 HA PRO A 24 6.299 4.194 -5.788 1.00 35.01 H new ATOM 0 HB2 PRO A 24 7.164 2.663 -8.039 1.00 33.83 H new ATOM 0 HB3 PRO A 24 5.993 3.693 -8.032 1.00 33.83 H new ATOM 0 HG2 PRO A 24 8.077 4.584 -8.976 1.00 29.00 H new ATOM 0 HG3 PRO A 24 7.461 5.484 -7.861 1.00 29.00 H new ATOM 0 HD2 PRO A 24 9.553 3.615 -7.527 1.00 29.09 H new ATOM 0 HD3 PRO A 24 9.558 5.099 -7.048 1.00 29.09 H new ATOM 198 N GLU A 25 7.489 1.345 -5.247 1.00 33.22 N ATOM 199 CA GLU A 25 7.184 0.075 -4.587 1.00 30.51 C ATOM 200 C GLU A 25 6.876 0.347 -3.121 1.00 27.13 C ATOM 201 O GLU A 25 5.906 -0.175 -2.589 1.00 26.23 O ATOM 202 CB GLU A 25 8.351 -0.899 -4.729 1.00 30.51 C ATOM 203 CG GLU A 25 8.557 -1.315 -6.161 1.00 31.08 C ATOM 204 CD GLU A 25 9.669 -2.302 -6.329 1.00 34.85 C ATOM 205 OE1 GLU A 25 9.442 -3.501 -6.054 1.00 45.39 O ATOM 206 OE2 GLU A 25 10.766 -1.879 -6.752 1.00 39.16 O ATOM 0 H GLU A 25 8.319 1.469 -5.434 1.00 33.22 H new ATOM 0 HA GLU A 25 6.411 -0.335 -5.007 1.00 30.51 H new ATOM 0 HB2 GLU A 25 9.161 -0.485 -4.392 1.00 30.51 H new ATOM 0 HB3 GLU A 25 8.186 -1.684 -4.184 1.00 30.51 H new ATOM 0 HG2 GLU A 25 7.735 -1.701 -6.502 1.00 31.08 H new ATOM 0 HG3 GLU A 25 8.745 -0.529 -6.697 1.00 31.08 H new ATOM 207 N TRP A 26 7.698 1.186 -2.492 1.00 24.00 N ATOM 208 CA TRP A 26 7.513 1.595 -1.109 1.00 23.38 C ATOM 209 C TRP A 26 6.213 2.418 -0.907 1.00 23.35 C ATOM 210 O TRP A 26 5.579 2.371 0.156 1.00 28.13 O ATOM 211 CB TRP A 26 8.698 2.445 -0.651 1.00 21.59 C ATOM 212 CG TRP A 26 9.830 1.675 -0.097 1.00 26.29 C ATOM 213 CD1 TRP A 26 11.127 1.739 -0.520 1.00 31.50 C ATOM 214 CD2 TRP A 26 9.809 0.745 0.985 1.00 29.80 C ATOM 215 NE1 TRP A 26 11.911 0.892 0.240 1.00 30.94 N ATOM 216 CE2 TRP A 26 11.132 0.274 1.170 1.00 27.37 C ATOM 217 CE3 TRP A 26 8.800 0.261 1.833 1.00 32.64 C ATOM 218 CZ2 TRP A 26 11.467 -0.649 2.153 1.00 26.88 C ATOM 219 CZ3 TRP A 26 9.154 -0.662 2.822 1.00 31.13 C ATOM 220 CH2 TRP A 26 10.474 -1.105 2.967 1.00 23.76 C ATOM 0 H TRP A 26 8.388 1.537 -2.866 1.00 24.00 H new ATOM 0 HA TRP A 26 7.448 0.783 -0.583 1.00 23.38 H new ATOM 0 HB2 TRP A 26 9.016 2.968 -1.404 1.00 21.59 H new ATOM 0 HB3 TRP A 26 8.390 3.073 0.021 1.00 21.59 H new ATOM 0 HD1 TRP A 26 11.436 2.273 -1.216 1.00 31.50 H new ATOM 0 HE1 TRP A 26 12.757 0.774 0.141 1.00 30.94 H new ATOM 0 HE3 TRP A 26 7.920 0.547 1.739 1.00 32.64 H new ATOM 0 HZ2 TRP A 26 12.342 -0.947 2.252 1.00 26.88 H new ATOM 0 HZ3 TRP A 26 8.499 -0.988 3.396 1.00 31.13 H new ATOM 0 HH2 TRP A 26 10.677 -1.723 3.632 1.00 23.76 H new ATOM 221 N VAL A 27 5.848 3.230 -1.887 1.00 22.91 N ATOM 222 CA VAL A 27 4.645 4.043 -1.769 1.00 24.76 C ATOM 223 C VAL A 27 3.463 3.098 -1.899 1.00 24.88 C ATOM 224 O VAL A 27 2.493 3.206 -1.155 1.00 27.59 O ATOM 225 CB VAL A 27 4.636 5.223 -2.809 1.00 28.79 C ATOM 226 CG1 VAL A 27 3.214 5.816 -3.017 1.00 20.88 C ATOM 227 CG2 VAL A 27 5.568 6.326 -2.310 1.00 24.70 C ATOM 0 H VAL A 27 6.279 3.326 -2.625 1.00 22.91 H new ATOM 0 HA VAL A 27 4.601 4.490 -0.909 1.00 24.76 H new ATOM 0 HB VAL A 27 4.935 4.870 -3.662 1.00 28.79 H new ATOM 0 HG11 VAL A 27 3.256 6.538 -3.664 1.00 20.88 H new ATOM 0 HG12 VAL A 27 2.619 5.123 -3.344 1.00 20.88 H new ATOM 0 HG13 VAL A 27 2.879 6.157 -2.173 1.00 20.88 H new ATOM 0 HG21 VAL A 27 5.570 7.060 -2.945 1.00 24.70 H new ATOM 0 HG22 VAL A 27 5.259 6.646 -1.448 1.00 24.70 H new ATOM 0 HG23 VAL A 27 6.467 5.974 -2.220 1.00 24.70 H new ATOM 228 N CYS A 28 3.582 2.107 -2.774 1.00 27.06 N ATOM 229 CA CYS A 28 2.510 1.120 -2.925 1.00 29.94 C ATOM 230 C CYS A 28 2.406 0.240 -1.672 1.00 28.58 C ATOM 231 O CYS A 28 1.322 0.083 -1.098 1.00 30.50 O ATOM 232 CB CYS A 28 2.752 0.217 -4.143 1.00 32.45 C ATOM 233 SG CYS A 28 1.444 -1.047 -4.369 1.00 27.30 S ATOM 0 H CYS A 28 4.263 1.985 -3.285 1.00 27.06 H new ATOM 0 HA CYS A 28 1.683 1.611 -3.052 1.00 29.94 H new ATOM 0 HB2 CYS A 28 2.805 0.766 -4.941 1.00 32.45 H new ATOM 0 HB3 CYS A 28 3.609 -0.226 -4.046 1.00 32.45 H new ATOM 234 N THR A 29 3.555 -0.279 -1.223 1.00 27.76 N ATOM 235 CA THR A 29 3.621 -1.163 -0.074 1.00 22.96 C ATOM 236 C THR A 29 3.057 -0.558 1.162 1.00 25.04 C ATOM 237 O THR A 29 2.198 -1.167 1.787 1.00 29.42 O ATOM 238 CB THR A 29 5.042 -1.640 0.236 1.00 24.81 C ATOM 239 OG1 THR A 29 5.627 -2.240 -0.929 1.00 35.21 O ATOM 240 CG2 THR A 29 4.985 -2.685 1.333 1.00 24.70 C ATOM 0 H THR A 29 4.319 -0.121 -1.585 1.00 27.76 H new ATOM 0 HA THR A 29 3.078 -1.923 -0.335 1.00 22.96 H new ATOM 0 HB THR A 29 5.576 -0.879 0.514 1.00 24.81 H new ATOM 0 HG1 THR A 29 5.839 -1.640 -1.477 1.00 35.21 H new ATOM 0 HG21 THR A 29 5.883 -2.992 1.535 1.00 24.70 H new ATOM 0 HG22 THR A 29 4.590 -2.297 2.129 1.00 24.70 H new ATOM 0 HG23 THR A 29 4.446 -3.435 1.038 1.00 24.70 H new ATOM 241 N THR A 30 3.511 0.650 1.502 1.00 21.08 N ATOM 242 CA THR A 30 3.046 1.319 2.710 1.00 17.23 C ATOM 243 C THR A 30 1.548 1.692 2.710 1.00 14.77 C ATOM 244 O THR A 30 0.928 1.785 3.774 1.00 19.45 O ATOM 245 CB THR A 30 3.975 2.520 3.121 1.00 18.10 C ATOM 246 OG1 THR A 30 4.123 3.448 2.049 1.00 28.53 O ATOM 247 CG2 THR A 30 5.352 2.030 3.488 1.00 18.55 C ATOM 0 H THR A 30 4.088 1.096 1.045 1.00 21.08 H new ATOM 0 HA THR A 30 3.120 0.649 3.407 1.00 17.23 H new ATOM 0 HB THR A 30 3.554 2.952 3.881 1.00 18.10 H new ATOM 0 HG1 THR A 30 4.667 3.142 1.487 1.00 28.53 H new ATOM 0 HG21 THR A 30 5.908 2.784 3.738 1.00 18.55 H new ATOM 0 HG22 THR A 30 5.288 1.414 4.235 1.00 18.55 H new ATOM 0 HG23 THR A 30 5.747 1.575 2.728 1.00 18.55 H new ATOM 248 N PHE A 31 0.944 1.881 1.545 1.00 14.79 N ATOM 249 CA PHE A 31 -0.475 2.194 1.546 1.00 17.80 C ATOM 250 C PHE A 31 -1.165 0.954 2.029 1.00 21.03 C ATOM 251 O PHE A 31 -1.992 1.009 2.927 1.00 27.48 O ATOM 252 CB PHE A 31 -1.016 2.507 0.167 1.00 14.09 C ATOM 253 CG PHE A 31 -2.520 2.652 0.139 1.00 13.51 C ATOM 254 CD1 PHE A 31 -3.149 3.575 0.935 1.00 12.73 C ATOM 255 CD2 PHE A 31 -3.299 1.846 -0.647 1.00 14.43 C ATOM 256 CE1 PHE A 31 -4.522 3.692 0.961 1.00 16.56 C ATOM 257 CE2 PHE A 31 -4.680 1.958 -0.628 1.00 23.79 C ATOM 258 CZ PHE A 31 -5.294 2.884 0.179 1.00 20.91 C ATOM 0 H PHE A 31 1.319 1.835 0.773 1.00 14.79 H new ATOM 0 HA PHE A 31 -0.624 2.977 2.098 1.00 17.80 H new ATOM 0 HB2 PHE A 31 -0.611 3.328 -0.155 1.00 14.09 H new ATOM 0 HB3 PHE A 31 -0.753 1.802 -0.445 1.00 14.09 H new ATOM 0 HD1 PHE A 31 -2.636 4.136 1.471 1.00 12.73 H new ATOM 0 HD2 PHE A 31 -2.897 1.216 -1.200 1.00 14.43 H new ATOM 0 HE1 PHE A 31 -4.923 4.324 1.513 1.00 16.56 H new ATOM 0 HE2 PHE A 31 -5.195 1.401 -1.166 1.00 23.79 H new ATOM 0 HZ PHE A 31 -6.221 2.959 0.192 1.00 20.91 H new ATOM 259 N HIS A 32 -0.779 -0.178 1.455 1.00 26.60 N ATOM 260 CA HIS A 32 -1.361 -1.463 1.816 1.00 27.74 C ATOM 261 C HIS A 32 -0.927 -1.998 3.160 1.00 24.24 C ATOM 262 O HIS A 32 -1.542 -2.922 3.658 1.00 33.83 O ATOM 263 CB HIS A 32 -1.130 -2.513 0.723 1.00 29.61 C ATOM 264 CG HIS A 32 -1.884 -2.234 -0.532 1.00 29.69 C ATOM 265 ND1 HIS A 32 -1.262 -1.940 -1.727 1.00 29.78 N ATOM 266 CD2 HIS A 32 -3.219 -2.132 -0.770 1.00 31.41 C ATOM 267 CE1 HIS A 32 -2.175 -1.664 -2.643 1.00 29.92 C ATOM 268 NE2 HIS A 32 -3.371 -1.773 -2.087 1.00 26.33 N ATOM 0 H HIS A 32 -0.173 -0.223 0.846 1.00 26.60 H new ATOM 0 HA HIS A 32 -2.311 -1.285 1.896 1.00 27.74 H new ATOM 0 HB2 HIS A 32 -0.182 -2.557 0.521 1.00 29.61 H new ATOM 0 HB3 HIS A 32 -1.388 -3.385 1.061 1.00 29.61 H new ATOM 0 HD2 HIS A 32 -3.902 -2.278 -0.156 1.00 31.41 H new ATOM 0 HE1 HIS A 32 -2.005 -1.433 -3.528 1.00 29.92 H new ATOM 0 HE2 HIS A 32 -4.121 -1.641 -2.486 1.00 26.33 H new ATOM 269 N THR A 33 0.124 -1.430 3.742 1.00 27.08 N ATOM 270 CA THR A 33 0.592 -1.836 5.056 1.00 24.40 C ATOM 271 C THR A 33 -0.136 -1.048 6.145 1.00 29.16 C ATOM 272 O THR A 33 -0.784 -1.645 7.005 1.00 33.54 O ATOM 273 CB THR A 33 2.097 -1.632 5.234 1.00 24.35 C ATOM 274 OG1 THR A 33 2.809 -2.498 4.347 1.00 25.77 O ATOM 275 CG2 THR A 33 2.502 -2.011 6.611 1.00 27.61 C ATOM 0 H THR A 33 0.584 -0.798 3.384 1.00 27.08 H new ATOM 0 HA THR A 33 0.402 -2.784 5.133 1.00 24.40 H new ATOM 0 HB THR A 33 2.297 -0.700 5.055 1.00 24.35 H new ATOM 0 HG1 THR A 33 2.717 -2.228 3.557 1.00 25.77 H new ATOM 0 HG21 THR A 33 3.457 -1.879 6.716 1.00 27.61 H new ATOM 0 HG22 THR A 33 2.028 -1.458 7.252 1.00 27.61 H new ATOM 0 HG23 THR A 33 2.286 -2.944 6.767 1.00 27.61 H new ATOM 276 N SER A 34 -0.114 0.282 6.068 1.00 30.43 N ATOM 277 CA SER A 34 -0.747 1.116 7.106 1.00 24.40 C ATOM 278 C SER A 34 -1.724 2.196 6.657 1.00 25.75 C ATOM 279 O SER A 34 -2.238 2.930 7.480 1.00 30.02 O ATOM 280 CB SER A 34 0.350 1.817 7.914 1.00 24.33 C ATOM 281 OG SER A 34 1.142 2.657 7.073 1.00 21.44 O ATOM 0 H SER A 34 0.258 0.723 5.430 1.00 30.43 H new ATOM 0 HA SER A 34 -1.282 0.479 7.606 1.00 24.40 H new ATOM 0 HB2 SER A 34 -0.051 2.346 8.621 1.00 24.33 H new ATOM 0 HB3 SER A 34 0.916 1.155 8.342 1.00 24.33 H new ATOM 0 HG SER A 34 1.918 2.342 7.013 1.00 21.44 H new ATOM 282 N GLY A 35 -2.028 2.285 5.379 1.00 24.54 N ATOM 283 CA GLY A 35 -2.890 3.364 4.942 1.00 23.71 C ATOM 284 C GLY A 35 -2.173 4.705 5.094 1.00 22.12 C ATOM 285 O GLY A 35 -2.808 5.744 4.993 1.00 25.65 O ATOM 0 H GLY A 35 -1.757 1.750 4.763 1.00 24.54 H new ATOM 0 HA2 GLY A 35 -3.145 3.229 4.016 1.00 23.71 H new ATOM 0 HA3 GLY A 35 -3.708 3.366 5.464 1.00 23.71 H new ATOM 286 N TYR A 36 -0.848 4.687 5.255 1.00 23.61 N ATOM 287 CA TYR A 36 -0.030 5.908 5.433 1.00 28.14 C ATOM 288 C TYR A 36 -0.206 6.585 6.791 1.00 31.59 C ATOM 289 O TYR A 36 0.237 7.706 6.957 1.00 31.00 O ATOM 290 CB TYR A 36 -0.306 6.974 4.377 1.00 25.49 C ATOM 291 CG TYR A 36 -0.029 6.582 2.954 1.00 27.48 C ATOM 292 CD1 TYR A 36 0.944 5.649 2.639 1.00 27.03 C ATOM 293 CD2 TYR A 36 -0.753 7.158 1.908 1.00 26.00 C ATOM 294 CE1 TYR A 36 1.188 5.292 1.313 1.00 30.44 C ATOM 295 CE2 TYR A 36 -0.524 6.811 0.596 1.00 28.50 C ATOM 296 CZ TYR A 36 0.449 5.878 0.302 1.00 25.98 C ATOM 297 OH TYR A 36 0.652 5.518 -1.014 1.00 30.91 O ATOM 0 H TYR A 36 -0.387 3.961 5.265 1.00 23.61 H new ATOM 0 HA TYR A 36 0.875 5.570 5.351 1.00 28.14 H new ATOM 0 HB2 TYR A 36 -1.237 7.238 4.445 1.00 25.49 H new ATOM 0 HB3 TYR A 36 0.227 7.757 4.587 1.00 25.49 H new ATOM 0 HD1 TYR A 36 1.441 5.256 3.320 1.00 27.03 H new ATOM 0 HD2 TYR A 36 -1.406 7.791 2.103 1.00 26.00 H new ATOM 0 HE1 TYR A 36 1.843 4.664 1.110 1.00 30.44 H new ATOM 0 HE2 TYR A 36 -1.021 7.202 -0.086 1.00 28.50 H new ATOM 0 HH TYR A 36 1.187 4.871 -1.048 1.00 30.91 H new ATOM 298 N ASP A 37 -0.913 5.935 7.721 1.00 35.23 N ATOM 299 CA ASP A 37 -1.133 6.433 9.086 1.00 33.29 C ATOM 300 C ASP A 37 0.080 6.139 10.013 1.00 35.72 C ATOM 301 O ASP A 37 0.292 4.993 10.422 1.00 33.62 O ATOM 302 CB ASP A 37 -2.378 5.769 9.671 1.00 31.71 C ATOM 303 CG ASP A 37 -2.631 6.172 11.095 1.00 35.12 C ATOM 304 OD1 ASP A 37 -1.963 7.090 11.611 1.00 34.72 O ATOM 305 OD2 ASP A 37 -3.527 5.566 11.705 1.00 41.03 O ATOM 0 H ASP A 37 -1.287 5.175 7.573 1.00 35.23 H new ATOM 0 HA ASP A 37 -1.248 7.395 9.036 1.00 33.29 H new ATOM 0 HB2 ASP A 37 -3.149 6.002 9.130 1.00 31.71 H new ATOM 0 HB3 ASP A 37 -2.279 4.805 9.624 1.00 31.71 H new ATOM 306 N THR A 38 0.803 7.192 10.409 1.00 36.99 N ATOM 307 CA THR A 38 2.016 7.095 11.247 1.00 36.79 C ATOM 308 C THR A 38 1.817 6.545 12.651 1.00 37.22 C ATOM 309 O THR A 38 2.795 6.207 13.334 1.00 33.05 O ATOM 310 CB THR A 38 2.732 8.465 11.363 1.00 37.15 C ATOM 311 OG1 THR A 38 1.758 9.488 11.595 1.00 44.55 O ATOM 312 CG2 THR A 38 3.467 8.795 10.078 1.00 36.50 C ATOM 0 H THR A 38 0.601 8.000 10.196 1.00 36.99 H new ATOM 0 HA THR A 38 2.557 6.446 10.771 1.00 36.79 H new ATOM 0 HB THR A 38 3.366 8.418 12.096 1.00 37.15 H new ATOM 0 HG1 THR A 38 2.143 10.232 11.660 1.00 44.55 H new ATOM 0 HG21 THR A 38 3.908 9.654 10.169 1.00 36.50 H new ATOM 0 HG22 THR A 38 4.129 8.109 9.898 1.00 36.50 H new ATOM 0 HG23 THR A 38 2.834 8.833 9.344 1.00 36.50 H new ATOM 313 N GLN A 39 0.547 6.497 13.068 1.00 38.96 N ATOM 314 CA GLN A 39 0.285 5.907 14.400 1.00 41.05 C ATOM 315 C GLN A 39 -0.582 4.653 14.347 1.00 39.52 C ATOM 316 O GLN A 39 -1.266 4.304 15.337 1.00 39.54 O ATOM 317 CB GLN A 39 -0.416 6.965 15.247 1.00 42.08 C ATOM 318 CG GLN A 39 0.512 8.076 15.693 1.00 48.71 C ATOM 319 CD GLN A 39 -0.271 9.322 15.971 1.00 56.72 C ATOM 320 OE1 GLN A 39 -1.461 9.307 16.242 1.00 64.02 O ATOM 321 NE2 GLN A 39 0.452 10.460 15.902 1.00 58.43 N ATOM 0 H GLN A 39 -0.140 6.778 12.633 1.00 38.96 H new ATOM 0 HA GLN A 39 1.136 5.637 14.780 1.00 41.05 H new ATOM 0 HB2 GLN A 39 -1.148 7.347 14.738 1.00 42.08 H new ATOM 0 HB3 GLN A 39 -0.804 6.541 16.028 1.00 42.08 H new ATOM 0 HG2 GLN A 39 0.994 7.804 16.490 1.00 48.71 H new ATOM 0 HG3 GLN A 39 1.175 8.249 15.006 1.00 48.71 H new ATOM 0 HE21 GLN A 39 1.289 10.426 15.708 1.00 58.43 H new ATOM 0 HE22 GLN A 39 0.075 11.218 16.052 1.00 58.43 H new ATOM 322 N ALA A 40 -0.483 3.923 13.239 1.00 35.08 N ATOM 323 CA ALA A 40 -1.134 2.633 13.154 1.00 30.16 C ATOM 324 C ALA A 40 -0.508 1.705 14.151 1.00 27.53 C ATOM 325 O ALA A 40 0.713 1.634 14.257 1.00 27.47 O ATOM 326 CB ALA A 40 -1.039 2.043 11.736 1.00 29.78 C ATOM 0 H ALA A 40 -0.047 4.158 12.536 1.00 35.08 H new ATOM 0 HA ALA A 40 -2.076 2.746 13.354 1.00 30.16 H new ATOM 0 HB1 ALA A 40 -1.484 1.181 11.713 1.00 29.78 H new ATOM 0 HB2 ALA A 40 -1.467 2.644 11.106 1.00 29.78 H new ATOM 0 HB3 ALA A 40 -0.106 1.932 11.493 1.00 29.78 H new ATOM 327 N ILE A 41 -1.367 1.073 14.939 1.00 31.26 N ATOM 328 CA ILE A 41 -0.971 0.085 15.936 1.00 33.56 C ATOM 329 C ILE A 41 -1.886 -1.098 15.732 1.00 32.62 C ATOM 330 O ILE A 41 -3.104 -0.956 15.775 1.00 38.80 O ATOM 331 CB ILE A 41 -1.158 0.567 17.375 1.00 33.70 C ATOM 332 CG1 ILE A 41 -0.026 1.497 17.756 1.00 36.08 C ATOM 333 CG2 ILE A 41 -1.158 -0.605 18.338 1.00 30.00 C ATOM 334 CD1 ILE A 41 -0.108 1.945 19.167 1.00 41.75 C ATOM 0 H ILE A 41 -2.216 1.209 14.909 1.00 31.26 H new ATOM 0 HA ILE A 41 -0.028 -0.112 15.821 1.00 33.56 H new ATOM 0 HB ILE A 41 -2.009 1.030 17.428 1.00 33.70 H new ATOM 0 HG12 ILE A 41 0.821 1.047 17.612 1.00 36.08 H new ATOM 0 HG13 ILE A 41 -0.038 2.272 17.173 1.00 36.08 H new ATOM 0 HG21 ILE A 41 -1.278 -0.280 19.244 1.00 30.00 H new ATOM 0 HG22 ILE A 41 -1.883 -1.209 18.113 1.00 30.00 H new ATOM 0 HG23 ILE A 41 -0.313 -1.077 18.273 1.00 30.00 H new ATOM 0 HD11 ILE A 41 0.636 2.536 19.363 1.00 41.75 H new ATOM 0 HD12 ILE A 41 -0.943 2.418 19.308 1.00 41.75 H new ATOM 0 HD13 ILE A 41 -0.070 1.174 19.754 1.00 41.75 H new ATOM 335 N VAL A 42 -1.307 -2.257 15.478 1.00 32.82 N ATOM 336 CA VAL A 42 -2.104 -3.440 15.279 1.00 34.32 C ATOM 337 C VAL A 42 -1.601 -4.569 16.117 1.00 35.61 C ATOM 338 O VAL A 42 -0.420 -4.852 16.123 1.00 36.28 O ATOM 339 CB VAL A 42 -2.122 -3.880 13.838 1.00 37.38 C ATOM 340 CG1 VAL A 42 -2.673 -5.300 13.728 1.00 37.52 C ATOM 341 CG2 VAL A 42 -2.960 -2.923 13.038 1.00 38.65 C ATOM 0 H VAL A 42 -0.457 -2.376 15.418 1.00 32.82 H new ATOM 0 HA VAL A 42 -3.008 -3.207 15.543 1.00 34.32 H new ATOM 0 HB VAL A 42 -1.218 -3.879 13.487 1.00 37.38 H new ATOM 0 HG11 VAL A 42 -2.680 -5.573 12.797 1.00 37.52 H new ATOM 0 HG12 VAL A 42 -2.112 -5.905 14.238 1.00 37.52 H new ATOM 0 HG13 VAL A 42 -3.577 -5.325 14.079 1.00 37.52 H new ATOM 0 HG21 VAL A 42 -2.974 -3.203 12.109 1.00 38.65 H new ATOM 0 HG22 VAL A 42 -3.865 -2.916 13.387 1.00 38.65 H new ATOM 0 HG23 VAL A 42 -2.583 -2.032 13.101 1.00 38.65 H new ATOM 342 N GLN A 43 -2.485 -5.097 16.948 1.00 46.21 N ATOM 343 CA GLN A 43 -2.174 -6.224 17.799 1.00 53.92 C ATOM 344 C GLN A 43 -3.011 -7.270 17.132 1.00 56.59 C ATOM 345 O GLN A 43 -4.106 -6.980 16.672 1.00 57.39 O ATOM 346 CB GLN A 43 -2.655 -6.005 19.234 1.00 56.37 C ATOM 347 CG GLN A 43 -2.595 -7.269 20.102 1.00 68.68 C ATOM 348 CD GLN A 43 -1.213 -7.595 20.667 1.00 74.84 C ATOM 349 OE1 GLN A 43 -0.410 -6.703 20.922 1.00 77.64 O ATOM 350 NE2 GLN A 43 -0.960 -8.882 20.919 1.00 77.05 N ATOM 0 H GLN A 43 -3.290 -4.806 17.033 1.00 46.21 H new ATOM 0 HA GLN A 43 -1.227 -6.418 17.882 1.00 53.92 H new ATOM 0 HB2 GLN A 43 -2.115 -5.313 19.646 1.00 56.37 H new ATOM 0 HB3 GLN A 43 -3.568 -5.678 19.215 1.00 56.37 H new ATOM 0 HG2 GLN A 43 -3.217 -7.169 20.840 1.00 68.68 H new ATOM 0 HG3 GLN A 43 -2.901 -8.023 19.574 1.00 68.68 H new ATOM 0 HE21 GLN A 43 -1.546 -9.481 20.727 1.00 77.05 H new ATOM 0 HE22 GLN A 43 -0.211 -9.112 21.273 1.00 77.05 H new ATOM 351 N ASN A 44 -2.448 -8.452 16.976 1.00 64.91 N ATOM 352 CA ASN A 44 -3.158 -9.541 16.324 1.00 70.45 C ATOM 353 C ASN A 44 -3.269 -10.786 17.214 1.00 73.64 C ATOM 354 O ASN A 44 -4.379 -11.255 17.520 1.00 74.12 O ATOM 355 CB ASN A 44 -2.528 -9.867 14.954 1.00 72.42 C ATOM 356 CG ASN A 44 -0.989 -9.738 14.929 1.00 72.46 C ATOM 357 OD1 ASN A 44 -0.390 -9.758 13.860 1.00 72.08 O ATOM 358 ND2 ASN A 44 -0.360 -9.604 16.089 1.00 72.30 N ATOM 0 H ASN A 44 -1.653 -8.648 17.240 1.00 64.91 H new ATOM 0 HA ASN A 44 -4.067 -9.239 16.169 1.00 70.45 H new ATOM 0 HB2 ASN A 44 -2.772 -10.771 14.702 1.00 72.42 H new ATOM 0 HB3 ASN A 44 -2.905 -9.274 14.285 1.00 72.42 H new ATOM 0 HD21 ASN A 44 0.496 -9.528 16.107 1.00 72.30 H new ATOM 0 HD22 ASN A 44 -0.809 -9.594 16.823 1.00 72.30 H new ATOM 359 N ASN A 45 -2.120 -11.284 17.667 1.00 74.28 N ATOM 360 CA ASN A 45 -2.078 -12.453 18.525 1.00 75.48 C ATOM 361 C ASN A 45 -0.930 -12.264 19.502 1.00 75.51 C ATOM 362 O ASN A 45 -1.129 -11.689 20.572 1.00 74.95 O ATOM 363 CB ASN A 45 -1.886 -13.727 17.693 1.00 77.65 C ATOM 364 CG ASN A 45 -2.547 -14.943 18.329 1.00 82.45 C ATOM 365 OD1 ASN A 45 -1.875 -15.917 18.696 1.00 81.23 O ATOM 366 ND2 ASN A 45 -3.877 -14.898 18.452 1.00 83.38 N ATOM 0 H ASN A 45 -1.348 -10.951 17.484 1.00 74.28 H new ATOM 0 HA ASN A 45 -2.914 -12.551 19.007 1.00 75.48 H new ATOM 0 HB2 ASN A 45 -2.254 -13.589 16.806 1.00 77.65 H new ATOM 0 HB3 ASN A 45 -0.938 -13.898 17.583 1.00 77.65 H new ATOM 0 HD21 ASN A 45 -4.300 -15.563 18.797 1.00 83.38 H new ATOM 0 HD22 ASN A 45 -4.310 -14.204 18.186 1.00 83.38 H new ATOM 367 N ASP A 46 0.279 -12.654 19.088 1.00 76.72 N ATOM 368 CA ASP A 46 1.479 -12.542 19.927 1.00 73.97 C ATOM 369 C ASP A 46 2.325 -11.269 19.723 1.00 68.28 C ATOM 370 O ASP A 46 3.305 -11.052 20.438 1.00 70.34 O ATOM 371 CB ASP A 46 2.356 -13.804 19.793 1.00 75.40 C ATOM 372 CG ASP A 46 1.795 -15.002 20.574 1.00 83.00 C ATOM 373 OD1 ASP A 46 1.490 -14.839 21.780 1.00 83.85 O ATOM 374 OD2 ASP A 46 1.660 -16.108 19.991 1.00 84.77 O ATOM 0 H ASP A 46 0.427 -12.992 18.311 1.00 76.72 H new ATOM 0 HA ASP A 46 1.136 -12.463 20.831 1.00 73.97 H new ATOM 0 HB2 ASP A 46 2.433 -14.041 18.856 1.00 75.40 H new ATOM 0 HB3 ASP A 46 3.251 -13.606 20.110 1.00 75.40 H new ATOM 375 N SER A 47 1.947 -10.420 18.770 1.00 59.25 N ATOM 376 CA SER A 47 2.714 -9.200 18.538 1.00 51.00 C ATOM 377 C SER A 47 1.911 -7.950 18.166 1.00 44.30 C ATOM 378 O SER A 47 0.788 -8.019 17.662 1.00 43.80 O ATOM 379 CB SER A 47 3.814 -9.443 17.501 1.00 48.77 C ATOM 380 OG SER A 47 3.262 -9.665 16.216 1.00 55.50 O ATOM 0 H SER A 47 1.265 -10.528 18.257 1.00 59.25 H new ATOM 0 HA SER A 47 3.093 -8.996 19.408 1.00 51.00 H new ATOM 0 HB2 SER A 47 4.410 -8.679 17.473 1.00 48.77 H new ATOM 0 HB3 SER A 47 4.347 -10.209 17.764 1.00 48.77 H new ATOM 0 HG SER A 47 3.881 -9.794 15.663 1.00 55.50 H new ATOM 381 N THR A 48 2.502 -6.810 18.475 1.00 36.61 N ATOM 382 CA THR A 48 1.920 -5.516 18.192 1.00 36.38 C ATOM 383 C THR A 48 2.796 -4.978 17.073 1.00 29.82 C ATOM 384 O THR A 48 4.008 -5.201 17.094 1.00 32.05 O ATOM 385 CB THR A 48 2.068 -4.581 19.418 1.00 40.41 C ATOM 386 OG1 THR A 48 1.782 -5.314 20.616 1.00 47.67 O ATOM 387 CG2 THR A 48 1.139 -3.358 19.322 1.00 35.97 C ATOM 0 H THR A 48 3.268 -6.767 18.863 1.00 36.61 H new ATOM 0 HA THR A 48 0.977 -5.572 17.972 1.00 36.38 H new ATOM 0 HB THR A 48 2.982 -4.255 19.436 1.00 40.41 H new ATOM 0 HG1 THR A 48 1.000 -5.618 20.579 1.00 47.67 H new ATOM 0 HG21 THR A 48 1.259 -2.798 20.105 1.00 35.97 H new ATOM 0 HG22 THR A 48 1.355 -2.849 18.525 1.00 35.97 H new ATOM 0 HG23 THR A 48 0.217 -3.655 19.276 1.00 35.97 H new ATOM 388 N GLU A 49 2.203 -4.280 16.109 1.00 31.46 N ATOM 389 CA GLU A 49 2.948 -3.705 14.990 1.00 28.78 C ATOM 390 C GLU A 49 2.696 -2.203 14.948 1.00 31.16 C ATOM 391 O GLU A 49 1.548 -1.768 14.939 1.00 29.46 O ATOM 392 CB GLU A 49 2.564 -4.402 13.706 1.00 29.64 C ATOM 393 CG GLU A 49 2.914 -5.880 13.752 1.00 29.00 C ATOM 394 CD GLU A 49 2.460 -6.630 12.524 1.00 37.06 C ATOM 395 OE1 GLU A 49 1.363 -6.370 11.992 1.00 41.63 O ATOM 396 OE2 GLU A 49 3.218 -7.506 12.082 1.00 47.32 O ATOM 0 H GLU A 49 1.357 -4.126 16.084 1.00 31.46 H new ATOM 0 HA GLU A 49 3.902 -3.840 15.105 1.00 28.78 H new ATOM 0 HB2 GLU A 49 1.612 -4.298 13.552 1.00 29.64 H new ATOM 0 HB3 GLU A 49 3.020 -3.983 12.959 1.00 29.64 H new ATOM 0 HG2 GLU A 49 3.874 -5.977 13.848 1.00 29.00 H new ATOM 0 HG3 GLU A 49 2.508 -6.279 14.537 1.00 29.00 H new ATOM 397 N TYR A 50 3.797 -1.438 14.947 1.00 36.33 N ATOM 398 CA TYR A 50 3.812 0.038 15.025 1.00 36.61 C ATOM 399 C TYR A 50 4.142 0.938 13.831 1.00 34.92 C ATOM 400 O TYR A 50 5.082 0.679 13.092 1.00 35.03 O ATOM 401 CB TYR A 50 4.799 0.459 16.129 1.00 39.10 C ATOM 402 CG TYR A 50 4.460 0.000 17.530 1.00 37.40 C ATOM 403 CD1 TYR A 50 4.856 -1.253 17.997 1.00 39.31 C ATOM 404 CD2 TYR A 50 3.736 0.817 18.384 1.00 42.34 C ATOM 405 CE1 TYR A 50 4.536 -1.672 19.278 1.00 40.29 C ATOM 406 CE2 TYR A 50 3.411 0.405 19.660 1.00 45.38 C ATOM 407 CZ TYR A 50 3.814 -0.839 20.098 1.00 43.02 C ATOM 408 OH TYR A 50 3.467 -1.237 21.371 1.00 48.68 O ATOM 0 H TYR A 50 4.587 -1.775 14.899 1.00 36.33 H new ATOM 0 HA TYR A 50 2.863 0.192 15.154 1.00 36.61 H new ATOM 0 HB2 TYR A 50 5.678 0.119 15.900 1.00 39.10 H new ATOM 0 HB3 TYR A 50 4.861 1.427 16.131 1.00 39.10 H new ATOM 0 HD1 TYR A 50 5.343 -1.816 17.440 1.00 39.31 H new ATOM 0 HD2 TYR A 50 3.465 1.657 18.092 1.00 42.34 H new ATOM 0 HE1 TYR A 50 4.807 -2.509 19.580 1.00 40.29 H new ATOM 0 HE2 TYR A 50 2.923 0.963 20.222 1.00 45.38 H new ATOM 0 HH TYR A 50 3.796 -1.994 21.528 1.00 48.68 H new ATOM 409 N GLY A 51 3.443 2.067 13.746 1.00 32.25 N ATOM 410 CA GLY A 51 3.706 3.055 12.714 1.00 31.67 C ATOM 411 C GLY A 51 3.369 2.826 11.252 1.00 34.00 C ATOM 412 O GLY A 51 2.633 1.909 10.868 1.00 38.25 O ATOM 0 H GLY A 51 2.806 2.278 14.284 1.00 32.25 H new ATOM 0 HA2 GLY A 51 3.242 3.864 12.981 1.00 31.67 H new ATOM 0 HA3 GLY A 51 4.656 3.248 12.752 1.00 31.67 H new ATOM 413 N LEU A 52 3.928 3.683 10.412 1.00 32.83 N ATOM 414 CA LEU A 52 3.696 3.608 8.982 1.00 31.36 C ATOM 415 C LEU A 52 4.178 2.310 8.371 1.00 28.78 C ATOM 416 O LEU A 52 3.576 1.827 7.430 1.00 27.39 O ATOM 417 CB LEU A 52 4.366 4.791 8.275 1.00 30.14 C ATOM 418 CG LEU A 52 3.958 5.132 6.838 1.00 28.26 C ATOM 419 CD1 LEU A 52 3.449 6.562 6.763 1.00 25.73 C ATOM 420 CD2 LEU A 52 5.168 4.982 5.947 1.00 30.56 C ATOM 0 H LEU A 52 4.450 4.322 10.654 1.00 32.83 H new ATOM 0 HA LEU A 52 2.735 3.644 8.855 1.00 31.36 H new ATOM 0 HB2 LEU A 52 4.212 5.580 8.817 1.00 30.14 H new ATOM 0 HB3 LEU A 52 5.322 4.628 8.276 1.00 30.14 H new ATOM 0 HG LEU A 52 3.251 4.534 6.550 1.00 28.26 H new ATOM 0 HD11 LEU A 52 3.194 6.767 5.850 1.00 25.73 H new ATOM 0 HD12 LEU A 52 2.679 6.662 7.344 1.00 25.73 H new ATOM 0 HD13 LEU A 52 4.149 7.170 7.047 1.00 25.73 H new ATOM 0 HD21 LEU A 52 4.925 5.195 5.032 1.00 30.56 H new ATOM 0 HD22 LEU A 52 5.866 5.586 6.245 1.00 30.56 H new ATOM 0 HD23 LEU A 52 5.491 4.068 5.991 1.00 30.56 H new ATOM 421 N PHE A 53 5.234 1.738 8.933 1.00 28.39 N ATOM 422 CA PHE A 53 5.832 0.500 8.429 1.00 25.04 C ATOM 423 C PHE A 53 5.422 -0.799 9.145 1.00 24.67 C ATOM 424 O PHE A 53 5.800 -1.884 8.718 1.00 25.11 O ATOM 425 CB PHE A 53 7.363 0.620 8.488 1.00 26.35 C ATOM 426 CG PHE A 53 7.942 1.594 7.520 1.00 20.72 C ATOM 427 CD1 PHE A 53 8.170 1.227 6.205 1.00 18.75 C ATOM 428 CD2 PHE A 53 8.257 2.880 7.922 1.00 22.74 C ATOM 429 CE1 PHE A 53 8.699 2.128 5.302 1.00 23.22 C ATOM 430 CE2 PHE A 53 8.788 3.791 7.024 1.00 19.35 C ATOM 431 CZ PHE A 53 9.009 3.422 5.723 1.00 21.19 C ATOM 0 H PHE A 53 5.631 2.058 9.626 1.00 28.39 H new ATOM 0 HA PHE A 53 5.489 0.415 7.525 1.00 25.04 H new ATOM 0 HB2 PHE A 53 7.622 0.880 9.386 1.00 26.35 H new ATOM 0 HB3 PHE A 53 7.752 -0.253 8.323 1.00 26.35 H new ATOM 0 HD1 PHE A 53 7.965 0.364 5.926 1.00 18.75 H new ATOM 0 HD2 PHE A 53 8.111 3.135 8.804 1.00 22.74 H new ATOM 0 HE1 PHE A 53 8.848 1.874 4.420 1.00 23.22 H new ATOM 0 HE2 PHE A 53 8.995 4.653 7.304 1.00 19.35 H new ATOM 0 HZ PHE A 53 9.366 4.034 5.120 1.00 21.19 H new ATOM 432 N GLN A 54 4.642 -0.684 10.217 1.00 28.80 N ATOM 433 CA GLN A 54 4.159 -1.824 11.030 1.00 27.16 C ATOM 434 C GLN A 54 5.310 -2.692 11.464 1.00 26.47 C ATOM 435 O GLN A 54 5.434 -3.802 11.017 1.00 30.04 O ATOM 436 CB GLN A 54 3.116 -2.675 10.297 1.00 27.22 C ATOM 437 CG GLN A 54 1.778 -1.986 10.018 1.00 18.36 C ATOM 438 CD GLN A 54 0.971 -1.675 11.254 1.00 22.62 C ATOM 439 OE1 GLN A 54 0.128 -2.461 11.656 1.00 32.80 O ATOM 440 NE2 GLN A 54 1.187 -0.512 11.835 1.00 24.64 N ATOM 0 H GLN A 54 4.366 0.077 10.507 1.00 28.80 H new ATOM 0 HA GLN A 54 3.726 -1.442 11.810 1.00 27.16 H new ATOM 0 HB2 GLN A 54 3.494 -2.965 9.452 1.00 27.22 H new ATOM 0 HB3 GLN A 54 2.947 -3.473 10.821 1.00 27.22 H new ATOM 0 HG2 GLN A 54 1.945 -1.160 9.537 1.00 18.36 H new ATOM 0 HG3 GLN A 54 1.250 -2.552 9.434 1.00 18.36 H new ATOM 0 HE21 GLN A 54 1.789 0.018 11.525 1.00 24.64 H new ATOM 0 HE22 GLN A 54 0.726 -0.283 12.524 1.00 24.64 H new ATOM 441 N ILE A 55 6.154 -2.152 12.336 1.00 29.23 N ATOM 442 CA ILE A 55 7.324 -2.848 12.848 1.00 28.01 C ATOM 443 C ILE A 55 6.867 -3.480 14.147 1.00 25.10 C ATOM 444 O ILE A 55 6.321 -2.784 14.978 1.00 25.53 O ATOM 445 CB ILE A 55 8.498 -1.853 13.070 1.00 28.94 C ATOM 446 CG1 ILE A 55 8.782 -1.105 11.765 1.00 24.90 C ATOM 447 CG2 ILE A 55 9.770 -2.583 13.438 1.00 27.40 C ATOM 448 CD1 ILE A 55 9.784 -0.023 11.861 1.00 21.82 C ATOM 0 H ILE A 55 6.060 -1.357 12.651 1.00 29.23 H new ATOM 0 HA ILE A 55 7.659 -3.517 12.230 1.00 28.01 H new ATOM 0 HB ILE A 55 8.240 -1.250 13.785 1.00 28.94 H new ATOM 0 HG12 ILE A 55 9.082 -1.746 11.101 1.00 24.90 H new ATOM 0 HG13 ILE A 55 7.950 -0.727 11.439 1.00 24.90 H new ATOM 0 HG21 ILE A 55 10.485 -1.941 13.571 1.00 27.40 H new ATOM 0 HG22 ILE A 55 9.630 -3.084 14.256 1.00 27.40 H new ATOM 0 HG23 ILE A 55 10.012 -3.193 12.723 1.00 27.40 H new ATOM 0 HD11 ILE A 55 9.898 0.391 10.991 1.00 21.82 H new ATOM 0 HD12 ILE A 55 9.482 0.643 12.499 1.00 21.82 H new ATOM 0 HD13 ILE A 55 10.631 -0.392 12.156 1.00 21.82 H new ATOM 449 N ASN A 56 6.997 -4.808 14.259 1.00 28.49 N ATOM 450 CA ASN A 56 6.560 -5.573 15.438 1.00 23.93 C ATOM 451 C ASN A 56 7.477 -5.495 16.633 1.00 25.07 C ATOM 452 O ASN A 56 8.711 -5.414 16.492 1.00 26.75 O ATOM 453 CB ASN A 56 6.263 -7.052 15.097 1.00 22.48 C ATOM 454 CG ASN A 56 7.526 -7.855 14.724 1.00 24.00 C ATOM 455 OD1 ASN A 56 8.372 -8.140 15.570 1.00 23.60 O ATOM 456 ND2 ASN A 56 7.627 -8.253 13.462 1.00 29.71 N ATOM 0 H ASN A 56 7.346 -5.297 13.644 1.00 28.49 H new ATOM 0 HA ASN A 56 5.739 -5.130 15.702 1.00 23.93 H new ATOM 0 HB2 ASN A 56 5.832 -7.473 15.857 1.00 22.48 H new ATOM 0 HB3 ASN A 56 5.634 -7.088 14.359 1.00 22.48 H new ATOM 0 HD21 ASN A 56 8.301 -8.726 13.213 1.00 29.71 H new ATOM 0 HD22 ASN A 56 7.019 -8.038 12.893 1.00 29.71 H new ATOM 457 N ASN A 57 6.851 -5.558 17.808 1.00 25.61 N ATOM 458 CA ASN A 57 7.530 -5.499 19.110 1.00 33.01 C ATOM 459 C ASN A 57 8.058 -6.884 19.521 1.00 39.57 C ATOM 460 O ASN A 57 8.506 -7.099 20.654 1.00 43.30 O ATOM 461 CB ASN A 57 6.566 -5.018 20.183 1.00 23.55 C ATOM 462 CG ASN A 57 5.485 -6.005 20.433 1.00 23.28 C ATOM 463 OD1 ASN A 57 5.334 -6.957 19.673 1.00 22.58 O ATOM 464 ND2 ASN A 57 4.719 -5.808 21.501 1.00 27.81 N ATOM 0 H ASN A 57 5.997 -5.638 17.875 1.00 25.61 H new ATOM 0 HA ASN A 57 8.274 -4.882 19.024 1.00 33.01 H new ATOM 0 HB2 ASN A 57 7.053 -4.855 21.006 1.00 23.55 H new ATOM 0 HB3 ASN A 57 6.176 -4.172 19.912 1.00 23.55 H new ATOM 0 HD21 ASN A 57 4.086 -6.360 21.684 1.00 27.81 H new ATOM 0 HD22 ASN A 57 4.857 -5.128 22.009 1.00 27.81 H new ATOM 465 N LYS A 58 8.025 -7.809 18.570 1.00 45.46 N ATOM 466 CA LYS A 58 8.454 -9.177 18.773 1.00 37.10 C ATOM 467 C LYS A 58 9.950 -9.319 18.525 1.00 34.45 C ATOM 468 O LYS A 58 10.691 -9.839 19.355 1.00 38.50 O ATOM 469 CB LYS A 58 7.680 -10.057 17.799 1.00 37.16 C ATOM 470 CG LYS A 58 7.278 -11.381 18.327 1.00 47.91 C ATOM 471 CD LYS A 58 6.597 -12.208 17.235 1.00 57.18 C ATOM 472 CE LYS A 58 6.379 -13.665 17.697 1.00 64.08 C ATOM 473 NZ LYS A 58 5.393 -14.455 16.887 1.00 67.14 N ATOM 0 H LYS A 58 7.746 -7.651 17.772 1.00 45.46 H new ATOM 0 HA LYS A 58 8.281 -9.444 19.689 1.00 37.10 H new ATOM 0 HB2 LYS A 58 6.883 -9.581 17.519 1.00 37.16 H new ATOM 0 HB3 LYS A 58 8.223 -10.192 17.006 1.00 37.16 H new ATOM 0 HG2 LYS A 58 8.057 -11.853 18.659 1.00 47.91 H new ATOM 0 HG3 LYS A 58 6.674 -11.266 19.078 1.00 47.91 H new ATOM 0 HD2 LYS A 58 5.744 -11.807 17.006 1.00 57.18 H new ATOM 0 HD3 LYS A 58 7.140 -12.198 16.431 1.00 57.18 H new ATOM 0 HE2 LYS A 58 7.233 -14.125 17.679 1.00 64.08 H new ATOM 0 HE3 LYS A 58 6.082 -13.655 18.620 1.00 64.08 H new ATOM 0 HZ1 LYS A 58 5.328 -15.278 17.219 1.00 67.14 H new ATOM 0 HZ2 LYS A 58 4.597 -14.059 16.919 1.00 67.14 H new ATOM 0 HZ3 LYS A 58 5.669 -14.497 16.042 1.00 67.14 H new ATOM 474 N ILE A 59 10.416 -8.791 17.408 1.00 33.88 N ATOM 475 CA ILE A 59 11.824 -8.939 17.055 1.00 32.06 C ATOM 476 C ILE A 59 12.576 -7.616 16.988 1.00 31.40 C ATOM 477 O ILE A 59 13.724 -7.517 17.421 1.00 31.33 O ATOM 478 CB ILE A 59 11.946 -9.581 15.621 1.00 29.78 C ATOM 479 CG1 ILE A 59 11.191 -10.917 15.526 1.00 28.35 C ATOM 480 CG2 ILE A 59 13.381 -9.661 15.177 1.00 26.10 C ATOM 481 CD1 ILE A 59 11.604 -11.976 16.520 1.00 34.51 C ATOM 0 H ILE A 59 9.944 -8.347 16.843 1.00 33.88 H new ATOM 0 HA ILE A 59 12.210 -9.491 17.753 1.00 32.06 H new ATOM 0 HB ILE A 59 11.505 -8.992 14.989 1.00 29.78 H new ATOM 0 HG12 ILE A 59 10.244 -10.743 15.639 1.00 28.35 H new ATOM 0 HG13 ILE A 59 11.309 -11.273 14.631 1.00 28.35 H new ATOM 0 HG21 ILE A 59 13.425 -10.059 14.294 1.00 26.10 H new ATOM 0 HG22 ILE A 59 13.761 -8.769 15.148 1.00 26.10 H new ATOM 0 HG23 ILE A 59 13.883 -10.206 15.802 1.00 26.10 H new ATOM 0 HD11 ILE A 59 11.073 -12.776 16.380 1.00 34.51 H new ATOM 0 HD12 ILE A 59 12.543 -12.186 16.398 1.00 34.51 H new ATOM 0 HD13 ILE A 59 11.461 -11.647 17.421 1.00 34.51 H new ATOM 482 N TRP A 60 11.886 -6.589 16.512 1.00 33.37 N ATOM 483 CA TRP A 60 12.505 -5.307 16.253 1.00 30.69 C ATOM 484 C TRP A 60 12.538 -4.179 17.274 1.00 30.59 C ATOM 485 O TRP A 60 13.502 -3.435 17.302 1.00 34.76 O ATOM 486 CB TRP A 60 12.018 -4.792 14.887 1.00 30.26 C ATOM 487 CG TRP A 60 12.038 -5.868 13.820 1.00 22.48 C ATOM 488 CD1 TRP A 60 10.959 -6.621 13.397 1.00 24.33 C ATOM 489 CD2 TRP A 60 13.167 -6.355 13.095 1.00 21.72 C ATOM 490 NE1 TRP A 60 11.369 -7.544 12.466 1.00 18.40 N ATOM 491 CE2 TRP A 60 12.715 -7.408 12.258 1.00 22.89 C ATOM 492 CE3 TRP A 60 14.520 -6.007 13.062 1.00 19.41 C ATOM 493 CZ2 TRP A 60 13.575 -8.112 11.408 1.00 26.56 C ATOM 494 CZ3 TRP A 60 15.368 -6.711 12.211 1.00 27.64 C ATOM 495 CH2 TRP A 60 14.894 -7.752 11.396 1.00 25.44 C ATOM 0 H TRP A 60 11.046 -6.619 16.331 1.00 33.37 H new ATOM 0 HA TRP A 60 13.442 -5.553 16.302 1.00 30.69 H new ATOM 0 HB2 TRP A 60 11.116 -4.447 14.978 1.00 30.26 H new ATOM 0 HB3 TRP A 60 12.578 -4.051 14.606 1.00 30.26 H new ATOM 0 HD1 TRP A 60 10.085 -6.518 13.698 1.00 24.33 H new ATOM 0 HE1 TRP A 60 10.860 -8.117 12.075 1.00 18.40 H new ATOM 0 HE3 TRP A 60 14.847 -5.320 13.597 1.00 19.41 H new ATOM 0 HZ2 TRP A 60 13.260 -8.802 10.869 1.00 26.56 H new ATOM 0 HZ3 TRP A 60 16.270 -6.486 12.182 1.00 27.64 H new ATOM 0 HH2 TRP A 60 15.487 -8.204 10.839 1.00 25.44 H new ATOM 496 N CYS A 61 11.528 -4.005 18.103 1.00 33.53 N ATOM 497 CA CYS A 61 11.631 -2.929 19.070 1.00 34.52 C ATOM 498 C CYS A 61 11.141 -3.262 20.455 1.00 40.21 C ATOM 499 O CYS A 61 10.439 -4.245 20.659 1.00 43.18 O ATOM 500 CB CYS A 61 10.947 -1.651 18.560 1.00 37.67 C ATOM 501 SG CYS A 61 9.234 -1.801 18.005 1.00 29.69 S ATOM 0 H CYS A 61 10.806 -4.472 18.127 1.00 33.53 H new ATOM 0 HA CYS A 61 12.585 -2.780 19.160 1.00 34.52 H new ATOM 0 HB2 CYS A 61 10.977 -0.990 19.269 1.00 37.67 H new ATOM 0 HB3 CYS A 61 11.473 -1.301 17.824 1.00 37.67 H new ATOM 502 N LYS A 62 11.550 -2.437 21.413 1.00 43.49 N ATOM 503 CA LYS A 62 11.182 -2.617 22.805 1.00 47.76 C ATOM 504 C LYS A 62 9.785 -2.074 23.137 1.00 43.63 C ATOM 505 O LYS A 62 9.436 -0.943 22.817 1.00 46.05 O ATOM 506 CB LYS A 62 12.258 -1.981 23.692 1.00 53.77 C ATOM 507 CG LYS A 62 12.332 -2.524 25.113 1.00 63.12 C ATOM 508 CD LYS A 62 12.623 -4.036 25.180 1.00 68.98 C ATOM 509 CE LYS A 62 11.354 -4.901 25.147 1.00 66.99 C ATOM 510 NZ LYS A 62 10.390 -4.516 26.227 1.00 72.84 N ATOM 0 H LYS A 62 12.052 -1.754 21.269 1.00 43.49 H new ATOM 0 HA LYS A 62 11.133 -3.570 22.980 1.00 47.76 H new ATOM 0 HB2 LYS A 62 13.121 -2.106 23.268 1.00 53.77 H new ATOM 0 HB3 LYS A 62 12.098 -1.025 23.734 1.00 53.77 H new ATOM 0 HG2 LYS A 62 13.024 -2.047 25.598 1.00 63.12 H new ATOM 0 HG3 LYS A 62 11.493 -2.343 25.565 1.00 63.12 H new ATOM 0 HD2 LYS A 62 13.194 -4.282 24.436 1.00 68.98 H new ATOM 0 HD3 LYS A 62 13.117 -4.228 25.992 1.00 68.98 H new ATOM 0 HE2 LYS A 62 10.924 -4.811 24.282 1.00 66.99 H new ATOM 0 HE3 LYS A 62 11.596 -5.835 25.248 1.00 66.99 H new ATOM 0 HZ1 LYS A 62 9.951 -5.239 26.505 1.00 72.84 H new ATOM 0 HZ2 LYS A 62 10.836 -4.159 26.910 1.00 72.84 H new ATOM 0 HZ3 LYS A 62 9.810 -3.921 25.909 1.00 72.84 H new ATOM 511 N ASP A 63 9.009 -2.879 23.833 1.00 46.53 N ATOM 512 CA ASP A 63 7.710 -2.562 24.216 1.00 47.91 C ATOM 513 C ASP A 63 7.493 -2.691 25.713 1.00 55.12 C ATOM 514 O ASP A 63 8.227 -3.471 26.382 1.00 57.21 O ATOM 515 CB ASP A 63 6.774 -3.497 23.482 1.00 42.42 C ATOM 516 CG ASP A 63 5.378 -2.925 23.569 1.00 35.80 C ATOM 517 OD1 ASP A 63 5.215 -1.817 24.016 1.00 47.20 O ATOM 518 OD2 ASP A 63 4.482 -3.583 23.190 1.00 39.29 O ATOM 0 H ASP A 63 9.262 -3.658 24.096 1.00 46.53 H new ATOM 0 HA ASP A 63 7.538 -1.634 23.991 1.00 47.91 H new ATOM 0 HB2 ASP A 63 7.045 -3.590 22.555 1.00 42.42 H new ATOM 0 HB3 ASP A 63 6.802 -4.383 23.876 1.00 42.42 H new ATOM 519 N ASP A 64 6.854 -1.713 26.342 1.00 63.77 N ATOM 520 CA ASP A 64 6.602 -1.711 27.787 1.00 70.88 C ATOM 521 C ASP A 64 5.728 -2.897 28.249 1.00 70.82 C ATOM 522 O ASP A 64 5.532 -3.109 29.447 1.00 71.64 O ATOM 523 CB ASP A 64 5.954 -0.372 28.205 1.00 76.85 C ATOM 524 CG ASP A 64 6.891 0.835 28.004 1.00 82.41 C ATOM 525 OD1 ASP A 64 7.955 0.864 28.658 1.00 87.77 O ATOM 526 OD2 ASP A 64 6.570 1.757 27.209 1.00 81.98 O ATOM 0 H ASP A 64 6.548 -1.018 25.939 1.00 63.77 H new ATOM 0 HA ASP A 64 7.461 -1.813 28.226 1.00 70.88 H new ATOM 0 HB2 ASP A 64 5.143 -0.236 27.690 1.00 76.85 H new ATOM 0 HB3 ASP A 64 5.693 -0.421 29.138 1.00 76.85 H new ATOM 527 N GLN A 65 5.216 -3.666 27.287 1.00 71.07 N ATOM 528 CA GLN A 65 4.378 -4.803 27.651 1.00 68.39 C ATOM 529 C GLN A 65 4.793 -6.096 26.968 1.00 65.94 C ATOM 530 O GLN A 65 3.963 -6.999 26.704 1.00 68.61 O ATOM 531 CB GLN A 65 2.940 -4.458 27.266 1.00 71.16 C ATOM 532 CG GLN A 65 2.786 -4.165 25.773 1.00 72.09 C ATOM 533 CD GLN A 65 1.818 -5.150 25.166 1.00 74.55 C ATOM 534 OE1 GLN A 65 1.197 -5.961 25.826 1.00 74.99 O ATOM 535 NE2 GLN A 65 1.697 -5.043 23.828 1.00 76.43 N ATOM 0 H GLN A 65 5.338 -3.550 26.444 1.00 71.07 H new ATOM 0 HA GLN A 65 4.472 -4.958 28.604 1.00 68.39 H new ATOM 0 HB2 GLN A 65 2.358 -5.195 27.509 1.00 71.16 H new ATOM 0 HB3 GLN A 65 2.649 -3.686 27.776 1.00 71.16 H new ATOM 0 HG2 GLN A 65 2.465 -3.259 25.642 1.00 72.09 H new ATOM 0 HG3 GLN A 65 3.647 -4.228 25.330 1.00 72.09 H new ATOM 0 HE21 GLN A 65 2.156 -4.455 23.400 1.00 76.43 H new ATOM 0 HE22 GLN A 65 1.161 -5.563 23.402 1.00 76.43 H new ATOM 536 N ASN A 66 6.093 -6.182 26.629 1.00 62.94 N ATOM 537 CA ASN A 66 6.621 -7.428 26.065 1.00 61.05 C ATOM 538 C ASN A 66 8.123 -7.521 26.208 1.00 56.43 C ATOM 539 O ASN A 66 8.900 -7.083 25.325 1.00 57.91 O ATOM 540 CB ASN A 66 6.238 -7.480 24.582 1.00 65.93 C ATOM 541 CG ASN A 66 6.710 -8.793 23.993 1.00 69.86 C ATOM 542 OD1 ASN A 66 6.783 -9.821 24.655 1.00 78.65 O ATOM 543 ND2 ASN A 66 7.041 -8.734 22.691 1.00 66.02 N ATOM 0 H ASN A 66 6.667 -5.547 26.716 1.00 62.94 H new ATOM 0 HA ASN A 66 6.240 -8.177 26.550 1.00 61.05 H new ATOM 0 HB2 ASN A 66 5.277 -7.395 24.482 1.00 65.93 H new ATOM 0 HB3 ASN A 66 6.640 -6.736 24.106 1.00 65.93 H new ATOM 0 HD21 ASN A 66 7.319 -9.440 22.286 1.00 66.02 H new ATOM 0 HD22 ASN A 66 6.975 -7.991 22.264 1.00 66.02 H new ATOM 544 N PRO A 67 8.555 -8.069 27.358 1.00 51.28 N ATOM 545 CA PRO A 67 9.980 -8.050 27.685 1.00 49.42 C ATOM 546 C PRO A 67 10.765 -9.099 26.924 1.00 48.07 C ATOM 547 O PRO A 67 11.996 -9.142 26.933 1.00 44.59 O ATOM 548 CB PRO A 67 10.120 -8.295 29.180 1.00 52.20 C ATOM 549 CG PRO A 67 8.848 -8.984 29.656 1.00 52.68 C ATOM 550 CD PRO A 67 7.804 -8.579 28.508 1.00 50.51 C ATOM 0 HA PRO A 67 10.343 -7.188 27.429 1.00 49.42 H new ATOM 0 HB2 PRO A 67 10.896 -8.848 29.363 1.00 52.20 H new ATOM 0 HB3 PRO A 67 10.251 -7.457 29.652 1.00 52.20 H new ATOM 0 HG2 PRO A 67 8.959 -9.945 29.724 1.00 52.68 H new ATOM 0 HG3 PRO A 67 8.568 -8.668 30.530 1.00 52.68 H new ATOM 0 HD2 PRO A 67 7.272 -9.348 28.249 1.00 50.51 H new ATOM 0 HD3 PRO A 67 7.188 -7.905 28.835 1.00 50.51 H new ATOM 551 N HIS A 68 10.024 -10.009 26.273 1.00 48.20 N ATOM 552 CA HIS A 68 10.699 -11.058 25.512 1.00 44.41 C ATOM 553 C HIS A 68 11.241 -10.562 24.187 1.00 43.94 C ATOM 554 O HIS A 68 11.877 -11.340 23.428 1.00 47.55 O ATOM 555 CB HIS A 68 9.686 -12.186 25.274 1.00 38.42 C ATOM 556 CG HIS A 68 9.081 -12.599 26.595 1.00 36.86 C ATOM 557 ND1 HIS A 68 9.809 -13.047 27.651 1.00 33.83 N ATOM 558 CD2 HIS A 68 7.730 -12.604 26.956 1.00 33.58 C ATOM 559 CE1 HIS A 68 8.915 -13.312 28.623 1.00 32.90 C ATOM 560 NE2 HIS A 68 7.664 -13.056 28.236 1.00 28.86 N ATOM 0 H HIS A 68 9.164 -10.034 26.261 1.00 48.20 H new ATOM 0 HA HIS A 68 11.464 -11.369 26.021 1.00 44.41 H new ATOM 0 HB2 HIS A 68 8.991 -11.888 24.667 1.00 38.42 H new ATOM 0 HB3 HIS A 68 10.123 -12.944 24.855 1.00 38.42 H new ATOM 0 HD2 HIS A 68 7.013 -12.347 26.422 1.00 33.58 H new ATOM 0 HE1 HIS A 68 9.143 -13.635 29.465 1.00 32.90 H new ATOM 0 HE2 HIS A 68 6.952 -13.158 28.707 1.00 28.86 H new ATOM 561 N SER A 69 11.022 -9.300 23.801 1.00 40.94 N ATOM 562 CA SER A 69 11.503 -8.773 22.538 1.00 34.08 C ATOM 563 C SER A 69 12.997 -8.906 22.372 1.00 37.97 C ATOM 564 O SER A 69 13.742 -8.868 23.354 1.00 40.75 O ATOM 565 CB SER A 69 11.132 -7.309 22.393 1.00 34.34 C ATOM 566 OG SER A 69 11.677 -6.786 21.187 1.00 31.15 O ATOM 0 H SER A 69 10.586 -8.729 24.274 1.00 40.94 H new ATOM 0 HA SER A 69 11.074 -9.305 21.849 1.00 34.08 H new ATOM 0 HB2 SER A 69 10.167 -7.211 22.390 1.00 34.34 H new ATOM 0 HB3 SER A 69 11.466 -6.806 23.152 1.00 34.34 H new ATOM 0 HG SER A 69 11.323 -6.043 21.018 1.00 31.15 H new ATOM 567 N SER A 70 13.420 -9.051 21.118 1.00 40.70 N ATOM 568 CA SER A 70 14.837 -9.168 20.747 1.00 40.00 C ATOM 569 C SER A 70 15.388 -7.748 20.557 1.00 41.51 C ATOM 570 O SER A 70 16.607 -7.526 20.602 1.00 42.96 O ATOM 571 CB SER A 70 14.996 -9.970 19.446 1.00 37.12 C ATOM 572 OG SER A 70 14.122 -11.078 19.439 1.00 37.08 O ATOM 0 H SER A 70 12.886 -9.085 20.445 1.00 40.70 H new ATOM 0 HA SER A 70 15.324 -9.636 21.443 1.00 40.00 H new ATOM 0 HB2 SER A 70 14.811 -9.400 18.683 1.00 37.12 H new ATOM 0 HB3 SER A 70 15.913 -10.274 19.357 1.00 37.12 H new ATOM 0 HG SER A 70 14.218 -11.506 18.723 1.00 37.08 H new ATOM 573 N ASN A 71 14.474 -6.805 20.299 1.00 38.95 N ATOM 574 CA ASN A 71 14.801 -5.393 20.142 1.00 37.90 C ATOM 575 C ASN A 71 16.019 -5.161 19.245 1.00 37.03 C ATOM 576 O ASN A 71 16.908 -4.387 19.591 1.00 36.90 O ATOM 577 CB ASN A 71 15.024 -4.771 21.531 1.00 39.11 C ATOM 578 CG ASN A 71 15.096 -3.257 21.506 1.00 38.76 C ATOM 579 OD1 ASN A 71 14.924 -2.634 20.472 1.00 45.15 O ATOM 580 ND2 ASN A 71 15.335 -2.654 22.662 1.00 37.73 N ATOM 0 H ASN A 71 13.636 -6.976 20.210 1.00 38.95 H new ATOM 0 HA ASN A 71 14.053 -4.962 19.699 1.00 37.90 H new ATOM 0 HB2 ASN A 71 14.304 -5.045 22.120 1.00 39.11 H new ATOM 0 HB3 ASN A 71 15.847 -5.121 21.907 1.00 39.11 H new ATOM 0 HD21 ASN A 71 15.373 -1.796 22.699 1.00 37.73 H new ATOM 0 HD22 ASN A 71 15.452 -3.121 23.375 1.00 37.73 H new ATOM 581 N ILE A 72 16.019 -5.794 18.071 1.00 36.10 N ATOM 582 CA ILE A 72 17.115 -5.663 17.123 1.00 35.44 C ATOM 583 C ILE A 72 17.352 -4.224 16.683 1.00 38.66 C ATOM 584 O ILE A 72 18.489 -3.827 16.443 1.00 40.20 O ATOM 585 CB ILE A 72 16.959 -6.619 15.909 1.00 34.37 C ATOM 586 CG1 ILE A 72 17.086 -8.074 16.396 1.00 35.55 C ATOM 587 CG2 ILE A 72 18.034 -6.332 14.868 1.00 30.16 C ATOM 588 CD1 ILE A 72 17.139 -9.148 15.310 1.00 30.07 C ATOM 0 H ILE A 72 15.383 -6.309 17.806 1.00 36.10 H new ATOM 0 HA ILE A 72 17.913 -5.936 17.602 1.00 35.44 H new ATOM 0 HB ILE A 72 16.089 -6.481 15.503 1.00 34.37 H new ATOM 0 HG12 ILE A 72 17.889 -8.146 16.935 1.00 35.55 H new ATOM 0 HG13 ILE A 72 16.335 -8.267 16.979 1.00 35.55 H new ATOM 0 HG21 ILE A 72 17.926 -6.935 14.116 1.00 30.16 H new ATOM 0 HG22 ILE A 72 17.951 -5.415 14.562 1.00 30.16 H new ATOM 0 HG23 ILE A 72 18.910 -6.463 15.263 1.00 30.16 H new ATOM 0 HD11 ILE A 72 17.219 -10.022 15.723 1.00 30.07 H new ATOM 0 HD12 ILE A 72 16.327 -9.114 14.781 1.00 30.07 H new ATOM 0 HD13 ILE A 72 17.905 -8.991 14.736 1.00 30.07 H new ATOM 589 N CYS A 73 16.292 -3.428 16.621 1.00 39.65 N ATOM 590 CA CYS A 73 16.444 -2.025 16.254 1.00 40.46 C ATOM 591 C CYS A 73 16.938 -1.172 17.419 1.00 42.36 C ATOM 592 O CYS A 73 17.230 0.003 17.229 1.00 47.38 O ATOM 593 CB CYS A 73 15.160 -1.454 15.652 1.00 33.36 C ATOM 594 SG CYS A 73 15.027 -1.857 13.876 1.00 32.92 S ATOM 0 H CYS A 73 15.485 -3.676 16.785 1.00 39.65 H new ATOM 0 HA CYS A 73 17.129 -1.992 15.568 1.00 40.46 H new ATOM 0 HB2 CYS A 73 14.392 -1.810 16.125 1.00 33.36 H new ATOM 0 HB3 CYS A 73 15.145 -0.491 15.770 1.00 33.36 H new ATOM 595 N ASN A 74 17.014 -1.767 18.617 1.00 46.10 N ATOM 596 CA ASN A 74 17.514 -1.105 19.837 1.00 48.75 C ATOM 597 C ASN A 74 16.771 0.187 20.176 1.00 48.63 C ATOM 598 O ASN A 74 17.324 1.107 20.782 1.00 51.75 O ATOM 599 CB ASN A 74 19.016 -0.806 19.667 1.00 55.80 C ATOM 600 CG ASN A 74 19.896 -1.597 20.622 1.00 59.37 C ATOM 601 OD1 ASN A 74 20.476 -1.034 21.547 1.00 60.72 O ATOM 602 ND2 ASN A 74 20.024 -2.900 20.386 1.00 60.66 N ATOM 0 H ASN A 74 16.772 -2.582 18.747 1.00 46.10 H new ATOM 0 HA ASN A 74 17.359 -1.715 20.575 1.00 48.75 H new ATOM 0 HB2 ASN A 74 19.278 -1.005 18.755 1.00 55.80 H new ATOM 0 HB3 ASN A 74 19.169 0.142 19.805 1.00 55.80 H new ATOM 0 HD21 ASN A 74 20.528 -3.381 20.890 1.00 60.66 H new ATOM 0 HD22 ASN A 74 19.603 -3.261 19.729 1.00 60.66 H new ATOM 603 N ILE A 75 15.483 0.207 19.896 1.00 44.19 N ATOM 604 CA ILE A 75 14.712 1.408 20.099 1.00 40.11 C ATOM 605 C ILE A 75 13.386 1.055 20.721 1.00 40.89 C ATOM 606 O ILE A 75 13.021 -0.110 20.791 1.00 43.81 O ATOM 607 CB ILE A 75 14.480 2.049 18.731 1.00 41.68 C ATOM 608 CG1 ILE A 75 13.850 3.425 18.849 1.00 35.93 C ATOM 609 CG2 ILE A 75 13.623 1.135 17.863 1.00 43.86 C ATOM 610 CD1 ILE A 75 13.882 4.160 17.531 1.00 36.18 C ATOM 0 H ILE A 75 15.039 -0.463 19.589 1.00 44.19 H new ATOM 0 HA ILE A 75 15.181 2.020 20.687 1.00 40.11 H new ATOM 0 HB ILE A 75 15.345 2.167 18.308 1.00 41.68 H new ATOM 0 HG12 ILE A 75 12.932 3.338 19.150 1.00 35.93 H new ATOM 0 HG13 ILE A 75 14.321 3.942 19.521 1.00 35.93 H new ATOM 0 HG21 ILE A 75 13.481 1.550 16.998 1.00 43.86 H new ATOM 0 HG22 ILE A 75 14.075 0.285 17.744 1.00 43.86 H new ATOM 0 HG23 ILE A 75 12.767 0.988 18.295 1.00 43.86 H new ATOM 0 HD11 ILE A 75 13.474 5.033 17.637 1.00 36.18 H new ATOM 0 HD12 ILE A 75 14.802 4.267 17.242 1.00 36.18 H new ATOM 0 HD13 ILE A 75 13.391 3.653 16.866 1.00 36.18 H new ATOM 611 N SER A 76 12.702 2.056 21.245 1.00 36.84 N ATOM 612 CA SER A 76 11.404 1.840 21.831 1.00 39.18 C ATOM 613 C SER A 76 10.396 1.950 20.692 1.00 41.12 C ATOM 614 O SER A 76 10.504 2.848 19.865 1.00 45.78 O ATOM 615 CB SER A 76 11.135 2.897 22.900 1.00 36.64 C ATOM 616 OG SER A 76 9.895 2.655 23.538 1.00 39.97 O ATOM 0 H SER A 76 12.977 2.871 21.269 1.00 36.84 H new ATOM 0 HA SER A 76 11.343 0.973 22.261 1.00 39.18 H new ATOM 0 HB2 SER A 76 11.849 2.890 23.556 1.00 36.64 H new ATOM 0 HB3 SER A 76 11.130 3.779 22.496 1.00 36.64 H new ATOM 0 HG SER A 76 9.469 3.376 23.605 1.00 39.97 H new ATOM 617 N CYS A 77 9.410 1.059 20.653 1.00 43.52 N ATOM 618 CA CYS A 77 8.401 1.061 19.581 1.00 43.39 C ATOM 619 C CYS A 77 7.578 2.344 19.420 1.00 41.42 C ATOM 620 O CYS A 77 7.016 2.597 18.349 1.00 38.11 O ATOM 621 CB CYS A 77 7.395 -0.086 19.760 1.00 40.87 C ATOM 622 SG CYS A 77 8.027 -1.790 19.638 1.00 36.31 S ATOM 0 H CYS A 77 9.302 0.439 21.239 1.00 43.52 H new ATOM 0 HA CYS A 77 8.946 0.965 18.785 1.00 43.39 H new ATOM 0 HB2 CYS A 77 6.977 0.016 20.629 1.00 40.87 H new ATOM 0 HB3 CYS A 77 6.697 0.022 19.095 1.00 40.87 H new ATOM 623 N ASP A 78 7.412 3.081 20.509 1.00 40.78 N ATOM 624 CA ASP A 78 6.631 4.311 20.497 1.00 39.28 C ATOM 625 C ASP A 78 7.284 5.405 19.674 1.00 36.65 C ATOM 626 O ASP A 78 6.603 6.268 19.130 1.00 34.41 O ATOM 627 CB ASP A 78 6.331 4.762 21.923 1.00 50.78 C ATOM 628 CG ASP A 78 7.469 4.455 22.882 1.00 65.58 C ATOM 629 OD1 ASP A 78 8.635 4.763 22.530 1.00 73.67 O ATOM 630 OD2 ASP A 78 7.203 3.910 23.980 1.00 75.08 O ATOM 0 H ASP A 78 7.748 2.884 21.276 1.00 40.78 H new ATOM 0 HA ASP A 78 5.787 4.122 20.058 1.00 39.28 H new ATOM 0 HB2 ASP A 78 6.157 5.716 21.927 1.00 50.78 H new ATOM 0 HB3 ASP A 78 5.523 4.325 22.234 1.00 50.78 H new ATOM 631 N LYS A 79 8.595 5.309 19.488 1.00 34.39 N ATOM 632 CA LYS A 79 9.297 6.281 18.671 1.00 31.54 C ATOM 633 C LYS A 79 8.920 6.122 17.192 1.00 37.28 C ATOM 634 O LYS A 79 9.338 6.903 16.325 1.00 39.63 O ATOM 635 CB LYS A 79 10.799 6.158 18.889 1.00 34.00 C ATOM 636 CG LYS A 79 11.196 6.677 20.287 1.00 42.76 C ATOM 637 CD LYS A 79 12.659 7.078 20.390 1.00 49.50 C ATOM 638 CE LYS A 79 13.575 5.925 20.849 1.00 56.50 C ATOM 639 NZ LYS A 79 13.403 5.463 22.280 1.00 58.04 N ATOM 0 H LYS A 79 9.091 4.692 19.824 1.00 34.39 H new ATOM 0 HA LYS A 79 9.029 7.173 18.940 1.00 31.54 H new ATOM 0 HB2 LYS A 79 11.068 5.231 18.795 1.00 34.00 H new ATOM 0 HB3 LYS A 79 11.271 6.661 18.207 1.00 34.00 H new ATOM 0 HG2 LYS A 79 10.642 7.441 20.510 1.00 42.76 H new ATOM 0 HG3 LYS A 79 11.009 5.989 20.945 1.00 42.76 H new ATOM 0 HD2 LYS A 79 12.962 7.399 19.526 1.00 49.50 H new ATOM 0 HD3 LYS A 79 12.743 7.817 21.013 1.00 49.50 H new ATOM 0 HE2 LYS A 79 13.426 5.166 20.264 1.00 56.50 H new ATOM 0 HE3 LYS A 79 14.497 6.201 20.727 1.00 56.50 H new ATOM 0 HZ1 LYS A 79 13.547 4.586 22.328 1.00 58.04 H new ATOM 0 HZ2 LYS A 79 13.986 5.888 22.801 1.00 58.04 H new ATOM 0 HZ3 LYS A 79 12.575 5.643 22.553 1.00 58.04 H new ATOM 640 N PHE A 80 8.140 5.088 16.901 1.00 38.22 N ATOM 641 CA PHE A 80 7.648 4.827 15.555 1.00 31.87 C ATOM 642 C PHE A 80 6.228 5.362 15.444 1.00 28.38 C ATOM 643 O PHE A 80 5.602 5.247 14.402 1.00 29.92 O ATOM 644 CB PHE A 80 7.599 3.322 15.253 1.00 29.50 C ATOM 645 CG PHE A 80 8.933 2.662 15.203 1.00 27.81 C ATOM 646 CD1 PHE A 80 10.068 3.394 14.935 1.00 23.58 C ATOM 647 CD2 PHE A 80 9.048 1.294 15.435 1.00 33.64 C ATOM 648 CE1 PHE A 80 11.307 2.789 14.889 1.00 24.97 C ATOM 649 CE2 PHE A 80 10.290 0.659 15.398 1.00 35.31 C ATOM 650 CZ PHE A 80 11.423 1.415 15.123 1.00 36.39 C ATOM 0 H PHE A 80 7.879 4.513 17.485 1.00 38.22 H new ATOM 0 HA PHE A 80 8.250 5.258 14.928 1.00 31.87 H new ATOM 0 HB2 PHE A 80 7.059 2.885 15.930 1.00 29.50 H new ATOM 0 HB3 PHE A 80 7.152 3.188 14.403 1.00 29.50 H new ATOM 0 HD1 PHE A 80 9.998 4.309 14.783 1.00 23.58 H new ATOM 0 HD2 PHE A 80 8.285 0.795 15.618 1.00 33.64 H new ATOM 0 HE1 PHE A 80 12.065 3.295 14.702 1.00 24.97 H new ATOM 0 HE2 PHE A 80 10.358 -0.255 15.555 1.00 35.31 H new ATOM 0 HZ PHE A 80 12.258 1.007 15.095 1.00 36.39 H new ATOM 651 N LEU A 81 5.697 5.925 16.520 1.00 28.68 N ATOM 652 CA LEU A 81 4.324 6.420 16.459 1.00 30.97 C ATOM 653 C LEU A 81 4.264 7.933 16.288 1.00 35.33 C ATOM 654 O LEU A 81 3.178 8.510 16.158 1.00 35.11 O ATOM 655 CB LEU A 81 3.538 5.983 17.690 1.00 20.29 C ATOM 656 CG LEU A 81 3.302 4.493 17.867 1.00 19.65 C ATOM 657 CD1 LEU A 81 2.796 4.223 19.267 1.00 19.99 C ATOM 658 CD2 LEU A 81 2.311 4.017 16.838 1.00 16.82 C ATOM 0 H LEU A 81 6.097 6.030 17.274 1.00 28.68 H new ATOM 0 HA LEU A 81 3.913 6.028 15.673 1.00 30.97 H new ATOM 0 HB2 LEU A 81 4.003 6.310 18.476 1.00 20.29 H new ATOM 0 HB3 LEU A 81 2.674 6.424 17.668 1.00 20.29 H new ATOM 0 HG LEU A 81 4.134 4.010 17.742 1.00 19.65 H new ATOM 0 HD11 LEU A 81 2.646 3.271 19.379 1.00 19.99 H new ATOM 0 HD12 LEU A 81 3.454 4.524 19.913 1.00 19.99 H new ATOM 0 HD13 LEU A 81 1.963 4.700 19.408 1.00 19.99 H new ATOM 0 HD21 LEU A 81 2.160 3.065 16.950 1.00 16.82 H new ATOM 0 HD22 LEU A 81 1.473 4.493 16.951 1.00 16.82 H new ATOM 0 HD23 LEU A 81 2.661 4.186 15.949 1.00 16.82 H new ATOM 659 N ASP A 82 5.436 8.569 16.267 1.00 37.47 N ATOM 660 CA ASP A 82 5.489 10.012 16.125 1.00 39.93 C ATOM 661 C ASP A 82 5.502 10.404 14.671 1.00 43.67 C ATOM 662 O ASP A 82 5.446 9.537 13.805 1.00 47.73 O ATOM 663 CB ASP A 82 6.674 10.628 16.881 1.00 30.89 C ATOM 664 CG ASP A 82 8.014 10.127 16.388 1.00 39.23 C ATOM 665 OD1 ASP A 82 8.094 9.648 15.235 1.00 35.35 O ATOM 666 OD2 ASP A 82 8.999 10.209 17.162 1.00 36.21 O ATOM 0 H ASP A 82 6.201 8.183 16.333 1.00 37.47 H new ATOM 0 HA ASP A 82 4.685 10.372 16.530 1.00 39.93 H new ATOM 0 HB2 ASP A 82 6.642 11.593 16.791 1.00 30.89 H new ATOM 0 HB3 ASP A 82 6.587 10.428 17.826 1.00 30.89 H new ATOM 667 N ASP A 83 5.676 11.702 14.431 1.00 45.85 N ATOM 668 CA ASP A 83 5.669 12.303 13.098 1.00 43.70 C ATOM 669 C ASP A 83 6.989 12.244 12.335 1.00 36.63 C ATOM 670 O ASP A 83 7.011 12.503 11.150 1.00 36.33 O ATOM 671 CB ASP A 83 5.208 13.759 13.205 1.00 48.81 C ATOM 672 CG ASP A 83 5.944 14.503 14.290 1.00 57.76 C ATOM 673 OD1 ASP A 83 5.608 14.286 15.479 1.00 62.56 O ATOM 674 OD2 ASP A 83 6.879 15.272 13.958 1.00 64.02 O ATOM 0 H ASP A 83 5.805 12.275 15.059 1.00 45.85 H new ATOM 0 HA ASP A 83 5.055 11.762 12.578 1.00 43.70 H new ATOM 0 HB2 ASP A 83 5.348 14.205 12.355 1.00 48.81 H new ATOM 0 HB3 ASP A 83 4.255 13.784 13.385 1.00 48.81 H new ATOM 675 N ASP A 84 8.084 11.950 13.018 1.00 35.58 N ATOM 676 CA ASP A 84 9.393 11.841 12.382 1.00 32.26 C ATOM 677 C ASP A 84 9.680 10.379 11.970 1.00 32.33 C ATOM 678 O ASP A 84 9.778 9.479 12.828 1.00 32.69 O ATOM 679 CB ASP A 84 10.467 12.326 13.344 1.00 33.58 C ATOM 680 CG ASP A 84 11.825 12.443 12.680 1.00 46.48 C ATOM 681 OD1 ASP A 84 11.897 12.404 11.429 1.00 50.25 O ATOM 682 OD2 ASP A 84 12.830 12.576 13.407 1.00 53.91 O ATOM 0 H ASP A 84 8.092 11.807 13.866 1.00 35.58 H new ATOM 0 HA ASP A 84 9.398 12.391 11.583 1.00 32.26 H new ATOM 0 HB2 ASP A 84 10.210 13.189 13.704 1.00 33.58 H new ATOM 0 HB3 ASP A 84 10.528 11.713 14.093 1.00 33.58 H new ATOM 683 N LEU A 85 9.853 10.150 10.671 1.00 33.02 N ATOM 684 CA LEU A 85 10.099 8.804 10.130 1.00 32.08 C ATOM 685 C LEU A 85 11.583 8.517 9.960 1.00 32.63 C ATOM 686 O LEU A 85 11.966 7.514 9.386 1.00 36.95 O ATOM 687 CB LEU A 85 9.369 8.603 8.780 1.00 28.60 C ATOM 688 CG LEU A 85 7.849 8.847 8.670 1.00 26.97 C ATOM 689 CD1 LEU A 85 7.357 8.554 7.286 1.00 32.37 C ATOM 690 CD2 LEU A 85 7.100 8.016 9.658 1.00 24.08 C ATOM 0 H LEU A 85 9.832 10.768 10.074 1.00 33.02 H new ATOM 0 HA LEU A 85 9.744 8.176 10.779 1.00 32.08 H new ATOM 0 HB2 LEU A 85 9.800 9.182 8.132 1.00 28.60 H new ATOM 0 HB3 LEU A 85 9.534 7.690 8.498 1.00 28.60 H new ATOM 0 HG LEU A 85 7.690 9.784 8.866 1.00 26.97 H new ATOM 0 HD11 LEU A 85 6.401 8.714 7.241 1.00 32.37 H new ATOM 0 HD12 LEU A 85 7.811 9.131 6.652 1.00 32.37 H new ATOM 0 HD13 LEU A 85 7.540 7.627 7.067 1.00 32.37 H new ATOM 0 HD21 LEU A 85 6.149 8.186 9.570 1.00 24.08 H new ATOM 0 HD22 LEU A 85 7.277 7.077 9.491 1.00 24.08 H new ATOM 0 HD23 LEU A 85 7.387 8.244 10.556 1.00 24.08 H new ATOM 691 N THR A 86 12.422 9.384 10.499 1.00 34.78 N ATOM 692 CA THR A 86 13.868 9.229 10.397 1.00 36.67 C ATOM 693 C THR A 86 14.365 7.926 11.026 1.00 34.90 C ATOM 694 O THR A 86 15.137 7.168 10.411 1.00 32.99 O ATOM 695 CB THR A 86 14.582 10.462 11.030 1.00 39.74 C ATOM 696 OG1 THR A 86 14.330 11.615 10.215 1.00 44.25 O ATOM 697 CG2 THR A 86 16.088 10.231 11.154 1.00 39.00 C ATOM 0 H THR A 86 12.172 10.081 10.936 1.00 34.78 H new ATOM 0 HA THR A 86 14.090 9.181 9.454 1.00 36.67 H new ATOM 0 HB THR A 86 14.230 10.600 11.923 1.00 39.74 H new ATOM 0 HG1 THR A 86 13.605 11.970 10.448 1.00 44.25 H new ATOM 0 HG21 THR A 86 16.504 11.013 11.550 1.00 39.00 H new ATOM 0 HG22 THR A 86 16.252 9.458 11.717 1.00 39.00 H new ATOM 0 HG23 THR A 86 16.465 10.075 10.274 1.00 39.00 H new ATOM 698 N ASP A 87 13.940 7.673 12.257 1.00 28.73 N ATOM 699 CA ASP A 87 14.361 6.453 12.893 1.00 29.89 C ATOM 700 C ASP A 87 13.608 5.232 12.363 1.00 29.77 C ATOM 701 O ASP A 87 14.160 4.137 12.327 1.00 33.16 O ATOM 702 CB ASP A 87 14.327 6.561 14.421 1.00 27.70 C ATOM 703 CG ASP A 87 13.027 7.108 14.962 1.00 26.99 C ATOM 704 OD1 ASP A 87 12.056 7.318 14.207 1.00 30.83 O ATOM 705 OD2 ASP A 87 12.987 7.311 16.186 1.00 28.65 O ATOM 0 H ASP A 87 13.425 8.181 12.722 1.00 28.73 H new ATOM 0 HA ASP A 87 15.291 6.315 12.653 1.00 29.89 H new ATOM 0 HB2 ASP A 87 14.483 5.683 14.803 1.00 27.70 H new ATOM 0 HB3 ASP A 87 15.055 7.131 14.713 1.00 27.70 H new ATOM 706 N ASP A 88 12.387 5.435 11.885 1.00 28.04 N ATOM 707 CA ASP A 88 11.623 4.331 11.326 1.00 26.87 C ATOM 708 C ASP A 88 12.445 3.811 10.165 1.00 27.47 C ATOM 709 O ASP A 88 12.637 2.609 10.006 1.00 32.35 O ATOM 710 CB ASP A 88 10.281 4.815 10.789 1.00 19.21 C ATOM 711 CG ASP A 88 9.425 5.432 11.843 1.00 24.28 C ATOM 712 OD1 ASP A 88 9.947 6.308 12.572 1.00 33.12 O ATOM 713 OD2 ASP A 88 8.229 5.064 11.934 1.00 25.11 O ATOM 0 H ASP A 88 11.987 6.196 11.875 1.00 28.04 H new ATOM 0 HA ASP A 88 11.450 3.657 12.001 1.00 26.87 H new ATOM 0 HB2 ASP A 88 10.434 5.462 10.083 1.00 19.21 H new ATOM 0 HB3 ASP A 88 9.808 4.068 10.391 1.00 19.21 H new ATOM 714 N ILE A 89 12.912 4.743 9.344 1.00 31.15 N ATOM 715 CA ILE A 89 13.741 4.438 8.191 1.00 30.89 C ATOM 716 C ILE A 89 14.998 3.695 8.635 1.00 30.55 C ATOM 717 O ILE A 89 15.468 2.810 7.927 1.00 34.43 O ATOM 718 CB ILE A 89 14.150 5.737 7.422 1.00 34.47 C ATOM 719 CG1 ILE A 89 13.170 6.076 6.298 1.00 33.34 C ATOM 720 CG2 ILE A 89 15.537 5.601 6.842 1.00 35.69 C ATOM 721 CD1 ILE A 89 11.791 6.422 6.750 1.00 37.80 C ATOM 0 H ILE A 89 12.753 5.582 9.444 1.00 31.15 H new ATOM 0 HA ILE A 89 13.222 3.879 7.592 1.00 30.89 H new ATOM 0 HB ILE A 89 14.133 6.459 8.070 1.00 34.47 H new ATOM 0 HG12 ILE A 89 13.526 6.821 5.790 1.00 33.34 H new ATOM 0 HG13 ILE A 89 13.118 5.320 5.693 1.00 33.34 H new ATOM 0 HG21 ILE A 89 15.772 6.415 6.370 1.00 35.69 H new ATOM 0 HG22 ILE A 89 16.174 5.448 7.558 1.00 35.69 H new ATOM 0 HG23 ILE A 89 15.558 4.853 6.225 1.00 35.69 H new ATOM 0 HD11 ILE A 89 11.238 6.622 5.979 1.00 37.80 H new ATOM 0 HD12 ILE A 89 11.411 5.672 7.234 1.00 37.80 H new ATOM 0 HD13 ILE A 89 11.826 7.197 7.332 1.00 37.80 H new ATOM 722 N VAL A 90 15.558 4.028 9.799 1.00 32.61 N ATOM 723 CA VAL A 90 16.766 3.316 10.213 1.00 35.76 C ATOM 724 C VAL A 90 16.426 1.858 10.532 1.00 34.99 C ATOM 725 O VAL A 90 17.123 0.937 10.097 1.00 39.02 O ATOM 726 CB VAL A 90 17.546 4.002 11.397 1.00 35.02 C ATOM 727 CG1 VAL A 90 16.964 3.615 12.763 1.00 39.07 C ATOM 728 CG2 VAL A 90 19.010 3.601 11.337 1.00 32.43 C ATOM 0 H VAL A 90 15.272 4.632 10.340 1.00 32.61 H new ATOM 0 HA VAL A 90 17.379 3.349 9.462 1.00 35.76 H new ATOM 0 HB VAL A 90 17.456 4.963 11.297 1.00 35.02 H new ATOM 0 HG11 VAL A 90 17.468 4.055 13.466 1.00 39.07 H new ATOM 0 HG12 VAL A 90 16.036 3.892 12.810 1.00 39.07 H new ATOM 0 HG13 VAL A 90 17.020 2.654 12.878 1.00 39.07 H new ATOM 0 HG21 VAL A 90 19.491 4.023 12.066 1.00 32.43 H new ATOM 0 HG22 VAL A 90 19.085 2.637 11.416 1.00 32.43 H new ATOM 0 HG23 VAL A 90 19.390 3.887 10.491 1.00 32.43 H new ATOM 729 N CYS A 91 15.315 1.649 11.226 1.00 32.17 N ATOM 730 CA CYS A 91 14.877 0.310 11.590 1.00 30.32 C ATOM 731 C CYS A 91 14.599 -0.490 10.313 1.00 32.29 C ATOM 732 O CYS A 91 15.131 -1.586 10.133 1.00 36.79 O ATOM 733 CB CYS A 91 13.635 0.414 12.466 1.00 31.57 C ATOM 734 SG CYS A 91 13.219 -1.092 13.379 1.00 35.84 S ATOM 0 H CYS A 91 14.795 2.278 11.498 1.00 32.17 H new ATOM 0 HA CYS A 91 15.566 -0.152 12.093 1.00 30.32 H new ATOM 0 HB2 CYS A 91 13.762 1.137 13.100 1.00 31.57 H new ATOM 0 HB3 CYS A 91 12.880 0.657 11.907 1.00 31.57 H new ATOM 735 N VAL A 92 13.872 0.124 9.378 1.00 32.37 N ATOM 736 CA VAL A 92 13.504 -0.480 8.095 1.00 25.91 C ATOM 737 C VAL A 92 14.707 -0.915 7.266 1.00 29.25 C ATOM 738 O VAL A 92 14.592 -1.800 6.425 1.00 32.09 O ATOM 739 CB VAL A 92 12.612 0.467 7.274 1.00 20.01 C ATOM 740 CG1 VAL A 92 12.397 -0.076 5.911 1.00 17.74 C ATOM 741 CG2 VAL A 92 11.281 0.640 7.945 1.00 13.30 C ATOM 0 H VAL A 92 13.571 0.924 9.475 1.00 32.37 H new ATOM 0 HA VAL A 92 13.006 -1.283 8.313 1.00 25.91 H new ATOM 0 HB VAL A 92 13.060 1.325 7.213 1.00 20.01 H new ATOM 0 HG11 VAL A 92 11.834 0.531 5.406 1.00 17.74 H new ATOM 0 HG12 VAL A 92 13.252 -0.172 5.462 1.00 17.74 H new ATOM 0 HG13 VAL A 92 11.965 -0.942 5.972 1.00 17.74 H new ATOM 0 HG21 VAL A 92 10.728 1.238 7.418 1.00 13.30 H new ATOM 0 HG22 VAL A 92 10.842 -0.222 8.021 1.00 13.30 H new ATOM 0 HG23 VAL A 92 11.411 1.015 8.830 1.00 13.30 H new ATOM 742 N LYS A 93 15.861 -0.297 7.491 1.00 35.51 N ATOM 743 CA LYS A 93 17.094 -0.667 6.780 1.00 35.33 C ATOM 744 C LYS A 93 17.733 -1.892 7.444 1.00 34.91 C ATOM 745 O LYS A 93 18.399 -2.682 6.788 1.00 38.09 O ATOM 746 CB LYS A 93 18.072 0.506 6.761 1.00 33.45 C ATOM 747 CG LYS A 93 17.692 1.578 5.776 1.00 35.28 C ATOM 748 CD LYS A 93 18.588 2.792 5.915 1.00 42.48 C ATOM 749 CE LYS A 93 18.306 3.804 4.805 1.00 52.34 C ATOM 750 NZ LYS A 93 18.889 5.177 5.027 1.00 57.56 N ATOM 0 H LYS A 93 15.958 0.345 8.055 1.00 35.51 H new ATOM 0 HA LYS A 93 16.872 -0.891 5.863 1.00 35.33 H new ATOM 0 HB2 LYS A 93 18.121 0.893 7.649 1.00 33.45 H new ATOM 0 HB3 LYS A 93 18.959 0.177 6.546 1.00 33.45 H new ATOM 0 HG2 LYS A 93 17.755 1.228 4.873 1.00 35.28 H new ATOM 0 HG3 LYS A 93 16.768 1.837 5.916 1.00 35.28 H new ATOM 0 HD2 LYS A 93 18.446 3.207 6.780 1.00 42.48 H new ATOM 0 HD3 LYS A 93 19.518 2.519 5.881 1.00 42.48 H new ATOM 0 HE2 LYS A 93 18.652 3.452 3.970 1.00 52.34 H new ATOM 0 HE3 LYS A 93 17.345 3.889 4.700 1.00 52.34 H new ATOM 0 HZ1 LYS A 93 18.705 5.694 4.327 1.00 57.56 H new ATOM 0 HZ2 LYS A 93 18.535 5.535 5.761 1.00 57.56 H new ATOM 0 HZ3 LYS A 93 19.771 5.113 5.125 1.00 57.56 H new ATOM 751 N LYS A 94 17.510 -2.062 8.743 1.00 38.01 N ATOM 752 CA LYS A 94 18.036 -3.212 9.460 1.00 38.89 C ATOM 753 C LYS A 94 17.196 -4.424 9.078 1.00 39.57 C ATOM 754 O LYS A 94 17.733 -5.505 8.850 1.00 42.59 O ATOM 755 CB LYS A 94 18.008 -2.971 10.968 1.00 42.73 C ATOM 756 CG LYS A 94 19.191 -2.156 11.450 1.00 55.67 C ATOM 757 CD LYS A 94 18.807 -1.094 12.498 1.00 63.14 C ATOM 758 CE LYS A 94 20.004 -0.183 12.826 1.00 63.45 C ATOM 759 NZ LYS A 94 20.592 0.476 11.598 1.00 65.60 N ATOM 0 H LYS A 94 17.053 -1.518 9.228 1.00 38.01 H new ATOM 0 HA LYS A 94 18.963 -3.364 9.218 1.00 38.89 H new ATOM 0 HB2 LYS A 94 17.186 -2.513 11.204 1.00 42.73 H new ATOM 0 HB3 LYS A 94 17.999 -3.825 11.428 1.00 42.73 H new ATOM 0 HG2 LYS A 94 19.854 -2.753 11.830 1.00 55.67 H new ATOM 0 HG3 LYS A 94 19.606 -1.718 10.691 1.00 55.67 H new ATOM 0 HD2 LYS A 94 18.070 -0.558 12.165 1.00 63.14 H new ATOM 0 HD3 LYS A 94 18.497 -1.530 13.307 1.00 63.14 H new ATOM 0 HE2 LYS A 94 19.722 0.502 13.452 1.00 63.45 H new ATOM 0 HE3 LYS A 94 20.691 -0.705 13.268 1.00 63.45 H new ATOM 0 HZ1 LYS A 94 20.928 1.270 11.819 1.00 65.60 H new ATOM 0 HZ2 LYS A 94 21.239 -0.037 11.266 1.00 65.60 H new ATOM 0 HZ3 LYS A 94 19.956 0.584 10.985 1.00 65.60 H new ATOM 760 N ILE A 95 15.882 -4.238 8.957 1.00 35.43 N ATOM 761 CA ILE A 95 14.980 -5.327 8.555 1.00 29.28 C ATOM 762 C ILE A 95 15.312 -5.806 7.129 1.00 28.43 C ATOM 763 O ILE A 95 15.296 -7.000 6.849 1.00 28.10 O ATOM 764 CB ILE A 95 13.486 -4.892 8.579 1.00 29.34 C ATOM 765 CG1 ILE A 95 13.095 -4.404 9.994 1.00 23.50 C ATOM 766 CG2 ILE A 95 12.608 -6.067 8.108 1.00 25.36 C ATOM 767 CD1 ILE A 95 11.677 -3.886 10.138 1.00 14.02 C ATOM 0 H ILE A 95 15.489 -3.487 9.103 1.00 35.43 H new ATOM 0 HA ILE A 95 15.112 -6.042 9.197 1.00 29.28 H new ATOM 0 HB ILE A 95 13.346 -4.149 7.972 1.00 29.34 H new ATOM 0 HG12 ILE A 95 13.220 -5.136 10.618 1.00 23.50 H new ATOM 0 HG13 ILE A 95 13.708 -3.700 10.257 1.00 23.50 H new ATOM 0 HG21 ILE A 95 11.676 -5.800 8.121 1.00 25.36 H new ATOM 0 HG22 ILE A 95 12.859 -6.317 7.205 1.00 25.36 H new ATOM 0 HG23 ILE A 95 12.736 -6.824 8.700 1.00 25.36 H new ATOM 0 HD11 ILE A 95 11.526 -3.605 11.054 1.00 14.02 H new ATOM 0 HD12 ILE A 95 11.546 -3.131 9.543 1.00 14.02 H new ATOM 0 HD13 ILE A 95 11.050 -4.590 9.909 1.00 14.02 H new ATOM 768 N LEU A 96 15.562 -4.875 6.218 1.00 26.37 N ATOM 769 CA LEU A 96 15.902 -5.236 4.861 1.00 23.58 C ATOM 770 C LEU A 96 17.253 -5.940 4.826 1.00 30.26 C ATOM 771 O LEU A 96 17.518 -6.721 3.920 1.00 36.08 O ATOM 772 CB LEU A 96 15.961 -4.000 3.974 1.00 21.21 C ATOM 773 CG LEU A 96 14.651 -3.335 3.618 1.00 23.54 C ATOM 774 CD1 LEU A 96 14.928 -1.933 3.158 1.00 26.85 C ATOM 775 CD2 LEU A 96 13.932 -4.105 2.553 1.00 22.19 C ATOM 0 H LEU A 96 15.539 -4.029 6.370 1.00 26.37 H new ATOM 0 HA LEU A 96 15.214 -5.834 4.528 1.00 23.58 H new ATOM 0 HB2 LEU A 96 16.521 -3.342 4.414 1.00 21.21 H new ATOM 0 HB3 LEU A 96 16.407 -4.245 3.148 1.00 21.21 H new ATOM 0 HG LEU A 96 14.079 -3.315 4.401 1.00 23.54 H new ATOM 0 HD11 LEU A 96 14.093 -1.497 2.927 1.00 26.85 H new ATOM 0 HD12 LEU A 96 15.364 -1.439 3.870 1.00 26.85 H new ATOM 0 HD13 LEU A 96 15.506 -1.956 2.380 1.00 26.85 H new ATOM 0 HD21 LEU A 96 13.096 -3.661 2.341 1.00 22.19 H new ATOM 0 HD22 LEU A 96 14.485 -4.150 1.757 1.00 22.19 H new ATOM 0 HD23 LEU A 96 13.749 -5.003 2.870 1.00 22.19 H new ATOM 776 N ASP A 97 18.139 -5.613 5.762 1.00 32.66 N ATOM 777 CA ASP A 97 19.447 -6.240 5.812 1.00 29.07 C ATOM 778 C ASP A 97 19.318 -7.677 6.211 1.00 29.38 C ATOM 779 O ASP A 97 19.953 -8.548 5.645 1.00 36.59 O ATOM 780 CB ASP A 97 20.310 -5.578 6.873 1.00 39.76 C ATOM 781 CG ASP A 97 21.000 -4.342 6.376 1.00 52.17 C ATOM 782 OD1 ASP A 97 21.110 -4.198 5.132 1.00 58.38 O ATOM 783 OD2 ASP A 97 21.455 -3.533 7.231 1.00 57.78 O ATOM 0 H ASP A 97 17.998 -5.029 6.377 1.00 32.66 H new ATOM 0 HA ASP A 97 19.844 -6.153 4.931 1.00 29.07 H new ATOM 0 HB2 ASP A 97 19.757 -5.349 7.637 1.00 39.76 H new ATOM 0 HB3 ASP A 97 20.975 -6.212 7.184 1.00 39.76 H new ATOM 784 N LYS A 98 18.509 -7.908 7.230 1.00 29.50 N ATOM 785 CA LYS A 98 18.324 -9.222 7.787 1.00 25.14 C ATOM 786 C LYS A 98 17.264 -10.103 7.194 1.00 26.90 C ATOM 787 O LYS A 98 17.499 -11.289 7.009 1.00 35.08 O ATOM 788 CB LYS A 98 18.098 -9.081 9.281 1.00 25.60 C ATOM 789 CG LYS A 98 19.310 -8.507 9.983 1.00 25.48 C ATOM 790 CD LYS A 98 19.037 -8.303 11.439 1.00 37.67 C ATOM 791 CE LYS A 98 20.164 -7.521 12.070 1.00 52.71 C ATOM 792 NZ LYS A 98 20.393 -6.225 11.347 1.00 63.04 N ATOM 0 H LYS A 98 18.048 -7.295 7.619 1.00 29.50 H new ATOM 0 HA LYS A 98 19.141 -9.693 7.560 1.00 25.14 H new ATOM 0 HB2 LYS A 98 17.331 -8.508 9.439 1.00 25.60 H new ATOM 0 HB3 LYS A 98 17.886 -9.949 9.659 1.00 25.60 H new ATOM 0 HG2 LYS A 98 20.066 -9.105 9.873 1.00 25.48 H new ATOM 0 HG3 LYS A 98 19.555 -7.662 9.575 1.00 25.48 H new ATOM 0 HD2 LYS A 98 18.199 -7.829 11.555 1.00 37.67 H new ATOM 0 HD3 LYS A 98 18.941 -9.161 11.881 1.00 37.67 H new ATOM 0 HE2 LYS A 98 19.957 -7.343 13.001 1.00 52.71 H new ATOM 0 HE3 LYS A 98 20.977 -8.051 12.056 1.00 52.71 H new ATOM 0 HZ1 LYS A 98 20.576 -5.584 11.937 1.00 63.04 H new ATOM 0 HZ2 LYS A 98 21.077 -6.315 10.785 1.00 63.04 H new ATOM 0 HZ3 LYS A 98 19.661 -6.006 10.890 1.00 63.04 H new ATOM 793 N VAL A 99 16.096 -9.540 6.908 1.00 28.26 N ATOM 794 CA VAL A 99 14.979 -10.309 6.376 1.00 25.04 C ATOM 795 C VAL A 99 14.754 -10.056 4.894 1.00 25.04 C ATOM 796 O VAL A 99 14.658 -10.980 4.090 1.00 25.43 O ATOM 797 CB VAL A 99 13.656 -9.999 7.193 1.00 28.03 C ATOM 798 CG1 VAL A 99 12.448 -10.825 6.689 1.00 27.78 C ATOM 799 CG2 VAL A 99 13.876 -10.310 8.654 1.00 23.57 C ATOM 0 H VAL A 99 15.929 -8.703 7.017 1.00 28.26 H new ATOM 0 HA VAL A 99 15.206 -11.247 6.475 1.00 25.04 H new ATOM 0 HB VAL A 99 13.455 -9.059 7.066 1.00 28.03 H new ATOM 0 HG11 VAL A 99 11.663 -10.605 7.215 1.00 27.78 H new ATOM 0 HG12 VAL A 99 12.281 -10.618 5.756 1.00 27.78 H new ATOM 0 HG13 VAL A 99 12.642 -11.771 6.780 1.00 27.78 H new ATOM 0 HG21 VAL A 99 13.065 -10.119 9.151 1.00 23.57 H new ATOM 0 HG22 VAL A 99 14.104 -11.247 8.755 1.00 23.57 H new ATOM 0 HG23 VAL A 99 14.601 -9.763 8.996 1.00 23.57 H new ATOM 800 N GLY A 100 14.713 -8.791 4.524 1.00 26.38 N ATOM 801 CA GLY A 100 14.438 -8.466 3.147 1.00 21.21 C ATOM 802 C GLY A 100 13.062 -7.799 3.070 1.00 22.83 C ATOM 803 O GLY A 100 12.302 -7.755 4.048 1.00 23.52 O ATOM 0 H GLY A 100 14.839 -8.119 5.045 1.00 26.38 H new ATOM 0 HA2 GLY A 100 15.121 -7.872 2.798 1.00 21.21 H new ATOM 0 HA3 GLY A 100 14.455 -9.268 2.602 1.00 21.21 H new ATOM 804 N ILE A 101 12.727 -7.285 1.894 1.00 25.02 N ATOM 805 CA ILE A 101 11.470 -6.587 1.666 1.00 27.65 C ATOM 806 C ILE A 101 10.263 -7.477 1.845 1.00 26.83 C ATOM 807 O ILE A 101 9.151 -6.963 1.893 1.00 33.49 O ATOM 808 CB ILE A 101 11.431 -5.951 0.228 1.00 27.58 C ATOM 809 CG1 ILE A 101 10.187 -5.090 0.020 1.00 24.50 C ATOM 810 CG2 ILE A 101 11.415 -7.017 -0.811 1.00 31.42 C ATOM 811 CD1 ILE A 101 10.146 -3.944 0.964 1.00 28.74 C ATOM 0 H ILE A 101 13.229 -7.332 1.198 1.00 25.02 H new ATOM 0 HA ILE A 101 11.428 -5.889 2.338 1.00 27.65 H new ATOM 0 HB ILE A 101 12.225 -5.399 0.149 1.00 27.58 H new ATOM 0 HG12 ILE A 101 10.171 -4.759 -0.892 1.00 24.50 H new ATOM 0 HG13 ILE A 101 9.393 -5.635 0.138 1.00 24.50 H new ATOM 0 HG21 ILE A 101 11.391 -6.611 -1.691 1.00 31.42 H new ATOM 0 HG22 ILE A 101 12.213 -7.562 -0.728 1.00 31.42 H new ATOM 0 HG23 ILE A 101 10.630 -7.574 -0.691 1.00 31.42 H new ATOM 0 HD11 ILE A 101 9.345 -3.421 0.804 1.00 28.74 H new ATOM 0 HD12 ILE A 101 10.138 -4.276 1.876 1.00 28.74 H new ATOM 0 HD13 ILE A 101 10.928 -3.386 0.830 1.00 28.74 H new ATOM 812 N ASN A 102 10.454 -8.801 1.916 1.00 30.11 N ATOM 813 CA ASN A 102 9.310 -9.725 2.070 1.00 30.60 C ATOM 814 C ASN A 102 8.737 -9.803 3.488 1.00 28.01 C ATOM 815 O ASN A 102 7.878 -10.620 3.796 1.00 28.22 O ATOM 816 CB ASN A 102 9.573 -11.101 1.451 1.00 31.91 C ATOM 817 CG ASN A 102 9.488 -11.073 -0.063 1.00 33.17 C ATOM 818 OD1 ASN A 102 8.510 -10.601 -0.633 1.00 34.04 O ATOM 819 ND2 ASN A 102 10.533 -11.545 -0.724 1.00 39.37 N ATOM 0 H ASN A 102 11.224 -9.183 1.878 1.00 30.11 H new ATOM 0 HA ASN A 102 8.598 -9.321 1.550 1.00 30.60 H new ATOM 0 HB2 ASN A 102 10.452 -11.412 1.718 1.00 31.91 H new ATOM 0 HB3 ASN A 102 8.929 -11.738 1.798 1.00 31.91 H new ATOM 0 HD21 ASN A 102 10.542 -11.527 -1.584 1.00 39.37 H new ATOM 0 HD22 ASN A 102 11.203 -11.869 -0.294 1.00 39.37 H new ATOM 820 N TYR A 103 9.265 -8.952 4.353 1.00 25.79 N ATOM 821 CA TYR A 103 8.752 -8.798 5.695 1.00 25.92 C ATOM 822 C TYR A 103 7.353 -8.183 5.447 1.00 25.42 C ATOM 823 O TYR A 103 6.426 -8.388 6.234 1.00 30.45 O ATOM 824 CB TYR A 103 9.631 -7.792 6.462 1.00 16.87 C ATOM 825 CG TYR A 103 9.042 -7.312 7.772 1.00 14.71 C ATOM 826 CD1 TYR A 103 8.146 -6.238 7.823 1.00 18.33 C ATOM 827 CD2 TYR A 103 9.396 -7.914 8.966 1.00 17.32 C ATOM 828 CE1 TYR A 103 7.629 -5.777 9.034 1.00 10.25 C ATOM 829 CE2 TYR A 103 8.883 -7.464 10.188 1.00 16.52 C ATOM 830 CZ TYR A 103 8.011 -6.403 10.213 1.00 17.80 C ATOM 831 OH TYR A 103 7.581 -5.959 11.449 1.00 24.25 O ATOM 0 H TYR A 103 9.936 -8.445 4.173 1.00 25.79 H new ATOM 0 HA TYR A 103 8.733 -9.620 6.210 1.00 25.92 H new ATOM 0 HB2 TYR A 103 10.492 -8.202 6.639 1.00 16.87 H new ATOM 0 HB3 TYR A 103 9.794 -7.023 5.893 1.00 16.87 H new ATOM 0 HD1 TYR A 103 7.889 -5.822 7.032 1.00 18.33 H new ATOM 0 HD2 TYR A 103 9.987 -8.632 8.957 1.00 17.32 H new ATOM 0 HE1 TYR A 103 7.037 -5.060 9.051 1.00 10.25 H new ATOM 0 HE2 TYR A 103 9.132 -7.882 10.981 1.00 16.52 H new ATOM 0 HH TYR A 103 6.917 -5.454 11.350 1.00 24.25 H new ATOM 832 N TRP A 104 7.245 -7.384 4.371 1.00 29.41 N ATOM 833 CA TRP A 104 6.004 -6.691 3.948 1.00 28.93 C ATOM 834 C TRP A 104 5.346 -7.532 2.871 1.00 29.69 C ATOM 835 O TRP A 104 5.817 -7.587 1.738 1.00 30.85 O ATOM 836 CB TRP A 104 6.301 -5.261 3.402 1.00 24.91 C ATOM 837 CG TRP A 104 6.709 -4.258 4.487 1.00 20.00 C ATOM 838 CD1 TRP A 104 5.858 -3.485 5.272 1.00 12.74 C ATOM 839 CD2 TRP A 104 8.019 -4.048 5.002 1.00 17.06 C ATOM 840 NE1 TRP A 104 6.578 -2.847 6.244 1.00 14.59 N ATOM 841 CE2 TRP A 104 7.902 -3.168 6.114 1.00 16.15 C ATOM 842 CE3 TRP A 104 9.288 -4.538 4.652 1.00 18.82 C ATOM 843 CZ2 TRP A 104 9.001 -2.771 6.879 1.00 14.57 C ATOM 844 CZ3 TRP A 104 10.387 -4.140 5.422 1.00 17.64 C ATOM 845 CH2 TRP A 104 10.229 -3.263 6.525 1.00 13.23 C ATOM 0 H TRP A 104 7.910 -7.224 3.850 1.00 29.41 H new ATOM 0 HA TRP A 104 5.418 -6.588 4.714 1.00 28.93 H new ATOM 0 HB2 TRP A 104 7.009 -5.317 2.742 1.00 24.91 H new ATOM 0 HB3 TRP A 104 5.513 -4.928 2.945 1.00 24.91 H new ATOM 0 HD1 TRP A 104 4.938 -3.413 5.153 1.00 12.74 H new ATOM 0 HE1 TRP A 104 6.250 -2.325 6.844 1.00 14.59 H new ATOM 0 HE3 TRP A 104 9.395 -5.112 3.928 1.00 18.82 H new ATOM 0 HZ2 TRP A 104 8.903 -2.194 7.602 1.00 14.57 H new ATOM 0 HZ3 TRP A 104 11.235 -4.456 5.207 1.00 17.64 H new ATOM 0 HH2 TRP A 104 10.977 -3.016 7.020 1.00 13.23 H new ATOM 846 N LEU A 105 4.249 -8.181 3.232 1.00 29.09 N ATOM 847 CA LEU A 105 3.549 -9.070 2.320 1.00 24.66 C ATOM 848 C LEU A 105 2.873 -8.366 1.150 1.00 26.75 C ATOM 849 O LEU A 105 2.754 -8.924 0.077 1.00 28.89 O ATOM 850 CB LEU A 105 2.546 -9.924 3.105 1.00 33.38 C ATOM 851 CG LEU A 105 3.072 -10.559 4.415 1.00 40.83 C ATOM 852 CD1 LEU A 105 2.099 -11.631 4.959 1.00 41.35 C ATOM 853 CD2 LEU A 105 4.482 -11.149 4.211 1.00 41.54 C ATOM 0 H LEU A 105 3.890 -8.119 4.011 1.00 29.09 H new ATOM 0 HA LEU A 105 4.224 -9.636 1.913 1.00 24.66 H new ATOM 0 HB2 LEU A 105 1.778 -9.372 3.320 1.00 33.38 H new ATOM 0 HB3 LEU A 105 2.231 -10.635 2.526 1.00 33.38 H new ATOM 0 HG LEU A 105 3.130 -9.854 5.079 1.00 40.83 H new ATOM 0 HD11 LEU A 105 2.457 -12.008 5.778 1.00 41.35 H new ATOM 0 HD12 LEU A 105 1.238 -11.224 5.141 1.00 41.35 H new ATOM 0 HD13 LEU A 105 1.991 -12.335 4.300 1.00 41.35 H new ATOM 0 HD21 LEU A 105 4.792 -11.541 5.042 1.00 41.54 H new ATOM 0 HD22 LEU A 105 4.451 -11.833 3.523 1.00 41.54 H new ATOM 0 HD23 LEU A 105 5.091 -10.445 3.939 1.00 41.54 H new ATOM 854 N ALA A 106 2.467 -7.114 1.325 1.00 26.63 N ATOM 855 CA ALA A 106 1.801 -6.393 0.244 1.00 22.15 C ATOM 856 C ALA A 106 2.728 -6.197 -0.915 1.00 20.21 C ATOM 857 O ALA A 106 2.300 -5.998 -2.041 1.00 24.08 O ATOM 858 CB ALA A 106 1.310 -5.042 0.733 1.00 29.44 C ATOM 0 H ALA A 106 2.565 -6.667 2.053 1.00 26.63 H new ATOM 0 HA ALA A 106 1.043 -6.924 -0.046 1.00 22.15 H new ATOM 0 HB1 ALA A 106 0.870 -4.575 0.006 1.00 29.44 H new ATOM 0 HB2 ALA A 106 0.682 -5.170 1.461 1.00 29.44 H new ATOM 0 HB3 ALA A 106 2.064 -4.517 1.045 1.00 29.44 H new ATOM 859 N HIS A 107 4.018 -6.207 -0.639 1.00 23.55 N ATOM 860 CA HIS A 107 4.964 -6.013 -1.705 1.00 24.53 C ATOM 861 C HIS A 107 4.788 -7.048 -2.808 1.00 30.32 C ATOM 862 O HIS A 107 4.462 -6.696 -3.930 1.00 38.53 O ATOM 863 CB HIS A 107 6.402 -6.046 -1.192 1.00 24.84 C ATOM 864 CG HIS A 107 7.398 -5.649 -2.227 1.00 27.63 C ATOM 865 ND1 HIS A 107 7.871 -6.529 -3.178 1.00 36.95 N ATOM 866 CD2 HIS A 107 7.953 -4.452 -2.518 1.00 32.93 C ATOM 867 CE1 HIS A 107 8.665 -5.887 -4.015 1.00 30.50 C ATOM 868 NE2 HIS A 107 8.731 -4.624 -3.640 1.00 33.45 N ATOM 0 H HIS A 107 4.357 -6.322 0.143 1.00 23.55 H new ATOM 0 HA HIS A 107 4.787 -5.134 -2.076 1.00 24.53 H new ATOM 0 HB2 HIS A 107 6.482 -5.452 -0.429 1.00 24.84 H new ATOM 0 HB3 HIS A 107 6.608 -6.940 -0.878 1.00 24.84 H new ATOM 0 HD2 HIS A 107 7.832 -3.659 -2.047 1.00 32.93 H new ATOM 0 HE1 HIS A 107 9.103 -6.261 -4.745 1.00 30.50 H new ATOM 0 HE2 HIS A 107 9.186 -4.009 -4.033 1.00 33.45 H new ATOM 869 N LYS A 108 4.986 -8.322 -2.491 1.00 29.81 N ATOM 870 CA LYS A 108 4.878 -9.391 -3.466 1.00 27.63 C ATOM 871 C LYS A 108 3.486 -9.534 -4.055 1.00 28.68 C ATOM 872 O LYS A 108 3.315 -9.755 -5.243 1.00 35.38 O ATOM 873 CB LYS A 108 5.279 -10.702 -2.806 1.00 30.42 C ATOM 874 CG LYS A 108 5.715 -11.786 -3.774 1.00 35.90 C ATOM 875 CD LYS A 108 5.949 -13.123 -3.058 1.00 35.10 C ATOM 876 CE LYS A 108 7.274 -13.143 -2.311 1.00 35.93 C ATOM 877 NZ LYS A 108 7.578 -14.506 -1.783 1.00 32.14 N ATOM 0 H LYS A 108 5.188 -8.589 -1.699 1.00 29.81 H new ATOM 0 HA LYS A 108 5.470 -9.167 -4.201 1.00 27.63 H new ATOM 0 HB2 LYS A 108 6.003 -10.530 -2.184 1.00 30.42 H new ATOM 0 HB3 LYS A 108 4.530 -11.031 -2.285 1.00 30.42 H new ATOM 0 HG2 LYS A 108 5.038 -11.900 -4.460 1.00 35.90 H new ATOM 0 HG3 LYS A 108 6.530 -11.511 -4.222 1.00 35.90 H new ATOM 0 HD2 LYS A 108 5.224 -13.287 -2.434 1.00 35.10 H new ATOM 0 HD3 LYS A 108 5.933 -13.844 -3.707 1.00 35.10 H new ATOM 0 HE2 LYS A 108 7.986 -12.857 -2.904 1.00 35.93 H new ATOM 0 HE3 LYS A 108 7.244 -12.509 -1.578 1.00 35.93 H new ATOM 0 HZ1 LYS A 108 8.132 -14.439 -1.089 1.00 32.14 H new ATOM 0 HZ2 LYS A 108 6.823 -14.899 -1.523 1.00 32.14 H new ATOM 0 HZ3 LYS A 108 7.961 -14.993 -2.422 1.00 32.14 H new ATOM 878 N ALA A 109 2.488 -9.414 -3.201 1.00 31.05 N ATOM 879 CA ALA A 109 1.088 -9.559 -3.575 1.00 27.58 C ATOM 880 C ALA A 109 0.457 -8.464 -4.419 1.00 31.90 C ATOM 881 O ALA A 109 -0.259 -8.748 -5.379 1.00 36.14 O ATOM 882 CB ALA A 109 0.253 -9.744 -2.308 1.00 26.14 C ATOM 0 H ALA A 109 2.604 -9.242 -2.366 1.00 31.05 H new ATOM 0 HA ALA A 109 1.088 -10.332 -4.161 1.00 27.58 H new ATOM 0 HB1 ALA A 109 -0.682 -9.841 -2.548 1.00 26.14 H new ATOM 0 HB2 ALA A 109 0.550 -10.538 -1.837 1.00 26.14 H new ATOM 0 HB3 ALA A 109 0.360 -8.970 -1.734 1.00 26.14 H new ATOM 883 N LEU A 110 0.713 -7.214 -4.062 1.00 31.43 N ATOM 884 CA LEU A 110 0.082 -6.104 -4.738 1.00 30.47 C ATOM 885 C LEU A 110 0.974 -5.052 -5.332 1.00 31.26 C ATOM 886 O LEU A 110 0.507 -4.253 -6.135 1.00 33.57 O ATOM 887 CB LEU A 110 -0.824 -5.405 -3.724 1.00 37.21 C ATOM 888 CG LEU A 110 -1.916 -6.205 -2.984 1.00 49.16 C ATOM 889 CD1 LEU A 110 -2.064 -5.763 -1.506 1.00 44.15 C ATOM 890 CD2 LEU A 110 -3.253 -6.083 -3.733 1.00 48.11 C ATOM 0 H LEU A 110 1.251 -6.991 -3.429 1.00 31.43 H new ATOM 0 HA LEU A 110 -0.370 -6.506 -5.497 1.00 30.47 H new ATOM 0 HB2 LEU A 110 -0.250 -5.009 -3.050 1.00 37.21 H new ATOM 0 HB3 LEU A 110 -1.265 -4.675 -4.186 1.00 37.21 H new ATOM 0 HG LEU A 110 -1.645 -7.136 -2.970 1.00 49.16 H new ATOM 0 HD11 LEU A 110 -2.758 -6.289 -1.079 1.00 44.15 H new ATOM 0 HD12 LEU A 110 -1.223 -5.900 -1.041 1.00 44.15 H new ATOM 0 HD13 LEU A 110 -2.303 -4.824 -1.471 1.00 44.15 H new ATOM 0 HD21 LEU A 110 -3.935 -6.588 -3.263 1.00 48.11 H new ATOM 0 HD22 LEU A 110 -3.515 -5.150 -3.778 1.00 48.11 H new ATOM 0 HD23 LEU A 110 -3.154 -6.434 -4.632 1.00 48.11 H new ATOM 891 N CYS A 111 2.258 -5.072 -5.009 1.00 33.37 N ATOM 892 CA CYS A 111 3.140 -3.991 -5.461 1.00 35.15 C ATOM 893 C CYS A 111 4.381 -4.276 -6.285 1.00 38.04 C ATOM 894 O CYS A 111 5.297 -3.462 -6.288 1.00 34.10 O ATOM 895 CB CYS A 111 3.564 -3.154 -4.241 1.00 24.52 C ATOM 896 SG CYS A 111 2.128 -2.594 -3.270 1.00 29.09 S ATOM 0 H CYS A 111 2.638 -5.685 -4.540 1.00 33.37 H new ATOM 0 HA CYS A 111 2.569 -3.549 -6.108 1.00 35.15 H new ATOM 0 HB2 CYS A 111 4.151 -3.681 -3.676 1.00 24.52 H new ATOM 0 HB3 CYS A 111 4.073 -2.384 -4.539 1.00 24.52 H new ATOM 897 N SER A 112 4.458 -5.404 -6.971 1.00 46.78 N ATOM 898 CA SER A 112 5.659 -5.651 -7.777 1.00 53.32 C ATOM 899 C SER A 112 5.390 -5.337 -9.231 1.00 57.17 C ATOM 900 O SER A 112 6.314 -5.216 -10.032 1.00 62.58 O ATOM 901 CB SER A 112 6.121 -7.107 -7.662 1.00 49.76 C ATOM 902 OG SER A 112 6.893 -7.305 -6.497 1.00 58.87 O ATOM 0 H SER A 112 3.858 -6.020 -6.990 1.00 46.78 H new ATOM 0 HA SER A 112 6.359 -5.072 -7.437 1.00 53.32 H new ATOM 0 HB2 SER A 112 5.349 -7.694 -7.645 1.00 49.76 H new ATOM 0 HB3 SER A 112 6.643 -7.347 -8.444 1.00 49.76 H new ATOM 0 HG SER A 112 7.134 -8.109 -6.454 1.00 58.87 H new ATOM 903 N GLU A 113 4.124 -5.097 -9.530 1.00 58.33 N ATOM 904 CA GLU A 113 3.692 -4.871 -10.887 1.00 59.55 C ATOM 905 C GLU A 113 2.782 -3.653 -11.039 1.00 59.19 C ATOM 906 O GLU A 113 2.045 -3.311 -10.120 1.00 64.80 O ATOM 907 CB GLU A 113 2.989 -6.159 -11.358 1.00 62.87 C ATOM 908 CG GLU A 113 1.647 -6.558 -10.648 1.00 70.83 C ATOM 909 CD GLU A 113 1.675 -6.711 -9.086 1.00 75.13 C ATOM 910 OE1 GLU A 113 2.665 -7.197 -8.485 1.00 69.92 O ATOM 911 OE2 GLU A 113 0.643 -6.378 -8.453 1.00 76.45 O ATOM 0 H GLU A 113 3.493 -5.061 -8.947 1.00 58.33 H new ATOM 0 HA GLU A 113 4.465 -4.670 -11.438 1.00 59.55 H new ATOM 0 HB2 GLU A 113 2.810 -6.071 -12.307 1.00 62.87 H new ATOM 0 HB3 GLU A 113 3.612 -6.895 -11.254 1.00 62.87 H new ATOM 0 HG2 GLU A 113 0.979 -5.891 -10.872 1.00 70.83 H new ATOM 0 HG3 GLU A 113 1.346 -7.399 -11.026 1.00 70.83 H new ATOM 912 N LYS A 114 2.845 -2.989 -12.192 1.00 56.12 N ATOM 913 CA LYS A 114 2.014 -1.811 -12.471 1.00 52.56 C ATOM 914 C LYS A 114 2.153 -0.725 -11.415 1.00 49.87 C ATOM 915 O LYS A 114 1.177 -0.309 -10.818 1.00 49.49 O ATOM 916 CB LYS A 114 0.537 -2.208 -12.622 1.00 56.19 C ATOM 917 CG LYS A 114 0.228 -3.001 -13.896 1.00 62.70 C ATOM 918 CD LYS A 114 -1.242 -2.880 -14.310 1.00 61.27 C ATOM 919 CE LYS A 114 -1.509 -3.601 -15.633 1.00 59.36 C ATOM 920 NZ LYS A 114 -0.599 -3.177 -16.732 1.00 51.63 N ATOM 0 H LYS A 114 3.370 -3.207 -12.837 1.00 56.12 H new ATOM 0 HA LYS A 114 2.337 -1.442 -13.308 1.00 52.56 H new ATOM 0 HB2 LYS A 114 0.274 -2.736 -11.852 1.00 56.19 H new ATOM 0 HB3 LYS A 114 -0.006 -1.404 -12.613 1.00 56.19 H new ATOM 0 HG2 LYS A 114 0.793 -2.683 -14.618 1.00 62.70 H new ATOM 0 HG3 LYS A 114 0.447 -3.935 -13.755 1.00 62.70 H new ATOM 0 HD2 LYS A 114 -1.807 -3.254 -13.616 1.00 61.27 H new ATOM 0 HD3 LYS A 114 -1.480 -1.944 -14.396 1.00 61.27 H new ATOM 0 HE2 LYS A 114 -1.417 -4.557 -15.497 1.00 59.36 H new ATOM 0 HE3 LYS A 114 -2.427 -3.440 -15.902 1.00 59.36 H new ATOM 0 HZ1 LYS A 114 -1.056 -3.129 -17.494 1.00 51.63 H new ATOM 0 HZ2 LYS A 114 -0.256 -2.378 -16.542 1.00 51.63 H new ATOM 0 HZ3 LYS A 114 0.059 -3.770 -16.818 1.00 51.63 H new ATOM 921 N LEU A 115 3.370 -0.216 -11.264 1.00 49.36 N ATOM 922 CA LEU A 115 3.689 0.809 -10.276 1.00 47.47 C ATOM 923 C LEU A 115 3.438 2.233 -10.726 1.00 52.72 C ATOM 924 O LEU A 115 3.700 3.170 -9.972 1.00 57.51 O ATOM 925 CB LEU A 115 5.155 0.671 -9.887 1.00 40.31 C ATOM 926 CG LEU A 115 5.431 -0.654 -9.178 1.00 42.73 C ATOM 927 CD1 LEU A 115 6.873 -1.030 -9.250 1.00 46.83 C ATOM 928 CD2 LEU A 115 5.006 -0.549 -7.753 1.00 42.80 C ATOM 0 H LEU A 115 4.044 -0.459 -11.739 1.00 49.36 H new ATOM 0 HA LEU A 115 3.089 0.656 -9.530 1.00 47.47 H new ATOM 0 HB2 LEU A 115 5.708 0.734 -10.681 1.00 40.31 H new ATOM 0 HB3 LEU A 115 5.407 1.407 -9.307 1.00 40.31 H new ATOM 0 HG LEU A 115 4.924 -1.348 -9.627 1.00 42.73 H new ATOM 0 HD11 LEU A 115 7.011 -1.873 -8.791 1.00 46.83 H new ATOM 0 HD12 LEU A 115 7.138 -1.120 -10.179 1.00 46.83 H new ATOM 0 HD13 LEU A 115 7.409 -0.341 -8.827 1.00 46.83 H new ATOM 0 HD21 LEU A 115 5.180 -1.389 -7.300 1.00 42.80 H new ATOM 0 HD22 LEU A 115 5.503 0.161 -7.318 1.00 42.80 H new ATOM 0 HD23 LEU A 115 4.057 -0.351 -7.712 1.00 42.80 H new ATOM 929 N ASP A 116 2.881 2.404 -11.922 1.00 56.00 N ATOM 930 CA ASP A 116 2.670 3.746 -12.471 1.00 55.12 C ATOM 931 C ASP A 116 1.643 4.633 -11.773 1.00 47.85 C ATOM 932 O ASP A 116 1.785 5.855 -11.745 1.00 48.63 O ATOM 933 CB ASP A 116 2.460 3.709 -14.005 1.00 64.18 C ATOM 934 CG ASP A 116 3.797 3.882 -14.809 1.00 73.19 C ATOM 935 OD1 ASP A 116 4.218 5.041 -15.068 1.00 72.44 O ATOM 936 OD2 ASP A 116 4.428 2.860 -15.191 1.00 77.93 O ATOM 0 H ASP A 116 2.619 1.762 -12.431 1.00 56.00 H new ATOM 0 HA ASP A 116 3.506 4.197 -12.272 1.00 55.12 H new ATOM 0 HB2 ASP A 116 2.047 2.866 -14.250 1.00 64.18 H new ATOM 0 HB3 ASP A 116 1.842 4.412 -14.259 1.00 64.18 H new ATOM 937 N GLN A 117 0.656 4.031 -11.137 1.00 40.95 N ATOM 938 CA GLN A 117 -0.346 4.824 -10.461 1.00 35.57 C ATOM 939 C GLN A 117 0.192 5.380 -9.159 1.00 34.25 C ATOM 940 O GLN A 117 -0.447 6.217 -8.553 1.00 35.73 O ATOM 941 CB GLN A 117 -1.591 3.975 -10.190 1.00 38.66 C ATOM 942 CG GLN A 117 -1.491 3.091 -8.950 1.00 52.72 C ATOM 943 CD GLN A 117 -2.569 2.003 -8.877 1.00 62.78 C ATOM 944 OE1 GLN A 117 -3.603 2.151 -8.191 1.00 64.25 O ATOM 945 NE2 GLN A 117 -2.322 0.887 -9.573 1.00 62.12 N ATOM 0 H GLN A 117 0.549 3.179 -11.085 1.00 40.95 H new ATOM 0 HA GLN A 117 -0.584 5.568 -11.036 1.00 35.57 H new ATOM 0 HB2 GLN A 117 -2.356 4.563 -10.094 1.00 38.66 H new ATOM 0 HB3 GLN A 117 -1.761 3.413 -10.962 1.00 38.66 H new ATOM 0 HG2 GLN A 117 -0.617 2.670 -8.933 1.00 52.72 H new ATOM 0 HG3 GLN A 117 -1.553 3.649 -8.159 1.00 52.72 H new ATOM 0 HE21 GLN A 117 -1.600 0.819 -10.035 1.00 62.12 H new ATOM 0 HE22 GLN A 117 -2.886 0.238 -9.559 1.00 62.12 H new ATOM 946 N TRP A 118 1.372 4.928 -8.736 1.00 36.81 N ATOM 947 CA TRP A 118 1.949 5.370 -7.455 1.00 37.39 C ATOM 948 C TRP A 118 2.926 6.498 -7.596 1.00 40.20 C ATOM 949 O TRP A 118 3.741 6.719 -6.709 1.00 44.94 O ATOM 950 CB TRP A 118 2.628 4.201 -6.712 1.00 27.35 C ATOM 951 CG TRP A 118 1.657 3.121 -6.386 1.00 25.28 C ATOM 952 CD1 TRP A 118 1.425 1.994 -7.129 1.00 21.68 C ATOM 953 CD2 TRP A 118 0.669 3.127 -5.348 1.00 21.25 C ATOM 954 NE1 TRP A 118 0.337 1.328 -6.629 1.00 25.10 N ATOM 955 CE2 TRP A 118 -0.146 1.995 -5.537 1.00 22.24 C ATOM 956 CE3 TRP A 118 0.390 3.987 -4.271 1.00 19.65 C ATOM 957 CZ2 TRP A 118 -1.216 1.703 -4.698 1.00 19.93 C ATOM 958 CZ3 TRP A 118 -0.666 3.686 -3.446 1.00 19.38 C ATOM 959 CH2 TRP A 118 -1.461 2.556 -3.661 1.00 18.44 C ATOM 0 H TRP A 118 1.857 4.366 -9.171 1.00 36.81 H new ATOM 0 HA TRP A 118 1.197 5.698 -6.937 1.00 37.39 H new ATOM 0 HB2 TRP A 118 3.343 3.840 -7.260 1.00 27.35 H new ATOM 0 HB3 TRP A 118 3.035 4.529 -5.895 1.00 27.35 H new ATOM 0 HD1 TRP A 118 1.929 1.722 -7.862 1.00 21.68 H new ATOM 0 HE1 TRP A 118 0.008 0.602 -6.952 1.00 25.10 H new ATOM 0 HE3 TRP A 118 0.910 4.744 -4.121 1.00 19.65 H new ATOM 0 HZ2 TRP A 118 -1.746 0.952 -4.839 1.00 19.93 H new ATOM 0 HZ3 TRP A 118 -0.857 4.246 -2.728 1.00 19.38 H new ATOM 0 HH2 TRP A 118 -2.171 2.382 -3.086 1.00 18.44 H new ATOM 960 N LEU A 119 2.865 7.189 -8.728 1.00 47.74 N ATOM 961 CA LEU A 119 3.760 8.309 -9.013 1.00 48.29 C ATOM 962 C LEU A 119 3.268 9.696 -8.594 1.00 50.97 C ATOM 963 O LEU A 119 2.069 9.966 -8.535 1.00 51.46 O ATOM 964 CB LEU A 119 4.172 8.287 -10.481 1.00 42.13 C ATOM 965 CG LEU A 119 5.311 7.292 -10.615 1.00 37.74 C ATOM 966 CD1 LEU A 119 5.305 6.607 -11.941 1.00 36.71 C ATOM 967 CD2 LEU A 119 6.605 8.002 -10.351 1.00 38.28 C ATOM 0 H LEU A 119 2.302 7.022 -9.356 1.00 47.74 H new ATOM 0 HA LEU A 119 4.529 8.163 -8.440 1.00 48.29 H new ATOM 0 HB2 LEU A 119 3.424 8.029 -11.042 1.00 42.13 H new ATOM 0 HB3 LEU A 119 4.453 9.169 -10.771 1.00 42.13 H new ATOM 0 HG LEU A 119 5.197 6.587 -9.958 1.00 37.74 H new ATOM 0 HD11 LEU A 119 6.046 5.982 -11.986 1.00 36.71 H new ATOM 0 HD12 LEU A 119 4.470 6.127 -12.054 1.00 36.71 H new ATOM 0 HD13 LEU A 119 5.396 7.266 -12.647 1.00 36.71 H new ATOM 0 HD21 LEU A 119 7.341 7.375 -10.434 1.00 38.28 H new ATOM 0 HD22 LEU A 119 6.718 8.719 -10.994 1.00 38.28 H new ATOM 0 HD23 LEU A 119 6.595 8.371 -9.454 1.00 38.28 H new ATOM 968 N CYS A 120 4.224 10.560 -8.272 1.00 58.91 N ATOM 969 CA CYS A 120 3.934 11.916 -7.840 1.00 65.83 C ATOM 970 C CYS A 120 4.917 12.935 -8.360 1.00 71.33 C ATOM 971 O CYS A 120 6.080 12.939 -7.960 1.00 74.28 O ATOM 972 CB CYS A 120 3.948 12.021 -6.315 1.00 62.17 C ATOM 973 SG CYS A 120 2.328 11.797 -5.531 1.00 68.57 S ATOM 0 H CYS A 120 5.063 10.373 -8.299 1.00 58.91 H new ATOM 0 HA CYS A 120 3.055 12.109 -8.203 1.00 65.83 H new ATOM 0 HB2 CYS A 120 4.560 11.357 -5.962 1.00 62.17 H new ATOM 0 HB3 CYS A 120 4.298 12.890 -6.065 1.00 62.17 H new ATOM 974 N GLU A 121 4.465 13.746 -9.307 1.00 78.07 N ATOM 975 CA GLU A 121 5.283 14.833 -9.816 1.00 86.34 C ATOM 976 C GLU A 121 4.505 16.042 -9.288 1.00 88.50 C ATOM 977 O GLU A 121 3.936 16.828 -10.049 1.00 90.74 O ATOM 978 CB GLU A 121 5.357 14.836 -11.349 1.00 91.53 C ATOM 979 CG GLU A 121 6.465 15.747 -11.928 1.00 96.58 C ATOM 980 CD GLU A 121 5.940 16.825 -12.880 1.00100.16 C ATOM 981 OE1 GLU A 121 5.637 16.497 -14.059 1.00101.80 O ATOM 982 OE2 GLU A 121 5.854 18.004 -12.448 1.00 99.00 O ATOM 0 H GLU A 121 3.687 13.683 -9.668 1.00 78.07 H new ATOM 0 HA GLU A 121 6.212 14.794 -9.540 1.00 86.34 H new ATOM 0 HB2 GLU A 121 5.504 13.928 -11.657 1.00 91.53 H new ATOM 0 HB3 GLU A 121 4.500 15.120 -11.704 1.00 91.53 H new ATOM 0 HG2 GLU A 121 6.936 16.175 -11.196 1.00 96.58 H new ATOM 0 HG3 GLU A 121 7.111 15.198 -12.399 1.00 96.58 H new ATOM 983 N LYS A 122 4.384 16.091 -7.963 1.00 89.99 N ATOM 984 CA LYS A 122 3.671 17.152 -7.258 1.00 90.00 C ATOM 985 C LYS A 122 4.465 17.452 -5.998 1.00 89.56 C ATOM 986 O LYS A 122 5.255 16.575 -5.577 1.00 90.76 O ATOM 987 CB LYS A 122 2.248 16.713 -6.872 1.00 90.01 C ATOM 988 CG LYS A 122 1.529 15.912 -7.954 1.00 91.48 C ATOM 989 CD LYS A 122 0.049 16.216 -8.035 1.00 91.45 C ATOM 990 CE LYS A 122 -0.489 15.701 -9.366 1.00 92.84 C ATOM 991 NZ LYS A 122 -1.896 16.100 -9.657 1.00 90.57 N ATOM 0 H LYS A 122 4.721 15.497 -7.440 1.00 89.99 H new ATOM 0 HA LYS A 122 3.589 17.931 -7.829 1.00 90.00 H new ATOM 0 HB2 LYS A 122 2.293 16.179 -6.063 1.00 90.01 H new ATOM 0 HB3 LYS A 122 1.722 17.501 -6.663 1.00 90.01 H new ATOM 0 HG2 LYS A 122 1.939 16.099 -8.813 1.00 91.48 H new ATOM 0 HG3 LYS A 122 1.650 14.965 -7.782 1.00 91.48 H new ATOM 0 HD2 LYS A 122 -0.421 15.795 -7.298 1.00 91.45 H new ATOM 0 HD3 LYS A 122 -0.102 17.171 -7.959 1.00 91.45 H new ATOM 0 HE2 LYS A 122 0.082 16.025 -10.080 1.00 92.84 H new ATOM 0 HE3 LYS A 122 -0.431 14.733 -9.373 1.00 92.84 H new ATOM 0 HZ1 LYS A 122 -2.142 15.767 -10.445 1.00 90.57 H new ATOM 0 HZ2 LYS A 122 -2.432 15.784 -9.021 1.00 90.57 H new ATOM 0 HZ3 LYS A 122 -1.954 16.988 -9.680 1.00 90.57 H new TER 992 LYS A 122 ATOM 993 N MET B 1X -5.635 17.067 22.664 1.00 56.62 N ATOM 994 CA MET B 1X -5.997 17.250 24.089 1.00 53.49 C ATOM 995 C MET B 1X -5.547 16.012 24.874 1.00 53.20 C ATOM 996 O MET B 1X -6.106 14.933 24.690 1.00 58.50 O ATOM 997 CB MET B 1X -7.511 17.471 24.189 1.00 52.58 C ATOM 998 CG MET B 1X -8.140 17.245 25.562 1.00 57.05 C ATOM 999 SD MET B 1X -8.679 18.722 26.448 1.00 63.61 S ATOM 1000 CE MET B 1X -10.051 19.271 25.465 1.00 61.67 C ATOM 0 H1 MET B 1X -5.892 17.781 22.198 1.00 56.62 H new ATOM 0 H2 MET B 1X -4.754 16.968 22.592 1.00 56.62 H new ATOM 0 H3 MET B 1X -6.042 16.343 22.345 1.00 56.62 H new ATOM 0 HA MET B 1X -5.554 18.025 24.468 1.00 53.49 H new ATOM 0 HB2 MET B 1X -7.705 18.380 23.912 1.00 52.58 H new ATOM 0 HB3 MET B 1X -7.947 16.882 23.554 1.00 52.58 H new ATOM 0 HG2 MET B 1X -8.905 16.659 25.453 1.00 57.05 H new ATOM 0 HG3 MET B 1X -7.499 16.774 26.117 1.00 57.05 H new ATOM 0 HE1 MET B 1X -10.476 20.028 25.897 1.00 61.67 H new ATOM 0 HE2 MET B 1X -9.735 19.536 24.587 1.00 61.67 H new ATOM 0 HE3 MET B 1X -10.693 18.550 25.373 1.00 61.67 H new ATOM 1001 N GLU B 1 -4.450 16.143 25.624 1.00 48.91 N ATOM 1002 CA GLU B 1 -3.942 15.059 26.467 1.00 46.71 C ATOM 1003 C GLU B 1 -3.693 15.562 27.885 1.00 41.68 C ATOM 1004 O GLU B 1 -2.692 16.209 28.158 1.00 42.77 O ATOM 1005 CB GLU B 1 -2.710 14.394 25.866 1.00 50.29 C ATOM 1006 CG GLU B 1 -3.116 13.259 24.913 1.00 71.05 C ATOM 1007 CD GLU B 1 -2.001 12.760 23.985 1.00 78.66 C ATOM 1008 OE1 GLU B 1 -0.829 12.659 24.427 1.00 85.21 O ATOM 1009 OE2 GLU B 1 -2.313 12.447 22.805 1.00 78.92 O ATOM 0 H GLU B 1 -3.980 16.863 25.658 1.00 48.91 H new ATOM 0 HA GLU B 1 -4.622 14.369 26.511 1.00 46.71 H new ATOM 0 HB2 GLU B 1 -2.183 15.052 25.387 1.00 50.29 H new ATOM 0 HB3 GLU B 1 -2.148 14.042 26.574 1.00 50.29 H new ATOM 0 HG2 GLU B 1 -3.437 12.511 25.441 1.00 71.05 H new ATOM 0 HG3 GLU B 1 -3.859 13.562 24.369 1.00 71.05 H new ATOM 1010 N GLN B 2 -4.703 15.359 28.729 1.00 38.00 N ATOM 1011 CA GLN B 2 -4.738 15.783 30.122 1.00 33.27 C ATOM 1012 C GLN B 2 -4.224 14.782 31.138 1.00 35.68 C ATOM 1013 O GLN B 2 -4.304 13.574 30.962 1.00 38.66 O ATOM 1014 CB GLN B 2 -6.175 16.101 30.525 1.00 34.36 C ATOM 1015 CG GLN B 2 -6.637 17.518 30.329 1.00 31.69 C ATOM 1016 CD GLN B 2 -8.001 17.753 30.955 1.00 35.26 C ATOM 1017 OE1 GLN B 2 -8.957 17.051 30.636 1.00 40.20 O ATOM 1018 NE2 GLN B 2 -8.099 18.731 31.849 1.00 30.58 N ATOM 0 H GLN B 2 -5.421 14.950 28.490 1.00 38.00 H new ATOM 0 HA GLN B 2 -4.142 16.548 30.145 1.00 33.27 H new ATOM 0 HB2 GLN B 2 -6.766 15.518 30.023 1.00 34.36 H new ATOM 0 HB3 GLN B 2 -6.283 15.875 31.462 1.00 34.36 H new ATOM 0 HG2 GLN B 2 -5.991 18.127 30.721 1.00 31.69 H new ATOM 0 HG3 GLN B 2 -6.677 17.718 29.381 1.00 31.69 H new ATOM 0 HE21 GLN B 2 -7.408 19.203 32.048 1.00 30.58 H new ATOM 0 HE22 GLN B 2 -8.854 18.892 32.229 1.00 30.58 H new ATOM 1019 N LEU B 3 -3.847 15.322 32.280 1.00 32.86 N ATOM 1020 CA LEU B 3 -3.346 14.560 33.398 1.00 33.00 C ATOM 1021 C LEU B 3 -4.314 14.797 34.558 1.00 32.95 C ATOM 1022 O LEU B 3 -5.035 15.777 34.550 1.00 36.83 O ATOM 1023 CB LEU B 3 -1.986 15.121 33.784 1.00 34.33 C ATOM 1024 CG LEU B 3 -0.722 14.724 33.036 1.00 31.79 C ATOM 1025 CD1 LEU B 3 0.307 15.810 33.229 1.00 35.68 C ATOM 1026 CD2 LEU B 3 -0.187 13.440 33.610 1.00 32.41 C ATOM 0 H LEU B 3 -3.877 16.168 32.429 1.00 32.86 H new ATOM 0 HA LEU B 3 -3.269 13.617 33.185 1.00 33.00 H new ATOM 0 HB2 LEU B 3 -2.054 16.087 33.730 1.00 34.33 H new ATOM 0 HB3 LEU B 3 -1.843 14.898 34.717 1.00 34.33 H new ATOM 0 HG LEU B 3 -0.917 14.604 32.093 1.00 31.79 H new ATOM 0 HD11 LEU B 3 1.121 15.572 32.758 1.00 35.68 H new ATOM 0 HD12 LEU B 3 -0.036 16.647 32.879 1.00 35.68 H new ATOM 0 HD13 LEU B 3 0.499 15.910 34.175 1.00 35.68 H new ATOM 0 HD21 LEU B 3 0.619 13.184 33.135 1.00 32.41 H new ATOM 0 HD22 LEU B 3 0.018 13.566 34.550 1.00 32.41 H new ATOM 0 HD23 LEU B 3 -0.853 12.741 33.516 1.00 32.41 H new ATOM 1027 N THR B 4 -4.327 13.918 35.556 1.00 30.12 N ATOM 1028 CA THR B 4 -5.190 14.100 36.716 1.00 30.59 C ATOM 1029 C THR B 4 -4.336 14.826 37.761 1.00 32.53 C ATOM 1030 O THR B 4 -3.105 14.778 37.700 1.00 31.87 O ATOM 1031 CB THR B 4 -5.691 12.756 37.296 1.00 31.26 C ATOM 1032 OG1 THR B 4 -4.566 11.902 37.487 1.00 37.69 O ATOM 1033 CG2 THR B 4 -6.694 12.068 36.368 1.00 23.39 C ATOM 0 H THR B 4 -3.842 13.208 35.580 1.00 30.12 H new ATOM 0 HA THR B 4 -5.983 14.599 36.466 1.00 30.59 H new ATOM 0 HB THR B 4 -6.144 12.934 38.135 1.00 31.26 H new ATOM 0 HG1 THR B 4 -4.822 11.167 37.803 1.00 37.69 H new ATOM 0 HG21 THR B 4 -6.983 11.232 36.766 1.00 23.39 H new ATOM 0 HG22 THR B 4 -7.462 12.645 36.236 1.00 23.39 H new ATOM 0 HG23 THR B 4 -6.274 11.890 35.512 1.00 23.39 H new ATOM 1034 N LYS B 5 -4.973 15.474 38.733 1.00 32.58 N ATOM 1035 CA LYS B 5 -4.230 16.214 39.745 1.00 33.29 C ATOM 1036 C LYS B 5 -3.090 15.407 40.365 1.00 36.72 C ATOM 1037 O LYS B 5 -1.942 15.847 40.348 1.00 44.76 O ATOM 1038 CB LYS B 5 -5.169 16.757 40.837 1.00 31.50 C ATOM 1039 CG LYS B 5 -4.515 17.693 41.837 1.00 27.74 C ATOM 1040 CD LYS B 5 -5.520 18.153 42.870 1.00 28.98 C ATOM 1041 CE LYS B 5 -5.958 17.024 43.775 1.00 31.28 C ATOM 1042 NZ LYS B 5 -7.069 17.397 44.703 1.00 33.01 N ATOM 0 H LYS B 5 -5.828 15.497 38.823 1.00 32.58 H new ATOM 0 HA LYS B 5 -3.820 16.963 39.284 1.00 33.29 H new ATOM 0 HB2 LYS B 5 -5.904 17.224 40.410 1.00 31.50 H new ATOM 0 HB3 LYS B 5 -5.551 16.007 41.319 1.00 31.50 H new ATOM 0 HG2 LYS B 5 -3.777 17.242 42.275 1.00 27.74 H new ATOM 0 HG3 LYS B 5 -4.144 18.461 41.375 1.00 27.74 H new ATOM 0 HD2 LYS B 5 -5.131 18.863 43.405 1.00 28.98 H new ATOM 0 HD3 LYS B 5 -6.295 18.527 42.422 1.00 28.98 H new ATOM 0 HE2 LYS B 5 -6.241 16.273 43.229 1.00 31.28 H new ATOM 0 HE3 LYS B 5 -5.197 16.725 44.297 1.00 31.28 H new ATOM 0 HZ1 LYS B 5 -7.243 16.715 45.247 1.00 33.01 H new ATOM 0 HZ2 LYS B 5 -6.829 18.106 45.184 1.00 33.01 H new ATOM 0 HZ3 LYS B 5 -7.798 17.593 44.231 1.00 33.01 H new ATOM 1043 N CYS B 6 -3.388 14.201 40.846 1.00 40.48 N ATOM 1044 CA CYS B 6 -2.383 13.327 41.483 1.00 40.64 C ATOM 1045 C CYS B 6 -1.221 12.980 40.552 1.00 34.90 C ATOM 1046 O CYS B 6 -0.085 12.834 40.997 1.00 30.33 O ATOM 1047 CB CYS B 6 -3.047 12.050 42.020 1.00 50.31 C ATOM 1048 SG CYS B 6 -3.780 12.176 43.688 1.00 54.53 S ATOM 0 H CYS B 6 -4.177 13.860 40.815 1.00 40.48 H new ATOM 0 HA CYS B 6 -2.005 13.827 42.223 1.00 40.64 H new ATOM 0 HB2 CYS B 6 -3.742 11.782 41.399 1.00 50.31 H new ATOM 0 HB3 CYS B 6 -2.385 11.341 42.029 1.00 50.31 H new ATOM 1049 N GLU B 7 -1.527 12.833 39.268 1.00 32.34 N ATOM 1050 CA GLU B 7 -0.521 12.551 38.268 1.00 36.20 C ATOM 1051 C GLU B 7 0.445 13.736 38.174 1.00 40.60 C ATOM 1052 O GLU B 7 1.673 13.561 38.096 1.00 42.16 O ATOM 1053 CB GLU B 7 -1.179 12.324 36.899 1.00 33.87 C ATOM 1054 CG GLU B 7 -1.963 11.018 36.786 1.00 44.08 C ATOM 1055 CD GLU B 7 -2.424 10.718 35.360 1.00 52.17 C ATOM 1056 OE1 GLU B 7 -3.251 11.474 34.820 1.00 55.70 O ATOM 1057 OE2 GLU B 7 -1.964 9.715 34.764 1.00 62.13 O ATOM 0 H GLU B 7 -2.326 12.895 38.957 1.00 32.34 H new ATOM 0 HA GLU B 7 -0.039 11.749 38.523 1.00 36.20 H new ATOM 0 HB2 GLU B 7 -1.777 13.065 36.713 1.00 33.87 H new ATOM 0 HB3 GLU B 7 -0.491 12.336 36.215 1.00 33.87 H new ATOM 0 HG2 GLU B 7 -1.410 10.287 37.102 1.00 44.08 H new ATOM 0 HG3 GLU B 7 -2.737 11.060 37.369 1.00 44.08 H new ATOM 1058 N VAL B 8 -0.109 14.948 38.191 1.00 40.00 N ATOM 1059 CA VAL B 8 0.705 16.154 38.089 1.00 36.99 C ATOM 1060 C VAL B 8 1.532 16.247 39.340 1.00 35.10 C ATOM 1061 O VAL B 8 2.675 16.683 39.306 1.00 38.57 O ATOM 1062 CB VAL B 8 -0.156 17.440 37.911 1.00 34.85 C ATOM 1063 CG1 VAL B 8 0.721 18.610 37.544 1.00 34.72 C ATOM 1064 CG2 VAL B 8 -1.171 17.248 36.824 1.00 30.96 C ATOM 0 H VAL B 8 -0.954 15.091 38.261 1.00 40.00 H new ATOM 0 HA VAL B 8 1.266 16.093 37.300 1.00 36.99 H new ATOM 0 HB VAL B 8 -0.607 17.615 38.752 1.00 34.85 H new ATOM 0 HG11 VAL B 8 0.174 19.404 37.436 1.00 34.72 H new ATOM 0 HG12 VAL B 8 1.372 18.760 38.247 1.00 34.72 H new ATOM 0 HG13 VAL B 8 1.182 18.420 36.712 1.00 34.72 H new ATOM 0 HG21 VAL B 8 -1.698 18.057 36.726 1.00 30.96 H new ATOM 0 HG22 VAL B 8 -0.718 17.055 35.988 1.00 30.96 H new ATOM 0 HG23 VAL B 8 -1.755 16.508 37.053 1.00 30.96 H new ATOM 1065 N PHE B 9 0.963 15.809 40.447 1.00 35.90 N ATOM 1066 CA PHE B 9 1.679 15.845 41.702 1.00 36.68 C ATOM 1067 C PHE B 9 2.948 15.003 41.571 1.00 40.70 C ATOM 1068 O PHE B 9 3.990 15.372 42.106 1.00 43.67 O ATOM 1069 CB PHE B 9 0.799 15.315 42.831 1.00 32.85 C ATOM 1070 CG PHE B 9 0.883 16.126 44.082 1.00 31.72 C ATOM 1071 CD1 PHE B 9 1.914 15.934 44.980 1.00 37.54 C ATOM 1072 CD2 PHE B 9 -0.033 17.119 44.336 1.00 32.88 C ATOM 1073 CE1 PHE B 9 2.031 16.725 46.101 1.00 39.10 C ATOM 1074 CE2 PHE B 9 0.081 17.910 45.453 1.00 34.44 C ATOM 1075 CZ PHE B 9 1.119 17.714 46.338 1.00 41.39 C ATOM 0 H PHE B 9 0.166 15.488 40.492 1.00 35.90 H new ATOM 0 HA PHE B 9 1.919 16.761 41.915 1.00 36.68 H new ATOM 0 HB2 PHE B 9 -0.123 15.293 42.530 1.00 32.85 H new ATOM 0 HB3 PHE B 9 1.055 14.401 43.029 1.00 32.85 H new ATOM 0 HD1 PHE B 9 2.538 15.262 44.826 1.00 37.54 H new ATOM 0 HD2 PHE B 9 -0.738 17.257 43.745 1.00 32.88 H new ATOM 0 HE1 PHE B 9 2.731 16.586 46.697 1.00 39.10 H new ATOM 0 HE2 PHE B 9 -0.544 18.580 45.613 1.00 34.44 H new ATOM 0 HZ PHE B 9 1.198 18.252 47.092 1.00 41.39 H new ATOM 1076 N ARG B 10 2.865 13.888 40.843 1.00 42.98 N ATOM 1077 CA ARG B 10 4.012 13.002 40.639 1.00 43.19 C ATOM 1078 C ARG B 10 4.963 13.616 39.642 1.00 41.64 C ATOM 1079 O ARG B 10 6.112 13.907 39.955 1.00 45.13 O ATOM 1080 CB ARG B 10 3.553 11.632 40.133 1.00 45.84 C ATOM 1081 CG ARG B 10 2.620 10.972 41.106 1.00 60.56 C ATOM 1082 CD ARG B 10 2.139 9.591 40.703 1.00 72.60 C ATOM 1083 NE ARG B 10 1.023 9.229 41.582 1.00 85.00 N ATOM 1084 CZ ARG B 10 -0.196 8.900 41.162 1.00 89.34 C ATOM 1085 NH1 ARG B 10 -0.473 8.853 39.863 1.00 95.01 N ATOM 1086 NH2 ARG B 10 -1.169 8.712 42.042 1.00 91.33 N ATOM 0 H ARG B 10 2.144 13.625 40.455 1.00 42.98 H new ATOM 0 HA ARG B 10 4.464 12.885 41.489 1.00 43.19 H new ATOM 0 HB2 ARG B 10 3.110 11.734 39.276 1.00 45.84 H new ATOM 0 HB3 ARG B 10 4.326 11.064 39.987 1.00 45.84 H new ATOM 0 HG2 ARG B 10 3.065 10.906 41.965 1.00 60.56 H new ATOM 0 HG3 ARG B 10 1.847 11.545 41.230 1.00 60.56 H new ATOM 0 HD2 ARG B 10 1.856 9.587 39.775 1.00 72.60 H new ATOM 0 HD3 ARG B 10 2.858 8.944 40.783 1.00 72.60 H new ATOM 0 HE ARG B 10 1.166 9.229 42.430 1.00 85.00 H new ATOM 0 HH11 ARG B 10 0.138 9.036 39.286 1.00 95.01 H new ATOM 0 HH12 ARG B 10 -1.263 8.640 39.599 1.00 95.01 H new ATOM 0 HH21 ARG B 10 -1.012 8.803 42.883 1.00 91.33 H new ATOM 0 HH22 ARG B 10 -1.957 8.499 41.772 1.00 91.33 H new ATOM 1087 N GLU B 11 4.452 13.841 38.440 1.00 41.25 N ATOM 1088 CA GLU B 11 5.216 14.412 37.349 1.00 38.85 C ATOM 1089 C GLU B 11 6.080 15.595 37.705 1.00 37.59 C ATOM 1090 O GLU B 11 7.239 15.630 37.349 1.00 43.19 O ATOM 1091 CB GLU B 11 4.280 14.797 36.220 1.00 43.30 C ATOM 1092 CG GLU B 11 3.782 13.613 35.411 1.00 55.49 C ATOM 1093 CD GLU B 11 4.919 12.784 34.841 1.00 63.02 C ATOM 1094 OE1 GLU B 11 5.666 13.273 33.944 1.00 64.73 O ATOM 1095 OE2 GLU B 11 5.067 11.633 35.309 1.00 67.55 O ATOM 0 H GLU B 11 3.636 13.662 38.234 1.00 41.25 H new ATOM 0 HA GLU B 11 5.835 13.714 37.084 1.00 38.85 H new ATOM 0 HB2 GLU B 11 3.518 15.270 36.589 1.00 43.30 H new ATOM 0 HB3 GLU B 11 4.737 15.414 35.628 1.00 43.30 H new ATOM 0 HG2 GLU B 11 3.225 13.051 35.973 1.00 55.49 H new ATOM 0 HG3 GLU B 11 3.222 13.932 34.686 1.00 55.49 H new ATOM 1096 N LEU B 12 5.528 16.549 38.439 1.00 40.95 N ATOM 1097 CA LEU B 12 6.249 17.760 38.827 1.00 40.43 C ATOM 1098 C LEU B 12 7.218 17.676 39.998 1.00 39.75 C ATOM 1099 O LEU B 12 7.719 18.698 40.447 1.00 39.54 O ATOM 1100 CB LEU B 12 5.251 18.879 39.092 1.00 38.64 C ATOM 1101 CG LEU B 12 5.117 19.842 37.919 1.00 42.39 C ATOM 1102 CD1 LEU B 12 4.804 19.104 36.625 1.00 34.18 C ATOM 1103 CD2 LEU B 12 4.044 20.841 38.262 1.00 43.80 C ATOM 0 H LEU B 12 4.719 16.516 38.730 1.00 40.95 H new ATOM 0 HA LEU B 12 6.825 17.927 38.065 1.00 40.43 H new ATOM 0 HB2 LEU B 12 4.383 18.493 39.288 1.00 38.64 H new ATOM 0 HB3 LEU B 12 5.527 19.373 39.880 1.00 38.64 H new ATOM 0 HG LEU B 12 5.958 20.301 37.769 1.00 42.39 H new ATOM 0 HD11 LEU B 12 4.725 19.743 35.899 1.00 34.18 H new ATOM 0 HD12 LEU B 12 5.518 18.478 36.428 1.00 34.18 H new ATOM 0 HD13 LEU B 12 3.969 18.620 36.722 1.00 34.18 H new ATOM 0 HD21 LEU B 12 3.939 21.468 37.529 1.00 43.80 H new ATOM 0 HD22 LEU B 12 3.206 20.377 38.413 1.00 43.80 H new ATOM 0 HD23 LEU B 12 4.295 21.323 39.065 1.00 43.80 H new ATOM 1104 N LYS B 13 7.552 16.468 40.433 1.00 45.20 N ATOM 1105 CA LYS B 13 8.433 16.275 41.580 1.00 46.58 C ATOM 1106 C LYS B 13 9.737 17.056 41.605 1.00 43.01 C ATOM 1107 O LYS B 13 10.183 17.473 42.666 1.00 41.19 O ATOM 1108 CB LYS B 13 8.740 14.787 41.781 1.00 53.59 C ATOM 1109 CG LYS B 13 9.672 14.521 42.972 1.00 63.43 C ATOM 1110 CD LYS B 13 9.883 13.034 43.258 1.00 70.32 C ATOM 1111 CE LYS B 13 10.709 12.337 42.186 1.00 69.67 C ATOM 1112 NZ LYS B 13 10.878 10.889 42.531 1.00 72.29 N ATOM 0 H LYS B 13 7.276 15.737 40.073 1.00 45.20 H new ATOM 0 HA LYS B 13 7.914 16.646 42.310 1.00 46.58 H new ATOM 0 HB2 LYS B 13 7.908 14.306 41.914 1.00 53.59 H new ATOM 0 HB3 LYS B 13 9.146 14.434 40.974 1.00 53.59 H new ATOM 0 HG2 LYS B 13 10.532 14.936 42.800 1.00 63.43 H new ATOM 0 HG3 LYS B 13 9.305 14.947 43.763 1.00 63.43 H new ATOM 0 HD2 LYS B 13 10.324 12.934 44.116 1.00 70.32 H new ATOM 0 HD3 LYS B 13 9.020 12.597 43.330 1.00 70.32 H new ATOM 0 HE2 LYS B 13 10.273 12.423 41.324 1.00 69.67 H new ATOM 0 HE3 LYS B 13 11.577 12.762 42.108 1.00 69.67 H new ATOM 0 HZ1 LYS B 13 11.361 10.488 41.901 1.00 72.29 H new ATOM 0 HZ2 LYS B 13 11.294 10.817 43.314 1.00 72.29 H new ATOM 0 HZ3 LYS B 13 10.079 10.501 42.583 1.00 72.29 H new ATOM 1113 N ASP B 14 10.357 17.244 40.449 1.00 45.59 N ATOM 1114 CA ASP B 14 11.617 17.966 40.396 1.00 48.23 C ATOM 1115 C ASP B 14 11.512 19.461 40.706 1.00 48.92 C ATOM 1116 O ASP B 14 12.531 20.144 40.860 1.00 47.72 O ATOM 1117 CB ASP B 14 12.285 17.761 39.041 1.00 58.32 C ATOM 1118 CG ASP B 14 12.942 16.391 38.911 1.00 67.84 C ATOM 1119 OD1 ASP B 14 13.599 15.956 39.885 1.00 73.50 O ATOM 1120 OD2 ASP B 14 12.813 15.752 37.834 1.00 70.77 O ATOM 0 H ASP B 14 10.067 16.964 39.689 1.00 45.59 H new ATOM 0 HA ASP B 14 12.160 17.589 41.105 1.00 48.23 H new ATOM 0 HB2 ASP B 14 11.624 17.866 38.339 1.00 58.32 H new ATOM 0 HB3 ASP B 14 12.954 18.451 38.907 1.00 58.32 H new ATOM 1121 N LEU B 15 10.281 19.957 40.809 1.00 46.83 N ATOM 1122 CA LEU B 15 10.007 21.371 41.086 1.00 39.40 C ATOM 1123 C LEU B 15 9.776 21.700 42.553 1.00 36.86 C ATOM 1124 O LEU B 15 9.906 22.853 42.968 1.00 40.39 O ATOM 1125 CB LEU B 15 8.775 21.823 40.303 1.00 33.51 C ATOM 1126 CG LEU B 15 8.898 22.035 38.809 1.00 23.20 C ATOM 1127 CD1 LEU B 15 7.559 22.489 38.282 1.00 25.89 C ATOM 1128 CD2 LEU B 15 9.960 23.080 38.543 1.00 23.25 C ATOM 0 H LEU B 15 9.572 19.479 40.719 1.00 46.83 H new ATOM 0 HA LEU B 15 10.810 21.841 40.812 1.00 39.40 H new ATOM 0 HB2 LEU B 15 8.076 21.166 40.450 1.00 33.51 H new ATOM 0 HB3 LEU B 15 8.468 22.656 40.694 1.00 33.51 H new ATOM 0 HG LEU B 15 9.156 21.213 38.363 1.00 23.20 H new ATOM 0 HD11 LEU B 15 7.619 22.630 37.324 1.00 25.89 H new ATOM 0 HD12 LEU B 15 6.891 21.810 38.467 1.00 25.89 H new ATOM 0 HD13 LEU B 15 7.305 23.319 38.715 1.00 25.89 H new ATOM 0 HD21 LEU B 15 10.044 23.220 37.587 1.00 23.25 H new ATOM 0 HD22 LEU B 15 9.709 23.913 38.971 1.00 23.25 H new ATOM 0 HD23 LEU B 15 10.809 22.777 38.900 1.00 23.25 H new ATOM 1129 N LYS B 16 9.399 20.709 43.339 1.00 39.02 N ATOM 1130 CA LYS B 16 9.124 20.972 44.729 1.00 45.36 C ATOM 1131 C LYS B 16 10.269 21.674 45.411 1.00 45.98 C ATOM 1132 O LYS B 16 11.351 21.135 45.537 1.00 50.31 O ATOM 1133 CB LYS B 16 8.692 19.710 45.501 1.00 51.98 C ATOM 1134 CG LYS B 16 9.677 18.553 45.541 1.00 59.86 C ATOM 1135 CD LYS B 16 9.264 17.521 46.604 1.00 64.05 C ATOM 1136 CE LYS B 16 9.411 18.085 48.029 1.00 66.42 C ATOM 1137 NZ LYS B 16 8.705 17.296 49.088 1.00 65.46 N ATOM 0 H LYS B 16 9.298 19.892 43.090 1.00 39.02 H new ATOM 0 HA LYS B 16 8.366 21.577 44.741 1.00 45.36 H new ATOM 0 HB2 LYS B 16 8.494 19.969 46.415 1.00 51.98 H new ATOM 0 HB3 LYS B 16 7.864 19.387 45.112 1.00 51.98 H new ATOM 0 HG2 LYS B 16 9.718 18.128 44.670 1.00 59.86 H new ATOM 0 HG3 LYS B 16 10.567 18.887 45.736 1.00 59.86 H new ATOM 0 HD2 LYS B 16 8.344 17.252 46.455 1.00 64.05 H new ATOM 0 HD3 LYS B 16 9.810 16.725 46.512 1.00 64.05 H new ATOM 0 HE2 LYS B 16 10.354 18.130 48.251 1.00 66.42 H new ATOM 0 HE3 LYS B 16 9.073 18.994 48.041 1.00 66.42 H new ATOM 0 HZ1 LYS B 16 8.834 17.680 49.880 1.00 65.46 H new ATOM 0 HZ2 LYS B 16 7.834 17.272 48.909 1.00 65.46 H new ATOM 0 HZ3 LYS B 16 9.027 16.466 49.105 1.00 65.46 H new ATOM 1138 N GLY B 17 10.036 22.930 45.755 1.00 48.21 N ATOM 1139 CA GLY B 17 11.034 23.713 46.449 1.00 46.25 C ATOM 1140 C GLY B 17 11.820 24.628 45.549 1.00 47.87 C ATOM 1141 O GLY B 17 12.355 25.632 46.007 1.00 52.69 O ATOM 0 H GLY B 17 9.301 23.347 45.594 1.00 48.21 H new ATOM 0 HA2 GLY B 17 10.598 24.243 47.135 1.00 46.25 H new ATOM 0 HA3 GLY B 17 11.647 23.113 46.901 1.00 46.25 H new ATOM 1142 N TYR B 18 11.914 24.305 44.270 1.00 44.41 N ATOM 1143 CA TYR B 18 12.670 25.168 43.389 1.00 42.69 C ATOM 1144 C TYR B 18 12.066 26.549 43.377 1.00 46.35 C ATOM 1145 O TYR B 18 10.941 26.744 42.903 1.00 49.84 O ATOM 1146 CB TYR B 18 12.720 24.643 41.961 1.00 44.10 C ATOM 1147 CG TYR B 18 13.829 25.312 41.181 1.00 47.52 C ATOM 1148 CD1 TYR B 18 15.165 24.978 41.408 1.00 52.15 C ATOM 1149 CD2 TYR B 18 13.559 26.307 40.249 1.00 45.89 C ATOM 1150 CE1 TYR B 18 16.198 25.624 40.739 1.00 49.57 C ATOM 1151 CE2 TYR B 18 14.589 26.956 39.574 1.00 45.33 C ATOM 1152 CZ TYR B 18 15.898 26.600 39.823 1.00 46.67 C ATOM 1153 OH TYR B 18 16.906 27.221 39.143 1.00 47.94 O ATOM 0 H TYR B 18 11.559 23.613 43.903 1.00 44.41 H new ATOM 0 HA TYR B 18 13.577 25.194 43.732 1.00 42.69 H new ATOM 0 HB2 TYR B 18 12.859 23.683 41.970 1.00 44.10 H new ATOM 0 HB3 TYR B 18 11.869 24.803 41.523 1.00 44.10 H new ATOM 0 HD1 TYR B 18 15.369 24.308 42.020 1.00 52.15 H new ATOM 0 HD2 TYR B 18 12.677 26.543 40.074 1.00 45.89 H new ATOM 0 HE1 TYR B 18 17.083 25.397 40.911 1.00 49.57 H new ATOM 0 HE2 TYR B 18 14.396 27.626 38.959 1.00 45.33 H new ATOM 0 HH TYR B 18 16.584 27.656 38.501 1.00 47.94 H new ATOM 1154 N GLY B 19 12.827 27.501 43.901 1.00 45.94 N ATOM 1155 CA GLY B 19 12.368 28.875 43.957 1.00 44.01 C ATOM 1156 C GLY B 19 11.545 29.158 45.197 1.00 43.56 C ATOM 1157 O GLY B 19 10.976 30.242 45.352 1.00 46.23 O ATOM 0 H GLY B 19 13.611 27.370 44.229 1.00 45.94 H new ATOM 0 HA2 GLY B 19 13.134 29.470 43.937 1.00 44.01 H new ATOM 0 HA3 GLY B 19 11.837 29.069 43.168 1.00 44.01 H new ATOM 1158 N GLY B 20 11.517 28.187 46.101 1.00 40.52 N ATOM 1159 CA GLY B 20 10.771 28.328 47.324 1.00 38.73 C ATOM 1160 C GLY B 20 9.351 27.864 47.131 1.00 43.13 C ATOM 1161 O GLY B 20 8.681 27.494 48.090 1.00 57.72 O ATOM 0 H GLY B 20 11.929 27.437 46.017 1.00 40.52 H new ATOM 0 HA2 GLY B 20 11.193 27.812 48.028 1.00 38.73 H new ATOM 0 HA3 GLY B 20 10.778 29.255 47.609 1.00 38.73 H new ATOM 1162 N VAL B 21 8.883 27.857 45.895 1.00 38.36 N ATOM 1163 CA VAL B 21 7.523 27.443 45.624 1.00 37.13 C ATOM 1164 C VAL B 21 7.375 25.934 45.821 1.00 36.87 C ATOM 1165 O VAL B 21 8.224 25.152 45.405 1.00 38.68 O ATOM 1166 CB VAL B 21 7.080 27.917 44.214 1.00 40.53 C ATOM 1167 CG1 VAL B 21 8.177 27.670 43.196 1.00 43.92 C ATOM 1168 CG2 VAL B 21 5.757 27.264 43.804 1.00 39.51 C ATOM 0 H VAL B 21 9.336 28.088 45.202 1.00 38.36 H new ATOM 0 HA VAL B 21 6.925 27.867 46.259 1.00 37.13 H new ATOM 0 HB VAL B 21 6.925 28.874 44.247 1.00 40.53 H new ATOM 0 HG11 VAL B 21 7.882 27.972 42.323 1.00 43.92 H new ATOM 0 HG12 VAL B 21 8.974 28.158 43.454 1.00 43.92 H new ATOM 0 HG13 VAL B 21 8.377 26.722 43.159 1.00 43.92 H new ATOM 0 HG21 VAL B 21 5.502 27.575 42.921 1.00 39.51 H new ATOM 0 HG22 VAL B 21 5.863 26.300 43.788 1.00 39.51 H new ATOM 0 HG23 VAL B 21 5.067 27.502 44.442 1.00 39.51 H new ATOM 1169 N SER B 22 6.328 25.547 46.535 1.00 37.51 N ATOM 1170 CA SER B 22 6.038 24.151 46.851 1.00 36.65 C ATOM 1171 C SER B 22 5.251 23.385 45.791 1.00 36.71 C ATOM 1172 O SER B 22 4.840 23.937 44.772 1.00 39.00 O ATOM 1173 CB SER B 22 5.237 24.101 48.144 1.00 36.99 C ATOM 1174 OG SER B 22 3.991 24.747 47.941 1.00 41.45 O ATOM 0 H SER B 22 5.752 26.098 46.858 1.00 37.51 H new ATOM 0 HA SER B 22 6.904 23.719 46.914 1.00 36.65 H new ATOM 0 HB2 SER B 22 5.097 23.180 48.416 1.00 36.99 H new ATOM 0 HB3 SER B 22 5.727 24.536 48.859 1.00 36.99 H new ATOM 0 HG SER B 22 3.543 24.722 48.651 1.00 41.45 H new ATOM 1175 N LEU B 23 4.965 22.119 46.069 1.00 35.88 N ATOM 1176 CA LEU B 23 4.214 21.321 45.118 1.00 36.71 C ATOM 1177 C LEU B 23 2.731 21.698 45.028 1.00 36.18 C ATOM 1178 O LEU B 23 2.171 21.758 43.925 1.00 43.42 O ATOM 1179 CB LEU B 23 4.420 19.838 45.395 1.00 37.45 C ATOM 1180 CG LEU B 23 5.493 19.291 44.454 1.00 34.12 C ATOM 1181 CD1 LEU B 23 5.817 17.861 44.805 1.00 41.32 C ATOM 1182 CD2 LEU B 23 4.976 19.394 43.032 1.00 36.09 C ATOM 0 H LEU B 23 5.193 21.711 46.791 1.00 35.88 H new ATOM 0 HA LEU B 23 4.569 21.522 44.238 1.00 36.71 H new ATOM 0 HB2 LEU B 23 4.687 19.705 46.318 1.00 37.45 H new ATOM 0 HB3 LEU B 23 3.588 19.356 45.268 1.00 37.45 H new ATOM 0 HG LEU B 23 6.310 19.807 44.542 1.00 34.12 H new ATOM 0 HD11 LEU B 23 6.498 17.526 44.201 1.00 41.32 H new ATOM 0 HD12 LEU B 23 6.144 17.818 45.717 1.00 41.32 H new ATOM 0 HD13 LEU B 23 5.017 17.318 44.723 1.00 41.32 H new ATOM 0 HD21 LEU B 23 5.645 19.051 42.419 1.00 36.09 H new ATOM 0 HD22 LEU B 23 4.161 18.875 42.945 1.00 36.09 H new ATOM 0 HD23 LEU B 23 4.791 20.323 42.821 1.00 36.09 H new ATOM 1183 N PRO B 24 2.075 21.954 46.153 1.00 34.99 N ATOM 1184 CA PRO B 24 0.661 22.314 46.057 1.00 34.03 C ATOM 1185 C PRO B 24 0.447 23.647 45.344 1.00 32.38 C ATOM 1186 O PRO B 24 -0.608 23.876 44.747 1.00 31.82 O ATOM 1187 CB PRO B 24 0.219 22.384 47.504 1.00 36.04 C ATOM 1188 CG PRO B 24 1.103 21.346 48.142 1.00 37.67 C ATOM 1189 CD PRO B 24 2.432 21.618 47.552 1.00 31.25 C ATOM 0 HA PRO B 24 0.154 21.676 45.532 1.00 34.03 H new ATOM 0 HB2 PRO B 24 0.358 23.265 47.885 1.00 36.04 H new ATOM 0 HB3 PRO B 24 -0.722 22.175 47.608 1.00 36.04 H new ATOM 0 HG2 PRO B 24 1.116 21.432 49.108 1.00 37.67 H new ATOM 0 HG3 PRO B 24 0.800 20.446 47.942 1.00 37.67 H new ATOM 0 HD2 PRO B 24 2.886 22.350 47.998 1.00 31.25 H new ATOM 0 HD3 PRO B 24 3.018 20.847 47.603 1.00 31.25 H new ATOM 1190 N GLU B 25 1.431 24.531 45.416 1.00 30.08 N ATOM 1191 CA GLU B 25 1.287 25.794 44.726 1.00 26.11 C ATOM 1192 C GLU B 25 1.341 25.521 43.215 1.00 29.95 C ATOM 1193 O GLU B 25 0.516 26.034 42.455 1.00 31.70 O ATOM 1194 CB GLU B 25 2.378 26.752 45.147 1.00 21.60 C ATOM 1195 CG GLU B 25 2.308 27.155 46.597 1.00 27.22 C ATOM 1196 CD GLU B 25 3.335 28.240 46.949 1.00 33.68 C ATOM 1197 OE1 GLU B 25 4.523 27.911 47.211 1.00 40.12 O ATOM 1198 OE2 GLU B 25 2.953 29.432 46.952 1.00 41.81 O ATOM 0 H GLU B 25 2.168 24.422 45.846 1.00 30.08 H new ATOM 0 HA GLU B 25 0.439 26.207 44.952 1.00 26.11 H new ATOM 0 HB2 GLU B 25 3.240 26.342 44.975 1.00 21.60 H new ATOM 0 HB3 GLU B 25 2.328 27.549 44.596 1.00 21.60 H new ATOM 0 HG2 GLU B 25 1.416 27.479 46.798 1.00 27.22 H new ATOM 0 HG3 GLU B 25 2.459 26.376 47.155 1.00 27.22 H new ATOM 1199 N TRP B 26 2.274 24.667 42.789 1.00 29.25 N ATOM 1200 CA TRP B 26 2.431 24.307 41.374 1.00 30.38 C ATOM 1201 C TRP B 26 1.254 23.529 40.789 1.00 32.49 C ATOM 1202 O TRP B 26 0.965 23.635 39.595 1.00 36.75 O ATOM 1203 CB TRP B 26 3.696 23.482 41.148 1.00 28.34 C ATOM 1204 CG TRP B 26 4.915 24.282 40.885 1.00 28.24 C ATOM 1205 CD1 TRP B 26 6.052 24.294 41.651 1.00 27.30 C ATOM 1206 CD2 TRP B 26 5.154 25.169 39.792 1.00 24.83 C ATOM 1207 NE1 TRP B 26 6.992 25.137 41.090 1.00 31.62 N ATOM 1208 CE2 TRP B 26 6.473 25.691 39.948 1.00 32.76 C ATOM 1209 CE3 TRP B 26 4.393 25.577 38.692 1.00 30.08 C ATOM 1210 CZ2 TRP B 26 7.048 26.607 39.035 1.00 29.87 C ATOM 1211 CZ3 TRP B 26 4.970 26.490 37.780 1.00 33.90 C ATOM 1212 CH2 TRP B 26 6.288 26.989 37.965 1.00 28.52 C ATOM 0 H TRP B 26 2.835 24.279 43.312 1.00 29.25 H new ATOM 0 HA TRP B 26 2.483 25.160 40.915 1.00 30.38 H new ATOM 0 HB2 TRP B 26 3.850 22.927 41.929 1.00 28.34 H new ATOM 0 HB3 TRP B 26 3.548 22.884 40.399 1.00 28.34 H new ATOM 0 HD1 TRP B 26 6.173 23.806 42.434 1.00 27.30 H new ATOM 0 HE1 TRP B 26 7.777 25.290 41.406 1.00 31.62 H new ATOM 0 HE3 TRP B 26 3.530 25.256 38.564 1.00 30.08 H new ATOM 0 HZ2 TRP B 26 7.909 26.936 39.158 1.00 29.87 H new ATOM 0 HZ3 TRP B 26 4.477 26.770 37.043 1.00 33.90 H new ATOM 0 HH2 TRP B 26 6.640 27.587 37.346 1.00 28.52 H new ATOM 1213 N VAL B 27 0.660 22.655 41.595 1.00 27.91 N ATOM 1214 CA VAL B 27 -0.476 21.862 41.169 1.00 24.14 C ATOM 1215 C VAL B 27 -1.710 22.771 40.971 1.00 26.89 C ATOM 1216 O VAL B 27 -2.513 22.552 40.068 1.00 30.74 O ATOM 1217 CB VAL B 27 -0.706 20.720 42.187 1.00 26.30 C ATOM 1218 CG1 VAL B 27 -2.098 20.086 42.061 1.00 28.19 C ATOM 1219 CG2 VAL B 27 0.308 19.680 41.943 1.00 25.11 C ATOM 0 H VAL B 27 0.908 22.508 42.405 1.00 27.91 H new ATOM 0 HA VAL B 27 -0.305 21.447 40.309 1.00 24.14 H new ATOM 0 HB VAL B 27 -0.637 21.095 43.079 1.00 26.30 H new ATOM 0 HG11 VAL B 27 -2.192 19.379 42.718 1.00 28.19 H new ATOM 0 HG12 VAL B 27 -2.777 20.762 42.215 1.00 28.19 H new ATOM 0 HG13 VAL B 27 -2.206 19.716 41.171 1.00 28.19 H new ATOM 0 HG21 VAL B 27 0.183 18.952 42.572 1.00 25.11 H new ATOM 0 HG22 VAL B 27 0.216 19.344 41.038 1.00 25.11 H new ATOM 0 HG23 VAL B 27 1.194 20.058 42.059 1.00 25.11 H new ATOM 1220 N CYS B 28 -1.867 23.787 41.813 1.00 26.18 N ATOM 1221 CA CYS B 28 -2.962 24.729 41.669 1.00 23.38 C ATOM 1222 C CYS B 28 -2.652 25.616 40.456 1.00 28.61 C ATOM 1223 O CYS B 28 -3.461 25.743 39.537 1.00 30.25 O ATOM 1224 CB CYS B 28 -3.045 25.610 42.913 1.00 30.43 C ATOM 1225 SG CYS B 28 -4.226 27.013 42.878 1.00 33.81 S ATOM 0 H CYS B 28 -1.345 23.946 42.478 1.00 26.18 H new ATOM 0 HA CYS B 28 -3.802 24.258 41.554 1.00 23.38 H new ATOM 0 HB2 CYS B 28 -3.275 25.044 43.666 1.00 30.43 H new ATOM 0 HB3 CYS B 28 -2.160 25.968 43.086 1.00 30.43 H new ATOM 1226 N THR B 29 -1.435 26.155 40.416 1.00 27.68 N ATOM 1227 CA THR B 29 -1.002 27.045 39.356 1.00 22.18 C ATOM 1228 C THR B 29 -1.242 26.502 37.965 1.00 22.33 C ATOM 1229 O THR B 29 -1.847 27.164 37.148 1.00 24.24 O ATOM 1230 CB THR B 29 0.491 27.413 39.545 1.00 23.30 C ATOM 1231 OG1 THR B 29 0.645 28.183 40.742 1.00 29.56 O ATOM 1232 CG2 THR B 29 1.013 28.219 38.384 1.00 23.40 C ATOM 0 H THR B 29 -0.834 26.009 41.014 1.00 27.68 H new ATOM 0 HA THR B 29 -1.551 27.842 39.428 1.00 22.18 H new ATOM 0 HB THR B 29 0.995 26.586 39.601 1.00 23.30 H new ATOM 0 HG1 THR B 29 0.642 27.670 41.407 1.00 29.56 H new ATOM 0 HG21 THR B 29 1.947 28.433 38.532 1.00 23.40 H new ATOM 0 HG22 THR B 29 0.925 27.704 37.567 1.00 23.40 H new ATOM 0 HG23 THR B 29 0.503 29.040 38.304 1.00 23.40 H new ATOM 1233 N THR B 30 -0.797 25.278 37.705 1.00 24.39 N ATOM 1234 CA THR B 30 -0.942 24.680 36.383 1.00 22.72 C ATOM 1235 C THR B 30 -2.388 24.337 36.022 1.00 24.03 C ATOM 1236 O THR B 30 -2.706 24.264 34.839 1.00 29.74 O ATOM 1237 CB THR B 30 -0.013 23.427 36.191 1.00 21.43 C ATOM 1238 OG1 THR B 30 -0.206 22.503 37.264 1.00 25.99 O ATOM 1239 CG2 THR B 30 1.465 23.822 36.163 1.00 13.18 C ATOM 0 H THR B 30 -0.406 24.775 38.283 1.00 24.39 H new ATOM 0 HA THR B 30 -0.654 25.370 35.764 1.00 22.72 H new ATOM 0 HB THR B 30 -0.251 23.021 35.343 1.00 21.43 H new ATOM 0 HG1 THR B 30 0.169 22.795 37.957 1.00 25.99 H new ATOM 0 HG21 THR B 30 2.010 23.029 36.044 1.00 13.18 H new ATOM 0 HG22 THR B 30 1.622 24.435 35.428 1.00 13.18 H new ATOM 0 HG23 THR B 30 1.701 24.253 36.999 1.00 13.18 H new ATOM 1240 N PHE B 31 -3.261 24.078 37.005 1.00 23.36 N ATOM 1241 CA PHE B 31 -4.668 23.788 36.680 1.00 19.73 C ATOM 1242 C PHE B 31 -5.279 25.027 36.066 1.00 20.89 C ATOM 1243 O PHE B 31 -5.862 24.976 35.001 1.00 30.27 O ATOM 1244 CB PHE B 31 -5.520 23.429 37.891 1.00 13.46 C ATOM 1245 CG PHE B 31 -6.979 23.318 37.554 1.00 14.25 C ATOM 1246 CD1 PHE B 31 -7.421 22.363 36.670 1.00 16.80 C ATOM 1247 CD2 PHE B 31 -7.884 24.229 38.021 1.00 10.91 C ATOM 1248 CE1 PHE B 31 -8.741 22.327 36.242 1.00 17.22 C ATOM 1249 CE2 PHE B 31 -9.205 24.199 37.599 1.00 10.95 C ATOM 1250 CZ PHE B 31 -9.628 23.247 36.706 1.00 11.50 C ATOM 0 H PHE B 31 -3.068 24.065 37.843 1.00 23.36 H new ATOM 0 HA PHE B 31 -4.660 23.023 36.083 1.00 19.73 H new ATOM 0 HB2 PHE B 31 -5.212 22.587 38.262 1.00 13.46 H new ATOM 0 HB3 PHE B 31 -5.400 24.103 38.578 1.00 13.46 H new ATOM 0 HD1 PHE B 31 -6.822 21.727 36.351 1.00 16.80 H new ATOM 0 HD2 PHE B 31 -7.611 24.877 38.629 1.00 10.91 H new ATOM 0 HE1 PHE B 31 -9.018 21.675 35.639 1.00 17.22 H new ATOM 0 HE2 PHE B 31 -9.808 24.828 37.923 1.00 10.95 H new ATOM 0 HZ PHE B 31 -10.513 23.231 36.421 1.00 11.50 H new ATOM 1251 N HIS B 32 -5.127 26.150 36.746 1.00 26.13 N ATOM 1252 CA HIS B 32 -5.639 27.418 36.273 1.00 24.77 C ATOM 1253 C HIS B 32 -4.956 27.929 35.007 1.00 28.63 C ATOM 1254 O HIS B 32 -5.543 28.725 34.279 1.00 34.35 O ATOM 1255 CB HIS B 32 -5.532 28.441 37.390 1.00 21.41 C ATOM 1256 CG HIS B 32 -6.439 28.151 38.532 1.00 17.83 C ATOM 1257 ND1 HIS B 32 -7.812 28.211 38.422 1.00 21.18 N ATOM 1258 CD2 HIS B 32 -6.179 27.783 39.806 1.00 16.31 C ATOM 1259 CE1 HIS B 32 -8.356 27.896 39.581 1.00 14.67 C ATOM 1260 NE2 HIS B 32 -7.385 27.632 40.437 1.00 19.36 N ATOM 0 H HIS B 32 -4.720 26.197 37.502 1.00 26.13 H new ATOM 0 HA HIS B 32 -6.566 27.277 36.025 1.00 24.77 H new ATOM 0 HB2 HIS B 32 -4.617 28.469 37.710 1.00 21.41 H new ATOM 0 HB3 HIS B 32 -5.736 29.321 37.037 1.00 21.41 H new ATOM 0 HD2 HIS B 32 -5.339 27.656 40.184 1.00 16.31 H new ATOM 0 HE1 HIS B 32 -9.267 27.865 39.764 1.00 14.67 H new ATOM 0 HE2 HIS B 32 -7.493 27.402 41.259 1.00 19.36 H new ATOM 1261 N THR B 33 -3.735 27.450 34.746 1.00 30.00 N ATOM 1262 CA THR B 33 -2.949 27.803 33.567 1.00 24.91 C ATOM 1263 C THR B 33 -3.335 27.033 32.298 1.00 28.13 C ATOM 1264 O THR B 33 -3.654 27.638 31.278 1.00 32.18 O ATOM 1265 CB THR B 33 -1.460 27.560 33.829 1.00 26.30 C ATOM 1266 OG1 THR B 33 -0.985 28.522 34.769 1.00 28.68 O ATOM 1267 CG2 THR B 33 -0.656 27.694 32.564 1.00 23.76 C ATOM 0 H THR B 33 -3.334 26.896 35.267 1.00 30.00 H new ATOM 0 HA THR B 33 -3.139 28.741 33.410 1.00 24.91 H new ATOM 0 HB THR B 33 -1.357 26.659 34.174 1.00 26.30 H new ATOM 0 HG1 THR B 33 -1.166 28.266 35.548 1.00 28.68 H new ATOM 0 HG21 THR B 33 0.281 27.536 32.758 1.00 23.76 H new ATOM 0 HG22 THR B 33 -0.965 27.045 31.913 1.00 23.76 H new ATOM 0 HG23 THR B 33 -0.765 28.588 32.204 1.00 23.76 H new ATOM 1268 N SER B 34 -3.309 25.703 32.374 1.00 32.00 N ATOM 1269 CA SER B 34 -3.600 24.847 31.228 1.00 28.25 C ATOM 1270 C SER B 34 -4.688 23.835 31.453 1.00 29.14 C ATOM 1271 O SER B 34 -5.193 23.255 30.503 1.00 32.37 O ATOM 1272 CB SER B 34 -2.338 24.068 30.822 1.00 25.94 C ATOM 1273 OG SER B 34 -1.875 23.260 31.892 1.00 22.70 O ATOM 0 H SER B 34 -3.121 25.272 33.094 1.00 32.00 H new ATOM 0 HA SER B 34 -3.904 25.457 30.538 1.00 28.25 H new ATOM 0 HB2 SER B 34 -2.531 23.511 30.052 1.00 25.94 H new ATOM 0 HB3 SER B 34 -1.642 24.689 30.556 1.00 25.94 H new ATOM 0 HG SER B 34 -1.069 23.438 32.050 1.00 22.70 H new ATOM 1274 N GLY B 35 -5.052 23.595 32.699 1.00 28.89 N ATOM 1275 CA GLY B 35 -6.049 22.569 32.949 1.00 28.83 C ATOM 1276 C GLY B 35 -5.375 21.187 32.962 1.00 29.37 C ATOM 1277 O GLY B 35 -6.060 20.166 32.910 1.00 28.28 O ATOM 0 H GLY B 35 -4.747 23.999 33.395 1.00 28.89 H new ATOM 0 HA2 GLY B 35 -6.489 22.733 33.798 1.00 28.83 H new ATOM 0 HA3 GLY B 35 -6.735 22.598 32.264 1.00 28.83 H new ATOM 1278 N TYR B 36 -4.037 21.170 33.041 1.00 24.92 N ATOM 1279 CA TYR B 36 -3.219 19.957 33.067 1.00 25.44 C ATOM 1280 C TYR B 36 -3.076 19.326 31.696 1.00 28.09 C ATOM 1281 O TYR B 36 -2.581 18.211 31.575 1.00 34.98 O ATOM 1282 CB TYR B 36 -3.782 18.901 34.021 1.00 25.17 C ATOM 1283 CG TYR B 36 -3.793 19.257 35.500 1.00 25.80 C ATOM 1284 CD1 TYR B 36 -2.862 20.138 36.052 1.00 24.20 C ATOM 1285 CD2 TYR B 36 -4.774 18.737 36.338 1.00 22.92 C ATOM 1286 CE1 TYR B 36 -2.923 20.502 37.403 1.00 23.22 C ATOM 1287 CE2 TYR B 36 -4.844 19.092 37.664 1.00 26.14 C ATOM 1288 CZ TYR B 36 -3.924 19.978 38.196 1.00 19.64 C ATOM 1289 OH TYR B 36 -4.069 20.376 39.512 1.00 19.34 O ATOM 0 H TYR B 36 -3.569 21.891 33.082 1.00 24.92 H new ATOM 0 HA TYR B 36 -2.348 20.247 33.380 1.00 25.44 H new ATOM 0 HB2 TYR B 36 -4.692 18.702 33.750 1.00 25.17 H new ATOM 0 HB3 TYR B 36 -3.268 18.086 33.909 1.00 25.17 H new ATOM 0 HD1 TYR B 36 -2.190 20.489 35.514 1.00 24.20 H new ATOM 0 HD2 TYR B 36 -5.395 18.137 35.994 1.00 22.92 H new ATOM 0 HE1 TYR B 36 -2.297 21.089 37.761 1.00 23.22 H new ATOM 0 HE2 TYR B 36 -5.511 18.736 38.205 1.00 26.14 H new ATOM 0 HH TYR B 36 -3.582 21.045 39.658 1.00 19.34 H new ATOM 1290 N ASP B 37 -3.525 20.020 30.658 1.00 29.82 N ATOM 1291 CA ASP B 37 -3.439 19.506 29.284 1.00 26.93 C ATOM 1292 C ASP B 37 -2.075 19.762 28.655 1.00 28.74 C ATOM 1293 O ASP B 37 -1.781 20.896 28.261 1.00 33.24 O ATOM 1294 CB ASP B 37 -4.519 20.161 28.439 1.00 23.15 C ATOM 1295 CG ASP B 37 -4.464 19.744 27.010 1.00 32.56 C ATOM 1296 OD1 ASP B 37 -3.570 18.950 26.618 1.00 32.93 O ATOM 1297 OD2 ASP B 37 -5.343 20.223 26.261 1.00 35.49 O ATOM 0 H ASP B 37 -3.887 20.798 30.723 1.00 29.82 H new ATOM 0 HA ASP B 37 -3.567 18.545 29.318 1.00 26.93 H new ATOM 0 HB2 ASP B 37 -5.390 19.938 28.804 1.00 23.15 H new ATOM 0 HB3 ASP B 37 -4.427 21.125 28.494 1.00 23.15 H new ATOM 1298 N THR B 38 -1.282 18.699 28.494 1.00 31.32 N ATOM 1299 CA THR B 38 0.076 18.785 27.930 1.00 32.15 C ATOM 1300 C THR B 38 0.158 19.214 26.449 1.00 32.86 C ATOM 1301 O THR B 38 1.240 19.535 25.948 1.00 33.31 O ATOM 1302 CB THR B 38 0.863 17.458 28.123 1.00 30.77 C ATOM 1303 OG1 THR B 38 0.147 16.386 27.518 1.00 30.95 O ATOM 1304 CG2 THR B 38 1.025 17.136 29.594 1.00 25.99 C ATOM 0 H THR B 38 -1.516 17.900 28.710 1.00 31.32 H new ATOM 0 HA THR B 38 0.486 19.501 28.441 1.00 32.15 H new ATOM 0 HB THR B 38 1.736 17.566 27.714 1.00 30.77 H new ATOM 0 HG1 THR B 38 -0.622 16.339 27.852 1.00 30.95 H new ATOM 0 HG21 THR B 38 1.518 16.306 29.691 1.00 25.99 H new ATOM 0 HG22 THR B 38 1.511 17.853 30.031 1.00 25.99 H new ATOM 0 HG23 THR B 38 0.151 17.042 30.003 1.00 25.99 H new ATOM 1305 N GLN B 39 -0.999 19.287 25.790 1.00 36.62 N ATOM 1306 CA GLN B 39 -0.966 19.754 24.372 1.00 37.77 C ATOM 1307 C GLN B 39 -1.691 21.083 24.174 1.00 38.64 C ATOM 1308 O GLN B 39 -2.036 21.447 23.030 1.00 37.04 O ATOM 1309 CB GLN B 39 -1.647 18.664 23.513 1.00 37.05 C ATOM 1310 CG GLN B 39 -0.936 17.344 23.566 1.00 46.86 C ATOM 1311 CD GLN B 39 -1.208 16.548 22.301 1.00 53.20 C ATOM 1312 OE1 GLN B 39 -2.185 15.851 22.179 1.00 58.90 O ATOM 1313 NE2 GLN B 39 -0.278 16.720 21.347 1.00 53.93 N ATOM 0 H GLN B 39 -1.773 19.088 26.107 1.00 36.62 H new ATOM 0 HA GLN B 39 -0.043 19.899 24.112 1.00 37.77 H new ATOM 0 HB2 GLN B 39 -2.561 18.545 23.816 1.00 37.05 H new ATOM 0 HB3 GLN B 39 -1.690 18.965 22.592 1.00 37.05 H new ATOM 0 HG2 GLN B 39 0.018 17.487 23.667 1.00 46.86 H new ATOM 0 HG3 GLN B 39 -1.231 16.842 24.342 1.00 46.86 H new ATOM 0 HE21 GLN B 39 0.398 17.231 21.493 1.00 53.93 H new ATOM 0 HE22 GLN B 39 -0.359 16.319 20.590 1.00 53.93 H new ATOM 1314 N ALA B 40 -1.898 21.793 25.270 1.00 40.38 N ATOM 1315 CA ALA B 40 -2.466 23.120 25.210 1.00 38.22 C ATOM 1316 C ALA B 40 -1.687 24.109 24.342 1.00 36.56 C ATOM 1317 O ALA B 40 -0.477 24.251 24.468 1.00 35.70 O ATOM 1318 CB ALA B 40 -2.673 23.665 26.644 1.00 35.69 C ATOM 0 H ALA B 40 -1.714 21.519 26.064 1.00 40.38 H new ATOM 0 HA ALA B 40 -3.323 23.031 24.764 1.00 38.22 H new ATOM 0 HB1 ALA B 40 -3.054 24.556 26.600 1.00 35.69 H new ATOM 0 HB2 ALA B 40 -3.275 23.080 27.129 1.00 35.69 H new ATOM 0 HB3 ALA B 40 -1.819 23.702 27.103 1.00 35.69 H new ATOM 1319 N ILE B 41 -2.415 24.754 23.437 1.00 38.53 N ATOM 1320 CA ILE B 41 -1.890 25.789 22.554 1.00 40.91 C ATOM 1321 C ILE B 41 -2.804 27.012 22.686 1.00 42.98 C ATOM 1322 O ILE B 41 -4.024 26.888 22.552 1.00 44.81 O ATOM 1323 CB ILE B 41 -1.943 25.385 21.101 1.00 38.96 C ATOM 1324 CG1 ILE B 41 -0.902 24.309 20.829 1.00 39.94 C ATOM 1325 CG2 ILE B 41 -1.773 26.627 20.217 1.00 35.04 C ATOM 1326 CD1 ILE B 41 0.523 24.812 20.884 1.00 36.75 C ATOM 0 H ILE B 41 -3.252 24.597 23.316 1.00 38.53 H new ATOM 0 HA ILE B 41 -0.968 25.956 22.806 1.00 40.91 H new ATOM 0 HB ILE B 41 -2.807 25.000 20.885 1.00 38.96 H new ATOM 0 HG12 ILE B 41 -1.010 23.595 21.477 1.00 39.94 H new ATOM 0 HG13 ILE B 41 -1.067 23.925 19.954 1.00 39.94 H new ATOM 0 HG21 ILE B 41 -1.807 26.367 19.283 1.00 35.04 H new ATOM 0 HG22 ILE B 41 -2.487 27.257 20.403 1.00 35.04 H new ATOM 0 HG23 ILE B 41 -0.917 27.044 20.405 1.00 35.04 H new ATOM 0 HD11 ILE B 41 1.132 24.079 20.703 1.00 36.75 H new ATOM 0 HD12 ILE B 41 0.647 25.507 20.219 1.00 36.75 H new ATOM 0 HD13 ILE B 41 0.705 25.173 21.766 1.00 36.75 H new ATOM 1327 N VAL B 42 -2.231 28.179 22.971 1.00 42.05 N ATOM 1328 CA VAL B 42 -3.028 29.390 23.100 1.00 37.99 C ATOM 1329 C VAL B 42 -2.298 30.518 22.392 1.00 38.06 C ATOM 1330 O VAL B 42 -1.167 30.824 22.749 1.00 33.61 O ATOM 1331 CB VAL B 42 -3.238 29.772 24.561 1.00 32.29 C ATOM 1332 CG1 VAL B 42 -4.100 30.990 24.655 1.00 33.46 C ATOM 1333 CG2 VAL B 42 -3.884 28.659 25.283 1.00 32.75 C ATOM 0 H VAL B 42 -1.387 28.288 23.092 1.00 42.05 H new ATOM 0 HA VAL B 42 -3.900 29.232 22.705 1.00 37.99 H new ATOM 0 HB VAL B 42 -2.374 29.959 24.961 1.00 32.29 H new ATOM 0 HG11 VAL B 42 -4.228 31.225 25.587 1.00 33.46 H new ATOM 0 HG12 VAL B 42 -3.671 31.727 24.192 1.00 33.46 H new ATOM 0 HG13 VAL B 42 -4.961 30.810 24.247 1.00 33.46 H new ATOM 0 HG21 VAL B 42 -4.015 28.908 26.211 1.00 32.75 H new ATOM 0 HG22 VAL B 42 -4.743 28.465 24.877 1.00 32.75 H new ATOM 0 HG23 VAL B 42 -3.319 27.872 25.236 1.00 32.75 H new ATOM 1334 N GLN B 43 -2.878 31.016 21.303 1.00 41.88 N ATOM 1335 CA GLN B 43 -2.287 32.127 20.543 1.00 55.81 C ATOM 1336 C GLN B 43 -3.048 33.350 21.041 1.00 60.13 C ATOM 1337 O GLN B 43 -4.237 33.471 20.778 1.00 67.27 O ATOM 1338 CB GLN B 43 -2.480 31.950 19.021 1.00 56.30 C ATOM 1339 CG GLN B 43 -2.239 30.526 18.522 1.00 63.72 C ATOM 1340 CD GLN B 43 -1.612 30.464 17.145 1.00 68.52 C ATOM 1341 OE1 GLN B 43 -2.242 30.799 16.144 1.00 74.35 O ATOM 1342 NE2 GLN B 43 -0.377 29.989 17.082 1.00 66.40 N ATOM 0 H GLN B 43 -3.621 30.725 20.982 1.00 41.88 H new ATOM 0 HA GLN B 43 -1.328 32.190 20.675 1.00 55.81 H new ATOM 0 HB2 GLN B 43 -3.383 32.216 18.786 1.00 56.30 H new ATOM 0 HB3 GLN B 43 -1.877 32.551 18.556 1.00 56.30 H new ATOM 0 HG2 GLN B 43 -1.664 30.064 19.152 1.00 63.72 H new ATOM 0 HG3 GLN B 43 -3.084 30.050 18.506 1.00 63.72 H new ATOM 0 HE21 GLN B 43 0.035 29.764 17.803 1.00 66.40 H new ATOM 0 HE22 GLN B 43 0.013 29.905 16.320 1.00 66.40 H new ATOM 1343 N ASN B 44 -2.402 34.221 21.811 1.00 63.94 N ATOM 1344 CA ASN B 44 -3.121 35.366 22.350 1.00 67.57 C ATOM 1345 C ASN B 44 -2.898 36.708 21.651 1.00 71.37 C ATOM 1346 O ASN B 44 -3.858 37.392 21.333 1.00 76.17 O ATOM 1347 CB ASN B 44 -2.898 35.484 23.858 1.00 67.13 C ATOM 1348 CG ASN B 44 -1.615 36.204 24.201 1.00 69.92 C ATOM 1349 OD1 ASN B 44 -0.574 35.980 23.578 1.00 70.64 O ATOM 1350 ND2 ASN B 44 -1.689 37.105 25.171 1.00 64.98 N ATOM 0 H ASN B 44 -1.571 34.170 22.028 1.00 63.94 H new ATOM 0 HA ASN B 44 -4.052 35.167 22.162 1.00 67.57 H new ATOM 0 HB2 ASN B 44 -3.646 35.956 24.256 1.00 67.13 H new ATOM 0 HB3 ASN B 44 -2.882 34.597 24.250 1.00 67.13 H new ATOM 0 HD21 ASN B 44 -0.993 37.561 25.388 1.00 64.98 H new ATOM 0 HD22 ASN B 44 -2.433 37.233 25.583 1.00 64.98 H new ATOM 1351 N ASN B 45 -1.655 37.112 21.433 1.00 72.10 N ATOM 1352 CA ASN B 45 -1.414 38.387 20.769 1.00 73.78 C ATOM 1353 C ASN B 45 -0.526 38.120 19.576 1.00 74.64 C ATOM 1354 O ASN B 45 -1.001 37.780 18.490 1.00 72.53 O ATOM 1355 CB ASN B 45 -0.750 39.362 21.748 1.00 77.80 C ATOM 1356 CG ASN B 45 -0.305 40.658 21.086 1.00 83.34 C ATOM 1357 OD1 ASN B 45 0.689 41.259 21.503 1.00 84.62 O ATOM 1358 ND2 ASN B 45 -1.034 41.100 20.060 1.00 85.31 N ATOM 0 H ASN B 45 -0.949 36.674 21.656 1.00 72.10 H new ATOM 0 HA ASN B 45 -2.245 38.790 20.473 1.00 73.78 H new ATOM 0 HB2 ASN B 45 -1.371 39.567 22.464 1.00 77.80 H new ATOM 0 HB3 ASN B 45 0.019 38.932 22.154 1.00 77.80 H new ATOM 0 HD21 ASN B 45 -0.817 41.831 19.662 1.00 85.31 H new ATOM 0 HD22 ASN B 45 -1.721 40.654 19.797 1.00 85.31 H new ATOM 1359 N ASP B 46 0.774 38.208 19.823 1.00 76.72 N ATOM 1360 CA ASP B 46 1.790 37.946 18.822 1.00 75.56 C ATOM 1361 C ASP B 46 2.661 36.798 19.366 1.00 71.61 C ATOM 1362 O ASP B 46 3.801 36.593 18.944 1.00 75.82 O ATOM 1363 CB ASP B 46 2.617 39.222 18.569 1.00 80.67 C ATOM 1364 CG ASP B 46 3.395 39.678 19.795 1.00 85.27 C ATOM 1365 OD1 ASP B 46 2.780 39.828 20.880 1.00 83.85 O ATOM 1366 OD2 ASP B 46 4.620 39.910 19.659 1.00 88.21 O ATOM 0 H ASP B 46 1.094 38.426 20.591 1.00 76.72 H new ATOM 0 HA ASP B 46 1.401 37.691 17.971 1.00 75.56 H new ATOM 0 HB2 ASP B 46 3.237 39.061 17.840 1.00 80.67 H new ATOM 0 HB3 ASP B 46 2.024 39.935 18.285 1.00 80.67 H new ATOM 1367 N SER B 47 2.119 36.074 20.337 1.00 62.37 N ATOM 1368 CA SER B 47 2.836 34.959 20.922 1.00 51.60 C ATOM 1369 C SER B 47 1.887 33.793 21.067 1.00 44.96 C ATOM 1370 O SER B 47 0.669 33.963 21.136 1.00 45.31 O ATOM 1371 CB SER B 47 3.384 35.329 22.294 1.00 50.98 C ATOM 1372 OG SER B 47 2.319 35.543 23.200 1.00 53.56 O ATOM 0 H SER B 47 1.338 36.214 20.669 1.00 62.37 H new ATOM 0 HA SER B 47 3.579 34.725 20.344 1.00 51.60 H new ATOM 0 HB2 SER B 47 3.960 34.621 22.622 1.00 50.98 H new ATOM 0 HB3 SER B 47 3.928 36.129 22.228 1.00 50.98 H new ATOM 0 HG SER B 47 2.629 35.745 23.954 1.00 53.56 H new ATOM 1373 N THR B 48 2.457 32.607 21.063 1.00 37.45 N ATOM 1374 CA THR B 48 1.685 31.405 21.223 1.00 35.77 C ATOM 1375 C THR B 48 2.223 30.823 22.499 1.00 32.23 C ATOM 1376 O THR B 48 3.413 30.943 22.764 1.00 33.72 O ATOM 1377 CB THR B 48 1.905 30.449 20.040 1.00 34.20 C ATOM 1378 OG1 THR B 48 1.353 31.036 18.849 1.00 37.63 O ATOM 1379 CG2 THR B 48 1.213 29.119 20.279 1.00 37.48 C ATOM 0 H THR B 48 3.302 32.479 20.967 1.00 37.45 H new ATOM 0 HA THR B 48 0.729 31.565 21.252 1.00 35.77 H new ATOM 0 HB THR B 48 2.859 30.299 19.944 1.00 34.20 H new ATOM 0 HG1 THR B 48 1.806 30.797 18.183 1.00 37.63 H new ATOM 0 HG21 THR B 48 1.366 28.534 19.521 1.00 37.48 H new ATOM 0 HG22 THR B 48 1.570 28.708 21.082 1.00 37.48 H new ATOM 0 HG23 THR B 48 0.260 29.265 20.388 1.00 37.48 H new ATOM 1380 N GLU B 49 1.344 30.240 23.306 1.00 33.45 N ATOM 1381 CA GLU B 49 1.713 29.636 24.578 1.00 30.24 C ATOM 1382 C GLU B 49 1.605 28.138 24.400 1.00 28.71 C ATOM 1383 O GLU B 49 0.588 27.661 23.912 1.00 25.34 O ATOM 1384 CB GLU B 49 0.757 30.101 25.668 1.00 39.22 C ATOM 1385 CG GLU B 49 1.365 31.035 26.692 1.00 42.63 C ATOM 1386 CD GLU B 49 1.188 32.494 26.362 1.00 42.29 C ATOM 1387 OE1 GLU B 49 1.814 32.964 25.396 1.00 54.44 O ATOM 1388 OE2 GLU B 49 0.439 33.171 27.085 1.00 41.82 O ATOM 0 H GLU B 49 0.505 30.184 23.127 1.00 33.45 H new ATOM 0 HA GLU B 49 2.612 29.891 24.838 1.00 30.24 H new ATOM 0 HB2 GLU B 49 0.003 30.546 25.251 1.00 39.22 H new ATOM 0 HB3 GLU B 49 0.407 29.322 26.128 1.00 39.22 H new ATOM 0 HG2 GLU B 49 0.966 30.857 27.558 1.00 42.63 H new ATOM 0 HG3 GLU B 49 2.312 30.842 26.771 1.00 42.63 H new ATOM 1389 N TYR B 50 2.626 27.409 24.860 1.00 31.10 N ATOM 1390 CA TYR B 50 2.738 25.951 24.697 1.00 28.53 C ATOM 1391 C TYR B 50 2.710 24.988 25.868 1.00 29.43 C ATOM 1392 O TYR B 50 3.518 25.120 26.791 1.00 33.46 O ATOM 1393 CB TYR B 50 4.045 25.655 23.977 1.00 29.93 C ATOM 1394 CG TYR B 50 4.034 26.056 22.533 1.00 34.18 C ATOM 1395 CD1 TYR B 50 4.368 27.349 22.127 1.00 41.43 C ATOM 1396 CD2 TYR B 50 3.717 25.131 21.559 1.00 38.67 C ATOM 1397 CE1 TYR B 50 4.384 27.687 20.773 1.00 37.70 C ATOM 1398 CE2 TYR B 50 3.735 25.459 20.232 1.00 37.57 C ATOM 1399 CZ TYR B 50 4.070 26.725 19.847 1.00 38.10 C ATOM 1400 OH TYR B 50 4.118 26.979 18.501 1.00 38.72 O ATOM 0 H TYR B 50 3.289 27.755 25.285 1.00 31.10 H new ATOM 0 HA TYR B 50 1.897 25.774 24.247 1.00 28.53 H new ATOM 0 HB2 TYR B 50 4.767 26.119 24.429 1.00 29.93 H new ATOM 0 HB3 TYR B 50 4.234 24.706 24.041 1.00 29.93 H new ATOM 0 HD1 TYR B 50 4.582 27.991 22.765 1.00 41.43 H new ATOM 0 HD2 TYR B 50 3.486 24.266 21.811 1.00 38.67 H new ATOM 0 HE1 TYR B 50 4.604 28.549 20.503 1.00 37.70 H new ATOM 0 HE2 TYR B 50 3.519 24.820 19.592 1.00 37.57 H new ATOM 0 HH TYR B 50 4.752 27.505 18.337 1.00 38.72 H new ATOM 1401 N GLY B 51 1.868 23.964 25.769 1.00 26.69 N ATOM 1402 CA GLY B 51 1.813 22.924 26.789 1.00 28.30 C ATOM 1403 C GLY B 51 1.199 23.111 28.167 1.00 31.19 C ATOM 1404 O GLY B 51 0.277 23.892 28.377 1.00 40.24 O ATOM 0 H GLY B 51 1.319 23.853 25.117 1.00 26.69 H new ATOM 0 HA2 GLY B 51 1.348 22.174 26.386 1.00 28.30 H new ATOM 0 HA3 GLY B 51 2.729 22.643 26.938 1.00 28.30 H new ATOM 1405 N LEU B 52 1.725 22.371 29.125 1.00 30.31 N ATOM 1406 CA LEU B 52 1.235 22.401 30.494 1.00 29.65 C ATOM 1407 C LEU B 52 1.519 23.726 31.209 1.00 29.00 C ATOM 1408 O LEU B 52 0.697 24.224 31.974 1.00 29.74 O ATOM 1409 CB LEU B 52 1.861 21.235 31.290 1.00 27.70 C ATOM 1410 CG LEU B 52 1.435 20.930 32.732 1.00 19.99 C ATOM 1411 CD1 LEU B 52 0.104 20.274 32.768 1.00 17.71 C ATOM 1412 CD2 LEU B 52 2.436 19.982 33.315 1.00 28.20 C ATOM 0 H LEU B 52 2.383 21.831 29.001 1.00 30.31 H new ATOM 0 HA LEU B 52 0.270 22.308 30.452 1.00 29.65 H new ATOM 0 HB2 LEU B 52 1.709 20.428 30.774 1.00 27.70 H new ATOM 0 HB3 LEU B 52 2.819 21.386 31.305 1.00 27.70 H new ATOM 0 HG LEU B 52 1.388 21.761 33.231 1.00 19.99 H new ATOM 0 HD11 LEU B 52 -0.142 20.092 33.688 1.00 17.71 H new ATOM 0 HD12 LEU B 52 -0.557 20.860 32.367 1.00 17.71 H new ATOM 0 HD13 LEU B 52 0.140 19.441 32.272 1.00 17.71 H new ATOM 0 HD21 LEU B 52 2.189 19.772 34.229 1.00 28.20 H new ATOM 0 HD22 LEU B 52 2.454 19.166 32.790 1.00 28.20 H new ATOM 0 HD23 LEU B 52 3.315 20.392 33.304 1.00 28.20 H new ATOM 1413 N PHE B 53 2.713 24.254 31.016 1.00 25.01 N ATOM 1414 CA PHE B 53 3.098 25.499 31.669 1.00 24.56 C ATOM 1415 C PHE B 53 2.843 26.717 30.766 1.00 23.80 C ATOM 1416 O PHE B 53 3.096 27.855 31.150 1.00 23.30 O ATOM 1417 CB PHE B 53 4.595 25.462 32.046 1.00 30.93 C ATOM 1418 CG PHE B 53 4.993 24.331 32.975 1.00 28.97 C ATOM 1419 CD1 PHE B 53 5.282 23.069 32.480 1.00 27.74 C ATOM 1420 CD2 PHE B 53 5.111 24.546 34.338 1.00 29.96 C ATOM 1421 CE1 PHE B 53 5.683 22.044 33.345 1.00 27.18 C ATOM 1422 CE2 PHE B 53 5.510 23.528 35.189 1.00 29.26 C ATOM 1423 CZ PHE B 53 5.792 22.281 34.687 1.00 23.73 C ATOM 0 H PHE B 53 3.319 23.910 30.511 1.00 25.01 H new ATOM 0 HA PHE B 53 2.554 25.586 32.467 1.00 24.56 H new ATOM 0 HB2 PHE B 53 5.118 25.394 31.232 1.00 30.93 H new ATOM 0 HB3 PHE B 53 4.830 26.305 32.465 1.00 30.93 H new ATOM 0 HD1 PHE B 53 5.209 22.902 31.568 1.00 27.74 H new ATOM 0 HD2 PHE B 53 4.920 25.386 34.687 1.00 29.96 H new ATOM 0 HE1 PHE B 53 5.876 21.200 33.006 1.00 27.18 H new ATOM 0 HE2 PHE B 53 5.587 23.689 36.102 1.00 29.26 H new ATOM 0 HZ PHE B 53 6.057 21.598 35.260 1.00 23.73 H new ATOM 1424 N GLN B 54 2.362 26.477 29.558 1.00 28.12 N ATOM 1425 CA GLN B 54 2.130 27.560 28.610 1.00 28.40 C ATOM 1426 C GLN B 54 3.352 28.484 28.468 1.00 28.84 C ATOM 1427 O GLN B 54 3.285 29.668 28.756 1.00 32.69 O ATOM 1428 CB GLN B 54 0.890 28.346 29.000 1.00 27.66 C ATOM 1429 CG GLN B 54 -0.387 27.529 28.907 1.00 30.29 C ATOM 1430 CD GLN B 54 -1.011 27.504 27.514 1.00 33.84 C ATOM 1431 OE1 GLN B 54 -1.587 28.488 27.044 1.00 37.23 O ATOM 1432 NE2 GLN B 54 -0.935 26.362 26.867 1.00 37.74 N ATOM 0 H GLN B 54 2.162 25.694 29.264 1.00 28.12 H new ATOM 0 HA GLN B 54 1.983 27.159 27.739 1.00 28.40 H new ATOM 0 HB2 GLN B 54 0.993 28.673 29.907 1.00 27.66 H new ATOM 0 HB3 GLN B 54 0.813 29.124 28.425 1.00 27.66 H new ATOM 0 HG2 GLN B 54 -0.198 26.618 29.182 1.00 30.29 H new ATOM 0 HG3 GLN B 54 -1.035 27.886 29.535 1.00 30.29 H new ATOM 0 HE21 GLN B 54 -0.526 25.693 27.221 1.00 37.74 H new ATOM 0 HE22 GLN B 54 -1.294 26.284 26.089 1.00 37.74 H new ATOM 1433 N ILE B 55 4.480 27.908 28.063 1.00 26.09 N ATOM 1434 CA ILE B 55 5.721 28.643 27.843 1.00 25.39 C ATOM 1435 C ILE B 55 5.488 29.419 26.530 1.00 27.95 C ATOM 1436 O ILE B 55 4.936 28.846 25.590 1.00 30.90 O ATOM 1437 CB ILE B 55 6.895 27.630 27.709 1.00 20.42 C ATOM 1438 CG1 ILE B 55 6.877 26.665 28.894 1.00 25.15 C ATOM 1439 CG2 ILE B 55 8.258 28.320 27.704 1.00 21.54 C ATOM 1440 CD1 ILE B 55 7.895 26.977 29.948 1.00 23.44 C ATOM 0 H ILE B 55 4.546 27.065 27.906 1.00 26.09 H new ATOM 0 HA ILE B 55 5.949 29.245 28.569 1.00 25.39 H new ATOM 0 HB ILE B 55 6.771 27.167 26.866 1.00 20.42 H new ATOM 0 HG12 ILE B 55 5.994 26.677 29.296 1.00 25.15 H new ATOM 0 HG13 ILE B 55 7.028 25.764 28.568 1.00 25.15 H new ATOM 0 HG21 ILE B 55 8.958 27.654 27.619 1.00 21.54 H new ATOM 0 HG22 ILE B 55 8.306 28.936 26.956 1.00 21.54 H new ATOM 0 HG23 ILE B 55 8.376 28.809 28.533 1.00 21.54 H new ATOM 0 HD11 ILE B 55 7.827 26.328 30.666 1.00 23.44 H new ATOM 0 HD12 ILE B 55 8.784 26.939 29.561 1.00 23.44 H new ATOM 0 HD13 ILE B 55 7.734 27.866 30.300 1.00 23.44 H new ATOM 1441 N ASN B 56 5.855 30.710 26.456 1.00 27.99 N ATOM 1442 CA ASN B 56 5.617 31.469 25.217 1.00 22.09 C ATOM 1443 C ASN B 56 6.742 31.466 24.207 1.00 19.73 C ATOM 1444 O ASN B 56 7.909 31.325 24.555 1.00 22.90 O ATOM 1445 CB ASN B 56 5.156 32.900 25.487 1.00 20.43 C ATOM 1446 CG ASN B 56 6.276 33.805 25.937 1.00 27.52 C ATOM 1447 OD1 ASN B 56 7.185 34.105 25.157 1.00 29.88 O ATOM 1448 ND2 ASN B 56 6.218 34.267 27.189 1.00 23.75 N ATOM 0 H ASN B 56 6.231 31.152 27.091 1.00 27.99 H new ATOM 0 HA ASN B 56 4.898 30.970 24.800 1.00 22.09 H new ATOM 0 HB2 ASN B 56 4.757 33.264 24.681 1.00 20.43 H new ATOM 0 HB3 ASN B 56 4.463 32.889 26.166 1.00 20.43 H new ATOM 0 HD21 ASN B 56 6.830 34.796 27.481 1.00 23.75 H new ATOM 0 HD22 ASN B 56 5.569 34.035 27.703 1.00 23.75 H new ATOM 1449 N ASN B 57 6.355 31.640 22.949 1.00 20.90 N ATOM 1450 CA ASN B 57 7.266 31.655 21.795 1.00 31.14 C ATOM 1451 C ASN B 57 7.898 33.011 21.457 1.00 34.30 C ATOM 1452 O ASN B 57 8.530 33.167 20.410 1.00 39.43 O ATOM 1453 CB ASN B 57 6.563 31.111 20.535 1.00 28.69 C ATOM 1454 CG ASN B 57 5.576 32.087 19.945 1.00 28.18 C ATOM 1455 OD1 ASN B 57 5.202 33.067 20.578 1.00 33.18 O ATOM 1456 ND2 ASN B 57 5.123 31.809 18.732 1.00 35.16 N ATOM 0 H ASN B 57 5.531 31.757 22.730 1.00 20.90 H new ATOM 0 HA ASN B 57 7.997 31.081 22.073 1.00 31.14 H new ATOM 0 HB2 ASN B 57 7.231 30.891 19.867 1.00 28.69 H new ATOM 0 HB3 ASN B 57 6.102 30.287 20.758 1.00 28.69 H new ATOM 0 HD21 ASN B 57 4.544 32.325 18.360 1.00 35.16 H new ATOM 0 HD22 ASN B 57 5.407 31.112 18.316 1.00 35.16 H new ATOM 1457 N LYS B 58 7.741 33.988 22.340 1.00 38.23 N ATOM 1458 CA LYS B 58 8.314 35.294 22.110 1.00 32.59 C ATOM 1459 C LYS B 58 9.689 35.391 22.758 1.00 34.11 C ATOM 1460 O LYS B 58 10.653 35.833 22.117 1.00 37.34 O ATOM 1461 CB LYS B 58 7.387 36.386 22.642 1.00 32.13 C ATOM 1462 CG LYS B 58 6.301 36.784 21.684 1.00 40.18 C ATOM 1463 CD LYS B 58 6.884 37.101 20.285 1.00 55.61 C ATOM 1464 CE LYS B 58 7.949 38.224 20.315 1.00 60.75 C ATOM 1465 NZ LYS B 58 8.810 38.349 19.091 1.00 59.66 N ATOM 0 H LYS B 58 7.305 33.910 23.077 1.00 38.23 H new ATOM 0 HA LYS B 58 8.417 35.423 21.154 1.00 32.59 H new ATOM 0 HB2 LYS B 58 6.981 36.079 23.468 1.00 32.13 H new ATOM 0 HB3 LYS B 58 7.916 37.169 22.860 1.00 32.13 H new ATOM 0 HG2 LYS B 58 5.650 36.068 21.612 1.00 40.18 H new ATOM 0 HG3 LYS B 58 5.832 37.561 22.026 1.00 40.18 H new ATOM 0 HD2 LYS B 58 7.280 36.296 19.915 1.00 55.61 H new ATOM 0 HD3 LYS B 58 6.163 37.362 19.691 1.00 55.61 H new ATOM 0 HE2 LYS B 58 7.497 39.070 20.458 1.00 60.75 H new ATOM 0 HE3 LYS B 58 8.526 38.078 21.081 1.00 60.75 H new ATOM 0 HZ1 LYS B 58 9.388 39.017 19.201 1.00 59.66 H new ATOM 0 HZ2 LYS B 58 9.256 37.590 18.963 1.00 59.66 H new ATOM 0 HZ3 LYS B 58 8.297 38.515 18.383 1.00 59.66 H new ATOM 1466 N ILE B 59 9.801 34.901 23.994 1.00 32.75 N ATOM 1467 CA ILE B 59 11.056 34.968 24.751 1.00 28.64 C ATOM 1468 C ILE B 59 11.772 33.616 24.968 1.00 29.61 C ATOM 1469 O ILE B 59 12.996 33.511 24.799 1.00 30.59 O ATOM 1470 CB ILE B 59 10.787 35.608 26.182 1.00 29.15 C ATOM 1471 CG1 ILE B 59 10.105 36.982 26.066 1.00 26.51 C ATOM 1472 CG2 ILE B 59 12.068 35.671 27.021 1.00 22.73 C ATOM 1473 CD1 ILE B 59 10.933 38.046 25.373 1.00 28.41 C ATOM 0 H ILE B 59 9.155 34.522 24.417 1.00 32.75 H new ATOM 0 HA ILE B 59 11.644 35.511 24.202 1.00 28.64 H new ATOM 0 HB ILE B 59 10.171 35.024 26.651 1.00 29.15 H new ATOM 0 HG12 ILE B 59 9.270 36.875 25.584 1.00 26.51 H new ATOM 0 HG13 ILE B 59 9.880 37.294 26.957 1.00 26.51 H new ATOM 0 HG21 ILE B 59 11.870 36.065 27.885 1.00 22.73 H new ATOM 0 HG22 ILE B 59 12.417 34.775 27.147 1.00 22.73 H new ATOM 0 HG23 ILE B 59 12.729 36.213 26.563 1.00 22.73 H new ATOM 0 HD11 ILE B 59 10.433 38.876 25.342 1.00 28.41 H new ATOM 0 HD12 ILE B 59 11.758 38.184 25.863 1.00 28.41 H new ATOM 0 HD13 ILE B 59 11.138 37.759 24.470 1.00 28.41 H new ATOM 1474 N TRP B 60 10.994 32.575 25.261 1.00 31.26 N ATOM 1475 CA TRP B 60 11.544 31.275 25.623 1.00 27.24 C ATOM 1476 C TRP B 60 11.857 30.142 24.634 1.00 27.68 C ATOM 1477 O TRP B 60 12.909 29.515 24.762 1.00 31.77 O ATOM 1478 CB TRP B 60 10.752 30.715 26.812 1.00 25.79 C ATOM 1479 CG TRP B 60 10.430 31.751 27.860 1.00 23.76 C ATOM 1480 CD1 TRP B 60 9.243 32.443 28.000 1.00 22.24 C ATOM 1481 CD2 TRP B 60 11.304 32.259 28.879 1.00 26.21 C ATOM 1482 NE1 TRP B 60 9.348 33.353 29.028 1.00 17.69 N ATOM 1483 CE2 TRP B 60 10.597 33.265 29.578 1.00 23.76 C ATOM 1484 CE3 TRP B 60 12.621 31.975 29.258 1.00 23.25 C ATOM 1485 CZ2 TRP B 60 11.169 33.980 30.619 1.00 30.00 C ATOM 1486 CZ3 TRP B 60 13.177 32.691 30.290 1.00 24.29 C ATOM 1487 CH2 TRP B 60 12.456 33.684 30.959 1.00 28.48 C ATOM 0 H TRP B 60 10.135 32.605 25.255 1.00 31.26 H new ATOM 0 HA TRP B 60 12.460 31.554 25.779 1.00 27.24 H new ATOM 0 HB2 TRP B 60 9.925 30.326 26.487 1.00 25.79 H new ATOM 0 HB3 TRP B 60 11.261 29.998 27.222 1.00 25.79 H new ATOM 0 HD1 TRP B 60 8.485 32.313 27.477 1.00 22.24 H new ATOM 0 HE1 TRP B 60 8.727 33.891 29.283 1.00 17.69 H new ATOM 0 HE3 TRP B 60 13.109 31.316 28.820 1.00 23.25 H new ATOM 0 HZ2 TRP B 60 10.692 34.639 31.070 1.00 30.00 H new ATOM 0 HZ3 TRP B 60 14.052 32.511 30.549 1.00 24.29 H new ATOM 0 HH2 TRP B 60 12.863 34.153 31.651 1.00 28.48 H new ATOM 1488 N CYS B 61 10.987 29.841 23.683 1.00 29.35 N ATOM 1489 CA CYS B 61 11.276 28.767 22.743 1.00 33.97 C ATOM 1490 C CYS B 61 11.044 29.157 21.308 1.00 40.78 C ATOM 1491 O CYS B 61 10.180 29.984 21.016 1.00 43.02 O ATOM 1492 CB CYS B 61 10.412 27.551 23.032 1.00 33.84 C ATOM 1493 SG CYS B 61 8.659 27.958 23.000 1.00 25.49 S ATOM 0 H CYS B 61 10.234 30.239 23.564 1.00 29.35 H new ATOM 0 HA CYS B 61 12.217 28.566 22.863 1.00 33.97 H new ATOM 0 HB2 CYS B 61 10.596 26.860 22.377 1.00 33.84 H new ATOM 0 HB3 CYS B 61 10.644 27.188 23.901 1.00 33.84 H new ATOM 1494 N LYS B 62 11.804 28.534 20.410 1.00 44.78 N ATOM 1495 CA LYS B 62 11.691 28.820 18.983 1.00 49.28 C ATOM 1496 C LYS B 62 10.458 28.193 18.323 1.00 49.31 C ATOM 1497 O LYS B 62 10.028 27.077 18.638 1.00 45.43 O ATOM 1498 CB LYS B 62 12.954 28.378 18.237 1.00 52.34 C ATOM 1499 CG LYS B 62 13.075 28.952 16.832 1.00 54.33 C ATOM 1500 CD LYS B 62 14.210 28.283 16.075 1.00 60.55 C ATOM 1501 CE LYS B 62 13.865 26.848 15.688 1.00 62.51 C ATOM 1502 NZ LYS B 62 12.985 26.798 14.478 1.00 64.34 N ATOM 0 H LYS B 62 12.393 27.940 20.608 1.00 44.78 H new ATOM 0 HA LYS B 62 11.586 29.782 18.918 1.00 49.28 H new ATOM 0 HB2 LYS B 62 13.732 28.642 18.752 1.00 52.34 H new ATOM 0 HB3 LYS B 62 12.965 27.410 18.183 1.00 52.34 H new ATOM 0 HG2 LYS B 62 12.241 28.825 16.353 1.00 54.33 H new ATOM 0 HG3 LYS B 62 13.232 29.908 16.880 1.00 54.33 H new ATOM 0 HD2 LYS B 62 14.411 28.794 15.275 1.00 60.55 H new ATOM 0 HD3 LYS B 62 15.011 28.287 16.623 1.00 60.55 H new ATOM 0 HE2 LYS B 62 14.682 26.354 15.515 1.00 62.51 H new ATOM 0 HE3 LYS B 62 13.420 26.410 16.431 1.00 62.51 H new ATOM 0 HZ1 LYS B 62 12.802 25.950 14.278 1.00 64.34 H new ATOM 0 HZ2 LYS B 62 12.227 27.233 14.644 1.00 64.34 H new ATOM 0 HZ3 LYS B 62 13.402 27.181 13.791 1.00 64.34 H new ATOM 1503 N ASP B 63 9.941 28.914 17.343 1.00 53.61 N ATOM 1504 CA ASP B 63 8.784 28.530 16.584 1.00 52.60 C ATOM 1505 C ASP B 63 9.085 28.442 15.115 1.00 56.69 C ATOM 1506 O ASP B 63 10.227 28.749 14.683 1.00 58.00 O ATOM 1507 CB ASP B 63 7.688 29.578 16.823 1.00 46.78 C ATOM 1508 CG ASP B 63 6.343 28.887 16.973 1.00 34.22 C ATOM 1509 OD1 ASP B 63 6.295 27.843 17.629 1.00 34.32 O ATOM 1510 OD2 ASP B 63 5.363 29.397 16.436 1.00 40.87 O ATOM 0 H ASP B 63 10.272 29.669 17.097 1.00 53.61 H new ATOM 0 HA ASP B 63 8.496 27.650 16.874 1.00 52.60 H new ATOM 0 HB2 ASP B 63 7.888 30.092 17.621 1.00 46.78 H new ATOM 0 HB3 ASP B 63 7.659 30.204 16.082 1.00 46.78 H new ATOM 1511 N ASP B 64 8.089 28.030 14.343 1.00 63.42 N ATOM 1512 CA ASP B 64 8.196 27.955 12.893 1.00 68.02 C ATOM 1513 C ASP B 64 7.697 29.316 12.401 1.00 66.46 C ATOM 1514 O ASP B 64 8.312 29.954 11.556 1.00 65.97 O ATOM 1515 CB ASP B 64 7.316 26.789 12.334 1.00 74.87 C ATOM 1516 CG ASP B 64 5.778 27.086 12.373 1.00 81.40 C ATOM 1517 OD1 ASP B 64 5.114 26.867 13.418 1.00 82.15 O ATOM 1518 OD2 ASP B 64 5.215 27.476 11.326 1.00 84.03 O ATOM 0 H ASP B 64 7.324 27.783 14.649 1.00 63.42 H new ATOM 0 HA ASP B 64 9.101 27.772 12.595 1.00 68.02 H new ATOM 0 HB2 ASP B 64 7.579 26.606 11.418 1.00 74.87 H new ATOM 0 HB3 ASP B 64 7.495 25.985 12.846 1.00 74.87 H new ATOM 1519 N GLN B 65 6.661 29.801 13.074 1.00 66.17 N ATOM 1520 CA GLN B 65 6.013 31.056 12.735 1.00 67.38 C ATOM 1521 C GLN B 65 6.473 32.304 13.479 1.00 66.90 C ATOM 1522 O GLN B 65 5.785 33.322 13.442 1.00 72.51 O ATOM 1523 CB GLN B 65 4.503 30.903 12.878 1.00 68.56 C ATOM 1524 CG GLN B 65 4.103 30.036 14.037 1.00 75.57 C ATOM 1525 CD GLN B 65 2.791 30.456 14.627 1.00 81.88 C ATOM 1526 OE1 GLN B 65 2.083 31.315 14.078 1.00 84.88 O ATOM 1527 NE2 GLN B 65 2.460 29.883 15.777 1.00 82.61 N ATOM 0 H GLN B 65 6.311 29.402 13.751 1.00 66.17 H new ATOM 0 HA GLN B 65 6.286 31.220 11.819 1.00 67.38 H new ATOM 0 HB2 GLN B 65 4.104 31.780 12.985 1.00 68.56 H new ATOM 0 HB3 GLN B 65 4.143 30.526 12.060 1.00 68.56 H new ATOM 0 HG2 GLN B 65 4.044 29.113 13.744 1.00 75.57 H new ATOM 0 HG3 GLN B 65 4.791 30.074 14.720 1.00 75.57 H new ATOM 0 HE21 GLN B 65 2.977 29.291 16.127 1.00 82.61 H new ATOM 0 HE22 GLN B 65 1.729 30.103 16.172 1.00 82.61 H new ATOM 1528 N ASN B 66 7.580 32.217 14.206 1.00 60.98 N ATOM 1529 CA ASN B 66 8.142 33.397 14.838 1.00 52.51 C ATOM 1530 C ASN B 66 9.628 33.310 14.956 1.00 47.48 C ATOM 1531 O ASN B 66 10.174 32.655 15.874 1.00 48.70 O ATOM 1532 CB ASN B 66 7.530 33.533 16.232 1.00 48.72 C ATOM 1533 CG ASN B 66 7.903 34.888 16.801 1.00 47.77 C ATOM 1534 OD1 ASN B 66 8.658 35.019 17.761 1.00 51.35 O ATOM 1535 ND2 ASN B 66 7.339 35.928 16.164 1.00 47.58 N ATOM 0 H ASN B 66 8.017 31.489 14.344 1.00 60.98 H new ATOM 0 HA ASN B 66 7.937 34.170 14.289 1.00 52.51 H new ATOM 0 HB2 ASN B 66 6.565 33.443 16.185 1.00 48.72 H new ATOM 0 HB3 ASN B 66 7.853 32.825 16.811 1.00 48.72 H new ATOM 0 HD21 ASN B 66 7.501 36.731 16.425 1.00 47.58 H new ATOM 0 HD22 ASN B 66 6.816 35.790 15.495 1.00 47.58 H new ATOM 1536 N PRO B 67 10.303 33.914 13.957 1.00 44.52 N ATOM 1537 CA PRO B 67 11.769 33.987 13.781 1.00 41.20 C ATOM 1538 C PRO B 67 12.396 34.963 14.775 1.00 38.02 C ATOM 1539 O PRO B 67 13.619 34.994 14.982 1.00 39.22 O ATOM 1540 CB PRO B 67 11.935 34.549 12.353 1.00 40.59 C ATOM 1541 CG PRO B 67 10.532 34.544 11.744 1.00 41.29 C ATOM 1542 CD PRO B 67 9.590 34.648 12.890 1.00 42.39 C ATOM 0 HA PRO B 67 12.196 33.127 13.921 1.00 41.20 H new ATOM 0 HB2 PRO B 67 12.304 35.446 12.372 1.00 40.59 H new ATOM 0 HB3 PRO B 67 12.544 34.003 11.832 1.00 40.59 H new ATOM 0 HG2 PRO B 67 10.417 35.287 11.131 1.00 41.29 H new ATOM 0 HG3 PRO B 67 10.376 33.731 11.238 1.00 41.29 H new ATOM 0 HD2 PRO B 67 9.422 35.571 13.137 1.00 42.39 H new ATOM 0 HD3 PRO B 67 8.730 34.247 12.688 1.00 42.39 H new ATOM 1543 N HIS B 68 11.523 35.721 15.420 1.00 36.82 N ATOM 1544 CA HIS B 68 11.912 36.749 16.352 1.00 34.97 C ATOM 1545 C HIS B 68 12.013 36.328 17.805 1.00 34.90 C ATOM 1546 O HIS B 68 12.236 37.162 18.653 1.00 42.84 O ATOM 1547 CB HIS B 68 10.935 37.923 16.193 1.00 34.61 C ATOM 1548 CG HIS B 68 10.663 38.294 14.759 1.00 32.57 C ATOM 1549 ND1 HIS B 68 11.629 38.829 13.927 1.00 25.73 N ATOM 1550 CD2 HIS B 68 9.535 38.199 14.014 1.00 28.00 C ATOM 1551 CE1 HIS B 68 11.105 39.043 12.731 1.00 20.47 C ATOM 1552 NE2 HIS B 68 9.838 38.672 12.759 1.00 24.83 N ATOM 0 H HIS B 68 10.672 35.646 15.322 1.00 36.82 H new ATOM 0 HA HIS B 68 12.823 36.995 16.126 1.00 34.97 H new ATOM 0 HB2 HIS B 68 10.096 37.696 16.625 1.00 34.61 H new ATOM 0 HB3 HIS B 68 11.293 38.696 16.657 1.00 34.61 H new ATOM 0 HD2 HIS B 68 8.711 37.875 14.298 1.00 28.00 H new ATOM 0 HE1 HIS B 68 11.553 39.395 11.996 1.00 20.47 H new ATOM 0 HE2 HIS B 68 9.290 38.719 12.098 1.00 24.83 H new ATOM 1553 N SER B 69 11.799 35.057 18.112 1.00 36.26 N ATOM 1554 CA SER B 69 11.864 34.621 19.495 1.00 31.22 C ATOM 1555 C SER B 69 13.264 34.767 20.010 1.00 31.62 C ATOM 1556 O SER B 69 14.195 34.507 19.287 1.00 35.90 O ATOM 1557 CB SER B 69 11.457 33.157 19.615 1.00 29.37 C ATOM 1558 OG SER B 69 11.816 32.647 20.905 1.00 29.43 O ATOM 0 H SER B 69 11.617 34.439 17.542 1.00 36.26 H new ATOM 0 HA SER B 69 11.256 35.171 20.013 1.00 31.22 H new ATOM 0 HB2 SER B 69 10.501 33.068 19.480 1.00 29.37 H new ATOM 0 HB3 SER B 69 11.891 32.636 18.922 1.00 29.37 H new ATOM 0 HG SER B 69 11.431 31.911 21.033 1.00 29.43 H new ATOM 1559 N SER B 70 13.425 35.179 21.258 1.00 33.26 N ATOM 1560 CA SER B 70 14.755 35.295 21.839 1.00 34.07 C ATOM 1561 C SER B 70 15.263 33.883 22.153 1.00 37.57 C ATOM 1562 O SER B 70 16.457 33.686 22.421 1.00 43.26 O ATOM 1563 CB SER B 70 14.698 36.110 23.124 1.00 33.29 C ATOM 1564 OG SER B 70 13.557 36.929 23.124 1.00 40.20 O ATOM 0 H SER B 70 12.781 35.396 21.785 1.00 33.26 H new ATOM 0 HA SER B 70 15.349 35.741 21.216 1.00 34.07 H new ATOM 0 HB2 SER B 70 14.679 35.517 23.891 1.00 33.29 H new ATOM 0 HB3 SER B 70 15.496 36.655 23.206 1.00 33.29 H new ATOM 0 HG SER B 70 13.531 37.374 23.836 1.00 40.20 H new ATOM 1565 N ASN B 71 14.331 32.925 22.203 1.00 36.12 N ATOM 1566 CA ASN B 71 14.613 31.506 22.450 1.00 35.65 C ATOM 1567 C ASN B 71 15.665 31.269 23.514 1.00 35.96 C ATOM 1568 O ASN B 71 16.720 30.683 23.255 1.00 33.77 O ATOM 1569 CB ASN B 71 14.984 30.779 21.151 1.00 37.91 C ATOM 1570 CG ASN B 71 15.052 29.264 21.309 1.00 42.05 C ATOM 1571 OD1 ASN B 71 14.858 28.734 22.397 1.00 47.17 O ATOM 1572 ND2 ASN B 71 15.320 28.561 20.210 1.00 40.48 N ATOM 0 H ASN B 71 13.494 33.088 22.091 1.00 36.12 H new ATOM 0 HA ASN B 71 13.788 31.133 22.797 1.00 35.65 H new ATOM 0 HB2 ASN B 71 14.332 30.998 20.467 1.00 37.91 H new ATOM 0 HB3 ASN B 71 15.843 31.105 20.839 1.00 37.91 H new ATOM 0 HD21 ASN B 71 15.362 27.703 20.248 1.00 40.48 H new ATOM 0 HD22 ASN B 71 15.451 28.965 19.462 1.00 40.48 H new ATOM 1573 N ILE B 72 15.330 31.687 24.727 1.00 37.95 N ATOM 1574 CA ILE B 72 16.213 31.529 25.867 1.00 42.26 C ATOM 1575 C ILE B 72 16.346 30.069 26.307 1.00 43.74 C ATOM 1576 O ILE B 72 17.399 29.648 26.767 1.00 45.94 O ATOM 1577 CB ILE B 72 15.748 32.413 27.027 1.00 41.72 C ATOM 1578 CG1 ILE B 72 15.873 33.868 26.594 1.00 49.65 C ATOM 1579 CG2 ILE B 72 16.561 32.139 28.289 1.00 36.02 C ATOM 1580 CD1 ILE B 72 15.401 34.880 27.612 1.00 62.77 C ATOM 0 H ILE B 72 14.582 32.071 24.910 1.00 37.95 H new ATOM 0 HA ILE B 72 17.097 31.815 25.589 1.00 42.26 H new ATOM 0 HB ILE B 72 14.824 32.214 27.243 1.00 41.72 H new ATOM 0 HG12 ILE B 72 16.802 34.050 26.384 1.00 49.65 H new ATOM 0 HG13 ILE B 72 15.367 33.992 25.776 1.00 49.65 H new ATOM 0 HG21 ILE B 72 16.247 32.711 29.007 1.00 36.02 H new ATOM 0 HG22 ILE B 72 16.456 31.210 28.547 1.00 36.02 H new ATOM 0 HG23 ILE B 72 17.498 32.322 28.117 1.00 36.02 H new ATOM 0 HD11 ILE B 72 15.516 35.775 27.256 1.00 62.77 H new ATOM 0 HD12 ILE B 72 14.463 34.728 27.808 1.00 62.77 H new ATOM 0 HD13 ILE B 72 15.920 34.787 28.426 1.00 62.77 H new ATOM 1581 N CYS B 73 15.291 29.287 26.143 1.00 45.82 N ATOM 1582 CA CYS B 73 15.355 27.889 26.541 1.00 46.97 C ATOM 1583 C CYS B 73 16.101 27.009 25.561 1.00 47.60 C ATOM 1584 O CYS B 73 16.334 25.833 25.819 1.00 49.42 O ATOM 1585 CB CYS B 73 13.967 27.338 26.877 1.00 41.18 C ATOM 1586 SG CYS B 73 13.473 27.883 28.543 1.00 36.04 S ATOM 0 H CYS B 73 14.540 29.539 25.809 1.00 45.82 H new ATOM 0 HA CYS B 73 15.885 27.866 27.353 1.00 46.97 H new ATOM 0 HB2 CYS B 73 13.321 27.645 26.222 1.00 41.18 H new ATOM 0 HB3 CYS B 73 13.975 26.369 26.834 1.00 41.18 H new ATOM 1587 N ASN B 74 16.492 27.595 24.436 1.00 50.33 N ATOM 1588 CA ASN B 74 17.259 26.879 23.418 1.00 53.54 C ATOM 1589 C ASN B 74 16.558 25.619 22.960 1.00 50.46 C ATOM 1590 O ASN B 74 17.193 24.627 22.590 1.00 52.90 O ATOM 1591 CB ASN B 74 18.633 26.520 23.975 1.00 54.86 C ATOM 1592 CG ASN B 74 19.729 27.107 23.164 1.00 55.83 C ATOM 1593 OD1 ASN B 74 19.998 26.651 22.057 1.00 55.25 O ATOM 1594 ND2 ASN B 74 20.325 28.184 23.667 1.00 58.69 N ATOM 0 H ASN B 74 16.322 28.415 24.239 1.00 50.33 H new ATOM 0 HA ASN B 74 17.347 27.465 22.650 1.00 53.54 H new ATOM 0 HB2 ASN B 74 18.703 26.835 24.890 1.00 54.86 H new ATOM 0 HB3 ASN B 74 18.730 25.555 23.999 1.00 54.86 H new ATOM 0 HD21 ASN B 74 20.929 28.594 23.212 1.00 58.69 H new ATOM 0 HD22 ASN B 74 20.107 28.471 24.448 1.00 58.69 H new ATOM 1595 N ILE B 75 15.251 25.732 22.809 1.00 45.13 N ATOM 1596 CA ILE B 75 14.476 24.580 22.466 1.00 38.52 C ATOM 1597 C ILE B 75 13.303 24.929 21.561 1.00 34.03 C ATOM 1598 O ILE B 75 12.973 26.094 21.386 1.00 32.70 O ATOM 1599 CB ILE B 75 14.029 23.966 23.786 1.00 40.29 C ATOM 1600 CG1 ILE B 75 13.453 22.570 23.606 1.00 33.61 C ATOM 1601 CG2 ILE B 75 13.132 24.944 24.548 1.00 37.23 C ATOM 1602 CD1 ILE B 75 13.318 21.884 24.938 1.00 33.58 C ATOM 0 H ILE B 75 14.805 26.462 22.901 1.00 45.13 H new ATOM 0 HA ILE B 75 15.000 23.946 21.952 1.00 38.52 H new ATOM 0 HB ILE B 75 14.805 23.822 24.349 1.00 40.29 H new ATOM 0 HG12 ILE B 75 12.586 22.624 23.174 1.00 33.61 H new ATOM 0 HG13 ILE B 75 14.028 22.049 23.024 1.00 33.61 H new ATOM 0 HG21 ILE B 75 12.854 24.543 25.386 1.00 37.23 H new ATOM 0 HG22 ILE B 75 13.623 25.761 24.729 1.00 37.23 H new ATOM 0 HG23 ILE B 75 12.349 25.150 24.013 1.00 37.23 H new ATOM 0 HD11 ILE B 75 12.950 20.996 24.809 1.00 33.58 H new ATOM 0 HD12 ILE B 75 14.190 21.814 25.356 1.00 33.58 H new ATOM 0 HD13 ILE B 75 12.726 22.399 25.509 1.00 33.58 H new ATOM 1603 N SER B 76 12.772 23.921 20.879 1.00 33.63 N ATOM 1604 CA SER B 76 11.632 24.098 19.995 1.00 32.56 C ATOM 1605 C SER B 76 10.393 24.083 20.865 1.00 33.25 C ATOM 1606 O SER B 76 10.340 23.369 21.864 1.00 39.06 O ATOM 1607 CB SER B 76 11.561 22.969 18.960 1.00 30.71 C ATOM 1608 OG SER B 76 10.464 23.168 18.084 1.00 40.40 O ATOM 0 H SER B 76 13.065 23.113 20.917 1.00 33.63 H new ATOM 0 HA SER B 76 11.709 24.933 19.507 1.00 32.56 H new ATOM 0 HB2 SER B 76 12.386 22.936 18.452 1.00 30.71 H new ATOM 0 HB3 SER B 76 11.471 22.115 19.411 1.00 30.71 H new ATOM 0 HG SER B 76 10.037 22.449 18.002 1.00 40.40 H new ATOM 1609 N CYS B 77 9.374 24.823 20.478 1.00 34.40 N ATOM 1610 CA CYS B 77 8.189 24.858 21.305 1.00 35.53 C ATOM 1611 C CYS B 77 7.389 23.552 21.260 1.00 37.68 C ATOM 1612 O CYS B 77 6.614 23.284 22.168 1.00 41.36 O ATOM 1613 CB CYS B 77 7.284 26.052 20.952 1.00 32.71 C ATOM 1614 SG CYS B 77 7.991 27.738 21.098 1.00 31.84 S ATOM 0 H CYS B 77 9.346 25.299 19.762 1.00 34.40 H new ATOM 0 HA CYS B 77 8.507 24.968 22.215 1.00 35.53 H new ATOM 0 HB2 CYS B 77 6.980 25.935 20.038 1.00 32.71 H new ATOM 0 HB3 CYS B 77 6.499 26.008 21.520 1.00 32.71 H new ATOM 1615 N ASP B 78 7.586 22.734 20.227 1.00 41.06 N ATOM 1616 CA ASP B 78 6.866 21.462 20.066 1.00 37.52 C ATOM 1617 C ASP B 78 7.203 20.462 21.159 1.00 35.24 C ATOM 1618 O ASP B 78 6.445 19.533 21.438 1.00 33.27 O ATOM 1619 CB ASP B 78 7.176 20.844 18.699 1.00 55.47 C ATOM 1620 CG ASP B 78 8.633 20.319 18.580 1.00 68.70 C ATOM 1621 OD1 ASP B 78 9.025 19.363 19.299 1.00 75.64 O ATOM 1622 OD2 ASP B 78 9.379 20.824 17.712 1.00 79.06 O ATOM 0 H ASP B 78 8.144 22.899 19.594 1.00 41.06 H new ATOM 0 HA ASP B 78 5.920 21.666 20.132 1.00 37.52 H new ATOM 0 HB2 ASP B 78 6.561 20.113 18.534 1.00 55.47 H new ATOM 0 HB3 ASP B 78 7.020 21.507 18.008 1.00 55.47 H new ATOM 1623 N LYS B 79 8.396 20.634 21.718 1.00 34.73 N ATOM 1624 CA LYS B 79 8.910 19.814 22.793 1.00 33.49 C ATOM 1625 C LYS B 79 8.073 19.997 24.054 1.00 38.38 C ATOM 1626 O LYS B 79 8.314 19.301 25.045 1.00 43.07 O ATOM 1627 CB LYS B 79 10.329 20.253 23.132 1.00 36.68 C ATOM 1628 CG LYS B 79 11.324 20.068 22.026 1.00 42.67 C ATOM 1629 CD LYS B 79 11.427 18.611 21.668 1.00 49.67 C ATOM 1630 CE LYS B 79 12.503 18.367 20.640 1.00 58.41 C ATOM 1631 NZ LYS B 79 12.316 17.022 20.017 1.00 64.60 N ATOM 0 H LYS B 79 8.941 21.252 21.471 1.00 34.73 H new ATOM 0 HA LYS B 79 8.884 18.889 22.502 1.00 33.49 H new ATOM 0 HB2 LYS B 79 10.313 21.190 23.383 1.00 36.68 H new ATOM 0 HB3 LYS B 79 10.631 19.756 23.909 1.00 36.68 H new ATOM 0 HG2 LYS B 79 11.055 20.582 21.249 1.00 42.67 H new ATOM 0 HG3 LYS B 79 12.191 20.404 22.301 1.00 42.67 H new ATOM 0 HD2 LYS B 79 11.618 18.094 22.466 1.00 49.67 H new ATOM 0 HD3 LYS B 79 10.574 18.300 21.325 1.00 49.67 H new ATOM 0 HE2 LYS B 79 12.471 19.056 19.957 1.00 58.41 H new ATOM 0 HE3 LYS B 79 13.377 18.420 21.057 1.00 58.41 H new ATOM 0 HZ1 LYS B 79 12.954 16.884 19.412 1.00 64.60 H new ATOM 0 HZ2 LYS B 79 12.363 16.394 20.646 1.00 64.60 H new ATOM 0 HZ3 LYS B 79 11.519 16.986 19.622 1.00 64.60 H new ATOM 1632 N PHE B 80 7.139 20.952 24.039 1.00 35.48 N ATOM 1633 CA PHE B 80 6.274 21.252 25.178 1.00 28.15 C ATOM 1634 C PHE B 80 4.865 20.755 24.922 1.00 29.37 C ATOM 1635 O PHE B 80 3.923 21.175 25.566 1.00 33.48 O ATOM 1636 CB PHE B 80 6.251 22.776 25.432 1.00 25.53 C ATOM 1637 CG PHE B 80 7.599 23.366 25.747 1.00 19.93 C ATOM 1638 CD1 PHE B 80 8.602 22.590 26.300 1.00 23.03 C ATOM 1639 CD2 PHE B 80 7.876 24.680 25.458 1.00 25.57 C ATOM 1640 CE1 PHE B 80 9.857 23.111 26.555 1.00 16.22 C ATOM 1641 CE2 PHE B 80 9.129 25.209 25.707 1.00 26.02 C ATOM 1642 CZ PHE B 80 10.118 24.417 26.255 1.00 23.22 C ATOM 0 H PHE B 80 6.990 21.450 23.354 1.00 35.48 H new ATOM 0 HA PHE B 80 6.626 20.800 25.961 1.00 28.15 H new ATOM 0 HB2 PHE B 80 5.890 23.219 24.649 1.00 25.53 H new ATOM 0 HB3 PHE B 80 5.647 22.963 26.168 1.00 25.53 H new ATOM 0 HD1 PHE B 80 8.428 21.699 26.504 1.00 23.03 H new ATOM 0 HD2 PHE B 80 7.214 25.220 25.091 1.00 25.57 H new ATOM 0 HE1 PHE B 80 10.519 22.575 26.928 1.00 16.22 H new ATOM 0 HE2 PHE B 80 9.306 26.099 25.505 1.00 26.02 H new ATOM 0 HZ PHE B 80 10.961 24.773 26.420 1.00 23.22 H new ATOM 1643 N LEU B 81 4.701 19.886 23.942 1.00 33.07 N ATOM 1644 CA LEU B 81 3.358 19.383 23.645 1.00 35.94 C ATOM 1645 C LEU B 81 3.287 17.858 23.760 1.00 38.65 C ATOM 1646 O LEU B 81 2.265 17.252 23.418 1.00 39.25 O ATOM 1647 CB LEU B 81 2.906 19.826 22.236 1.00 35.77 C ATOM 1648 CG LEU B 81 2.820 21.329 21.973 1.00 27.63 C ATOM 1649 CD1 LEU B 81 2.549 21.579 20.541 1.00 21.76 C ATOM 1650 CD2 LEU B 81 1.761 21.930 22.834 1.00 28.43 C ATOM 0 H LEU B 81 5.331 19.577 23.444 1.00 33.07 H new ATOM 0 HA LEU B 81 2.757 19.763 24.305 1.00 35.94 H new ATOM 0 HB2 LEU B 81 3.518 19.442 21.589 1.00 35.77 H new ATOM 0 HB3 LEU B 81 2.033 19.440 22.065 1.00 35.77 H new ATOM 0 HG LEU B 81 3.668 21.746 22.195 1.00 27.63 H new ATOM 0 HD11 LEU B 81 2.496 22.535 20.384 1.00 21.76 H new ATOM 0 HD12 LEU B 81 3.265 21.203 20.005 1.00 21.76 H new ATOM 0 HD13 LEU B 81 1.708 21.164 20.293 1.00 21.76 H new ATOM 0 HD21 LEU B 81 1.709 22.884 22.665 1.00 28.43 H new ATOM 0 HD22 LEU B 81 0.906 21.519 22.631 1.00 28.43 H new ATOM 0 HD23 LEU B 81 1.978 21.779 23.767 1.00 28.43 H new ATOM 1651 N ASP B 82 4.373 17.245 24.233 1.00 41.24 N ATOM 1652 CA ASP B 82 4.436 15.792 24.351 1.00 47.51 C ATOM 1653 C ASP B 82 4.261 15.297 25.771 1.00 52.94 C ATOM 1654 O ASP B 82 4.426 16.057 26.726 1.00 59.60 O ATOM 1655 CB ASP B 82 5.745 15.238 23.739 1.00 45.56 C ATOM 1656 CG ASP B 82 7.001 15.744 24.440 1.00 50.18 C ATOM 1657 OD1 ASP B 82 6.909 16.100 25.620 1.00 46.97 O ATOM 1658 OD2 ASP B 82 8.085 15.785 23.812 1.00 50.61 O ATOM 0 H ASP B 82 5.084 17.655 24.491 1.00 41.24 H new ATOM 0 HA ASP B 82 3.682 15.451 23.845 1.00 47.51 H new ATOM 0 HB2 ASP B 82 5.728 14.269 23.779 1.00 45.56 H new ATOM 0 HB3 ASP B 82 5.785 15.483 22.801 1.00 45.56 H new ATOM 1659 N ASP B 83 4.009 13.999 25.889 1.00 54.30 N ATOM 1660 CA ASP B 83 3.798 13.331 27.162 1.00 55.16 C ATOM 1661 C ASP B 83 4.934 13.548 28.170 1.00 52.30 C ATOM 1662 O ASP B 83 4.699 13.539 29.382 1.00 55.25 O ATOM 1663 CB ASP B 83 3.524 11.814 26.934 1.00 60.07 C ATOM 1664 CG ASP B 83 4.648 11.098 26.150 1.00 62.57 C ATOM 1665 OD1 ASP B 83 4.837 11.395 24.948 1.00 61.97 O ATOM 1666 OD2 ASP B 83 5.319 10.205 26.725 1.00 62.33 O ATOM 0 H ASP B 83 3.955 13.471 25.213 1.00 54.30 H new ATOM 0 HA ASP B 83 3.016 13.741 27.564 1.00 55.16 H new ATOM 0 HB2 ASP B 83 3.411 11.380 27.794 1.00 60.07 H new ATOM 0 HB3 ASP B 83 2.688 11.712 26.453 1.00 60.07 H new ATOM 1667 N ASP B 84 6.148 13.769 27.666 1.00 46.77 N ATOM 1668 CA ASP B 84 7.322 13.984 28.501 1.00 42.53 C ATOM 1669 C ASP B 84 7.441 15.447 28.958 1.00 44.66 C ATOM 1670 O ASP B 84 7.386 16.374 28.139 1.00 52.50 O ATOM 1671 CB ASP B 84 8.580 13.568 27.726 1.00 40.62 C ATOM 1672 CG ASP B 84 9.834 13.594 28.586 1.00 45.25 C ATOM 1673 OD1 ASP B 84 9.718 13.921 29.776 1.00 47.81 O ATOM 1674 OD2 ASP B 84 10.940 13.280 28.091 1.00 47.77 O ATOM 0 H ASP B 84 6.311 13.798 26.822 1.00 46.77 H new ATOM 0 HA ASP B 84 7.229 13.440 29.298 1.00 42.53 H new ATOM 0 HB2 ASP B 84 8.455 12.675 27.370 1.00 40.62 H new ATOM 0 HB3 ASP B 84 8.700 14.162 26.968 1.00 40.62 H new ATOM 1675 N LEU B 85 7.663 15.649 30.255 1.00 42.68 N ATOM 1676 CA LEU B 85 7.798 16.989 30.833 1.00 37.16 C ATOM 1677 C LEU B 85 9.187 17.242 31.415 1.00 38.04 C ATOM 1678 O LEU B 85 9.338 18.067 32.301 1.00 42.19 O ATOM 1679 CB LEU B 85 6.793 17.202 31.961 1.00 30.02 C ATOM 1680 CG LEU B 85 5.307 17.115 31.696 1.00 27.93 C ATOM 1681 CD1 LEU B 85 4.619 17.279 33.000 1.00 26.94 C ATOM 1682 CD2 LEU B 85 4.875 18.181 30.752 1.00 28.70 C ATOM 0 H LEU B 85 7.740 15.012 30.828 1.00 42.68 H new ATOM 0 HA LEU B 85 7.638 17.604 30.100 1.00 37.16 H new ATOM 0 HB2 LEU B 85 6.998 16.554 32.653 1.00 30.02 H new ATOM 0 HB3 LEU B 85 6.965 18.080 32.335 1.00 30.02 H new ATOM 0 HG LEU B 85 5.086 16.262 31.291 1.00 27.93 H new ATOM 0 HD11 LEU B 85 3.659 17.228 32.868 1.00 26.94 H new ATOM 0 HD12 LEU B 85 4.899 16.575 33.605 1.00 26.94 H new ATOM 0 HD13 LEU B 85 4.848 18.141 33.381 1.00 26.94 H new ATOM 0 HD21 LEU B 85 3.921 18.108 30.596 1.00 28.70 H new ATOM 0 HD22 LEU B 85 5.074 19.051 31.133 1.00 28.70 H new ATOM 0 HD23 LEU B 85 5.349 18.080 29.911 1.00 28.70 H new ATOM 1683 N THR B 86 10.211 16.560 30.928 1.00 41.42 N ATOM 1684 CA THR B 86 11.539 16.788 31.483 1.00 44.32 C ATOM 1685 C THR B 86 12.071 18.119 30.968 1.00 41.52 C ATOM 1686 O THR B 86 12.577 18.941 31.744 1.00 41.73 O ATOM 1687 CB THR B 86 12.555 15.660 31.129 1.00 50.12 C ATOM 1688 OG1 THR B 86 11.925 14.377 31.241 1.00 50.41 O ATOM 1689 CG2 THR B 86 13.740 15.710 32.087 1.00 49.89 C ATOM 0 H THR B 86 10.166 15.978 30.297 1.00 41.42 H new ATOM 0 HA THR B 86 11.447 16.794 32.449 1.00 44.32 H new ATOM 0 HB THR B 86 12.861 15.795 30.219 1.00 50.12 H new ATOM 0 HG1 THR B 86 11.355 14.290 30.630 1.00 50.41 H new ATOM 0 HG21 THR B 86 14.368 15.006 31.862 1.00 49.89 H new ATOM 0 HG22 THR B 86 14.180 16.571 32.013 1.00 49.89 H new ATOM 0 HG23 THR B 86 13.427 15.584 32.996 1.00 49.89 H new ATOM 1690 N ASP B 87 12.000 18.329 29.657 1.00 34.97 N ATOM 1691 CA ASP B 87 12.482 19.591 29.147 1.00 38.59 C ATOM 1692 C ASP B 87 11.567 20.759 29.524 1.00 38.75 C ATOM 1693 O ASP B 87 12.033 21.883 29.643 1.00 46.27 O ATOM 1694 CB ASP B 87 12.784 19.533 27.649 1.00 35.79 C ATOM 1695 CG ASP B 87 11.794 18.715 26.884 1.00 39.93 C ATOM 1696 OD1 ASP B 87 10.609 18.692 27.277 1.00 35.40 O ATOM 1697 OD2 ASP B 87 12.202 18.117 25.863 1.00 47.57 O ATOM 0 H ASP B 87 11.690 17.778 29.074 1.00 34.97 H new ATOM 0 HA ASP B 87 13.330 19.763 29.586 1.00 38.59 H new ATOM 0 HB2 ASP B 87 12.796 20.435 27.292 1.00 35.79 H new ATOM 0 HB3 ASP B 87 13.671 19.164 27.517 1.00 35.79 H new ATOM 1698 N ASP B 88 10.291 20.487 29.786 1.00 34.43 N ATOM 1699 CA ASP B 88 9.362 21.543 30.164 1.00 30.64 C ATOM 1700 C ASP B 88 9.801 22.116 31.486 1.00 32.93 C ATOM 1701 O ASP B 88 9.743 23.317 31.725 1.00 39.83 O ATOM 1702 CB ASP B 88 7.965 20.992 30.334 1.00 21.59 C ATOM 1703 CG ASP B 88 7.412 20.459 29.058 1.00 25.41 C ATOM 1704 OD1 ASP B 88 8.178 19.821 28.312 1.00 30.02 O ATOM 1705 OD2 ASP B 88 6.216 20.673 28.784 1.00 29.47 O ATOM 0 H ASP B 88 9.946 19.700 29.750 1.00 34.43 H new ATOM 0 HA ASP B 88 9.357 22.219 29.468 1.00 30.64 H new ATOM 0 HB2 ASP B 88 7.976 20.287 31.000 1.00 21.59 H new ATOM 0 HB3 ASP B 88 7.382 21.691 30.671 1.00 21.59 H new ATOM 1706 N ILE B 89 10.282 21.243 32.345 1.00 31.18 N ATOM 1707 CA ILE B 89 10.702 21.654 33.658 1.00 25.95 C ATOM 1708 C ILE B 89 12.009 22.393 33.598 1.00 27.36 C ATOM 1709 O ILE B 89 12.183 23.380 34.300 1.00 28.79 O ATOM 1710 CB ILE B 89 10.728 20.445 34.602 1.00 28.01 C ATOM 1711 CG1 ILE B 89 9.308 19.889 34.727 1.00 24.99 C ATOM 1712 CG2 ILE B 89 11.262 20.825 35.951 1.00 30.26 C ATOM 1713 CD1 ILE B 89 9.189 18.700 35.588 1.00 32.13 C ATOM 0 H ILE B 89 10.373 20.403 32.184 1.00 31.18 H new ATOM 0 HA ILE B 89 10.059 22.283 34.022 1.00 25.95 H new ATOM 0 HB ILE B 89 11.317 19.767 34.236 1.00 28.01 H new ATOM 0 HG12 ILE B 89 8.730 20.586 35.076 1.00 24.99 H new ATOM 0 HG13 ILE B 89 8.981 19.666 33.841 1.00 24.99 H new ATOM 0 HG21 ILE B 89 11.268 20.045 36.528 1.00 30.26 H new ATOM 0 HG22 ILE B 89 12.166 21.165 35.858 1.00 30.26 H new ATOM 0 HG23 ILE B 89 10.698 21.511 36.341 1.00 30.26 H new ATOM 0 HD11 ILE B 89 8.263 18.411 35.615 1.00 32.13 H new ATOM 0 HD12 ILE B 89 9.740 17.986 35.232 1.00 32.13 H new ATOM 0 HD13 ILE B 89 9.485 18.919 36.485 1.00 32.13 H new ATOM 1714 N VAL B 90 12.922 21.993 32.722 1.00 31.65 N ATOM 1715 CA VAL B 90 14.182 22.735 32.663 1.00 37.03 C ATOM 1716 C VAL B 90 13.908 24.186 32.277 1.00 35.88 C ATOM 1717 O VAL B 90 14.427 25.111 32.916 1.00 37.50 O ATOM 1718 CB VAL B 90 15.295 22.093 31.736 1.00 36.91 C ATOM 1719 CG1 VAL B 90 14.834 21.942 30.299 1.00 42.47 C ATOM 1720 CG2 VAL B 90 16.574 22.960 31.773 1.00 35.85 C ATOM 0 H VAL B 90 12.844 21.331 32.178 1.00 31.65 H new ATOM 0 HA VAL B 90 14.560 22.692 33.555 1.00 37.03 H new ATOM 0 HB VAL B 90 15.478 21.206 32.083 1.00 36.91 H new ATOM 0 HG11 VAL B 90 15.545 21.547 29.771 1.00 42.47 H new ATOM 0 HG12 VAL B 90 14.052 21.369 30.268 1.00 42.47 H new ATOM 0 HG13 VAL B 90 14.610 22.814 29.938 1.00 42.47 H new ATOM 0 HG21 VAL B 90 17.251 22.562 31.204 1.00 35.85 H new ATOM 0 HG22 VAL B 90 16.369 23.853 31.455 1.00 35.85 H new ATOM 0 HG23 VAL B 90 16.905 23.009 32.683 1.00 35.85 H new ATOM 1721 N CYS B 91 13.028 24.386 31.299 1.00 33.97 N ATOM 1722 CA CYS B 91 12.699 25.726 30.845 1.00 33.34 C ATOM 1723 C CYS B 91 12.042 26.464 31.999 1.00 33.86 C ATOM 1724 O CYS B 91 12.386 27.610 32.295 1.00 40.35 O ATOM 1725 CB CYS B 91 11.766 25.665 29.635 1.00 33.03 C ATOM 1726 SG CYS B 91 11.569 27.228 28.712 1.00 34.58 S ATOM 0 H CYS B 91 12.612 23.756 30.887 1.00 33.97 H new ATOM 0 HA CYS B 91 13.502 26.195 30.569 1.00 33.34 H new ATOM 0 HB2 CYS B 91 12.097 24.987 29.025 1.00 33.03 H new ATOM 0 HB3 CYS B 91 10.891 25.373 29.936 1.00 33.03 H new ATOM 1727 N VAL B 92 11.170 25.776 32.723 1.00 30.81 N ATOM 1728 CA VAL B 92 10.477 26.402 33.834 1.00 26.20 C ATOM 1729 C VAL B 92 11.468 26.916 34.862 1.00 27.31 C ATOM 1730 O VAL B 92 11.305 28.020 35.394 1.00 31.62 O ATOM 1731 CB VAL B 92 9.397 25.466 34.428 1.00 17.96 C ATOM 1732 CG1 VAL B 92 8.939 25.953 35.754 1.00 22.82 C ATOM 1733 CG2 VAL B 92 8.192 25.413 33.510 1.00 13.83 C ATOM 0 H VAL B 92 10.967 24.951 32.588 1.00 30.81 H new ATOM 0 HA VAL B 92 9.996 27.177 33.505 1.00 26.20 H new ATOM 0 HB VAL B 92 9.794 24.586 34.523 1.00 17.96 H new ATOM 0 HG11 VAL B 92 8.264 25.351 36.105 1.00 22.82 H new ATOM 0 HG12 VAL B 92 9.692 25.985 36.365 1.00 22.82 H new ATOM 0 HG13 VAL B 92 8.562 26.842 35.660 1.00 22.82 H new ATOM 0 HG21 VAL B 92 7.521 24.825 33.890 1.00 13.83 H new ATOM 0 HG22 VAL B 92 7.821 26.304 33.411 1.00 13.83 H new ATOM 0 HG23 VAL B 92 8.462 25.077 32.641 1.00 13.83 H new ATOM 1734 N LYS B 93 12.556 26.185 35.062 1.00 30.51 N ATOM 1735 CA LYS B 93 13.558 26.614 36.035 1.00 32.80 C ATOM 1736 C LYS B 93 14.276 27.874 35.591 1.00 32.62 C ATOM 1737 O LYS B 93 14.671 28.692 36.445 1.00 30.03 O ATOM 1738 CB LYS B 93 14.562 25.504 36.363 1.00 36.06 C ATOM 1739 CG LYS B 93 13.910 24.276 36.999 1.00 40.46 C ATOM 1740 CD LYS B 93 14.912 23.371 37.694 1.00 43.41 C ATOM 1741 CE LYS B 93 14.330 21.986 37.919 1.00 43.39 C ATOM 1742 NZ LYS B 93 14.418 21.559 39.333 1.00 48.66 N ATOM 0 H LYS B 93 12.734 25.449 34.654 1.00 30.51 H new ATOM 0 HA LYS B 93 13.073 26.819 36.850 1.00 32.80 H new ATOM 0 HB2 LYS B 93 15.018 25.237 35.550 1.00 36.06 H new ATOM 0 HB3 LYS B 93 15.237 25.854 36.965 1.00 36.06 H new ATOM 0 HG2 LYS B 93 13.242 24.565 37.641 1.00 40.46 H new ATOM 0 HG3 LYS B 93 13.445 23.771 36.314 1.00 40.46 H new ATOM 0 HD2 LYS B 93 15.718 23.304 37.158 1.00 43.41 H new ATOM 0 HD3 LYS B 93 15.168 23.760 38.545 1.00 43.41 H new ATOM 0 HE2 LYS B 93 13.401 21.979 37.639 1.00 43.39 H new ATOM 0 HE3 LYS B 93 14.799 21.346 37.361 1.00 43.39 H new ATOM 0 HZ1 LYS B 93 13.696 21.085 39.546 1.00 48.66 H new ATOM 0 HZ2 LYS B 93 15.145 21.059 39.448 1.00 48.66 H new ATOM 0 HZ3 LYS B 93 14.466 22.276 39.858 1.00 48.66 H new ATOM 1743 N LYS B 94 14.408 28.052 34.269 1.00 35.90 N ATOM 1744 CA LYS B 94 15.058 29.245 33.696 1.00 38.72 C ATOM 1745 C LYS B 94 14.164 30.462 33.879 1.00 37.22 C ATOM 1746 O LYS B 94 14.664 31.556 34.131 1.00 38.23 O ATOM 1747 CB LYS B 94 15.367 29.088 32.206 1.00 46.16 C ATOM 1748 CG LYS B 94 16.183 27.871 31.902 1.00 58.16 C ATOM 1749 CD LYS B 94 16.877 27.963 30.571 1.00 67.02 C ATOM 1750 CE LYS B 94 18.017 26.945 30.527 1.00 73.49 C ATOM 1751 NZ LYS B 94 18.977 27.127 31.672 1.00 76.70 N ATOM 0 H LYS B 94 14.126 27.490 33.682 1.00 35.90 H new ATOM 0 HA LYS B 94 15.898 29.358 34.168 1.00 38.72 H new ATOM 0 HB2 LYS B 94 14.534 29.044 31.711 1.00 46.16 H new ATOM 0 HB3 LYS B 94 15.841 29.875 31.895 1.00 46.16 H new ATOM 0 HG2 LYS B 94 16.844 27.745 32.601 1.00 58.16 H new ATOM 0 HG3 LYS B 94 15.609 27.089 31.911 1.00 58.16 H new ATOM 0 HD2 LYS B 94 16.248 27.791 29.853 1.00 67.02 H new ATOM 0 HD3 LYS B 94 17.223 28.859 30.436 1.00 67.02 H new ATOM 0 HE2 LYS B 94 17.650 26.048 30.553 1.00 73.49 H new ATOM 0 HE3 LYS B 94 18.495 27.032 29.688 1.00 73.49 H new ATOM 0 HZ1 LYS B 94 19.811 27.025 31.379 1.00 76.70 H new ATOM 0 HZ2 LYS B 94 18.880 27.943 32.014 1.00 76.70 H new ATOM 0 HZ3 LYS B 94 18.808 26.520 32.301 1.00 76.70 H new ATOM 1752 N ILE B 95 12.847 30.280 33.736 1.00 36.10 N ATOM 1753 CA ILE B 95 11.893 31.370 33.935 1.00 30.45 C ATOM 1754 C ILE B 95 11.896 31.786 35.416 1.00 30.49 C ATOM 1755 O ILE B 95 11.870 32.968 35.729 1.00 31.72 O ATOM 1756 CB ILE B 95 10.447 30.987 33.516 1.00 31.48 C ATOM 1757 CG1 ILE B 95 10.425 30.498 32.068 1.00 28.23 C ATOM 1758 CG2 ILE B 95 9.519 32.209 33.662 1.00 30.76 C ATOM 1759 CD1 ILE B 95 9.038 30.084 31.550 1.00 26.03 C ATOM 0 H ILE B 95 12.487 29.528 33.523 1.00 36.10 H new ATOM 0 HA ILE B 95 12.174 32.105 33.368 1.00 30.45 H new ATOM 0 HB ILE B 95 10.135 30.273 34.094 1.00 31.48 H new ATOM 0 HG12 ILE B 95 10.773 31.201 31.497 1.00 28.23 H new ATOM 0 HG13 ILE B 95 11.026 29.741 31.986 1.00 28.23 H new ATOM 0 HG21 ILE B 95 8.618 31.964 33.399 1.00 30.76 H new ATOM 0 HG22 ILE B 95 9.517 32.505 34.586 1.00 30.76 H new ATOM 0 HG23 ILE B 95 9.838 32.927 33.093 1.00 30.76 H new ATOM 0 HD11 ILE B 95 9.111 29.788 30.629 1.00 26.03 H new ATOM 0 HD12 ILE B 95 8.692 29.360 32.095 1.00 26.03 H new ATOM 0 HD13 ILE B 95 8.435 30.842 31.599 1.00 26.03 H new ATOM 1760 N LEU B 96 11.929 30.819 36.331 1.00 31.11 N ATOM 1761 CA LEU B 96 11.948 31.141 37.750 1.00 29.80 C ATOM 1762 C LEU B 96 13.185 31.936 38.120 1.00 32.33 C ATOM 1763 O LEU B 96 13.157 32.758 39.025 1.00 34.87 O ATOM 1764 CB LEU B 96 11.882 29.877 38.603 1.00 27.44 C ATOM 1765 CG LEU B 96 10.561 29.131 38.468 1.00 32.29 C ATOM 1766 CD1 LEU B 96 10.707 27.724 38.995 1.00 33.16 C ATOM 1767 CD2 LEU B 96 9.421 29.869 39.188 1.00 31.28 C ATOM 0 H LEU B 96 11.941 29.978 36.150 1.00 31.11 H new ATOM 0 HA LEU B 96 11.164 31.683 37.928 1.00 29.80 H new ATOM 0 HB2 LEU B 96 12.608 29.285 38.351 1.00 27.44 H new ATOM 0 HB3 LEU B 96 12.019 30.114 39.533 1.00 27.44 H new ATOM 0 HG LEU B 96 10.330 29.092 37.527 1.00 32.29 H new ATOM 0 HD11 LEU B 96 9.862 27.256 38.906 1.00 33.16 H new ATOM 0 HD12 LEU B 96 11.390 27.258 38.488 1.00 33.16 H new ATOM 0 HD13 LEU B 96 10.963 27.753 39.930 1.00 33.16 H new ATOM 0 HD21 LEU B 96 8.596 29.370 39.084 1.00 31.28 H new ATOM 0 HD22 LEU B 96 9.633 29.950 40.131 1.00 31.28 H new ATOM 0 HD23 LEU B 96 9.314 30.753 38.804 1.00 31.28 H new ATOM 1768 N ASP B 97 14.289 31.699 37.438 1.00 32.01 N ATOM 1769 CA ASP B 97 15.485 32.436 37.780 1.00 33.23 C ATOM 1770 C ASP B 97 15.537 33.825 37.169 1.00 31.89 C ATOM 1771 O ASP B 97 15.862 34.795 37.842 1.00 38.34 O ATOM 1772 CB ASP B 97 16.716 31.631 37.398 1.00 37.19 C ATOM 1773 CG ASP B 97 16.732 30.266 38.053 1.00 44.99 C ATOM 1774 OD1 ASP B 97 16.005 30.056 39.054 1.00 45.74 O ATOM 1775 OD2 ASP B 97 17.484 29.395 37.565 1.00 53.28 O ATOM 0 H ASP B 97 14.367 31.134 36.794 1.00 32.01 H new ATOM 0 HA ASP B 97 15.467 32.570 38.740 1.00 33.23 H new ATOM 0 HB2 ASP B 97 16.746 31.526 36.434 1.00 37.19 H new ATOM 0 HB3 ASP B 97 17.513 32.121 37.655 1.00 37.19 H new ATOM 1776 N LYS B 98 15.219 33.922 35.888 1.00 35.05 N ATOM 1777 CA LYS B 98 15.238 35.195 35.162 1.00 31.88 C ATOM 1778 C LYS B 98 14.040 36.110 35.404 1.00 31.87 C ATOM 1779 O LYS B 98 14.183 37.338 35.408 1.00 36.91 O ATOM 1780 CB LYS B 98 15.331 34.925 33.656 1.00 30.39 C ATOM 1781 CG LYS B 98 16.605 34.230 33.256 1.00 31.32 C ATOM 1782 CD LYS B 98 16.861 34.290 31.775 1.00 35.22 C ATOM 1783 CE LYS B 98 18.079 33.442 31.443 1.00 40.49 C ATOM 1784 NZ LYS B 98 19.283 33.807 32.252 1.00 44.26 N ATOM 0 H LYS B 98 14.983 33.250 35.406 1.00 35.05 H new ATOM 0 HA LYS B 98 16.014 35.664 35.508 1.00 31.88 H new ATOM 0 HB2 LYS B 98 14.574 34.383 33.383 1.00 30.39 H new ATOM 0 HB3 LYS B 98 15.264 35.766 33.178 1.00 30.39 H new ATOM 0 HG2 LYS B 98 17.351 34.635 33.726 1.00 31.32 H new ATOM 0 HG3 LYS B 98 16.564 33.302 33.536 1.00 31.32 H new ATOM 0 HD2 LYS B 98 16.086 33.967 31.289 1.00 35.22 H new ATOM 0 HD3 LYS B 98 17.007 35.208 31.498 1.00 35.22 H new ATOM 0 HE2 LYS B 98 17.867 32.507 31.592 1.00 40.49 H new ATOM 0 HE3 LYS B 98 18.287 33.539 30.501 1.00 40.49 H new ATOM 0 HZ1 LYS B 98 20.011 33.461 31.875 1.00 44.26 H new ATOM 0 HZ2 LYS B 98 19.360 34.693 32.287 1.00 44.26 H new ATOM 0 HZ3 LYS B 98 19.195 33.485 33.077 1.00 44.26 H new ATOM 1785 N VAL B 99 12.878 35.504 35.627 1.00 27.36 N ATOM 1786 CA VAL B 99 11.635 36.213 35.821 1.00 24.67 C ATOM 1787 C VAL B 99 10.915 35.971 37.160 1.00 26.93 C ATOM 1788 O VAL B 99 10.357 36.896 37.732 1.00 31.08 O ATOM 1789 CB VAL B 99 10.711 35.854 34.675 1.00 24.79 C ATOM 1790 CG1 VAL B 99 9.394 36.512 34.825 1.00 33.70 C ATOM 1791 CG2 VAL B 99 11.353 36.240 33.378 1.00 29.15 C ATOM 0 H VAL B 99 12.796 34.649 35.669 1.00 27.36 H new ATOM 0 HA VAL B 99 11.866 37.155 35.843 1.00 24.67 H new ATOM 0 HB VAL B 99 10.560 34.896 34.683 1.00 24.79 H new ATOM 0 HG11 VAL B 99 8.823 36.266 34.081 1.00 33.70 H new ATOM 0 HG12 VAL B 99 8.982 36.227 35.656 1.00 33.70 H new ATOM 0 HG13 VAL B 99 9.513 37.475 34.837 1.00 33.70 H new ATOM 0 HG21 VAL B 99 10.762 36.011 32.643 1.00 29.15 H new ATOM 0 HG22 VAL B 99 11.521 37.195 33.371 1.00 29.15 H new ATOM 0 HG23 VAL B 99 12.192 35.764 33.278 1.00 29.15 H new ATOM 1792 N GLY B 100 10.922 34.750 37.676 1.00 29.62 N ATOM 1793 CA GLY B 100 10.216 34.491 38.928 1.00 28.17 C ATOM 1794 C GLY B 100 8.876 33.786 38.692 1.00 32.05 C ATOM 1795 O GLY B 100 8.373 33.749 37.570 1.00 33.34 O ATOM 0 H GLY B 100 11.319 34.070 37.329 1.00 29.62 H new ATOM 0 HA2 GLY B 100 10.772 33.944 39.505 1.00 28.17 H new ATOM 0 HA3 GLY B 100 10.063 35.329 39.392 1.00 28.17 H new ATOM 1796 N ILE B 101 8.252 33.250 39.735 1.00 32.69 N ATOM 1797 CA ILE B 101 6.989 32.530 39.552 1.00 32.16 C ATOM 1798 C ILE B 101 5.875 33.426 39.009 1.00 31.19 C ATOM 1799 O ILE B 101 4.881 32.932 38.501 1.00 33.68 O ATOM 1800 CB ILE B 101 6.537 31.829 40.876 1.00 29.94 C ATOM 1801 CG1 ILE B 101 5.201 31.092 40.699 1.00 27.29 C ATOM 1802 CG2 ILE B 101 6.433 32.850 42.011 1.00 31.62 C ATOM 1803 CD1 ILE B 101 5.270 29.822 39.857 1.00 20.90 C ATOM 0 H ILE B 101 8.535 33.289 40.546 1.00 32.69 H new ATOM 0 HA ILE B 101 7.158 31.847 38.884 1.00 32.16 H new ATOM 0 HB ILE B 101 7.211 31.169 41.104 1.00 29.94 H new ATOM 0 HG12 ILE B 101 4.855 30.864 41.576 1.00 27.29 H new ATOM 0 HG13 ILE B 101 4.564 31.699 40.292 1.00 27.29 H new ATOM 0 HG21 ILE B 101 6.152 32.402 42.824 1.00 31.62 H new ATOM 0 HG22 ILE B 101 7.298 33.265 42.153 1.00 31.62 H new ATOM 0 HG23 ILE B 101 5.783 33.530 41.776 1.00 31.62 H new ATOM 0 HD11 ILE B 101 4.387 29.424 39.798 1.00 20.90 H new ATOM 0 HD12 ILE B 101 5.586 30.041 38.966 1.00 20.90 H new ATOM 0 HD13 ILE B 101 5.881 29.192 40.270 1.00 20.90 H new ATOM 1804 N ASN B 102 6.098 34.739 39.007 1.00 35.46 N ATOM 1805 CA ASN B 102 5.073 35.681 38.549 1.00 36.34 C ATOM 1806 C ASN B 102 4.751 35.760 37.065 1.00 33.31 C ATOM 1807 O ASN B 102 3.967 36.589 36.602 1.00 33.65 O ATOM 1808 CB ASN B 102 5.242 37.037 39.207 1.00 33.03 C ATOM 1809 CG ASN B 102 4.586 37.078 40.559 1.00 28.53 C ATOM 1810 OD1 ASN B 102 3.470 36.596 40.722 1.00 35.54 O ATOM 1811 ND2 ASN B 102 5.287 37.601 41.550 1.00 32.83 N ATOM 0 H ASN B 102 6.832 35.105 39.265 1.00 35.46 H new ATOM 0 HA ASN B 102 4.254 35.266 38.863 1.00 36.34 H new ATOM 0 HB2 ASN B 102 6.186 37.238 39.298 1.00 33.03 H new ATOM 0 HB3 ASN B 102 4.859 37.724 38.639 1.00 33.03 H new ATOM 0 HD21 ASN B 102 4.963 37.612 42.347 1.00 32.83 H new ATOM 0 HD22 ASN B 102 6.067 37.930 41.398 1.00 32.83 H new ATOM 1812 N TYR B 103 5.356 34.851 36.332 1.00 30.34 N ATOM 1813 CA TYR B 103 5.100 34.718 34.920 1.00 30.50 C ATOM 1814 C TYR B 103 3.709 34.040 34.867 1.00 29.36 C ATOM 1815 O TYR B 103 2.945 34.245 33.930 1.00 30.67 O ATOM 1816 CB TYR B 103 6.201 33.818 34.323 1.00 19.98 C ATOM 1817 CG TYR B 103 5.962 33.320 32.929 1.00 21.71 C ATOM 1818 CD1 TYR B 103 5.143 32.215 32.685 1.00 22.85 C ATOM 1819 CD2 TYR B 103 6.586 33.920 31.848 1.00 25.40 C ATOM 1820 CE1 TYR B 103 4.959 31.711 31.376 1.00 22.33 C ATOM 1821 CE2 TYR B 103 6.409 33.433 30.541 1.00 26.63 C ATOM 1822 CZ TYR B 103 5.601 32.333 30.315 1.00 24.97 C ATOM 1823 OH TYR B 103 5.482 31.847 29.030 1.00 26.09 O ATOM 0 H TYR B 103 5.930 34.291 36.642 1.00 30.34 H new ATOM 0 HA TYR B 103 5.106 35.549 34.420 1.00 30.50 H new ATOM 0 HB2 TYR B 103 7.036 34.311 34.332 1.00 19.98 H new ATOM 0 HB3 TYR B 103 6.318 33.051 34.905 1.00 19.98 H new ATOM 0 HD1 TYR B 103 4.710 31.802 33.397 1.00 22.85 H new ATOM 0 HD2 TYR B 103 7.133 34.659 31.989 1.00 25.40 H new ATOM 0 HE1 TYR B 103 4.414 30.972 31.229 1.00 22.33 H new ATOM 0 HE2 TYR B 103 6.835 33.851 29.828 1.00 26.63 H new ATOM 0 HH TYR B 103 4.877 31.264 29.005 1.00 26.09 H new ATOM 1824 N TRP B 104 3.401 33.227 35.885 1.00 30.90 N ATOM 1825 CA TRP B 104 2.134 32.500 35.963 1.00 27.77 C ATOM 1826 C TRP B 104 1.288 33.366 36.830 1.00 30.58 C ATOM 1827 O TRP B 104 1.590 33.509 38.011 1.00 27.22 O ATOM 1828 CB TRP B 104 2.324 31.099 36.609 1.00 19.85 C ATOM 1829 CG TRP B 104 3.063 30.113 35.693 1.00 19.98 C ATOM 1830 CD1 TRP B 104 2.510 29.350 34.680 1.00 18.13 C ATOM 1831 CD2 TRP B 104 4.487 29.934 35.592 1.00 13.60 C ATOM 1832 NE1 TRP B 104 3.513 28.746 33.947 1.00 21.43 N ATOM 1833 CE2 TRP B 104 4.728 29.084 34.482 1.00 16.23 C ATOM 1834 CE3 TRP B 104 5.577 30.427 36.321 1.00 13.58 C ATOM 1835 CZ2 TRP B 104 6.013 28.718 34.089 1.00 12.03 C ATOM 1836 CZ3 TRP B 104 6.842 30.067 35.928 1.00 16.87 C ATOM 1837 CH2 TRP B 104 7.054 29.217 34.817 1.00 13.79 C ATOM 0 H TRP B 104 3.926 33.084 36.551 1.00 30.90 H new ATOM 0 HA TRP B 104 1.745 32.336 35.090 1.00 27.77 H new ATOM 0 HB2 TRP B 104 2.818 31.195 37.438 1.00 19.85 H new ATOM 0 HB3 TRP B 104 1.455 30.733 36.837 1.00 19.85 H new ATOM 0 HD1 TRP B 104 1.599 29.258 34.517 1.00 18.13 H new ATOM 0 HE1 TRP B 104 3.394 28.238 33.263 1.00 21.43 H new ATOM 0 HE3 TRP B 104 5.447 30.985 37.054 1.00 13.58 H new ATOM 0 HZ2 TRP B 104 6.156 28.157 33.361 1.00 12.03 H new ATOM 0 HZ3 TRP B 104 7.575 30.388 36.402 1.00 16.87 H new ATOM 0 HH2 TRP B 104 7.924 28.993 34.577 1.00 13.79 H new ATOM 1838 N LEU B 105 0.231 33.937 36.246 1.00 31.59 N ATOM 1839 CA LEU B 105 -0.654 34.847 36.964 1.00 32.58 C ATOM 1840 C LEU B 105 -1.533 34.183 37.983 1.00 32.60 C ATOM 1841 O LEU B 105 -1.904 34.807 38.963 1.00 33.60 O ATOM 1842 CB LEU B 105 -1.526 35.624 35.992 1.00 39.21 C ATOM 1843 CG LEU B 105 -0.777 36.296 34.844 1.00 50.95 C ATOM 1844 CD1 LEU B 105 -1.753 37.252 34.133 1.00 54.72 C ATOM 1845 CD2 LEU B 105 0.498 37.039 35.341 1.00 46.43 C ATOM 0 H LEU B 105 0.011 33.806 35.425 1.00 31.59 H new ATOM 0 HA LEU B 105 -0.061 35.442 37.450 1.00 32.58 H new ATOM 0 HB2 LEU B 105 -2.187 35.020 35.619 1.00 39.21 H new ATOM 0 HB3 LEU B 105 -2.010 36.304 36.486 1.00 39.21 H new ATOM 0 HG LEU B 105 -0.464 35.623 34.220 1.00 50.95 H new ATOM 0 HD11 LEU B 105 -1.298 37.692 33.398 1.00 54.72 H new ATOM 0 HD12 LEU B 105 -2.508 36.748 33.791 1.00 54.72 H new ATOM 0 HD13 LEU B 105 -2.069 37.919 34.762 1.00 54.72 H new ATOM 0 HD21 LEU B 105 0.947 37.452 34.587 1.00 46.43 H new ATOM 0 HD22 LEU B 105 0.245 37.723 35.981 1.00 46.43 H new ATOM 0 HD23 LEU B 105 1.097 36.405 35.765 1.00 46.43 H new ATOM 1846 N ALA B 106 -1.900 32.927 37.722 1.00 30.33 N ATOM 1847 CA ALA B 106 -2.747 32.137 38.606 1.00 21.76 C ATOM 1848 C ALA B 106 -2.144 32.035 39.989 1.00 22.44 C ATOM 1849 O ALA B 106 -2.867 32.008 40.974 1.00 28.99 O ATOM 1850 CB ALA B 106 -2.931 30.750 38.030 1.00 22.43 C ATOM 0 H ALA B 106 -1.657 32.506 37.012 1.00 30.33 H new ATOM 0 HA ALA B 106 -3.607 32.580 38.679 1.00 21.76 H new ATOM 0 HB1 ALA B 106 -3.495 30.226 38.620 1.00 22.43 H new ATOM 0 HB2 ALA B 106 -3.349 30.815 37.157 1.00 22.43 H new ATOM 0 HB3 ALA B 106 -2.067 30.318 37.943 1.00 22.43 H new ATOM 1851 N HIS B 107 -0.822 31.982 40.079 1.00 22.32 N ATOM 1852 CA HIS B 107 -0.165 31.861 41.367 1.00 23.21 C ATOM 1853 C HIS B 107 -0.571 32.883 42.414 1.00 30.02 C ATOM 1854 O HIS B 107 -1.008 32.517 43.498 1.00 33.78 O ATOM 1855 CB HIS B 107 1.344 31.921 41.238 1.00 22.46 C ATOM 1856 CG HIS B 107 2.052 31.545 42.506 1.00 34.11 C ATOM 1857 ND1 HIS B 107 2.531 32.482 43.393 1.00 36.21 N ATOM 1858 CD2 HIS B 107 2.256 30.340 43.088 1.00 34.18 C ATOM 1859 CE1 HIS B 107 2.988 31.872 44.474 1.00 32.39 C ATOM 1860 NE2 HIS B 107 2.833 30.574 44.316 1.00 30.55 N ATOM 0 H HIS B 107 -0.289 32.015 39.405 1.00 22.32 H new ATOM 0 HA HIS B 107 -0.466 30.992 41.676 1.00 23.21 H new ATOM 0 HB2 HIS B 107 1.627 31.326 40.526 1.00 22.46 H new ATOM 0 HB3 HIS B 107 1.607 32.818 40.980 1.00 22.46 H new ATOM 0 HD2 HIS B 107 2.046 29.509 42.726 1.00 34.18 H new ATOM 0 HE1 HIS B 107 3.356 32.289 45.219 1.00 32.39 H new ATOM 0 HE2 HIS B 107 3.056 29.971 44.887 1.00 30.55 H new ATOM 1861 N LYS B 108 -0.357 34.158 42.122 1.00 33.52 N ATOM 1862 CA LYS B 108 -0.688 35.243 43.050 1.00 30.55 C ATOM 1863 C LYS B 108 -2.195 35.410 43.241 1.00 29.87 C ATOM 1864 O LYS B 108 -2.655 35.787 44.305 1.00 32.33 O ATOM 1865 CB LYS B 108 -0.089 36.543 42.495 1.00 33.21 C ATOM 1866 CG LYS B 108 -0.355 37.826 43.263 1.00 35.24 C ATOM 1867 CD LYS B 108 0.087 39.051 42.447 1.00 29.92 C ATOM 1868 CE LYS B 108 1.595 39.205 42.473 1.00 31.65 C ATOM 1869 NZ LYS B 108 2.092 40.253 41.564 1.00 28.95 N ATOM 0 H LYS B 108 -0.015 34.424 41.379 1.00 33.52 H new ATOM 0 HA LYS B 108 -0.318 35.027 43.920 1.00 30.55 H new ATOM 0 HB2 LYS B 108 0.872 36.426 42.432 1.00 33.21 H new ATOM 0 HB3 LYS B 108 -0.420 36.662 41.591 1.00 33.21 H new ATOM 0 HG2 LYS B 108 -1.300 37.894 43.470 1.00 35.24 H new ATOM 0 HG3 LYS B 108 0.120 37.806 44.108 1.00 35.24 H new ATOM 0 HD2 LYS B 108 -0.217 38.960 41.530 1.00 29.92 H new ATOM 0 HD3 LYS B 108 -0.329 39.850 42.806 1.00 29.92 H new ATOM 0 HE2 LYS B 108 1.877 39.411 43.378 1.00 31.65 H new ATOM 0 HE3 LYS B 108 2.004 38.358 42.234 1.00 31.65 H new ATOM 0 HZ1 LYS B 108 2.979 40.299 41.620 1.00 28.95 H new ATOM 0 HZ2 LYS B 108 1.858 40.057 40.728 1.00 28.95 H new ATOM 0 HZ3 LYS B 108 1.740 41.037 41.794 1.00 28.95 H new ATOM 1870 N ALA B 109 -2.959 35.061 42.218 1.00 33.48 N ATOM 1871 CA ALA B 109 -4.406 35.217 42.215 1.00 31.97 C ATOM 1872 C ALA B 109 -5.294 34.100 42.724 1.00 36.04 C ATOM 1873 O ALA B 109 -6.443 34.347 43.076 1.00 40.67 O ATOM 1874 CB ALA B 109 -4.839 35.567 40.837 1.00 36.34 C ATOM 0 H ALA B 109 -2.647 34.721 41.492 1.00 33.48 H new ATOM 0 HA ALA B 109 -4.538 35.908 42.883 1.00 31.97 H new ATOM 0 HB1 ALA B 109 -5.803 35.675 40.818 1.00 36.34 H new ATOM 0 HB2 ALA B 109 -4.416 36.397 40.566 1.00 36.34 H new ATOM 0 HB3 ALA B 109 -4.581 34.858 40.227 1.00 36.34 H new ATOM 1875 N LEU B 110 -4.794 32.872 42.731 1.00 39.89 N ATOM 1876 CA LEU B 110 -5.591 31.721 43.154 1.00 35.30 C ATOM 1877 C LEU B 110 -4.832 30.664 43.947 1.00 33.40 C ATOM 1878 O LEU B 110 -5.443 29.905 44.699 1.00 34.45 O ATOM 1879 CB LEU B 110 -6.179 31.045 41.902 1.00 34.56 C ATOM 1880 CG LEU B 110 -7.226 31.781 41.051 1.00 41.79 C ATOM 1881 CD1 LEU B 110 -7.221 31.297 39.588 1.00 38.39 C ATOM 1882 CD2 LEU B 110 -8.615 31.585 41.660 1.00 45.21 C ATOM 0 H LEU B 110 -3.990 32.680 42.493 1.00 39.89 H new ATOM 0 HA LEU B 110 -6.269 32.075 43.751 1.00 35.30 H new ATOM 0 HB2 LEU B 110 -5.437 30.824 41.318 1.00 34.56 H new ATOM 0 HB3 LEU B 110 -6.576 30.207 42.186 1.00 34.56 H new ATOM 0 HG LEU B 110 -6.997 32.724 41.048 1.00 41.79 H new ATOM 0 HD11 LEU B 110 -7.893 31.783 39.084 1.00 38.39 H new ATOM 0 HD12 LEU B 110 -6.347 31.455 39.198 1.00 38.39 H new ATOM 0 HD13 LEU B 110 -7.420 30.348 39.560 1.00 38.39 H new ATOM 0 HD21 LEU B 110 -9.274 32.051 41.121 1.00 45.21 H new ATOM 0 HD22 LEU B 110 -8.828 30.639 41.684 1.00 45.21 H new ATOM 0 HD23 LEU B 110 -8.626 31.941 42.562 1.00 45.21 H new ATOM 1883 N CYS B 111 -3.504 30.702 43.864 1.00 33.18 N ATOM 1884 CA CYS B 111 -2.652 29.690 44.477 1.00 30.97 C ATOM 1885 C CYS B 111 -1.680 30.043 45.571 1.00 32.05 C ATOM 1886 O CYS B 111 -0.556 29.573 45.587 1.00 31.68 O ATOM 1887 CB CYS B 111 -1.930 28.948 43.369 1.00 26.18 C ATOM 1888 SG CYS B 111 -3.128 28.505 42.064 1.00 30.42 S ATOM 0 H CYS B 111 -3.072 31.319 43.449 1.00 33.18 H new ATOM 0 HA CYS B 111 -3.293 29.166 44.983 1.00 30.97 H new ATOM 0 HB2 CYS B 111 -1.224 29.502 43.001 1.00 26.18 H new ATOM 0 HB3 CYS B 111 -1.509 28.149 43.721 1.00 26.18 H new ATOM 1889 N SER B 112 -2.131 30.852 46.505 1.00 39.13 N ATOM 1890 CA SER B 112 -1.323 31.235 47.650 1.00 46.74 C ATOM 1891 C SER B 112 -2.208 30.962 48.875 1.00 54.57 C ATOM 1892 O SER B 112 -1.743 30.587 49.959 1.00 56.77 O ATOM 1893 CB SER B 112 -0.962 32.719 47.547 1.00 44.01 C ATOM 1894 OG SER B 112 0.034 32.929 46.561 1.00 45.92 O ATOM 0 H SER B 112 -2.918 31.199 46.497 1.00 39.13 H new ATOM 0 HA SER B 112 -0.488 30.744 47.704 1.00 46.74 H new ATOM 0 HB2 SER B 112 -1.754 33.234 47.327 1.00 44.01 H new ATOM 0 HB3 SER B 112 -0.645 33.039 48.406 1.00 44.01 H new ATOM 0 HG SER B 112 -0.303 32.834 45.797 1.00 45.92 H new ATOM 1895 N GLU B 113 -3.506 31.120 48.655 1.00 61.80 N ATOM 1896 CA GLU B 113 -4.528 30.904 49.665 1.00 67.41 C ATOM 1897 C GLU B 113 -4.993 29.451 49.632 1.00 68.10 C ATOM 1898 O GLU B 113 -5.053 28.827 48.572 1.00 71.07 O ATOM 1899 CB GLU B 113 -5.752 31.758 49.336 1.00 72.10 C ATOM 1900 CG GLU B 113 -5.483 33.219 49.154 1.00 81.80 C ATOM 1901 CD GLU B 113 -5.760 33.970 50.419 1.00 88.88 C ATOM 1902 OE1 GLU B 113 -4.835 34.087 51.257 1.00 93.22 O ATOM 1903 OE2 GLU B 113 -6.917 34.414 50.588 1.00 91.63 O ATOM 0 H GLU B 113 -3.824 31.362 47.894 1.00 61.80 H new ATOM 0 HA GLU B 113 -4.154 31.131 50.531 1.00 67.41 H new ATOM 0 HB2 GLU B 113 -6.158 31.416 48.524 1.00 72.10 H new ATOM 0 HB3 GLU B 113 -6.404 31.650 50.047 1.00 72.10 H new ATOM 0 HG2 GLU B 113 -4.559 33.352 48.889 1.00 81.80 H new ATOM 0 HG3 GLU B 113 -6.036 33.568 48.438 1.00 81.80 H new ATOM 1904 N LYS B 114 -5.308 28.930 50.806 1.00 65.00 N ATOM 1905 CA LYS B 114 -5.848 27.592 50.969 1.00 61.11 C ATOM 1906 C LYS B 114 -5.460 26.565 49.898 1.00 56.36 C ATOM 1907 O LYS B 114 -6.245 26.241 49.011 1.00 52.91 O ATOM 1908 CB LYS B 114 -7.364 27.737 51.123 1.00 69.21 C ATOM 1909 CG LYS B 114 -7.700 28.785 52.208 1.00 77.43 C ATOM 1910 CD LYS B 114 -9.126 29.284 52.160 1.00 79.99 C ATOM 1911 CE LYS B 114 -9.247 30.577 52.948 1.00 82.06 C ATOM 1912 NZ LYS B 114 -10.676 30.974 53.088 1.00 89.26 N ATOM 0 H LYS B 114 -5.212 29.354 51.548 1.00 65.00 H new ATOM 0 HA LYS B 114 -5.441 27.206 51.760 1.00 61.11 H new ATOM 0 HB2 LYS B 114 -7.757 28.002 50.277 1.00 69.21 H new ATOM 0 HB3 LYS B 114 -7.754 26.881 51.361 1.00 69.21 H new ATOM 0 HG2 LYS B 114 -7.532 28.398 53.081 1.00 77.43 H new ATOM 0 HG3 LYS B 114 -7.099 29.541 52.112 1.00 77.43 H new ATOM 0 HD2 LYS B 114 -9.395 29.430 51.240 1.00 79.99 H new ATOM 0 HD3 LYS B 114 -9.724 28.615 52.528 1.00 79.99 H new ATOM 0 HE2 LYS B 114 -8.850 30.465 53.826 1.00 82.06 H new ATOM 0 HE3 LYS B 114 -8.753 31.282 52.501 1.00 82.06 H new ATOM 0 HZ1 LYS B 114 -10.730 31.732 53.551 1.00 89.26 H new ATOM 0 HZ2 LYS B 114 -11.031 31.094 52.281 1.00 89.26 H new ATOM 0 HZ3 LYS B 114 -11.122 30.333 53.516 1.00 89.26 H new ATOM 1913 N LEU B 115 -4.275 25.984 50.087 1.00 54.28 N ATOM 1914 CA LEU B 115 -3.685 24.997 49.179 1.00 49.97 C ATOM 1915 C LEU B 115 -3.962 23.542 49.520 1.00 52.04 C ATOM 1916 O LEU B 115 -3.485 22.629 48.843 1.00 50.80 O ATOM 1917 CB LEU B 115 -2.185 25.224 49.116 1.00 44.06 C ATOM 1918 CG LEU B 115 -1.944 26.605 48.541 1.00 39.22 C ATOM 1919 CD1 LEU B 115 -0.517 26.971 48.677 1.00 42.13 C ATOM 1920 CD2 LEU B 115 -2.402 26.638 47.098 1.00 38.95 C ATOM 0 H LEU B 115 -3.777 26.158 50.767 1.00 54.28 H new ATOM 0 HA LEU B 115 -4.115 25.140 48.322 1.00 49.97 H new ATOM 0 HB2 LEU B 115 -1.794 25.152 50.001 1.00 44.06 H new ATOM 0 HB3 LEU B 115 -1.763 24.548 48.563 1.00 44.06 H new ATOM 0 HG LEU B 115 -2.459 27.263 49.034 1.00 39.22 H new ATOM 0 HD11 LEU B 115 -0.373 27.856 48.306 1.00 42.13 H new ATOM 0 HD12 LEU B 115 -0.270 26.970 49.615 1.00 42.13 H new ATOM 0 HD13 LEU B 115 0.029 26.328 48.199 1.00 42.13 H new ATOM 0 HD21 LEU B 115 -2.248 27.522 46.730 1.00 38.95 H new ATOM 0 HD22 LEU B 115 -1.903 25.983 46.585 1.00 38.95 H new ATOM 0 HD23 LEU B 115 -3.348 26.430 47.054 1.00 38.95 H new ATOM 1921 N ASP B 116 -4.743 23.330 50.566 1.00 54.44 N ATOM 1922 CA ASP B 116 -5.084 21.991 51.002 1.00 59.09 C ATOM 1923 C ASP B 116 -5.875 21.250 49.934 1.00 56.72 C ATOM 1924 O ASP B 116 -5.682 20.048 49.718 1.00 60.12 O ATOM 1925 CB ASP B 116 -5.851 22.067 52.316 1.00 68.13 C ATOM 1926 CG ASP B 116 -5.023 22.695 53.409 1.00 77.13 C ATOM 1927 OD1 ASP B 116 -4.226 21.955 54.044 1.00 82.52 O ATOM 1928 OD2 ASP B 116 -5.127 23.935 53.590 1.00 81.86 O ATOM 0 H ASP B 116 -5.089 23.957 51.042 1.00 54.44 H new ATOM 0 HA ASP B 116 -4.268 21.487 51.147 1.00 59.09 H new ATOM 0 HB2 ASP B 116 -6.663 22.582 52.188 1.00 68.13 H new ATOM 0 HB3 ASP B 116 -6.121 21.175 52.586 1.00 68.13 H new ATOM 1929 N GLN B 117 -6.755 21.971 49.257 1.00 49.85 N ATOM 1930 CA GLN B 117 -7.556 21.391 48.196 1.00 45.75 C ATOM 1931 C GLN B 117 -6.683 20.656 47.172 1.00 40.17 C ATOM 1932 O GLN B 117 -7.104 19.672 46.582 1.00 40.10 O ATOM 1933 CB GLN B 117 -8.344 22.510 47.487 1.00 46.01 C ATOM 1934 CG GLN B 117 -8.909 22.096 46.136 1.00 57.78 C ATOM 1935 CD GLN B 117 -9.764 23.162 45.463 1.00 64.72 C ATOM 1936 OE1 GLN B 117 -10.703 23.692 46.053 1.00 67.61 O ATOM 1937 NE2 GLN B 117 -9.479 23.429 44.185 1.00 60.49 N ATOM 0 H GLN B 117 -6.904 22.806 49.399 1.00 49.85 H new ATOM 0 HA GLN B 117 -8.164 20.747 48.591 1.00 45.75 H new ATOM 0 HB2 GLN B 117 -9.073 22.795 48.060 1.00 46.01 H new ATOM 0 HB3 GLN B 117 -7.763 23.277 47.365 1.00 46.01 H new ATOM 0 HG2 GLN B 117 -8.174 21.866 45.546 1.00 57.78 H new ATOM 0 HG3 GLN B 117 -9.442 21.294 46.252 1.00 57.78 H new ATOM 0 HE21 GLN B 117 -8.814 23.040 43.802 1.00 60.49 H new ATOM 0 HE22 GLN B 117 -9.960 23.990 43.745 1.00 60.49 H new ATOM 1938 N TRP B 118 -5.435 21.088 47.044 1.00 35.67 N ATOM 1939 CA TRP B 118 -4.533 20.551 46.038 1.00 32.13 C ATOM 1940 C TRP B 118 -3.560 19.516 46.498 1.00 31.20 C ATOM 1941 O TRP B 118 -2.486 19.363 45.912 1.00 29.56 O ATOM 1942 CB TRP B 118 -3.773 21.718 45.408 1.00 31.84 C ATOM 1943 CG TRP B 118 -4.711 22.786 44.925 1.00 28.80 C ATOM 1944 CD1 TRP B 118 -5.082 23.921 45.617 1.00 26.10 C ATOM 1945 CD2 TRP B 118 -5.406 22.828 43.689 1.00 20.19 C ATOM 1946 NE1 TRP B 118 -5.969 24.647 44.866 1.00 25.56 N ATOM 1947 CE2 TRP B 118 -6.189 24.012 43.681 1.00 26.93 C ATOM 1948 CE3 TRP B 118 -5.441 21.985 42.569 1.00 23.98 C ATOM 1949 CZ2 TRP B 118 -6.994 24.370 42.596 1.00 23.60 C ATOM 1950 CZ3 TRP B 118 -6.242 22.349 41.494 1.00 22.49 C ATOM 1951 CH2 TRP B 118 -7.006 23.532 41.514 1.00 22.21 C ATOM 0 H TRP B 118 -5.088 21.701 47.538 1.00 35.67 H new ATOM 0 HA TRP B 118 -5.100 20.079 45.408 1.00 32.13 H new ATOM 0 HB2 TRP B 118 -3.159 22.094 46.058 1.00 31.84 H new ATOM 0 HB3 TRP B 118 -3.238 21.395 44.666 1.00 31.84 H new ATOM 0 HD1 TRP B 118 -4.777 24.157 46.463 1.00 26.10 H new ATOM 0 HE1 TRP B 118 -6.331 25.389 45.106 1.00 25.56 H new ATOM 0 HE3 TRP B 118 -4.940 21.202 42.546 1.00 23.98 H new ATOM 0 HZ2 TRP B 118 -7.502 25.149 42.609 1.00 23.60 H new ATOM 0 HZ3 TRP B 118 -6.274 21.799 40.745 1.00 22.49 H new ATOM 0 HH2 TRP B 118 -7.530 23.748 40.776 1.00 22.21 H new ATOM 1952 N LEU B 119 -3.914 18.828 47.570 1.00 39.17 N ATOM 1953 CA LEU B 119 -3.053 17.793 48.129 1.00 48.14 C ATOM 1954 C LEU B 119 -3.317 16.391 47.583 1.00 53.54 C ATOM 1955 O LEU B 119 -4.468 15.962 47.463 1.00 55.19 O ATOM 1956 CB LEU B 119 -3.113 17.811 49.664 1.00 45.17 C ATOM 1957 CG LEU B 119 -2.212 18.860 50.336 1.00 47.36 C ATOM 1958 CD1 LEU B 119 -2.726 19.244 51.703 1.00 45.27 C ATOM 1959 CD2 LEU B 119 -0.778 18.356 50.409 1.00 41.21 C ATOM 0 H LEU B 119 -4.653 18.944 47.994 1.00 39.17 H new ATOM 0 HA LEU B 119 -2.154 18.013 47.840 1.00 48.14 H new ATOM 0 HB2 LEU B 119 -4.030 17.970 49.937 1.00 45.17 H new ATOM 0 HB3 LEU B 119 -2.867 16.933 49.994 1.00 45.17 H new ATOM 0 HG LEU B 119 -2.229 19.662 49.791 1.00 47.36 H new ATOM 0 HD11 LEU B 119 -2.136 19.905 52.097 1.00 45.27 H new ATOM 0 HD12 LEU B 119 -3.618 19.616 51.621 1.00 45.27 H new ATOM 0 HD13 LEU B 119 -2.755 18.458 52.271 1.00 45.27 H new ATOM 0 HD21 LEU B 119 -0.221 19.026 50.834 1.00 41.21 H new ATOM 0 HD22 LEU B 119 -0.749 17.536 50.926 1.00 41.21 H new ATOM 0 HD23 LEU B 119 -0.449 18.184 49.513 1.00 41.21 H new ATOM 1960 N CYS B 120 -2.235 15.722 47.195 1.00 59.60 N ATOM 1961 CA CYS B 120 -2.265 14.355 46.680 1.00 69.86 C ATOM 1962 C CYS B 120 -1.092 13.656 47.348 1.00 77.02 C ATOM 1963 O CYS B 120 -0.269 13.031 46.675 1.00 84.52 O ATOM 1964 CB CYS B 120 -2.066 14.313 45.162 1.00 65.12 C ATOM 1965 SG CYS B 120 -3.596 14.143 44.200 1.00 74.37 S ATOM 0 H CYS B 120 -1.444 16.058 47.224 1.00 59.60 H new ATOM 0 HA CYS B 120 -3.121 13.939 46.865 1.00 69.86 H new ATOM 0 HB2 CYS B 120 -1.613 15.125 44.885 1.00 65.12 H new ATOM 0 HB3 CYS B 120 -1.478 13.572 44.946 1.00 65.12 H new ATOM 1966 N GLU B 121 -1.007 13.800 48.668 1.00 82.49 N ATOM 1967 CA GLU B 121 0.055 13.205 49.467 1.00 85.40 C ATOM 1968 C GLU B 121 1.393 13.941 49.266 1.00 88.53 C ATOM 1969 O GLU B 121 2.413 13.484 49.833 1.00 91.74 O ATOM 1970 CB GLU B 121 0.182 11.693 49.183 1.00 83.64 C ATOM 1971 CG GLU B 121 -0.844 10.789 49.918 1.00 84.44 C ATOM 1972 CD GLU B 121 -2.273 11.364 49.977 1.00 87.93 C ATOM 1973 OE1 GLU B 121 -2.890 11.618 48.915 1.00 86.26 O ATOM 1974 OE2 GLU B 121 -2.782 11.549 51.107 1.00 84.26 O ATOM 0 H GLU B 121 -1.574 14.253 49.129 1.00 82.49 H new ATOM 0 HA GLU B 121 -0.185 13.306 50.401 1.00 85.40 H new ATOM 0 HB2 GLU B 121 0.090 11.550 48.228 1.00 83.64 H new ATOM 0 HB3 GLU B 121 1.076 11.407 49.428 1.00 83.64 H new ATOM 0 HG2 GLU B 121 -0.873 9.926 49.476 1.00 84.44 H new ATOM 0 HG3 GLU B 121 -0.532 10.634 50.823 1.00 84.44 H new TER 1975 GLU B 121 ATOM 1976 N MET C 1X 38.166 -9.717 -8.505 1.00 92.43 N ATOM 1977 CA MET C 1X 39.000 -8.489 -8.582 1.00 93.06 C ATOM 1978 C MET C 1X 38.187 -7.428 -9.298 1.00 91.57 C ATOM 1979 O MET C 1X 38.120 -7.409 -10.528 1.00 90.23 O ATOM 1980 CB MET C 1X 40.309 -8.774 -9.326 1.00 98.14 C ATOM 1981 CG MET C 1X 41.287 -7.596 -9.372 1.00102.01 C ATOM 1982 SD MET C 1X 43.041 -8.075 -9.352 1.00106.52 S ATOM 1983 CE MET C 1X 43.519 -7.804 -11.079 1.00104.71 C ATOM 0 H1 MET C 1X 38.609 -10.350 -8.062 1.00 92.43 H new ATOM 0 H2 MET C 1X 37.406 -9.534 -8.079 1.00 92.43 H new ATOM 0 H3 MET C 1X 37.983 -10.004 -9.327 1.00 92.43 H new ATOM 0 HA MET C 1X 39.238 -8.182 -7.693 1.00 93.06 H new ATOM 0 HB2 MET C 1X 40.749 -9.528 -8.904 1.00 98.14 H new ATOM 0 HB3 MET C 1X 40.099 -9.040 -10.235 1.00 98.14 H new ATOM 0 HG2 MET C 1X 41.114 -7.077 -10.173 1.00102.01 H new ATOM 0 HG3 MET C 1X 41.113 -7.015 -8.615 1.00102.01 H new ATOM 0 HE1 MET C 1X 44.455 -8.030 -11.195 1.00104.71 H new ATOM 0 HE2 MET C 1X 42.977 -8.364 -11.657 1.00104.71 H new ATOM 0 HE3 MET C 1X 43.381 -6.872 -11.311 1.00104.71 H new ATOM 1984 N GLU C 1 37.501 -6.605 -8.506 1.00 89.97 N ATOM 1985 CA GLU C 1 36.646 -5.531 -9.021 1.00 87.42 C ATOM 1986 C GLU C 1 37.469 -4.273 -9.302 1.00 82.24 C ATOM 1987 O GLU C 1 37.413 -3.294 -8.551 1.00 79.55 O ATOM 1988 CB GLU C 1 35.509 -5.230 -8.033 1.00 89.05 C ATOM 1989 CG GLU C 1 34.428 -4.264 -8.550 1.00 93.57 C ATOM 1990 CD GLU C 1 33.327 -4.929 -9.387 1.00 96.81 C ATOM 1991 OE1 GLU C 1 33.276 -6.182 -9.466 1.00 98.05 O ATOM 1992 OE2 GLU C 1 32.497 -4.180 -9.952 1.00 95.77 O ATOM 0 H GLU C 1 37.518 -6.653 -7.648 1.00 89.97 H new ATOM 0 HA GLU C 1 36.253 -5.826 -9.857 1.00 87.42 H new ATOM 0 HB2 GLU C 1 35.084 -6.066 -7.787 1.00 89.05 H new ATOM 0 HB3 GLU C 1 35.893 -4.859 -7.223 1.00 89.05 H new ATOM 0 HG2 GLU C 1 34.018 -3.820 -7.791 1.00 93.57 H new ATOM 0 HG3 GLU C 1 34.854 -3.576 -9.085 1.00 93.57 H new ATOM 1993 N GLN C 2 38.277 -4.352 -10.357 1.00 76.70 N ATOM 1994 CA GLN C 2 39.130 -3.250 -10.766 1.00 72.33 C ATOM 1995 C GLN C 2 38.395 -2.123 -11.478 1.00 67.39 C ATOM 1996 O GLN C 2 38.013 -2.236 -12.650 1.00 65.79 O ATOM 1997 CB GLN C 2 40.298 -3.733 -11.634 1.00 75.12 C ATOM 1998 CG GLN C 2 41.568 -4.075 -10.853 1.00 80.85 C ATOM 1999 CD GLN C 2 42.843 -3.783 -11.638 1.00 83.54 C ATOM 2000 OE1 GLN C 2 43.101 -4.391 -12.679 1.00 83.06 O ATOM 2001 NE2 GLN C 2 43.640 -2.840 -11.143 1.00 84.81 N ATOM 0 H GLN C 2 38.343 -5.050 -10.855 1.00 76.70 H new ATOM 0 HA GLN C 2 39.470 -2.882 -9.936 1.00 72.33 H new ATOM 0 HB2 GLN C 2 40.015 -4.517 -12.130 1.00 75.12 H new ATOM 0 HB3 GLN C 2 40.508 -3.046 -12.286 1.00 75.12 H new ATOM 0 HG2 GLN C 2 41.580 -3.569 -10.026 1.00 80.85 H new ATOM 0 HG3 GLN C 2 41.550 -5.014 -10.611 1.00 80.85 H new ATOM 0 HE21 GLN C 2 43.428 -2.437 -10.414 1.00 84.81 H new ATOM 0 HE22 GLN C 2 44.368 -2.634 -11.552 1.00 84.81 H new ATOM 2002 N LEU C 3 38.163 -1.052 -10.730 1.00 60.58 N ATOM 2003 CA LEU C 3 37.521 0.135 -11.255 1.00 52.22 C ATOM 2004 C LEU C 3 38.639 0.839 -12.002 1.00 48.52 C ATOM 2005 O LEU C 3 39.772 0.361 -12.012 1.00 45.79 O ATOM 2006 CB LEU C 3 37.052 1.044 -10.100 1.00 47.36 C ATOM 2007 CG LEU C 3 35.926 0.578 -9.158 1.00 44.74 C ATOM 2008 CD1 LEU C 3 36.463 -0.440 -8.155 1.00 42.50 C ATOM 2009 CD2 LEU C 3 35.316 1.764 -8.421 1.00 34.69 C ATOM 0 H LEU C 3 38.376 -0.997 -9.899 1.00 60.58 H new ATOM 0 HA LEU C 3 36.747 -0.071 -11.802 1.00 52.22 H new ATOM 0 HB2 LEU C 3 37.828 1.234 -9.550 1.00 47.36 H new ATOM 0 HB3 LEU C 3 36.770 1.885 -10.492 1.00 47.36 H new ATOM 0 HG LEU C 3 35.235 0.159 -9.694 1.00 44.74 H new ATOM 0 HD11 LEU C 3 35.746 -0.726 -7.568 1.00 42.50 H new ATOM 0 HD12 LEU C 3 36.816 -1.208 -8.631 1.00 42.50 H new ATOM 0 HD13 LEU C 3 37.169 -0.034 -7.628 1.00 42.50 H new ATOM 0 HD21 LEU C 3 34.610 1.452 -7.834 1.00 34.69 H new ATOM 0 HD22 LEU C 3 36.001 2.206 -7.896 1.00 34.69 H new ATOM 0 HD23 LEU C 3 34.948 2.390 -9.064 1.00 34.69 H new ATOM 2010 N THR C 4 38.322 1.926 -12.690 1.00 46.28 N ATOM 2011 CA THR C 4 39.379 2.678 -13.334 1.00 46.57 C ATOM 2012 C THR C 4 39.495 3.986 -12.560 1.00 46.64 C ATOM 2013 O THR C 4 38.600 4.325 -11.757 1.00 45.19 O ATOM 2014 CB THR C 4 39.115 2.961 -14.801 1.00 44.67 C ATOM 2015 OG1 THR C 4 37.901 3.702 -14.939 1.00 45.39 O ATOM 2016 CG2 THR C 4 39.026 1.670 -15.567 1.00 49.40 C ATOM 0 H THR C 4 37.526 2.236 -12.793 1.00 46.28 H new ATOM 0 HA THR C 4 40.198 2.158 -13.320 1.00 46.57 H new ATOM 0 HB THR C 4 39.847 3.486 -15.161 1.00 44.67 H new ATOM 0 HG1 THR C 4 37.543 3.518 -15.676 1.00 45.39 H new ATOM 0 HG21 THR C 4 38.857 1.860 -16.503 1.00 49.40 H new ATOM 0 HG22 THR C 4 39.861 1.185 -15.482 1.00 49.40 H new ATOM 0 HG23 THR C 4 38.302 1.132 -15.211 1.00 49.40 H new ATOM 2017 N LYS C 5 40.597 4.697 -12.781 1.00 42.04 N ATOM 2018 CA LYS C 5 40.874 5.970 -12.123 1.00 39.58 C ATOM 2019 C LYS C 5 39.655 6.909 -12.097 1.00 40.37 C ATOM 2020 O LYS C 5 39.170 7.312 -11.038 1.00 41.65 O ATOM 2021 CB LYS C 5 42.041 6.668 -12.861 1.00 38.34 C ATOM 2022 CG LYS C 5 42.728 7.791 -12.109 1.00 32.99 C ATOM 2023 CD LYS C 5 43.822 8.425 -12.939 1.00 30.50 C ATOM 2024 CE LYS C 5 43.238 9.412 -13.919 1.00 35.89 C ATOM 2025 NZ LYS C 5 44.292 10.096 -14.708 1.00 36.48 N ATOM 0 H LYS C 5 41.214 4.449 -13.326 1.00 42.04 H new ATOM 0 HA LYS C 5 41.105 5.778 -11.200 1.00 39.58 H new ATOM 0 HB2 LYS C 5 42.706 5.998 -13.084 1.00 38.34 H new ATOM 0 HB3 LYS C 5 41.704 7.023 -13.699 1.00 38.34 H new ATOM 0 HG2 LYS C 5 42.075 8.465 -11.863 1.00 32.99 H new ATOM 0 HG3 LYS C 5 43.104 7.447 -11.284 1.00 32.99 H new ATOM 0 HD2 LYS C 5 44.456 8.874 -12.359 1.00 30.50 H new ATOM 0 HD3 LYS C 5 44.312 7.738 -13.417 1.00 30.50 H new ATOM 0 HE2 LYS C 5 42.632 8.951 -14.520 1.00 35.89 H new ATOM 0 HE3 LYS C 5 42.714 10.072 -13.439 1.00 35.89 H new ATOM 0 HZ1 LYS C 5 43.925 10.486 -15.419 1.00 36.48 H new ATOM 0 HZ2 LYS C 5 44.688 10.713 -14.203 1.00 36.48 H new ATOM 0 HZ3 LYS C 5 44.896 9.500 -14.976 1.00 36.48 H new ATOM 2026 N CYS C 6 39.117 7.191 -13.273 1.00 41.44 N ATOM 2027 CA CYS C 6 38.000 8.109 -13.393 1.00 38.23 C ATOM 2028 C CYS C 6 36.685 7.526 -12.937 1.00 38.82 C ATOM 2029 O CYS C 6 35.698 8.239 -12.825 1.00 42.60 O ATOM 2030 CB CYS C 6 37.930 8.688 -14.822 1.00 47.27 C ATOM 2031 SG CYS C 6 39.376 9.718 -15.308 1.00 52.42 S ATOM 0 H CYS C 6 39.387 6.858 -14.019 1.00 41.44 H new ATOM 0 HA CYS C 6 38.167 8.841 -12.778 1.00 38.23 H new ATOM 0 HB2 CYS C 6 37.845 7.954 -15.451 1.00 47.27 H new ATOM 0 HB3 CYS C 6 37.126 9.224 -14.901 1.00 47.27 H new ATOM 2032 N GLU C 7 36.649 6.216 -12.720 1.00 41.27 N ATOM 2033 CA GLU C 7 35.443 5.578 -12.218 1.00 38.88 C ATOM 2034 C GLU C 7 35.514 5.832 -10.721 1.00 40.50 C ATOM 2035 O GLU C 7 34.514 6.207 -10.089 1.00 41.81 O ATOM 2036 CB GLU C 7 35.451 4.068 -12.500 1.00 46.50 C ATOM 2037 CG GLU C 7 35.078 3.660 -13.927 1.00 53.70 C ATOM 2038 CD GLU C 7 34.972 2.145 -14.118 1.00 58.37 C ATOM 2039 OE1 GLU C 7 36.013 1.460 -14.228 1.00 61.60 O ATOM 2040 OE2 GLU C 7 33.836 1.632 -14.171 1.00 69.69 O ATOM 0 H GLU C 7 37.310 5.683 -12.857 1.00 41.27 H new ATOM 0 HA GLU C 7 34.638 5.922 -12.635 1.00 38.88 H new ATOM 0 HB2 GLU C 7 36.336 3.723 -12.303 1.00 46.50 H new ATOM 0 HB3 GLU C 7 34.836 3.637 -11.886 1.00 46.50 H new ATOM 0 HG2 GLU C 7 34.230 4.069 -14.162 1.00 53.70 H new ATOM 0 HG3 GLU C 7 35.742 4.011 -14.541 1.00 53.70 H new ATOM 2041 N VAL C 8 36.707 5.638 -10.150 1.00 37.02 N ATOM 2042 CA VAL C 8 36.907 5.868 -8.719 1.00 40.03 C ATOM 2043 C VAL C 8 36.749 7.365 -8.377 1.00 42.94 C ATOM 2044 O VAL C 8 36.211 7.706 -7.314 1.00 46.65 O ATOM 2045 CB VAL C 8 38.255 5.319 -8.242 1.00 36.49 C ATOM 2046 CG1 VAL C 8 38.444 5.580 -6.757 1.00 35.32 C ATOM 2047 CG2 VAL C 8 38.303 3.845 -8.497 1.00 33.76 C ATOM 0 H VAL C 8 37.408 5.375 -10.573 1.00 37.02 H new ATOM 0 HA VAL C 8 36.218 5.380 -8.241 1.00 40.03 H new ATOM 0 HB VAL C 8 38.966 5.765 -8.729 1.00 36.49 H new ATOM 0 HG11 VAL C 8 39.301 5.226 -6.473 1.00 35.32 H new ATOM 0 HG12 VAL C 8 38.417 6.535 -6.590 1.00 35.32 H new ATOM 0 HG13 VAL C 8 37.734 5.145 -6.259 1.00 35.32 H new ATOM 0 HG21 VAL C 8 39.155 3.492 -8.197 1.00 33.76 H new ATOM 0 HG22 VAL C 8 37.584 3.409 -8.013 1.00 33.76 H new ATOM 0 HG23 VAL C 8 38.201 3.677 -9.447 1.00 33.76 H new ATOM 2048 N PHE C 9 37.172 8.241 -9.293 1.00 42.42 N ATOM 2049 CA PHE C 9 37.058 9.699 -9.145 1.00 42.93 C ATOM 2050 C PHE C 9 35.587 10.118 -8.981 1.00 46.76 C ATOM 2051 O PHE C 9 35.296 11.068 -8.258 1.00 51.13 O ATOM 2052 CB PHE C 9 37.655 10.392 -10.379 1.00 40.76 C ATOM 2053 CG PHE C 9 37.899 11.871 -10.201 1.00 43.01 C ATOM 2054 CD1 PHE C 9 36.864 12.778 -10.275 1.00 48.95 C ATOM 2055 CD2 PHE C 9 39.184 12.360 -9.995 1.00 43.76 C ATOM 2056 CE1 PHE C 9 37.115 14.140 -10.150 1.00 47.07 C ATOM 2057 CE2 PHE C 9 39.433 13.719 -9.872 1.00 38.39 C ATOM 2058 CZ PHE C 9 38.410 14.603 -9.948 1.00 41.56 C ATOM 0 H PHE C 9 37.540 8.001 -10.032 1.00 42.42 H new ATOM 0 HA PHE C 9 37.546 9.966 -8.351 1.00 42.93 H new ATOM 0 HB2 PHE C 9 38.494 9.961 -10.605 1.00 40.76 H new ATOM 0 HB3 PHE C 9 37.057 10.261 -11.132 1.00 40.76 H new ATOM 0 HD1 PHE C 9 35.994 12.478 -10.409 1.00 48.95 H new ATOM 0 HD2 PHE C 9 39.894 11.762 -9.938 1.00 43.76 H new ATOM 0 HE1 PHE C 9 36.411 14.746 -10.202 1.00 47.07 H new ATOM 0 HE2 PHE C 9 40.302 14.023 -9.737 1.00 38.39 H new ATOM 0 HZ PHE C 9 38.573 15.515 -9.865 1.00 41.56 H new ATOM 2059 N ARG C 10 34.671 9.446 -9.684 1.00 48.85 N ATOM 2060 CA ARG C 10 33.242 9.748 -9.584 1.00 45.89 C ATOM 2061 C ARG C 10 32.598 9.030 -8.412 1.00 43.61 C ATOM 2062 O ARG C 10 31.716 9.578 -7.758 1.00 39.88 O ATOM 2063 CB ARG C 10 32.495 9.388 -10.881 1.00 52.06 C ATOM 2064 CG ARG C 10 32.348 7.890 -11.206 1.00 60.95 C ATOM 2065 CD ARG C 10 31.287 7.655 -12.310 1.00 69.93 C ATOM 2066 NE ARG C 10 30.083 6.926 -11.868 1.00 78.88 N ATOM 2067 CZ ARG C 10 29.213 7.334 -10.931 1.00 82.95 C ATOM 2068 NH1 ARG C 10 29.378 8.485 -10.283 1.00 85.52 N ATOM 2069 NH2 ARG C 10 28.139 6.598 -10.662 1.00 80.72 N ATOM 0 H ARG C 10 34.860 8.807 -10.228 1.00 48.85 H new ATOM 0 HA ARG C 10 33.172 10.705 -9.439 1.00 45.89 H new ATOM 0 HB2 ARG C 10 31.607 9.776 -10.836 1.00 52.06 H new ATOM 0 HB3 ARG C 10 32.953 9.814 -11.622 1.00 52.06 H new ATOM 0 HG2 ARG C 10 33.203 7.534 -11.495 1.00 60.95 H new ATOM 0 HG3 ARG C 10 32.096 7.406 -10.404 1.00 60.95 H new ATOM 0 HD2 ARG C 10 31.016 8.515 -12.668 1.00 69.93 H new ATOM 0 HD3 ARG C 10 31.699 7.162 -13.037 1.00 69.93 H new ATOM 0 HE ARG C 10 29.924 6.170 -12.246 1.00 78.88 H new ATOM 0 HH11 ARG C 10 30.054 8.986 -10.461 1.00 85.52 H new ATOM 0 HH12 ARG C 10 28.809 8.728 -9.686 1.00 85.52 H new ATOM 0 HH21 ARG C 10 28.004 5.863 -11.088 1.00 80.72 H new ATOM 0 HH22 ARG C 10 27.580 6.857 -10.062 1.00 80.72 H new ATOM 2070 N GLU C 11 33.062 7.819 -8.113 1.00 45.10 N ATOM 2071 CA GLU C 11 32.483 7.053 -7.012 1.00 47.08 C ATOM 2072 C GLU C 11 32.694 7.678 -5.645 1.00 46.98 C ATOM 2073 O GLU C 11 31.833 7.590 -4.762 1.00 50.48 O ATOM 2074 CB GLU C 11 32.996 5.605 -7.005 1.00 44.38 C ATOM 2075 CG GLU C 11 32.549 4.770 -8.207 1.00 57.23 C ATOM 2076 CD GLU C 11 31.023 4.798 -8.478 1.00 64.53 C ATOM 2077 OE1 GLU C 11 30.228 4.716 -7.515 1.00 68.01 O ATOM 2078 OE2 GLU C 11 30.622 4.878 -9.669 1.00 65.88 O ATOM 0 H GLU C 11 33.704 7.426 -8.530 1.00 45.10 H new ATOM 0 HA GLU C 11 31.527 7.060 -7.179 1.00 47.08 H new ATOM 0 HB2 GLU C 11 33.965 5.617 -6.976 1.00 44.38 H new ATOM 0 HB3 GLU C 11 32.693 5.170 -6.192 1.00 44.38 H new ATOM 0 HG2 GLU C 11 33.012 5.088 -8.998 1.00 57.23 H new ATOM 0 HG3 GLU C 11 32.824 3.850 -8.068 1.00 57.23 H new ATOM 2079 N LEU C 12 33.822 8.351 -5.474 1.00 47.88 N ATOM 2080 CA LEU C 12 34.152 8.959 -4.185 1.00 47.77 C ATOM 2081 C LEU C 12 33.693 10.399 -3.906 1.00 48.42 C ATOM 2082 O LEU C 12 33.936 10.905 -2.811 1.00 51.12 O ATOM 2083 CB LEU C 12 35.670 8.858 -3.948 1.00 40.25 C ATOM 2084 CG LEU C 12 36.264 7.616 -3.283 1.00 36.45 C ATOM 2085 CD1 LEU C 12 35.975 6.391 -4.052 1.00 36.85 C ATOM 2086 CD2 LEU C 12 37.743 7.784 -3.169 1.00 37.13 C ATOM 0 H LEU C 12 34.412 8.470 -6.088 1.00 47.88 H new ATOM 0 HA LEU C 12 33.624 8.438 -3.561 1.00 47.77 H new ATOM 0 HB2 LEU C 12 36.103 8.957 -4.810 1.00 40.25 H new ATOM 0 HB3 LEU C 12 35.929 9.623 -3.411 1.00 40.25 H new ATOM 0 HG LEU C 12 35.859 7.522 -2.406 1.00 36.45 H new ATOM 0 HD11 LEU C 12 36.366 5.626 -3.602 1.00 36.85 H new ATOM 0 HD12 LEU C 12 35.015 6.270 -4.120 1.00 36.85 H new ATOM 0 HD13 LEU C 12 36.354 6.470 -4.941 1.00 36.85 H new ATOM 0 HD21 LEU C 12 38.127 6.999 -2.748 1.00 37.13 H new ATOM 0 HD22 LEU C 12 38.125 7.895 -4.054 1.00 37.13 H new ATOM 0 HD23 LEU C 12 37.939 8.567 -2.632 1.00 37.13 H new ATOM 2087 N LYS C 13 32.945 11.016 -4.816 1.00 49.94 N ATOM 2088 CA LYS C 13 32.570 12.422 -4.640 1.00 56.04 C ATOM 2089 C LYS C 13 32.213 13.022 -3.267 1.00 53.37 C ATOM 2090 O LYS C 13 32.522 14.191 -3.003 1.00 47.84 O ATOM 2091 CB LYS C 13 31.609 12.917 -5.742 1.00 65.43 C ATOM 2092 CG LYS C 13 30.306 12.142 -5.977 1.00 81.01 C ATOM 2093 CD LYS C 13 29.381 12.943 -6.941 1.00 87.28 C ATOM 2094 CE LYS C 13 28.236 12.110 -7.567 1.00 91.96 C ATOM 2095 NZ LYS C 13 28.631 11.288 -8.758 1.00 88.70 N ATOM 0 H LYS C 13 32.647 10.648 -5.533 1.00 49.94 H new ATOM 0 HA LYS C 13 33.462 12.793 -4.726 1.00 56.04 H new ATOM 0 HB2 LYS C 13 31.373 13.836 -5.538 1.00 65.43 H new ATOM 0 HB3 LYS C 13 32.100 12.929 -6.578 1.00 65.43 H new ATOM 0 HG2 LYS C 13 30.502 11.270 -6.354 1.00 81.01 H new ATOM 0 HG3 LYS C 13 29.853 11.991 -5.133 1.00 81.01 H new ATOM 0 HD2 LYS C 13 28.996 13.689 -6.456 1.00 87.28 H new ATOM 0 HD3 LYS C 13 29.922 13.317 -7.654 1.00 87.28 H new ATOM 0 HE2 LYS C 13 27.875 11.519 -6.888 1.00 91.96 H new ATOM 0 HE3 LYS C 13 27.521 12.712 -7.828 1.00 91.96 H new ATOM 0 HZ1 LYS C 13 27.923 10.841 -9.059 1.00 88.70 H new ATOM 0 HZ2 LYS C 13 28.938 11.823 -9.400 1.00 88.70 H new ATOM 0 HZ3 LYS C 13 29.267 10.712 -8.523 1.00 88.70 H new ATOM 2096 N ASP C 14 31.618 12.236 -2.376 1.00 54.70 N ATOM 2097 CA ASP C 14 31.263 12.762 -1.055 1.00 57.35 C ATOM 2098 C ASP C 14 32.454 12.962 -0.105 1.00 55.45 C ATOM 2099 O ASP C 14 32.324 13.581 0.955 1.00 54.57 O ATOM 2100 CB ASP C 14 30.195 11.896 -0.377 1.00 64.28 C ATOM 2101 CG ASP C 14 28.837 11.983 -1.063 1.00 71.05 C ATOM 2102 OD1 ASP C 14 28.656 12.840 -1.960 1.00 74.92 O ATOM 2103 OD2 ASP C 14 27.940 11.189 -0.695 1.00 76.53 O ATOM 0 H ASP C 14 31.413 11.411 -2.509 1.00 54.70 H new ATOM 0 HA ASP C 14 30.906 13.646 -1.232 1.00 57.35 H new ATOM 0 HB2 ASP C 14 30.490 10.972 -0.371 1.00 64.28 H new ATOM 0 HB3 ASP C 14 30.103 12.170 0.549 1.00 64.28 H new ATOM 2104 N LEU C 15 33.606 12.409 -0.468 1.00 51.96 N ATOM 2105 CA LEU C 15 34.808 12.536 0.349 1.00 45.10 C ATOM 2106 C LEU C 15 35.596 13.785 -0.016 1.00 44.41 C ATOM 2107 O LEU C 15 36.556 14.148 0.672 1.00 46.56 O ATOM 2108 CB LEU C 15 35.692 11.307 0.170 1.00 41.74 C ATOM 2109 CG LEU C 15 35.337 10.082 1.007 1.00 42.58 C ATOM 2110 CD1 LEU C 15 36.168 8.874 0.573 1.00 34.53 C ATOM 2111 CD2 LEU C 15 35.566 10.418 2.475 1.00 37.72 C ATOM 0 H LEU C 15 33.713 11.953 -1.189 1.00 51.96 H new ATOM 0 HA LEU C 15 34.531 12.609 1.276 1.00 45.10 H new ATOM 0 HB2 LEU C 15 35.670 11.052 -0.766 1.00 41.74 H new ATOM 0 HB3 LEU C 15 36.606 11.559 0.374 1.00 41.74 H new ATOM 0 HG LEU C 15 34.405 9.847 0.875 1.00 42.58 H new ATOM 0 HD11 LEU C 15 35.930 8.106 1.115 1.00 34.53 H new ATOM 0 HD12 LEU C 15 35.992 8.678 -0.361 1.00 34.53 H new ATOM 0 HD13 LEU C 15 37.111 9.071 0.689 1.00 34.53 H new ATOM 0 HD21 LEU C 15 35.344 9.648 3.022 1.00 37.72 H new ATOM 0 HD22 LEU C 15 36.497 10.654 2.612 1.00 37.72 H new ATOM 0 HD23 LEU C 15 35.003 11.166 2.728 1.00 37.72 H new ATOM 2112 N LYS C 16 35.206 14.430 -1.110 1.00 42.51 N ATOM 2113 CA LYS C 16 35.887 15.625 -1.549 1.00 45.56 C ATOM 2114 C LYS C 16 35.877 16.695 -0.472 1.00 48.94 C ATOM 2115 O LYS C 16 34.839 16.976 0.132 1.00 51.48 O ATOM 2116 CB LYS C 16 35.248 16.189 -2.816 1.00 51.78 C ATOM 2117 CG LYS C 16 35.932 17.468 -3.342 1.00 56.59 C ATOM 2118 CD LYS C 16 35.216 18.038 -4.566 1.00 65.74 C ATOM 2119 CE LYS C 16 35.788 19.399 -4.991 1.00 72.93 C ATOM 2120 NZ LYS C 16 35.048 20.028 -6.140 1.00 72.12 N ATOM 0 H LYS C 16 34.548 14.187 -1.608 1.00 42.51 H new ATOM 0 HA LYS C 16 36.805 15.373 -1.737 1.00 45.56 H new ATOM 0 HB2 LYS C 16 35.272 15.511 -3.509 1.00 51.78 H new ATOM 0 HB3 LYS C 16 34.314 16.381 -2.639 1.00 51.78 H new ATOM 0 HG2 LYS C 16 35.951 18.136 -2.639 1.00 56.59 H new ATOM 0 HG3 LYS C 16 36.854 17.270 -3.570 1.00 56.59 H new ATOM 0 HD2 LYS C 16 35.292 17.413 -5.304 1.00 65.74 H new ATOM 0 HD3 LYS C 16 34.271 18.133 -4.371 1.00 65.74 H new ATOM 0 HE2 LYS C 16 35.766 20.003 -4.232 1.00 72.93 H new ATOM 0 HE3 LYS C 16 36.720 19.288 -5.238 1.00 72.93 H new ATOM 0 HZ1 LYS C 16 35.422 20.810 -6.342 1.00 72.12 H new ATOM 0 HZ2 LYS C 16 35.086 19.490 -6.848 1.00 72.12 H new ATOM 0 HZ3 LYS C 16 34.198 20.156 -5.911 1.00 72.12 H new ATOM 2121 N GLY C 17 37.049 17.288 -0.252 1.00 51.42 N ATOM 2122 CA GLY C 17 37.221 18.345 0.734 1.00 45.69 C ATOM 2123 C GLY C 17 37.198 17.901 2.180 1.00 42.24 C ATOM 2124 O GLY C 17 37.735 18.569 3.053 1.00 41.35 O ATOM 0 H GLY C 17 37.770 17.085 -0.675 1.00 51.42 H new ATOM 0 HA2 GLY C 17 38.065 18.791 0.563 1.00 45.69 H new ATOM 0 HA3 GLY C 17 36.521 19.004 0.604 1.00 45.69 H new ATOM 2125 N TYR C 18 36.642 16.728 2.428 1.00 43.56 N ATOM 2126 CA TYR C 18 36.494 16.224 3.776 1.00 46.49 C ATOM 2127 C TYR C 18 37.808 15.910 4.428 1.00 48.45 C ATOM 2128 O TYR C 18 38.570 15.083 3.936 1.00 51.16 O ATOM 2129 CB TYR C 18 35.588 14.993 3.775 1.00 54.51 C ATOM 2130 CG TYR C 18 34.954 14.684 5.108 1.00 58.86 C ATOM 2131 CD1 TYR C 18 35.642 13.958 6.068 1.00 60.45 C ATOM 2132 CD2 TYR C 18 33.681 15.152 5.425 1.00 62.58 C ATOM 2133 CE1 TYR C 18 35.091 13.712 7.315 1.00 63.58 C ATOM 2134 CE2 TYR C 18 33.121 14.909 6.676 1.00 65.52 C ATOM 2135 CZ TYR C 18 33.837 14.190 7.617 1.00 64.01 C ATOM 2136 OH TYR C 18 33.324 13.974 8.884 1.00 68.41 O ATOM 0 H TYR C 18 36.340 16.202 1.818 1.00 43.56 H new ATOM 0 HA TYR C 18 36.086 16.929 4.303 1.00 46.49 H new ATOM 0 HB2 TYR C 18 34.886 15.122 3.118 1.00 54.51 H new ATOM 0 HB3 TYR C 18 36.106 14.224 3.490 1.00 54.51 H new ATOM 0 HD1 TYR C 18 36.490 13.630 5.871 1.00 60.45 H new ATOM 0 HD2 TYR C 18 33.199 15.633 4.792 1.00 62.58 H new ATOM 0 HE1 TYR C 18 35.568 13.224 7.947 1.00 63.58 H new ATOM 0 HE2 TYR C 18 32.271 15.228 6.878 1.00 65.52 H new ATOM 0 HH TYR C 18 33.847 13.481 9.318 1.00 68.41 H new ATOM 2137 N GLY C 19 38.043 16.559 5.562 1.00 50.16 N ATOM 2138 CA GLY C 19 39.274 16.360 6.307 1.00 50.67 C ATOM 2139 C GLY C 19 40.473 17.008 5.631 1.00 53.07 C ATOM 2140 O GLY C 19 41.628 16.731 5.982 1.00 57.37 O ATOM 0 H GLY C 19 37.498 17.122 5.917 1.00 50.16 H new ATOM 0 HA2 GLY C 19 39.172 16.727 7.199 1.00 50.67 H new ATOM 0 HA3 GLY C 19 39.438 15.409 6.408 1.00 50.67 H new ATOM 2141 N GLY C 20 40.203 17.877 4.659 1.00 47.29 N ATOM 2142 CA GLY C 20 41.277 18.549 3.955 1.00 43.22 C ATOM 2143 C GLY C 20 41.871 17.692 2.857 1.00 40.86 C ATOM 2144 O GLY C 20 42.956 17.992 2.345 1.00 45.33 O ATOM 0 H GLY C 20 39.411 18.086 4.398 1.00 47.29 H new ATOM 0 HA2 GLY C 20 40.942 19.375 3.572 1.00 43.22 H new ATOM 0 HA3 GLY C 20 41.973 18.790 4.586 1.00 43.22 H new ATOM 2145 N VAL C 21 41.155 16.637 2.478 1.00 37.78 N ATOM 2146 CA VAL C 21 41.621 15.723 1.433 1.00 32.82 C ATOM 2147 C VAL C 21 40.805 15.960 0.171 1.00 35.34 C ATOM 2148 O VAL C 21 39.583 15.997 0.224 1.00 41.28 O ATOM 2149 CB VAL C 21 41.516 14.232 1.853 1.00 26.51 C ATOM 2150 CG1 VAL C 21 42.450 13.394 1.012 1.00 24.08 C ATOM 2151 CG2 VAL C 21 41.874 14.055 3.306 1.00 19.89 C ATOM 0 H VAL C 21 40.391 16.430 2.815 1.00 37.78 H new ATOM 0 HA VAL C 21 42.560 15.907 1.276 1.00 32.82 H new ATOM 0 HB VAL C 21 40.599 13.946 1.717 1.00 26.51 H new ATOM 0 HG11 VAL C 21 42.380 12.464 1.279 1.00 24.08 H new ATOM 0 HG12 VAL C 21 42.209 13.480 0.076 1.00 24.08 H new ATOM 0 HG13 VAL C 21 43.362 13.699 1.140 1.00 24.08 H new ATOM 0 HG21 VAL C 21 41.802 13.118 3.545 1.00 19.89 H new ATOM 0 HG22 VAL C 21 42.784 14.357 3.454 1.00 19.89 H new ATOM 0 HG23 VAL C 21 41.267 14.576 3.855 1.00 19.89 H new ATOM 2152 N SER C 22 41.482 16.193 -0.951 1.00 37.35 N ATOM 2153 CA SER C 22 40.826 16.447 -2.234 1.00 34.82 C ATOM 2154 C SER C 22 40.555 15.155 -3.032 1.00 36.25 C ATOM 2155 O SER C 22 41.018 14.079 -2.643 1.00 36.48 O ATOM 2156 CB SER C 22 41.710 17.388 -3.055 1.00 31.31 C ATOM 2157 OG SER C 22 42.987 16.809 -3.287 1.00 30.66 O ATOM 0 H SER C 22 42.341 16.208 -0.990 1.00 37.35 H new ATOM 0 HA SER C 22 39.962 16.849 -2.054 1.00 34.82 H new ATOM 0 HB2 SER C 22 41.281 17.584 -3.902 1.00 31.31 H new ATOM 0 HB3 SER C 22 41.813 18.231 -2.587 1.00 31.31 H new ATOM 0 HG SER C 22 43.457 17.338 -3.739 1.00 30.66 H new ATOM 2158 N LEU C 23 39.812 15.251 -4.141 1.00 36.63 N ATOM 2159 CA LEU C 23 39.535 14.062 -4.953 1.00 36.39 C ATOM 2160 C LEU C 23 40.813 13.445 -5.478 1.00 35.21 C ATOM 2161 O LEU C 23 40.957 12.231 -5.375 1.00 42.28 O ATOM 2162 CB LEU C 23 38.542 14.332 -6.080 1.00 34.04 C ATOM 2163 CG LEU C 23 37.096 14.144 -5.635 1.00 36.15 C ATOM 2164 CD1 LEU C 23 36.142 14.459 -6.771 1.00 39.60 C ATOM 2165 CD2 LEU C 23 36.890 12.710 -5.140 1.00 44.29 C ATOM 0 H LEU C 23 39.466 15.981 -4.435 1.00 36.63 H new ATOM 0 HA LEU C 23 39.111 13.419 -4.364 1.00 36.39 H new ATOM 0 HB2 LEU C 23 38.663 15.238 -6.405 1.00 34.04 H new ATOM 0 HB3 LEU C 23 38.730 13.737 -6.823 1.00 34.04 H new ATOM 0 HG LEU C 23 36.909 14.758 -4.908 1.00 36.15 H new ATOM 0 HD11 LEU C 23 35.228 14.334 -6.470 1.00 39.60 H new ATOM 0 HD12 LEU C 23 36.267 15.379 -7.053 1.00 39.60 H new ATOM 0 HD13 LEU C 23 36.320 13.866 -7.517 1.00 39.60 H new ATOM 0 HD21 LEU C 23 35.969 12.594 -4.858 1.00 44.29 H new ATOM 0 HD22 LEU C 23 37.089 12.088 -5.857 1.00 44.29 H new ATOM 0 HD23 LEU C 23 37.481 12.538 -4.391 1.00 44.29 H new ATOM 2166 N PRO C 24 41.723 14.241 -6.101 1.00 33.38 N ATOM 2167 CA PRO C 24 42.992 13.693 -6.606 1.00 27.15 C ATOM 2168 C PRO C 24 43.782 12.947 -5.524 1.00 28.65 C ATOM 2169 O PRO C 24 44.366 11.910 -5.797 1.00 31.94 O ATOM 2170 CB PRO C 24 43.737 14.935 -7.068 1.00 22.86 C ATOM 2171 CG PRO C 24 42.618 15.714 -7.711 1.00 26.88 C ATOM 2172 CD PRO C 24 41.461 15.564 -6.729 1.00 29.22 C ATOM 0 HA PRO C 24 42.858 13.034 -7.305 1.00 27.15 H new ATOM 0 HB2 PRO C 24 44.143 15.416 -6.330 1.00 22.86 H new ATOM 0 HB3 PRO C 24 44.447 14.726 -7.695 1.00 22.86 H new ATOM 0 HG2 PRO C 24 42.859 16.645 -7.838 1.00 26.88 H new ATOM 0 HG3 PRO C 24 42.392 15.358 -8.585 1.00 26.88 H new ATOM 0 HD2 PRO C 24 41.453 16.278 -6.072 1.00 29.22 H new ATOM 0 HD3 PRO C 24 40.602 15.584 -7.180 1.00 29.22 H new ATOM 2173 N GLU C 25 43.776 13.436 -4.289 1.00 28.63 N ATOM 2174 CA GLU C 25 44.514 12.755 -3.247 1.00 23.78 C ATOM 2175 C GLU C 25 43.900 11.421 -2.914 1.00 26.48 C ATOM 2176 O GLU C 25 44.607 10.494 -2.538 1.00 28.74 O ATOM 2177 CB GLU C 25 44.579 13.608 -1.990 1.00 30.97 C ATOM 2178 CG GLU C 25 45.436 14.859 -2.130 1.00 33.20 C ATOM 2179 CD GLU C 25 45.600 15.634 -0.818 1.00 31.73 C ATOM 2180 OE1 GLU C 25 44.610 15.851 -0.106 1.00 31.15 O ATOM 2181 OE2 GLU C 25 46.724 16.052 -0.501 1.00 32.39 O ATOM 0 H GLU C 25 43.359 14.146 -4.042 1.00 28.63 H new ATOM 0 HA GLU C 25 45.412 12.606 -3.583 1.00 23.78 H new ATOM 0 HB2 GLU C 25 43.679 13.871 -1.742 1.00 30.97 H new ATOM 0 HB3 GLU C 25 44.927 13.069 -1.263 1.00 30.97 H new ATOM 0 HG2 GLU C 25 46.312 14.607 -2.461 1.00 33.20 H new ATOM 0 HG3 GLU C 25 45.039 15.443 -2.795 1.00 33.20 H new ATOM 2182 N TRP C 26 42.581 11.313 -3.023 1.00 29.20 N ATOM 2183 CA TRP C 26 41.892 10.050 -2.709 1.00 29.10 C ATOM 2184 C TRP C 26 42.045 8.978 -3.769 1.00 26.92 C ATOM 2185 O TRP C 26 42.200 7.811 -3.455 1.00 30.76 O ATOM 2186 CB TRP C 26 40.407 10.266 -2.408 1.00 30.24 C ATOM 2187 CG TRP C 26 40.142 10.494 -0.927 1.00 31.26 C ATOM 2188 CD1 TRP C 26 39.575 11.615 -0.364 1.00 30.32 C ATOM 2189 CD2 TRP C 26 40.456 9.615 0.165 1.00 26.60 C ATOM 2190 NE1 TRP C 26 39.530 11.467 1.006 1.00 30.37 N ATOM 2191 CE2 TRP C 26 40.062 10.258 1.354 1.00 24.86 C ATOM 2192 CE3 TRP C 26 41.041 8.343 0.254 1.00 31.23 C ATOM 2193 CZ2 TRP C 26 40.234 9.680 2.596 1.00 29.93 C ATOM 2194 CZ3 TRP C 26 41.208 7.778 1.496 1.00 25.34 C ATOM 2195 CH2 TRP C 26 40.808 8.442 2.648 1.00 31.02 C ATOM 0 H TRP C 26 42.063 11.951 -3.275 1.00 29.20 H new ATOM 0 HA TRP C 26 42.339 9.726 -1.912 1.00 29.10 H new ATOM 0 HB2 TRP C 26 40.085 11.029 -2.913 1.00 30.24 H new ATOM 0 HB3 TRP C 26 39.903 9.494 -2.709 1.00 30.24 H new ATOM 0 HD1 TRP C 26 39.270 12.357 -0.835 1.00 30.32 H new ATOM 0 HE1 TRP C 26 39.215 12.047 1.557 1.00 30.37 H new ATOM 0 HE3 TRP C 26 41.311 7.891 -0.513 1.00 31.23 H new ATOM 0 HZ2 TRP C 26 39.968 10.119 3.371 1.00 29.93 H new ATOM 0 HZ3 TRP C 26 41.596 6.936 1.566 1.00 25.34 H new ATOM 0 HH2 TRP C 26 40.934 8.034 3.474 1.00 31.02 H new ATOM 2196 N VAL C 27 42.008 9.388 -5.027 1.00 30.03 N ATOM 2197 CA VAL C 27 42.166 8.507 -6.182 1.00 27.15 C ATOM 2198 C VAL C 27 43.611 7.973 -6.206 1.00 28.51 C ATOM 2199 O VAL C 27 43.870 6.852 -6.633 1.00 37.89 O ATOM 2200 CB VAL C 27 41.794 9.295 -7.483 1.00 28.16 C ATOM 2201 CG1 VAL C 27 41.903 8.443 -8.707 1.00 30.00 C ATOM 2202 CG2 VAL C 27 40.378 9.799 -7.373 1.00 26.46 C ATOM 0 H VAL C 27 41.887 10.212 -5.243 1.00 30.03 H new ATOM 0 HA VAL C 27 41.571 7.743 -6.126 1.00 27.15 H new ATOM 0 HB VAL C 27 42.421 10.031 -7.568 1.00 28.16 H new ATOM 0 HG11 VAL C 27 41.665 8.967 -9.488 1.00 30.00 H new ATOM 0 HG12 VAL C 27 42.814 8.122 -8.798 1.00 30.00 H new ATOM 0 HG13 VAL C 27 41.301 7.687 -8.630 1.00 30.00 H new ATOM 0 HG21 VAL C 27 40.145 10.288 -8.178 1.00 26.46 H new ATOM 0 HG22 VAL C 27 39.774 9.047 -7.265 1.00 26.46 H new ATOM 0 HG23 VAL C 27 40.302 10.387 -6.605 1.00 26.46 H new ATOM 2203 N CYS C 28 44.549 8.771 -5.717 1.00 26.98 N ATOM 2204 CA CYS C 28 45.937 8.371 -5.656 1.00 27.89 C ATOM 2205 C CYS C 28 46.151 7.454 -4.451 1.00 33.77 C ATOM 2206 O CYS C 28 46.788 6.391 -4.548 1.00 36.62 O ATOM 2207 CB CYS C 28 46.811 9.602 -5.482 1.00 26.43 C ATOM 2208 SG CYS C 28 48.563 9.247 -5.221 1.00 23.32 S ATOM 0 H CYS C 28 44.395 9.560 -5.412 1.00 26.98 H new ATOM 0 HA CYS C 28 46.170 7.907 -6.475 1.00 27.89 H new ATOM 0 HB2 CYS C 28 46.720 10.163 -6.268 1.00 26.43 H new ATOM 0 HB3 CYS C 28 46.481 10.115 -4.728 1.00 26.43 H new ATOM 2209 N THR C 29 45.606 7.866 -3.309 1.00 35.58 N ATOM 2210 CA THR C 29 45.746 7.113 -2.062 1.00 30.09 C ATOM 2211 C THR C 29 45.173 5.719 -2.257 1.00 31.64 C ATOM 2212 O THR C 29 45.881 4.719 -2.077 1.00 35.01 O ATOM 2213 CB THR C 29 45.074 7.868 -0.863 1.00 22.08 C ATOM 2214 OG1 THR C 29 45.714 9.129 -0.675 1.00 25.43 O ATOM 2215 CG2 THR C 29 45.216 7.114 0.427 1.00 16.06 C ATOM 0 H THR C 29 45.145 8.588 -3.234 1.00 35.58 H new ATOM 0 HA THR C 29 46.686 7.031 -1.837 1.00 30.09 H new ATOM 0 HB THR C 29 44.134 7.965 -1.082 1.00 22.08 H new ATOM 0 HG1 THR C 29 45.511 9.643 -1.307 1.00 25.43 H new ATOM 0 HG21 THR C 29 44.789 7.612 1.142 1.00 16.06 H new ATOM 0 HG22 THR C 29 44.794 6.245 0.342 1.00 16.06 H new ATOM 0 HG23 THR C 29 46.157 6.997 0.632 1.00 16.06 H new ATOM 2216 N THR C 30 43.939 5.652 -2.743 1.00 31.12 N ATOM 2217 CA THR C 30 43.301 4.371 -2.945 1.00 28.99 C ATOM 2218 C THR C 30 44.027 3.517 -3.993 1.00 31.98 C ATOM 2219 O THR C 30 44.104 2.291 -3.834 1.00 32.93 O ATOM 2220 CB THR C 30 41.788 4.507 -3.256 1.00 25.12 C ATOM 2221 OG1 THR C 30 41.598 5.232 -4.466 1.00 27.15 O ATOM 2222 CG2 THR C 30 41.060 5.220 -2.121 1.00 24.45 C ATOM 0 H THR C 30 43.462 6.334 -2.959 1.00 31.12 H new ATOM 0 HA THR C 30 43.370 3.897 -2.101 1.00 28.99 H new ATOM 0 HB THR C 30 41.421 3.614 -3.351 1.00 25.12 H new ATOM 0 HG1 THR C 30 41.743 6.048 -4.330 1.00 27.15 H new ATOM 0 HG21 THR C 30 40.117 5.294 -2.337 1.00 24.45 H new ATOM 0 HG22 THR C 30 41.165 4.713 -1.300 1.00 24.45 H new ATOM 0 HG23 THR C 30 41.434 6.107 -2.003 1.00 24.45 H new ATOM 2223 N PHE C 31 44.589 4.131 -5.038 1.00 30.60 N ATOM 2224 CA PHE C 31 45.305 3.340 -6.029 1.00 27.60 C ATOM 2225 C PHE C 31 46.414 2.544 -5.384 1.00 30.90 C ATOM 2226 O PHE C 31 46.486 1.340 -5.590 1.00 39.48 O ATOM 2227 CB PHE C 31 45.930 4.166 -7.139 1.00 23.72 C ATOM 2228 CG PHE C 31 46.700 3.313 -8.141 1.00 24.88 C ATOM 2229 CD1 PHE C 31 46.038 2.415 -8.957 1.00 19.52 C ATOM 2230 CD2 PHE C 31 48.077 3.339 -8.196 1.00 24.42 C ATOM 2231 CE1 PHE C 31 46.727 1.563 -9.787 1.00 19.74 C ATOM 2232 CE2 PHE C 31 48.772 2.476 -9.032 1.00 21.12 C ATOM 2233 CZ PHE C 31 48.087 1.595 -9.819 1.00 18.64 C ATOM 0 H PHE C 31 44.567 4.978 -5.185 1.00 30.60 H new ATOM 0 HA PHE C 31 44.630 2.762 -6.418 1.00 27.60 H new ATOM 0 HB2 PHE C 31 45.234 4.656 -7.604 1.00 23.72 H new ATOM 0 HB3 PHE C 31 46.529 4.823 -6.751 1.00 23.72 H new ATOM 0 HD1 PHE C 31 45.109 2.387 -8.944 1.00 19.52 H new ATOM 0 HD2 PHE C 31 48.546 3.942 -7.666 1.00 24.42 H new ATOM 0 HE1 PHE C 31 46.263 0.964 -10.327 1.00 19.74 H new ATOM 0 HE2 PHE C 31 49.701 2.498 -9.056 1.00 21.12 H new ATOM 0 HZ PHE C 31 48.551 1.015 -10.379 1.00 18.64 H new ATOM 2234 N HIS C 32 47.269 3.204 -4.605 1.00 30.50 N ATOM 2235 CA HIS C 32 48.387 2.544 -3.937 1.00 27.70 C ATOM 2236 C HIS C 32 47.997 1.677 -2.760 1.00 30.51 C ATOM 2237 O HIS C 32 48.799 0.886 -2.269 1.00 36.73 O ATOM 2238 CB HIS C 32 49.431 3.564 -3.469 1.00 30.36 C ATOM 2239 CG HIS C 32 50.044 4.352 -4.579 1.00 28.91 C ATOM 2240 ND1 HIS C 32 50.968 3.816 -5.454 1.00 30.64 N ATOM 2241 CD2 HIS C 32 49.841 5.624 -4.980 1.00 30.05 C ATOM 2242 CE1 HIS C 32 51.303 4.728 -6.345 1.00 27.91 C ATOM 2243 NE2 HIS C 32 50.634 5.836 -6.081 1.00 31.95 N ATOM 0 H HIS C 32 47.216 4.048 -4.449 1.00 30.50 H new ATOM 0 HA HIS C 32 48.757 1.955 -4.613 1.00 27.70 H new ATOM 0 HB2 HIS C 32 49.015 4.175 -2.841 1.00 30.36 H new ATOM 0 HB3 HIS C 32 50.133 3.098 -2.988 1.00 30.36 H new ATOM 0 HD2 HIS C 32 49.270 6.242 -4.584 1.00 30.05 H new ATOM 0 HE1 HIS C 32 51.908 4.611 -7.042 1.00 27.91 H new ATOM 0 HE2 HIS C 32 50.686 6.570 -6.526 1.00 31.95 H new ATOM 2244 N THR C 33 46.791 1.882 -2.265 1.00 31.34 N ATOM 2245 CA THR C 33 46.280 1.122 -1.148 1.00 30.43 C ATOM 2246 C THR C 33 45.699 -0.247 -1.579 1.00 30.66 C ATOM 2247 O THR C 33 46.123 -1.284 -1.079 1.00 30.24 O ATOM 2248 CB THR C 33 45.202 1.967 -0.384 1.00 34.04 C ATOM 2249 OG1 THR C 33 45.823 3.085 0.276 1.00 27.14 O ATOM 2250 CG2 THR C 33 44.460 1.114 0.636 1.00 34.46 C ATOM 0 H THR C 33 46.243 2.470 -2.571 1.00 31.34 H new ATOM 0 HA THR C 33 47.024 0.932 -0.555 1.00 30.43 H new ATOM 0 HB THR C 33 44.561 2.294 -1.035 1.00 34.04 H new ATOM 0 HG1 THR C 33 45.948 3.704 -0.278 1.00 27.14 H new ATOM 0 HG21 THR C 33 43.800 1.658 1.094 1.00 34.46 H new ATOM 0 HG22 THR C 33 44.015 0.381 0.183 1.00 34.46 H new ATOM 0 HG23 THR C 33 45.091 0.759 1.282 1.00 34.46 H new ATOM 2251 N SER C 34 44.801 -0.249 -2.564 1.00 31.21 N ATOM 2252 CA SER C 34 44.133 -1.472 -3.004 1.00 30.65 C ATOM 2253 C SER C 34 44.060 -1.750 -4.499 1.00 33.20 C ATOM 2254 O SER C 34 43.318 -2.623 -4.918 1.00 35.23 O ATOM 2255 CB SER C 34 42.710 -1.424 -2.495 1.00 28.29 C ATOM 2256 OG SER C 34 42.048 -0.339 -3.120 1.00 25.86 O ATOM 0 H SER C 34 44.563 0.457 -2.994 1.00 31.21 H new ATOM 0 HA SER C 34 44.686 -2.185 -2.646 1.00 30.65 H new ATOM 0 HB2 SER C 34 42.253 -2.257 -2.692 1.00 28.29 H new ATOM 0 HB3 SER C 34 42.700 -1.316 -1.531 1.00 28.29 H new ATOM 0 HG SER C 34 41.949 0.285 -2.567 1.00 25.86 H new ATOM 2257 N GLY C 35 44.761 -0.983 -5.320 1.00 36.83 N ATOM 2258 CA GLY C 35 44.725 -1.225 -6.759 1.00 36.06 C ATOM 2259 C GLY C 35 43.358 -1.010 -7.394 1.00 39.71 C ATOM 2260 O GLY C 35 43.122 -1.376 -8.551 1.00 38.66 O ATOM 0 H GLY C 35 45.258 -0.326 -5.072 1.00 36.83 H new ATOM 0 HA2 GLY C 35 45.367 -0.640 -7.191 1.00 36.06 H new ATOM 0 HA3 GLY C 35 45.011 -2.136 -6.931 1.00 36.06 H new ATOM 2261 N TYR C 36 42.484 -0.328 -6.658 1.00 42.19 N ATOM 2262 CA TYR C 36 41.125 -0.034 -7.100 1.00 43.92 C ATOM 2263 C TYR C 36 40.314 -1.322 -7.076 1.00 49.33 C ATOM 2264 O TYR C 36 39.323 -1.468 -7.799 1.00 56.23 O ATOM 2265 CB TYR C 36 41.108 0.570 -8.513 1.00 38.87 C ATOM 2266 CG TYR C 36 41.738 1.949 -8.662 1.00 32.95 C ATOM 2267 CD1 TYR C 36 41.692 2.894 -7.632 1.00 33.16 C ATOM 2268 CD2 TYR C 36 42.359 2.316 -9.846 1.00 31.16 C ATOM 2269 CE1 TYR C 36 42.241 4.155 -7.791 1.00 25.66 C ATOM 2270 CE2 TYR C 36 42.912 3.573 -10.010 1.00 28.11 C ATOM 2271 CZ TYR C 36 42.846 4.477 -8.985 1.00 22.84 C ATOM 2272 OH TYR C 36 43.377 5.723 -9.169 1.00 30.93 O ATOM 0 H TYR C 36 42.667 -0.019 -5.877 1.00 42.19 H new ATOM 0 HA TYR C 36 40.737 0.621 -6.499 1.00 43.92 H new ATOM 0 HB2 TYR C 36 41.566 -0.041 -9.111 1.00 38.87 H new ATOM 0 HB3 TYR C 36 40.187 0.622 -8.811 1.00 38.87 H new ATOM 0 HD1 TYR C 36 41.285 2.671 -6.826 1.00 33.16 H new ATOM 0 HD2 TYR C 36 42.405 1.704 -10.545 1.00 31.16 H new ATOM 0 HE1 TYR C 36 42.202 4.776 -7.100 1.00 25.66 H new ATOM 0 HE2 TYR C 36 43.326 3.802 -10.811 1.00 28.11 H new ATOM 0 HH TYR C 36 43.581 6.054 -8.424 1.00 30.93 H new ATOM 2273 N ASP C 37 40.717 -2.238 -6.208 1.00 50.87 N ATOM 2274 CA ASP C 37 40.053 -3.525 -6.091 1.00 51.82 C ATOM 2275 C ASP C 37 39.142 -3.530 -4.878 1.00 51.72 C ATOM 2276 O ASP C 37 39.581 -3.760 -3.761 1.00 50.41 O ATOM 2277 CB ASP C 37 41.106 -4.626 -5.969 1.00 55.67 C ATOM 2278 CG ASP C 37 40.532 -6.014 -6.110 1.00 56.67 C ATOM 2279 OD1 ASP C 37 39.310 -6.204 -5.921 1.00 53.78 O ATOM 2280 OD2 ASP C 37 41.332 -6.929 -6.402 1.00 59.51 O ATOM 0 H ASP C 37 41.381 -2.131 -5.672 1.00 50.87 H new ATOM 0 HA ASP C 37 39.514 -3.685 -6.881 1.00 51.82 H new ATOM 0 HB2 ASP C 37 41.785 -4.493 -6.648 1.00 55.67 H new ATOM 0 HB3 ASP C 37 41.547 -4.550 -5.108 1.00 55.67 H new ATOM 2281 N THR C 38 37.860 -3.303 -5.108 1.00 55.16 N ATOM 2282 CA THR C 38 36.887 -3.280 -4.020 1.00 60.71 C ATOM 2283 C THR C 38 36.693 -4.619 -3.272 1.00 63.02 C ATOM 2284 O THR C 38 35.972 -4.681 -2.267 1.00 59.40 O ATOM 2285 CB THR C 38 35.550 -2.782 -4.538 1.00 63.25 C ATOM 2286 OG1 THR C 38 35.286 -3.399 -5.809 1.00 66.19 O ATOM 2287 CG2 THR C 38 35.590 -1.287 -4.734 1.00 69.03 C ATOM 0 H THR C 38 37.528 -3.159 -5.888 1.00 55.16 H new ATOM 0 HA THR C 38 37.259 -2.674 -3.360 1.00 60.71 H new ATOM 0 HB THR C 38 34.859 -3.005 -3.895 1.00 63.25 H new ATOM 0 HG1 THR C 38 34.657 -3.950 -5.728 1.00 66.19 H new ATOM 0 HG21 THR C 38 34.731 -0.981 -5.065 1.00 69.03 H new ATOM 0 HG22 THR C 38 35.783 -0.854 -3.887 1.00 69.03 H new ATOM 0 HG23 THR C 38 36.282 -1.063 -5.376 1.00 69.03 H new ATOM 2288 N GLN C 39 37.323 -5.679 -3.781 1.00 62.34 N ATOM 2289 CA GLN C 39 37.216 -6.996 -3.164 1.00 61.03 C ATOM 2290 C GLN C 39 38.379 -7.264 -2.210 1.00 58.71 C ATOM 2291 O GLN C 39 38.277 -7.320 -0.970 1.00 60.85 O ATOM 2292 CB GLN C 39 37.284 -8.033 -4.282 1.00 65.99 C ATOM 2293 CG GLN C 39 35.950 -8.625 -4.663 1.00 74.85 C ATOM 2294 CD GLN C 39 36.125 -9.785 -5.652 1.00 76.82 C ATOM 2295 OE1 GLN C 39 36.986 -10.657 -5.550 1.00 80.04 O ATOM 2296 NE2 GLN C 39 35.219 -9.751 -6.659 1.00 74.62 N ATOM 0 H GLN C 39 37.817 -5.654 -4.484 1.00 62.34 H new ATOM 0 HA GLN C 39 36.387 -7.042 -2.663 1.00 61.03 H new ATOM 0 HB2 GLN C 39 37.679 -7.622 -5.067 1.00 65.99 H new ATOM 0 HB3 GLN C 39 37.878 -8.750 -4.008 1.00 65.99 H new ATOM 0 HG2 GLN C 39 35.493 -8.940 -3.867 1.00 74.85 H new ATOM 0 HG3 GLN C 39 35.390 -7.940 -5.059 1.00 74.85 H new ATOM 0 HE21 GLN C 39 34.634 -9.121 -6.690 1.00 74.62 H new ATOM 0 HE22 GLN C 39 35.229 -10.359 -7.267 1.00 74.62 H new ATOM 2297 N ALA C 40 39.595 -7.198 -2.733 1.00 55.61 N ATOM 2298 CA ALA C 40 40.826 -7.452 -1.982 1.00 54.79 C ATOM 2299 C ALA C 40 40.769 -7.468 -0.451 1.00 53.60 C ATOM 2300 O ALA C 40 40.260 -6.548 0.186 1.00 52.00 O ATOM 2301 CB ALA C 40 41.941 -6.520 -2.469 1.00 57.59 C ATOM 0 H ALA C 40 39.736 -6.999 -3.558 1.00 55.61 H new ATOM 0 HA ALA C 40 41.008 -8.383 -2.186 1.00 54.79 H new ATOM 0 HB1 ALA C 40 42.752 -6.695 -1.966 1.00 57.59 H new ATOM 0 HB2 ALA C 40 42.105 -6.677 -3.412 1.00 57.59 H new ATOM 0 HB3 ALA C 40 41.672 -5.597 -2.337 1.00 57.59 H new ATOM 2302 N ILE C 41 41.356 -8.520 0.108 1.00 57.38 N ATOM 2303 CA ILE C 41 41.444 -8.769 1.551 1.00 61.01 C ATOM 2304 C ILE C 41 42.921 -9.037 1.843 1.00 63.38 C ATOM 2305 O ILE C 41 43.598 -9.679 1.039 1.00 64.65 O ATOM 2306 CB ILE C 41 40.682 -10.080 1.934 1.00 62.42 C ATOM 2307 CG1 ILE C 41 39.248 -10.055 1.412 1.00 60.15 C ATOM 2308 CG2 ILE C 41 40.712 -10.319 3.431 1.00 57.86 C ATOM 2309 CD1 ILE C 41 38.645 -11.425 1.321 1.00 64.91 C ATOM 0 H ILE C 41 41.731 -9.137 -0.359 1.00 57.38 H new ATOM 0 HA ILE C 41 41.071 -8.018 2.039 1.00 61.01 H new ATOM 0 HB ILE C 41 41.142 -10.821 1.509 1.00 62.42 H new ATOM 0 HG12 ILE C 41 38.704 -9.504 1.996 1.00 60.15 H new ATOM 0 HG13 ILE C 41 39.233 -9.640 0.536 1.00 60.15 H new ATOM 0 HG21 ILE C 41 40.233 -11.137 3.638 1.00 57.86 H new ATOM 0 HG22 ILE C 41 41.632 -10.400 3.728 1.00 57.86 H new ATOM 0 HG23 ILE C 41 40.290 -9.574 3.886 1.00 57.86 H new ATOM 0 HD11 ILE C 41 37.737 -11.358 0.986 1.00 64.91 H new ATOM 0 HD12 ILE C 41 39.172 -11.971 0.718 1.00 64.91 H new ATOM 0 HD13 ILE C 41 38.635 -11.833 2.201 1.00 64.91 H new ATOM 2310 N VAL C 42 43.430 -8.567 2.978 1.00 66.06 N ATOM 2311 CA VAL C 42 44.830 -8.817 3.310 1.00 69.48 C ATOM 2312 C VAL C 42 44.988 -9.232 4.760 1.00 72.91 C ATOM 2313 O VAL C 42 44.839 -8.416 5.676 1.00 69.16 O ATOM 2314 CB VAL C 42 45.741 -7.602 3.028 1.00 71.24 C ATOM 2315 CG1 VAL C 42 47.163 -7.882 3.516 1.00 71.64 C ATOM 2316 CG2 VAL C 42 45.761 -7.299 1.541 1.00 68.30 C ATOM 0 H VAL C 42 42.992 -8.110 3.560 1.00 66.06 H new ATOM 0 HA VAL C 42 45.111 -9.543 2.731 1.00 69.48 H new ATOM 0 HB VAL C 42 45.389 -6.834 3.505 1.00 71.24 H new ATOM 0 HG11 VAL C 42 47.725 -7.113 3.334 1.00 71.64 H new ATOM 0 HG12 VAL C 42 47.150 -8.053 4.471 1.00 71.64 H new ATOM 0 HG13 VAL C 42 47.517 -8.658 3.054 1.00 71.64 H new ATOM 0 HG21 VAL C 42 46.335 -6.535 1.374 1.00 68.30 H new ATOM 0 HG22 VAL C 42 46.099 -8.069 1.058 1.00 68.30 H new ATOM 0 HG23 VAL C 42 44.861 -7.099 1.239 1.00 68.30 H new ATOM 2317 N GLN C 43 45.183 -10.536 4.953 1.00 79.35 N ATOM 2318 CA GLN C 43 45.389 -11.112 6.271 1.00 86.02 C ATOM 2319 C GLN C 43 46.841 -10.774 6.628 1.00 88.86 C ATOM 2320 O GLN C 43 47.756 -11.023 5.838 1.00 89.68 O ATOM 2321 CB GLN C 43 45.188 -12.631 6.222 1.00 88.47 C ATOM 2322 CG GLN C 43 45.357 -13.341 7.562 1.00 94.15 C ATOM 2323 CD GLN C 43 44.047 -13.531 8.305 1.00 97.42 C ATOM 2324 OE1 GLN C 43 43.049 -13.960 7.721 1.00 98.06 O ATOM 2325 NE2 GLN C 43 44.054 -13.252 9.607 1.00 99.46 N ATOM 0 H GLN C 43 45.199 -11.112 4.315 1.00 79.35 H new ATOM 0 HA GLN C 43 44.763 -10.765 6.926 1.00 86.02 H new ATOM 0 HB2 GLN C 43 44.299 -12.816 5.882 1.00 88.47 H new ATOM 0 HB3 GLN C 43 45.818 -13.008 5.588 1.00 88.47 H new ATOM 0 HG2 GLN C 43 45.767 -14.208 7.413 1.00 94.15 H new ATOM 0 HG3 GLN C 43 45.967 -12.831 8.118 1.00 94.15 H new ATOM 0 HE21 GLN C 43 44.770 -12.954 9.979 1.00 99.46 H new ATOM 0 HE22 GLN C 43 43.343 -13.370 10.076 1.00 99.46 H new ATOM 2326 N ASN C 44 47.034 -10.142 7.779 1.00 91.22 N ATOM 2327 CA ASN C 44 48.356 -9.724 8.238 1.00 94.58 C ATOM 2328 C ASN C 44 48.696 -10.474 9.533 1.00 96.74 C ATOM 2329 O ASN C 44 48.716 -11.704 9.552 1.00 95.00 O ATOM 2330 CB ASN C 44 48.346 -8.191 8.425 1.00 97.68 C ATOM 2331 CG ASN C 44 49.718 -7.606 8.764 1.00 99.09 C ATOM 2332 OD1 ASN C 44 49.806 -6.701 9.589 1.00 99.82 O ATOM 2333 ND2 ASN C 44 50.778 -8.097 8.123 1.00101.16 N ATOM 0 H ASN C 44 46.397 -9.941 8.321 1.00 91.22 H new ATOM 0 HA ASN C 44 49.044 -9.941 7.589 1.00 94.58 H new ATOM 0 HB2 ASN C 44 48.018 -7.776 7.612 1.00 97.68 H new ATOM 0 HB3 ASN C 44 47.722 -7.963 9.132 1.00 97.68 H new ATOM 0 HD21 ASN C 44 51.561 -7.779 8.281 1.00101.16 H new ATOM 0 HD22 ASN C 44 50.679 -8.732 7.551 1.00101.16 H new ATOM 2334 N ASN C 45 48.947 -9.740 10.612 1.00 99.92 N ATOM 2335 CA ASN C 45 49.278 -10.335 11.908 1.00102.68 C ATOM 2336 C ASN C 45 47.957 -10.626 12.662 1.00102.27 C ATOM 2337 O ASN C 45 47.325 -11.670 12.452 1.00102.28 O ATOM 2338 CB ASN C 45 50.212 -9.365 12.665 1.00105.17 C ATOM 2339 CG ASN C 45 50.401 -9.719 14.138 1.00107.51 C ATOM 2340 OD1 ASN C 45 50.025 -8.944 15.018 1.00107.16 O ATOM 2341 ND2 ASN C 45 51.005 -10.869 14.408 1.00109.85 N ATOM 0 H ASN C 45 48.931 -8.880 10.616 1.00 99.92 H new ATOM 0 HA ASN C 45 49.750 -11.177 11.817 1.00102.68 H new ATOM 0 HB2 ASN C 45 51.078 -9.357 12.229 1.00105.17 H new ATOM 0 HB3 ASN C 45 49.853 -8.466 12.600 1.00105.17 H new ATOM 0 HD21 ASN C 45 51.148 -11.098 15.224 1.00109.85 H new ATOM 0 HD22 ASN C 45 51.254 -11.385 13.767 1.00109.85 H new ATOM 2342 N ASP C 46 47.519 -9.694 13.502 1.00 99.78 N ATOM 2343 CA ASP C 46 46.266 -9.843 14.242 1.00 97.93 C ATOM 2344 C ASP C 46 45.266 -8.945 13.505 1.00 94.66 C ATOM 2345 O ASP C 46 44.434 -8.269 14.123 1.00 96.72 O ATOM 2346 CB ASP C 46 46.455 -9.348 15.689 1.00100.65 C ATOM 2347 CG ASP C 46 46.565 -10.485 16.716 1.00103.24 C ATOM 2348 OD1 ASP C 46 46.599 -11.682 16.340 1.00104.32 O ATOM 2349 OD2 ASP C 46 46.608 -10.158 17.926 1.00103.25 O ATOM 0 H ASP C 46 47.937 -8.959 13.660 1.00 99.78 H new ATOM 0 HA ASP C 46 45.967 -10.765 14.286 1.00 97.93 H new ATOM 0 HB2 ASP C 46 47.256 -8.802 15.735 1.00100.65 H new ATOM 0 HB3 ASP C 46 45.708 -8.777 15.928 1.00100.65 H new ATOM 2350 N SER C 47 45.308 -8.992 12.176 1.00 87.11 N ATOM 2351 CA SER C 47 44.464 -8.117 11.387 1.00 75.80 C ATOM 2352 C SER C 47 44.146 -8.585 9.971 1.00 70.05 C ATOM 2353 O SER C 47 44.918 -9.327 9.364 1.00 71.12 O ATOM 2354 CB SER C 47 45.183 -6.771 11.291 1.00 75.45 C ATOM 2355 OG SER C 47 46.583 -6.975 11.115 1.00 70.49 O ATOM 0 H SER C 47 45.813 -9.518 11.721 1.00 87.11 H new ATOM 0 HA SER C 47 43.607 -8.086 11.841 1.00 75.80 H new ATOM 0 HB2 SER C 47 44.828 -6.259 10.548 1.00 75.45 H new ATOM 0 HB3 SER C 47 45.023 -6.253 12.095 1.00 75.45 H new ATOM 0 HG SER C 47 46.970 -6.231 11.062 1.00 70.49 H new ATOM 2356 N THR C 48 43.013 -8.125 9.457 1.00 61.89 N ATOM 2357 CA THR C 48 42.585 -8.398 8.091 1.00 55.70 C ATOM 2358 C THR C 48 41.972 -7.093 7.569 1.00 53.15 C ATOM 2359 O THR C 48 41.235 -6.406 8.283 1.00 53.37 O ATOM 2360 CB THR C 48 41.628 -9.589 8.004 1.00 52.75 C ATOM 2361 OG1 THR C 48 42.372 -10.781 8.258 1.00 52.01 O ATOM 2362 CG2 THR C 48 41.028 -9.707 6.618 1.00 48.67 C ATOM 0 H THR C 48 42.461 -7.636 9.900 1.00 61.89 H new ATOM 0 HA THR C 48 43.335 -8.665 7.537 1.00 55.70 H new ATOM 0 HB THR C 48 40.916 -9.461 8.650 1.00 52.75 H new ATOM 0 HG1 THR C 48 41.860 -11.446 8.215 1.00 52.01 H new ATOM 0 HG21 THR C 48 40.427 -10.468 6.589 1.00 48.67 H new ATOM 0 HG22 THR C 48 40.536 -8.898 6.408 1.00 48.67 H new ATOM 0 HG23 THR C 48 41.737 -9.831 5.968 1.00 48.67 H new ATOM 2363 N GLU C 49 42.366 -6.701 6.365 1.00 50.52 N ATOM 2364 CA GLU C 49 41.909 -5.452 5.786 1.00 47.18 C ATOM 2365 C GLU C 49 41.090 -5.704 4.540 1.00 44.52 C ATOM 2366 O GLU C 49 41.499 -6.484 3.670 1.00 39.35 O ATOM 2367 CB GLU C 49 43.125 -4.572 5.504 1.00 51.17 C ATOM 2368 CG GLU C 49 43.813 -4.143 6.802 1.00 53.94 C ATOM 2369 CD GLU C 49 45.310 -3.887 6.670 1.00 58.33 C ATOM 2370 OE1 GLU C 49 45.913 -4.277 5.651 1.00 68.59 O ATOM 2371 OE2 GLU C 49 45.889 -3.300 7.613 1.00 56.88 O ATOM 0 H GLU C 49 42.903 -7.150 5.865 1.00 50.52 H new ATOM 0 HA GLU C 49 41.326 -4.990 6.409 1.00 47.18 H new ATOM 0 HB2 GLU C 49 43.754 -5.055 4.946 1.00 51.17 H new ATOM 0 HB3 GLU C 49 42.850 -3.786 5.006 1.00 51.17 H new ATOM 0 HG2 GLU C 49 43.386 -3.336 7.129 1.00 53.94 H new ATOM 0 HG3 GLU C 49 43.672 -4.830 7.472 1.00 53.94 H new ATOM 2372 N TYR C 50 39.936 -5.040 4.469 1.00 42.57 N ATOM 2373 CA TYR C 50 38.998 -5.216 3.365 1.00 43.58 C ATOM 2374 C TYR C 50 38.710 -4.087 2.402 1.00 40.88 C ATOM 2375 O TYR C 50 38.532 -2.939 2.808 1.00 41.16 O ATOM 2376 CB TYR C 50 37.628 -5.597 3.911 1.00 50.18 C ATOM 2377 CG TYR C 50 37.616 -6.781 4.825 1.00 60.17 C ATOM 2378 CD1 TYR C 50 37.941 -6.637 6.170 1.00 64.05 C ATOM 2379 CD2 TYR C 50 37.275 -8.047 4.353 1.00 61.14 C ATOM 2380 CE1 TYR C 50 37.927 -7.717 7.022 1.00 69.00 C ATOM 2381 CE2 TYR C 50 37.258 -9.132 5.193 1.00 69.45 C ATOM 2382 CZ TYR C 50 37.589 -8.957 6.529 1.00 71.74 C ATOM 2383 OH TYR C 50 37.604 -10.029 7.387 1.00 81.78 O ATOM 0 H TYR C 50 39.676 -4.474 5.062 1.00 42.57 H new ATOM 0 HA TYR C 50 39.480 -5.882 2.850 1.00 43.58 H new ATOM 0 HB2 TYR C 50 37.261 -4.835 4.387 1.00 50.18 H new ATOM 0 HB3 TYR C 50 37.036 -5.777 3.164 1.00 50.18 H new ATOM 0 HD1 TYR C 50 38.171 -5.798 6.498 1.00 64.05 H new ATOM 0 HD2 TYR C 50 37.056 -8.158 3.456 1.00 61.14 H new ATOM 0 HE1 TYR C 50 38.143 -7.611 7.920 1.00 69.00 H new ATOM 0 HE2 TYR C 50 37.028 -9.974 4.871 1.00 69.45 H new ATOM 0 HH TYR C 50 37.380 -10.724 6.971 1.00 81.78 H new ATOM 2384 N GLY C 51 38.484 -4.480 1.155 1.00 38.03 N ATOM 2385 CA GLY C 51 38.092 -3.561 0.106 1.00 40.56 C ATOM 2386 C GLY C 51 39.022 -2.509 -0.440 1.00 38.83 C ATOM 2387 O GLY C 51 40.235 -2.593 -0.276 1.00 41.99 O ATOM 0 H GLY C 51 38.556 -5.297 0.895 1.00 38.03 H new ATOM 0 HA2 GLY C 51 37.814 -4.104 -0.648 1.00 40.56 H new ATOM 0 HA3 GLY C 51 37.304 -3.095 0.426 1.00 40.56 H new ATOM 2388 N LEU C 52 38.414 -1.496 -1.059 1.00 38.64 N ATOM 2389 CA LEU C 52 39.101 -0.354 -1.668 1.00 36.62 C ATOM 2390 C LEU C 52 40.006 0.414 -0.698 1.00 36.87 C ATOM 2391 O LEU C 52 41.166 0.668 -1.021 1.00 39.69 O ATOM 2392 CB LEU C 52 38.047 0.606 -2.219 1.00 32.96 C ATOM 2393 CG LEU C 52 38.354 1.772 -3.158 1.00 37.34 C ATOM 2394 CD1 LEU C 52 38.540 1.283 -4.587 1.00 30.92 C ATOM 2395 CD2 LEU C 52 37.195 2.764 -3.101 1.00 37.24 C ATOM 0 H LEU C 52 37.559 -1.453 -1.139 1.00 38.64 H new ATOM 0 HA LEU C 52 39.676 -0.708 -2.364 1.00 36.62 H new ATOM 0 HB2 LEU C 52 37.393 0.055 -2.677 1.00 32.96 H new ATOM 0 HB3 LEU C 52 37.602 0.991 -1.447 1.00 32.96 H new ATOM 0 HG LEU C 52 39.178 2.199 -2.876 1.00 37.34 H new ATOM 0 HD11 LEU C 52 38.734 2.038 -5.165 1.00 30.92 H new ATOM 0 HD12 LEU C 52 39.277 0.653 -4.620 1.00 30.92 H new ATOM 0 HD13 LEU C 52 37.728 0.846 -4.888 1.00 30.92 H new ATOM 0 HD21 LEU C 52 37.378 3.510 -3.694 1.00 37.24 H new ATOM 0 HD22 LEU C 52 36.377 2.323 -3.380 1.00 37.24 H new ATOM 0 HD23 LEU C 52 37.092 3.090 -2.193 1.00 37.24 H new ATOM 2396 N PHE C 53 39.488 0.724 0.497 1.00 39.70 N ATOM 2397 CA PHE C 53 40.195 1.495 1.541 1.00 40.00 C ATOM 2398 C PHE C 53 40.997 0.682 2.575 1.00 43.98 C ATOM 2399 O PHE C 53 41.558 1.265 3.509 1.00 44.65 O ATOM 2400 CB PHE C 53 39.191 2.386 2.330 1.00 38.30 C ATOM 2401 CG PHE C 53 38.422 3.395 1.485 1.00 37.44 C ATOM 2402 CD1 PHE C 53 38.959 4.633 1.188 1.00 36.76 C ATOM 2403 CD2 PHE C 53 37.136 3.115 1.039 1.00 37.44 C ATOM 2404 CE1 PHE C 53 38.229 5.566 0.471 1.00 34.98 C ATOM 2405 CE2 PHE C 53 36.407 4.049 0.321 1.00 36.69 C ATOM 2406 CZ PHE C 53 36.953 5.269 0.039 1.00 36.57 C ATOM 0 H PHE C 53 38.695 0.487 0.732 1.00 39.70 H new ATOM 0 HA PHE C 53 40.843 2.008 1.034 1.00 40.00 H new ATOM 0 HB2 PHE C 53 38.554 1.810 2.781 1.00 38.30 H new ATOM 0 HB3 PHE C 53 39.677 2.865 3.019 1.00 38.30 H new ATOM 0 HD1 PHE C 53 39.819 4.842 1.473 1.00 36.76 H new ATOM 0 HD2 PHE C 53 36.758 2.286 1.226 1.00 37.44 H new ATOM 0 HE1 PHE C 53 38.601 6.397 0.280 1.00 34.98 H new ATOM 0 HE2 PHE C 53 35.547 3.846 0.031 1.00 36.69 H new ATOM 0 HZ PHE C 53 36.466 5.898 -0.443 1.00 36.57 H new ATOM 2407 N GLN C 54 41.036 -0.647 2.419 1.00 46.18 N ATOM 2408 CA GLN C 54 41.731 -1.567 3.340 1.00 43.92 C ATOM 2409 C GLN C 54 41.471 -1.310 4.824 1.00 46.07 C ATOM 2410 O GLN C 54 42.387 -1.285 5.641 1.00 49.64 O ATOM 2411 CB GLN C 54 43.220 -1.636 3.061 1.00 43.36 C ATOM 2412 CG GLN C 54 43.557 -2.369 1.760 1.00 48.49 C ATOM 2413 CD GLN C 54 43.086 -3.822 1.733 1.00 45.63 C ATOM 2414 OE1 GLN C 54 43.667 -4.685 2.380 1.00 43.91 O ATOM 2415 NE2 GLN C 54 42.048 -4.092 0.964 1.00 47.20 N ATOM 0 H GLN C 54 40.652 -1.049 1.763 1.00 46.18 H new ATOM 0 HA GLN C 54 41.336 -2.432 3.151 1.00 43.92 H new ATOM 0 HB2 GLN C 54 43.577 -0.735 3.020 1.00 43.36 H new ATOM 0 HB3 GLN C 54 43.661 -2.083 3.800 1.00 43.36 H new ATOM 0 HG2 GLN C 54 43.155 -1.893 1.017 1.00 48.49 H new ATOM 0 HG3 GLN C 54 44.517 -2.346 1.625 1.00 48.49 H new ATOM 0 HE21 GLN C 54 41.664 -3.461 0.523 1.00 47.20 H new ATOM 0 HE22 GLN C 54 41.756 -4.899 0.904 1.00 47.20 H new ATOM 2416 N ILE C 55 40.192 -1.158 5.149 1.00 48.87 N ATOM 2417 CA ILE C 55 39.716 -0.918 6.509 1.00 51.20 C ATOM 2418 C ILE C 55 39.946 -2.192 7.377 1.00 54.14 C ATOM 2419 O ILE C 55 39.487 -3.279 7.014 1.00 53.11 O ATOM 2420 CB ILE C 55 38.211 -0.518 6.459 1.00 45.38 C ATOM 2421 CG1 ILE C 55 38.047 0.663 5.498 1.00 31.20 C ATOM 2422 CG2 ILE C 55 37.678 -0.115 7.846 1.00 45.35 C ATOM 2423 CD1 ILE C 55 36.642 1.071 5.273 1.00 29.01 C ATOM 0 H ILE C 55 39.558 -1.192 4.569 1.00 48.87 H new ATOM 0 HA ILE C 55 40.211 -0.190 6.917 1.00 51.20 H new ATOM 0 HB ILE C 55 37.703 -1.287 6.156 1.00 45.38 H new ATOM 0 HG12 ILE C 55 38.542 1.421 5.846 1.00 31.20 H new ATOM 0 HG13 ILE C 55 38.446 0.431 4.645 1.00 31.20 H new ATOM 0 HG21 ILE C 55 36.741 0.127 7.775 1.00 45.35 H new ATOM 0 HG22 ILE C 55 37.774 -0.861 8.459 1.00 45.35 H new ATOM 0 HG23 ILE C 55 38.183 0.643 8.179 1.00 45.35 H new ATOM 0 HD11 ILE C 55 36.617 1.820 4.657 1.00 29.01 H new ATOM 0 HD12 ILE C 55 36.145 0.327 4.897 1.00 29.01 H new ATOM 0 HD13 ILE C 55 36.242 1.333 6.117 1.00 29.01 H new ATOM 2424 N ASN C 56 40.708 -2.057 8.470 1.00 57.98 N ATOM 2425 CA ASN C 56 41.024 -3.183 9.362 1.00 60.50 C ATOM 2426 C ASN C 56 39.900 -3.615 10.327 1.00 65.94 C ATOM 2427 O ASN C 56 39.146 -2.780 10.867 1.00 67.44 O ATOM 2428 CB ASN C 56 42.348 -2.950 10.129 1.00 55.89 C ATOM 2429 CG ASN C 56 42.210 -1.983 11.314 1.00 55.75 C ATOM 2430 OD1 ASN C 56 41.234 -2.030 12.078 1.00 55.94 O ATOM 2431 ND2 ASN C 56 43.224 -1.146 11.513 1.00 52.00 N ATOM 0 H ASN C 56 41.056 -1.310 8.715 1.00 57.98 H new ATOM 0 HA ASN C 56 41.128 -3.933 8.756 1.00 60.50 H new ATOM 0 HB2 ASN C 56 42.679 -3.802 10.453 1.00 55.89 H new ATOM 0 HB3 ASN C 56 43.013 -2.603 9.514 1.00 55.89 H new ATOM 0 HD21 ASN C 56 43.216 -0.614 12.189 1.00 52.00 H new ATOM 0 HD22 ASN C 56 43.887 -1.136 10.966 1.00 52.00 H new ATOM 2432 N ASN C 57 39.825 -4.927 10.550 1.00 67.18 N ATOM 2433 CA ASN C 57 38.822 -5.551 11.418 1.00 67.76 C ATOM 2434 C ASN C 57 39.140 -5.439 12.902 1.00 65.81 C ATOM 2435 O ASN C 57 38.417 -5.998 13.726 1.00 67.84 O ATOM 2436 CB ASN C 57 38.699 -7.038 11.095 1.00 71.46 C ATOM 2437 CG ASN C 57 39.857 -7.860 11.674 1.00 78.93 C ATOM 2438 OD1 ASN C 57 40.759 -8.288 10.938 1.00 81.71 O ATOM 2439 ND2 ASN C 57 39.830 -8.092 12.983 1.00 80.94 N ATOM 0 H ASN C 57 40.367 -5.492 10.194 1.00 67.18 H new ATOM 0 HA ASN C 57 37.998 -5.070 11.244 1.00 67.76 H new ATOM 0 HB2 ASN C 57 37.860 -7.374 11.446 1.00 71.46 H new ATOM 0 HB3 ASN C 57 38.671 -7.156 10.133 1.00 71.46 H new ATOM 0 HD21 ASN C 57 40.454 -8.555 13.351 1.00 80.94 H new ATOM 0 HD22 ASN C 57 39.188 -7.779 13.462 1.00 80.94 H new ATOM 2440 N LYS C 58 40.250 -4.799 13.244 1.00 62.14 N ATOM 2441 CA LYS C 58 40.623 -4.673 14.638 1.00 57.84 C ATOM 2442 C LYS C 58 39.888 -3.560 15.353 1.00 57.29 C ATOM 2443 O LYS C 58 39.269 -3.804 16.383 1.00 63.18 O ATOM 2444 CB LYS C 58 42.134 -4.505 14.787 1.00 59.19 C ATOM 2445 CG LYS C 58 42.592 -4.454 16.231 1.00 62.33 C ATOM 2446 CD LYS C 58 43.969 -5.073 16.426 1.00 66.11 C ATOM 2447 CE LYS C 58 45.103 -4.145 16.012 1.00 70.95 C ATOM 2448 NZ LYS C 58 46.436 -4.785 16.234 1.00 68.71 N ATOM 0 H LYS C 58 40.795 -4.434 12.687 1.00 62.14 H new ATOM 0 HA LYS C 58 40.355 -5.501 15.066 1.00 57.84 H new ATOM 0 HB2 LYS C 58 42.581 -5.240 14.338 1.00 59.19 H new ATOM 0 HB3 LYS C 58 42.408 -3.690 14.338 1.00 59.19 H new ATOM 0 HG2 LYS C 58 42.610 -3.531 16.529 1.00 62.33 H new ATOM 0 HG3 LYS C 58 41.949 -4.920 16.788 1.00 62.33 H new ATOM 0 HD2 LYS C 58 44.080 -5.315 17.359 1.00 66.11 H new ATOM 0 HD3 LYS C 58 44.025 -5.893 15.911 1.00 66.11 H new ATOM 0 HE2 LYS C 58 45.006 -3.910 15.076 1.00 70.95 H new ATOM 0 HE3 LYS C 58 45.050 -3.319 16.519 1.00 70.95 H new ATOM 0 HZ1 LYS C 58 47.080 -4.224 15.985 1.00 68.71 H new ATOM 0 HZ2 LYS C 58 46.531 -4.981 17.097 1.00 68.71 H new ATOM 0 HZ3 LYS C 58 46.491 -5.532 15.753 1.00 68.71 H new ATOM 2449 N ILE C 59 39.920 -2.347 14.822 1.00 56.69 N ATOM 2450 CA ILE C 59 39.228 -1.253 15.500 1.00 56.76 C ATOM 2451 C ILE C 59 37.990 -0.832 14.735 1.00 56.92 C ATOM 2452 O ILE C 59 37.006 -0.383 15.321 1.00 54.10 O ATOM 2453 CB ILE C 59 40.140 -0.004 15.641 1.00 57.34 C ATOM 2454 CG1 ILE C 59 41.540 -0.409 16.103 1.00 57.85 C ATOM 2455 CG2 ILE C 59 39.528 1.004 16.625 1.00 57.30 C ATOM 2456 CD1 ILE C 59 41.613 -1.006 17.497 1.00 64.97 C ATOM 0 H ILE C 59 40.323 -2.136 14.092 1.00 56.69 H new ATOM 0 HA ILE C 59 38.984 -1.586 16.378 1.00 56.76 H new ATOM 0 HB ILE C 59 40.212 0.418 14.770 1.00 57.34 H new ATOM 0 HG12 ILE C 59 41.900 -1.052 15.472 1.00 57.85 H new ATOM 0 HG13 ILE C 59 42.114 0.372 16.071 1.00 57.85 H new ATOM 0 HG21 ILE C 59 40.110 1.776 16.701 1.00 57.30 H new ATOM 0 HG22 ILE C 59 38.658 1.285 16.301 1.00 57.30 H new ATOM 0 HG23 ILE C 59 39.429 0.588 17.495 1.00 57.30 H new ATOM 0 HD11 ILE C 59 42.533 -1.232 17.705 1.00 64.97 H new ATOM 0 HD12 ILE C 59 41.285 -0.361 18.143 1.00 64.97 H new ATOM 0 HD13 ILE C 59 41.067 -1.807 17.535 1.00 64.97 H new ATOM 2457 N TRP C 60 38.024 -1.042 13.425 1.00 60.51 N ATOM 2458 CA TRP C 60 36.941 -0.602 12.561 1.00 59.21 C ATOM 2459 C TRP C 60 35.690 -1.460 12.368 1.00 54.95 C ATOM 2460 O TRP C 60 34.619 -1.059 12.805 1.00 50.79 O ATOM 2461 CB TRP C 60 37.527 -0.101 11.211 1.00 59.04 C ATOM 2462 CG TRP C 60 38.751 0.798 11.433 1.00 55.15 C ATOM 2463 CD1 TRP C 60 40.048 0.436 11.216 1.00 58.70 C ATOM 2464 CD2 TRP C 60 38.798 2.090 12.083 1.00 51.17 C ATOM 2465 NE1 TRP C 60 40.899 1.397 11.716 1.00 58.10 N ATOM 2466 CE2 TRP C 60 40.162 2.421 12.253 1.00 50.32 C ATOM 2467 CE3 TRP C 60 37.830 2.980 12.548 1.00 49.15 C ATOM 2468 CZ2 TRP C 60 40.576 3.593 12.872 1.00 47.08 C ATOM 2469 CZ3 TRP C 60 38.253 4.156 13.170 1.00 45.84 C ATOM 2470 CH2 TRP C 60 39.612 4.444 13.324 1.00 42.96 C ATOM 0 H TRP C 60 38.668 -1.439 13.017 1.00 60.51 H new ATOM 0 HA TRP C 60 36.542 0.109 13.086 1.00 59.21 H new ATOM 0 HB2 TRP C 60 37.777 -0.861 10.663 1.00 59.04 H new ATOM 0 HB3 TRP C 60 36.847 0.390 10.723 1.00 59.04 H new ATOM 0 HD1 TRP C 60 40.319 -0.346 10.792 1.00 58.70 H new ATOM 0 HE1 TRP C 60 41.758 1.360 11.695 1.00 58.10 H new ATOM 0 HE3 TRP C 60 36.924 2.794 12.446 1.00 49.15 H new ATOM 0 HZ2 TRP C 60 41.479 3.790 12.975 1.00 47.08 H new ATOM 0 HZ3 TRP C 60 37.619 4.758 13.487 1.00 45.84 H new ATOM 0 HH2 TRP C 60 39.864 5.234 13.744 1.00 42.96 H new ATOM 2471 N CYS C 61 35.798 -2.588 11.682 1.00 55.39 N ATOM 2472 CA CYS C 61 34.639 -3.431 11.481 1.00 61.56 C ATOM 2473 C CYS C 61 34.771 -4.779 12.182 1.00 68.67 C ATOM 2474 O CYS C 61 35.878 -5.245 12.468 1.00 69.47 O ATOM 2475 CB CYS C 61 34.389 -3.645 9.994 1.00 61.59 C ATOM 2476 SG CYS C 61 35.795 -4.455 9.180 1.00 68.97 S ATOM 0 H CYS C 61 36.526 -2.879 11.329 1.00 55.39 H new ATOM 0 HA CYS C 61 33.883 -2.969 11.876 1.00 61.56 H new ATOM 0 HB2 CYS C 61 33.592 -4.185 9.875 1.00 61.59 H new ATOM 0 HB3 CYS C 61 34.218 -2.790 9.569 1.00 61.59 H new ATOM 2477 N LYS C 62 33.618 -5.389 12.457 1.00 75.78 N ATOM 2478 CA LYS C 62 33.509 -6.688 13.139 1.00 78.34 C ATOM 2479 C LYS C 62 33.541 -7.856 12.125 1.00 76.50 C ATOM 2480 O LYS C 62 32.644 -7.975 11.274 1.00 75.77 O ATOM 2481 CB LYS C 62 32.171 -6.718 13.909 1.00 80.02 C ATOM 2482 CG LYS C 62 32.122 -7.551 15.199 1.00 83.07 C ATOM 2483 CD LYS C 62 32.621 -6.775 16.421 1.00 81.45 C ATOM 2484 CE LYS C 62 31.723 -6.962 17.654 1.00 79.30 C ATOM 2485 NZ LYS C 62 30.354 -6.387 17.499 1.00 80.45 N ATOM 0 H LYS C 62 32.855 -5.052 12.248 1.00 75.78 H new ATOM 0 HA LYS C 62 34.261 -6.794 13.743 1.00 78.34 H new ATOM 0 HB2 LYS C 62 31.932 -5.805 14.132 1.00 80.02 H new ATOM 0 HB3 LYS C 62 31.486 -7.052 13.309 1.00 80.02 H new ATOM 0 HG2 LYS C 62 31.211 -7.844 15.356 1.00 83.07 H new ATOM 0 HG3 LYS C 62 32.661 -8.349 15.085 1.00 83.07 H new ATOM 0 HD2 LYS C 62 33.522 -7.063 16.636 1.00 81.45 H new ATOM 0 HD3 LYS C 62 32.670 -5.831 16.202 1.00 81.45 H new ATOM 0 HE2 LYS C 62 31.646 -7.910 17.846 1.00 79.30 H new ATOM 0 HE3 LYS C 62 32.152 -6.551 18.421 1.00 79.30 H new ATOM 0 HZ1 LYS C 62 29.937 -6.397 18.285 1.00 80.45 H new ATOM 0 HZ2 LYS C 62 30.415 -5.549 17.207 1.00 80.45 H new ATOM 0 HZ3 LYS C 62 29.893 -6.872 16.913 1.00 80.45 H new ATOM 2486 N ASP C 63 34.573 -8.690 12.172 1.00 73.33 N ATOM 2487 CA ASP C 63 34.618 -9.822 11.278 1.00 76.76 C ATOM 2488 C ASP C 63 34.639 -11.128 12.026 1.00 79.03 C ATOM 2489 O ASP C 63 34.994 -11.159 13.233 1.00 76.72 O ATOM 2490 CB ASP C 63 35.885 -9.703 10.417 1.00 79.69 C ATOM 2491 CG ASP C 63 37.117 -9.887 11.287 1.00 83.09 C ATOM 2492 OD1 ASP C 63 36.972 -9.881 12.509 1.00 75.39 O ATOM 2493 OD2 ASP C 63 38.198 -10.031 10.736 1.00 88.30 O ATOM 0 H ASP C 63 35.243 -8.616 12.706 1.00 73.33 H new ATOM 0 HA ASP C 63 33.819 -9.816 10.728 1.00 76.76 H new ATOM 0 HB2 ASP C 63 35.872 -10.371 9.714 1.00 79.69 H new ATOM 0 HB3 ASP C 63 35.911 -8.836 9.984 1.00 79.69 H new ATOM 2494 N ASP C 64 34.244 -12.207 11.365 1.00 85.04 N ATOM 2495 CA ASP C 64 34.215 -13.514 12.013 1.00 88.04 C ATOM 2496 C ASP C 64 35.636 -13.846 12.487 1.00 87.27 C ATOM 2497 O ASP C 64 35.815 -14.528 13.492 1.00 88.98 O ATOM 2498 CB ASP C 64 33.651 -14.609 11.063 1.00 90.88 C ATOM 2499 CG ASP C 64 32.132 -14.431 10.735 1.00 90.56 C ATOM 2500 OD1 ASP C 64 31.365 -13.847 11.545 1.00 86.51 O ATOM 2501 OD2 ASP C 64 31.701 -14.905 9.655 1.00 90.27 O ATOM 0 H ASP C 64 33.989 -12.206 10.544 1.00 85.04 H new ATOM 0 HA ASP C 64 33.618 -13.489 12.777 1.00 88.04 H new ATOM 0 HB2 ASP C 64 34.156 -14.600 10.235 1.00 90.88 H new ATOM 0 HB3 ASP C 64 33.787 -15.480 11.468 1.00 90.88 H new ATOM 2502 N GLN C 65 36.634 -13.308 11.779 1.00 85.35 N ATOM 2503 CA GLN C 65 38.041 -13.511 12.113 1.00 83.50 C ATOM 2504 C GLN C 65 38.317 -12.902 13.484 1.00 83.72 C ATOM 2505 O GLN C 65 39.284 -13.266 14.151 1.00 83.19 O ATOM 2506 CB GLN C 65 38.948 -12.860 11.052 1.00 82.14 C ATOM 2507 CG GLN C 65 40.449 -13.228 11.146 1.00 85.83 C ATOM 2508 CD GLN C 65 41.343 -12.118 11.734 1.00 87.76 C ATOM 2509 OE1 GLN C 65 42.550 -12.037 11.440 1.00 84.20 O ATOM 2510 NE2 GLN C 65 40.762 -11.277 12.572 1.00 91.17 N ATOM 0 H GLN C 65 36.509 -12.812 11.087 1.00 85.35 H new ATOM 0 HA GLN C 65 38.233 -14.462 12.132 1.00 83.50 H new ATOM 0 HB2 GLN C 65 38.623 -13.111 10.173 1.00 82.14 H new ATOM 0 HB3 GLN C 65 38.862 -11.896 11.122 1.00 82.14 H new ATOM 0 HG2 GLN C 65 40.542 -14.025 11.691 1.00 85.83 H new ATOM 0 HG3 GLN C 65 40.772 -13.452 10.259 1.00 85.83 H new ATOM 0 HE21 GLN C 65 39.926 -11.360 12.754 1.00 91.17 H new ATOM 0 HE22 GLN C 65 41.220 -10.646 12.935 1.00 91.17 H new ATOM 2511 N ASN C 66 37.485 -11.946 13.880 1.00 84.85 N ATOM 2512 CA ASN C 66 37.646 -11.239 15.170 1.00 87.81 C ATOM 2513 C ASN C 66 36.359 -10.534 15.570 1.00 88.68 C ATOM 2514 O ASN C 66 35.958 -9.552 14.952 1.00 87.61 O ATOM 2515 CB ASN C 66 38.755 -10.150 14.994 1.00 92.11 C ATOM 2516 CG ASN C 66 39.473 -9.896 16.299 1.00 99.28 C ATOM 2517 OD1 ASN C 66 40.561 -9.362 16.358 1.00102.84 O ATOM 2518 ND2 ASN C 66 38.860 -10.289 17.369 1.00102.26 N ATOM 0 H ASN C 66 36.810 -11.682 13.417 1.00 84.85 H new ATOM 0 HA ASN C 66 37.879 -11.886 15.854 1.00 87.81 H new ATOM 0 HB2 ASN C 66 39.392 -10.437 14.321 1.00 92.11 H new ATOM 0 HB3 ASN C 66 38.356 -9.326 14.674 1.00 92.11 H new ATOM 0 HD21 ASN C 66 39.223 -10.173 18.140 1.00102.26 H new ATOM 0 HD22 ASN C 66 38.089 -10.666 17.309 1.00102.26 H new ATOM 2519 N PRO C 67 35.478 -11.187 16.347 1.00 89.81 N ATOM 2520 CA PRO C 67 34.228 -10.579 16.817 1.00 88.84 C ATOM 2521 C PRO C 67 34.561 -9.693 18.013 1.00 89.53 C ATOM 2522 O PRO C 67 33.714 -8.976 18.536 1.00 89.99 O ATOM 2523 CB PRO C 67 33.400 -11.794 17.265 1.00 87.52 C ATOM 2524 CG PRO C 67 33.999 -12.939 16.496 1.00 88.90 C ATOM 2525 CD PRO C 67 35.464 -12.641 16.593 1.00 89.43 C ATOM 0 HA PRO C 67 33.765 -10.036 16.160 1.00 88.84 H new ATOM 0 HB2 PRO C 67 33.465 -11.936 18.222 1.00 87.52 H new ATOM 0 HB3 PRO C 67 32.459 -11.680 17.058 1.00 87.52 H new ATOM 0 HG2 PRO C 67 33.776 -13.797 16.889 1.00 88.90 H new ATOM 0 HG3 PRO C 67 33.692 -12.959 15.576 1.00 88.90 H new ATOM 0 HD2 PRO C 67 35.827 -12.869 17.463 1.00 89.43 H new ATOM 0 HD3 PRO C 67 35.981 -13.129 15.933 1.00 89.43 H new ATOM 2526 N HIS C 68 35.810 -9.787 18.453 1.00 89.72 N ATOM 2527 CA HIS C 68 36.320 -9.023 19.581 1.00 91.75 C ATOM 2528 C HIS C 68 36.573 -7.573 19.179 1.00 91.34 C ATOM 2529 O HIS C 68 36.876 -6.719 20.013 1.00 91.29 O ATOM 2530 CB HIS C 68 37.604 -9.688 20.064 1.00 95.00 C ATOM 2531 CG HIS C 68 37.460 -11.162 20.272 1.00100.86 C ATOM 2532 ND1 HIS C 68 38.088 -12.098 19.473 1.00101.94 N ATOM 2533 CD2 HIS C 68 36.719 -11.869 21.161 1.00102.82 C ATOM 2534 CE1 HIS C 68 37.738 -13.311 19.855 1.00103.86 C ATOM 2535 NE2 HIS C 68 36.905 -13.200 20.879 1.00105.16 N ATOM 0 H HIS C 68 36.395 -10.307 18.097 1.00 89.72 H new ATOM 0 HA HIS C 68 35.667 -9.012 20.298 1.00 91.75 H new ATOM 0 HB2 HIS C 68 38.309 -9.526 19.418 1.00 95.00 H new ATOM 0 HB3 HIS C 68 37.882 -9.275 20.897 1.00 95.00 H new ATOM 0 HD2 HIS C 68 36.184 -11.518 21.836 1.00102.82 H new ATOM 0 HE1 HIS C 68 38.027 -14.108 19.471 1.00103.86 H new ATOM 0 HE2 HIS C 68 36.540 -13.855 21.299 1.00105.16 H new ATOM 2536 N SER C 69 36.456 -7.328 17.878 1.00 90.79 N ATOM 2537 CA SER C 69 36.654 -6.024 17.261 1.00 87.09 C ATOM 2538 C SER C 69 35.910 -4.890 17.961 1.00 85.52 C ATOM 2539 O SER C 69 34.740 -5.033 18.328 1.00 86.62 O ATOM 2540 CB SER C 69 36.223 -6.111 15.786 1.00 85.46 C ATOM 2541 OG SER C 69 35.865 -4.842 15.257 1.00 84.58 O ATOM 0 H SER C 69 36.251 -7.941 17.310 1.00 90.79 H new ATOM 0 HA SER C 69 37.596 -5.806 17.340 1.00 87.09 H new ATOM 0 HB2 SER C 69 36.947 -6.486 15.261 1.00 85.46 H new ATOM 0 HB3 SER C 69 35.470 -6.717 15.706 1.00 85.46 H new ATOM 0 HG SER C 69 35.968 -4.847 14.423 1.00 84.58 H new ATOM 2542 N SER C 70 36.592 -3.759 18.125 1.00 83.80 N ATOM 2543 CA SER C 70 35.992 -2.579 18.751 1.00 80.61 C ATOM 2544 C SER C 70 34.773 -2.121 17.920 1.00 78.56 C ATOM 2545 O SER C 70 33.889 -1.431 18.435 1.00 80.33 O ATOM 2546 CB SER C 70 37.028 -1.443 18.877 1.00 78.21 C ATOM 2547 OG SER C 70 38.221 -1.868 19.530 1.00 70.89 O ATOM 0 H SER C 70 37.409 -3.653 17.879 1.00 83.80 H new ATOM 0 HA SER C 70 35.696 -2.809 19.646 1.00 80.61 H new ATOM 0 HB2 SER C 70 37.247 -1.109 17.993 1.00 78.21 H new ATOM 0 HB3 SER C 70 36.637 -0.705 19.370 1.00 78.21 H new ATOM 0 HG SER C 70 38.759 -1.225 19.578 1.00 70.89 H new ATOM 2548 N ASN C 71 34.755 -2.500 16.636 1.00 75.21 N ATOM 2549 CA ASN C 71 33.673 -2.191 15.691 1.00 73.20 C ATOM 2550 C ASN C 71 33.111 -0.765 15.765 1.00 74.44 C ATOM 2551 O ASN C 71 31.894 -0.570 15.877 1.00 74.89 O ATOM 2552 CB ASN C 71 32.543 -3.217 15.847 1.00 70.78 C ATOM 2553 CG ASN C 71 31.513 -3.143 14.732 1.00 66.83 C ATOM 2554 OD1 ASN C 71 31.826 -2.811 13.599 1.00 66.14 O ATOM 2555 ND2 ASN C 71 30.275 -3.484 15.051 1.00 69.92 N ATOM 0 H ASN C 71 35.391 -2.957 16.281 1.00 75.21 H new ATOM 0 HA ASN C 71 34.079 -2.247 14.812 1.00 73.20 H new ATOM 0 HB2 ASN C 71 32.924 -4.109 15.869 1.00 70.78 H new ATOM 0 HB3 ASN C 71 32.101 -3.076 16.699 1.00 70.78 H new ATOM 0 HD21 ASN C 71 29.659 -3.477 14.451 1.00 69.92 H new ATOM 0 HD22 ASN C 71 30.087 -3.713 15.858 1.00 69.92 H new ATOM 2556 N ILE C 72 33.994 0.228 15.641 1.00 72.65 N ATOM 2557 CA ILE C 72 33.610 1.642 15.700 1.00 65.33 C ATOM 2558 C ILE C 72 32.639 1.992 14.567 1.00 66.62 C ATOM 2559 O ILE C 72 31.672 2.721 14.774 1.00 66.80 O ATOM 2560 CB ILE C 72 34.868 2.567 15.664 1.00 60.94 C ATOM 2561 CG1 ILE C 72 35.710 2.343 16.915 1.00 56.39 C ATOM 2562 CG2 ILE C 72 34.482 4.036 15.575 1.00 61.49 C ATOM 2563 CD1 ILE C 72 36.772 3.385 17.133 1.00 60.03 C ATOM 0 H ILE C 72 34.836 0.100 15.520 1.00 72.65 H new ATOM 0 HA ILE C 72 33.154 1.793 16.543 1.00 65.33 H new ATOM 0 HB ILE C 72 35.379 2.339 14.872 1.00 60.94 H new ATOM 0 HG12 ILE C 72 35.125 2.324 17.688 1.00 56.39 H new ATOM 0 HG13 ILE C 72 36.132 1.472 16.858 1.00 56.39 H new ATOM 0 HG21 ILE C 72 35.284 4.581 15.555 1.00 61.49 H new ATOM 0 HG22 ILE C 72 33.968 4.187 14.766 1.00 61.49 H new ATOM 0 HG23 ILE C 72 33.947 4.278 16.347 1.00 61.49 H new ATOM 0 HD11 ILE C 72 37.266 3.180 17.942 1.00 60.03 H new ATOM 0 HD12 ILE C 72 37.380 3.391 16.377 1.00 60.03 H new ATOM 0 HD13 ILE C 72 36.357 4.257 17.221 1.00 60.03 H new ATOM 2564 N CYS C 73 32.877 1.443 13.381 1.00 67.71 N ATOM 2565 CA CYS C 73 32.007 1.728 12.251 1.00 67.05 C ATOM 2566 C CYS C 73 30.689 0.985 12.366 1.00 68.35 C ATOM 2567 O CYS C 73 29.740 1.309 11.668 1.00 70.01 O ATOM 2568 CB CYS C 73 32.703 1.405 10.919 1.00 64.93 C ATOM 2569 SG CYS C 73 33.963 2.643 10.449 1.00 63.64 S ATOM 0 H CYS C 73 33.530 0.909 13.212 1.00 67.71 H new ATOM 0 HA CYS C 73 31.813 2.678 12.266 1.00 67.05 H new ATOM 0 HB2 CYS C 73 33.123 0.533 10.983 1.00 64.93 H new ATOM 0 HB3 CYS C 73 32.036 1.348 10.217 1.00 64.93 H new ATOM 2570 N ASN C 74 30.639 0.012 13.277 1.00 71.07 N ATOM 2571 CA ASN C 74 29.453 -0.820 13.503 1.00 74.43 C ATOM 2572 C ASN C 74 28.886 -1.351 12.190 1.00 75.17 C ATOM 2573 O ASN C 74 27.805 -0.944 11.739 1.00 77.38 O ATOM 2574 CB ASN C 74 28.389 -0.066 14.332 1.00 76.17 C ATOM 2575 CG ASN C 74 28.413 -0.469 15.815 1.00 79.36 C ATOM 2576 OD1 ASN C 74 27.881 -1.516 16.198 1.00 76.07 O ATOM 2577 ND2 ASN C 74 29.065 0.347 16.644 1.00 81.44 N ATOM 0 H ASN C 74 31.301 -0.187 13.788 1.00 71.07 H new ATOM 0 HA ASN C 74 29.727 -1.591 14.024 1.00 74.43 H new ATOM 0 HB2 ASN C 74 28.540 0.889 14.256 1.00 76.17 H new ATOM 0 HB3 ASN C 74 27.509 -0.245 13.965 1.00 76.17 H new ATOM 0 HD21 ASN C 74 29.127 0.152 17.479 1.00 81.44 H new ATOM 0 HD22 ASN C 74 29.424 1.068 16.343 1.00 81.44 H new ATOM 2578 N ILE C 75 29.628 -2.276 11.589 1.00 75.16 N ATOM 2579 CA ILE C 75 29.261 -2.883 10.314 1.00 74.13 C ATOM 2580 C ILE C 75 30.111 -4.122 10.024 1.00 73.02 C ATOM 2581 O ILE C 75 31.252 -4.251 10.489 1.00 70.43 O ATOM 2582 CB ILE C 75 29.468 -1.878 9.150 1.00 76.43 C ATOM 2583 CG1 ILE C 75 28.878 -2.418 7.847 1.00 77.44 C ATOM 2584 CG2 ILE C 75 30.965 -1.585 8.971 1.00 76.50 C ATOM 2585 CD1 ILE C 75 29.070 -1.481 6.650 1.00 78.59 C ATOM 0 H ILE C 75 30.367 -2.572 11.914 1.00 75.16 H new ATOM 0 HA ILE C 75 28.327 -3.135 10.379 1.00 74.13 H new ATOM 0 HB ILE C 75 29.005 -1.055 9.372 1.00 76.43 H new ATOM 0 HG12 ILE C 75 29.287 -3.274 7.646 1.00 77.44 H new ATOM 0 HG13 ILE C 75 27.930 -2.579 7.973 1.00 77.44 H new ATOM 0 HG21 ILE C 75 31.087 -0.957 8.242 1.00 76.50 H new ATOM 0 HG22 ILE C 75 31.320 -1.204 9.789 1.00 76.50 H new ATOM 0 HG23 ILE C 75 31.434 -2.409 8.768 1.00 76.50 H new ATOM 0 HD11 ILE C 75 28.675 -1.881 5.859 1.00 78.59 H new ATOM 0 HD12 ILE C 75 28.639 -0.631 6.832 1.00 78.59 H new ATOM 0 HD13 ILE C 75 30.017 -1.337 6.500 1.00 78.59 H new ATOM 2586 N SER C 76 29.531 -5.034 9.254 1.00 72.02 N ATOM 2587 CA SER C 76 30.205 -6.264 8.870 1.00 72.89 C ATOM 2588 C SER C 76 31.286 -5.946 7.816 1.00 71.02 C ATOM 2589 O SER C 76 31.031 -5.252 6.821 1.00 69.91 O ATOM 2590 CB SER C 76 29.166 -7.275 8.332 1.00 74.62 C ATOM 2591 OG SER C 76 29.701 -8.585 8.201 1.00 79.34 O ATOM 0 H SER C 76 28.734 -4.956 8.940 1.00 72.02 H new ATOM 0 HA SER C 76 30.641 -6.663 9.639 1.00 72.89 H new ATOM 0 HB2 SER C 76 28.402 -7.299 8.930 1.00 74.62 H new ATOM 0 HB3 SER C 76 28.842 -6.973 7.469 1.00 74.62 H new ATOM 0 HG SER C 76 29.107 -9.102 7.909 1.00 79.34 H new ATOM 2592 N CYS C 77 32.493 -6.455 8.034 1.00 68.06 N ATOM 2593 CA CYS C 77 33.575 -6.215 7.094 1.00 68.26 C ATOM 2594 C CYS C 77 33.241 -6.700 5.692 1.00 70.05 C ATOM 2595 O CYS C 77 33.827 -6.245 4.719 1.00 72.40 O ATOM 2596 CB CYS C 77 34.855 -6.901 7.550 1.00 64.92 C ATOM 2597 SG CYS C 77 35.415 -6.457 9.220 1.00 71.42 S ATOM 0 H CYS C 77 32.703 -6.937 8.714 1.00 68.06 H new ATOM 0 HA CYS C 77 33.702 -5.254 7.069 1.00 68.26 H new ATOM 0 HB2 CYS C 77 34.722 -7.861 7.513 1.00 64.92 H new ATOM 0 HB3 CYS C 77 35.561 -6.689 6.920 1.00 64.92 H new ATOM 2598 N ASP C 78 32.342 -7.670 5.599 1.00 73.50 N ATOM 2599 CA ASP C 78 31.921 -8.226 4.314 1.00 74.44 C ATOM 2600 C ASP C 78 31.287 -7.144 3.407 1.00 70.35 C ATOM 2601 O ASP C 78 31.416 -7.199 2.173 1.00 67.97 O ATOM 2602 CB ASP C 78 30.935 -9.411 4.523 1.00 80.42 C ATOM 2603 CG ASP C 78 31.588 -10.644 5.205 1.00 81.77 C ATOM 2604 OD1 ASP C 78 31.951 -10.563 6.404 1.00 83.28 O ATOM 2605 OD2 ASP C 78 31.702 -11.715 4.550 1.00 80.34 O ATOM 0 H ASP C 78 31.956 -8.028 6.279 1.00 73.50 H new ATOM 0 HA ASP C 78 32.714 -8.559 3.866 1.00 74.44 H new ATOM 0 HB2 ASP C 78 30.187 -9.110 5.063 1.00 80.42 H new ATOM 0 HB3 ASP C 78 30.575 -9.679 3.663 1.00 80.42 H new ATOM 2606 N LYS C 79 30.614 -6.162 4.013 1.00 66.06 N ATOM 2607 CA LYS C 79 29.969 -5.077 3.267 1.00 62.86 C ATOM 2608 C LYS C 79 30.959 -4.118 2.593 1.00 61.49 C ATOM 2609 O LYS C 79 30.574 -3.268 1.761 1.00 59.63 O ATOM 2610 CB LYS C 79 29.020 -4.306 4.177 1.00 62.10 C ATOM 2611 CG LYS C 79 27.590 -4.778 4.067 1.00 68.31 C ATOM 2612 CD LYS C 79 26.683 -3.898 4.892 1.00 75.31 C ATOM 2613 CE LYS C 79 25.237 -4.359 4.825 1.00 79.04 C ATOM 2614 NZ LYS C 79 24.421 -3.771 5.941 1.00 82.93 N ATOM 0 H LYS C 79 30.519 -6.106 4.866 1.00 66.06 H new ATOM 0 HA LYS C 79 29.471 -5.498 2.549 1.00 62.86 H new ATOM 0 HB2 LYS C 79 29.316 -4.396 5.096 1.00 62.10 H new ATOM 0 HB3 LYS C 79 29.062 -3.362 3.956 1.00 62.10 H new ATOM 0 HG2 LYS C 79 27.308 -4.763 3.139 1.00 68.31 H new ATOM 0 HG3 LYS C 79 27.522 -5.697 4.370 1.00 68.31 H new ATOM 0 HD2 LYS C 79 26.981 -3.901 5.815 1.00 75.31 H new ATOM 0 HD3 LYS C 79 26.746 -2.983 4.577 1.00 75.31 H new ATOM 0 HE2 LYS C 79 24.853 -4.102 3.972 1.00 79.04 H new ATOM 0 HE3 LYS C 79 25.202 -5.327 4.872 1.00 79.04 H new ATOM 0 HZ1 LYS C 79 23.732 -4.305 6.118 1.00 82.93 H new ATOM 0 HZ2 LYS C 79 24.927 -3.689 6.668 1.00 82.93 H new ATOM 0 HZ3 LYS C 79 24.120 -2.969 5.698 1.00 82.93 H new ATOM 2615 N PHE C 80 32.230 -4.261 2.963 1.00 59.03 N ATOM 2616 CA PHE C 80 33.329 -3.474 2.422 1.00 52.37 C ATOM 2617 C PHE C 80 33.872 -4.164 1.168 1.00 55.90 C ATOM 2618 O PHE C 80 34.710 -3.613 0.444 1.00 56.13 O ATOM 2619 CB PHE C 80 34.434 -3.340 3.479 1.00 45.78 C ATOM 2620 CG PHE C 80 34.069 -2.455 4.660 1.00 39.76 C ATOM 2621 CD1 PHE C 80 33.091 -1.475 4.556 1.00 37.79 C ATOM 2622 CD2 PHE C 80 34.734 -2.593 5.873 1.00 39.84 C ATOM 2623 CE1 PHE C 80 32.784 -0.648 5.636 1.00 35.08 C ATOM 2624 CE2 PHE C 80 34.428 -1.767 6.961 1.00 35.69 C ATOM 2625 CZ PHE C 80 33.457 -0.800 6.838 1.00 33.92 C ATOM 0 H PHE C 80 32.481 -4.835 3.552 1.00 59.03 H new ATOM 0 HA PHE C 80 33.015 -2.587 2.186 1.00 52.37 H new ATOM 0 HB2 PHE C 80 34.660 -4.224 3.809 1.00 45.78 H new ATOM 0 HB3 PHE C 80 35.230 -2.983 3.055 1.00 45.78 H new ATOM 0 HD1 PHE C 80 32.633 -1.368 3.753 1.00 37.79 H new ATOM 0 HD2 PHE C 80 35.392 -3.244 5.963 1.00 39.84 H new ATOM 0 HE1 PHE C 80 32.128 0.005 5.550 1.00 35.08 H new ATOM 0 HE2 PHE C 80 34.881 -1.872 7.767 1.00 35.69 H new ATOM 0 HZ PHE C 80 33.253 -0.250 7.559 1.00 33.92 H new ATOM 2626 N LEU C 81 33.368 -5.369 0.913 1.00 59.56 N ATOM 2627 CA LEU C 81 33.771 -6.143 -0.252 1.00 64.39 C ATOM 2628 C LEU C 81 32.767 -6.029 -1.409 1.00 67.47 C ATOM 2629 O LEU C 81 33.012 -6.532 -2.512 1.00 73.04 O ATOM 2630 CB LEU C 81 33.989 -7.615 0.115 1.00 62.71 C ATOM 2631 CG LEU C 81 35.190 -7.976 0.989 1.00 60.46 C ATOM 2632 CD1 LEU C 81 34.784 -7.973 2.448 1.00 58.17 C ATOM 2633 CD2 LEU C 81 35.672 -9.354 0.603 1.00 60.33 C ATOM 0 H LEU C 81 32.784 -5.758 1.411 1.00 59.56 H new ATOM 0 HA LEU C 81 34.611 -5.765 -0.557 1.00 64.39 H new ATOM 0 HB2 LEU C 81 33.190 -7.928 0.567 1.00 62.71 H new ATOM 0 HB3 LEU C 81 34.063 -8.118 -0.711 1.00 62.71 H new ATOM 0 HG LEU C 81 35.898 -7.326 0.858 1.00 60.46 H new ATOM 0 HD11 LEU C 81 35.550 -8.203 2.998 1.00 58.17 H new ATOM 0 HD12 LEU C 81 34.463 -7.091 2.693 1.00 58.17 H new ATOM 0 HD13 LEU C 81 34.078 -8.624 2.589 1.00 58.17 H new ATOM 0 HD21 LEU C 81 36.435 -9.595 1.151 1.00 60.33 H new ATOM 0 HD22 LEU C 81 34.959 -9.997 0.741 1.00 60.33 H new ATOM 0 HD23 LEU C 81 35.932 -9.356 -0.331 1.00 60.33 H new ATOM 2634 N ASP C 82 31.630 -5.384 -1.170 1.00 67.59 N ATOM 2635 CA ASP C 82 30.653 -5.238 -2.242 1.00 67.78 C ATOM 2636 C ASP C 82 30.903 -4.011 -3.115 1.00 68.38 C ATOM 2637 O ASP C 82 31.436 -3.000 -2.642 1.00 68.41 O ATOM 2638 CB ASP C 82 29.219 -5.230 -1.687 1.00 67.86 C ATOM 2639 CG ASP C 82 28.894 -3.981 -0.890 1.00 68.81 C ATOM 2640 OD1 ASP C 82 28.967 -2.866 -1.431 1.00 65.91 O ATOM 2641 OD2 ASP C 82 28.492 -4.106 0.276 1.00 78.80 O ATOM 0 H ASP C 82 31.409 -5.033 -0.417 1.00 67.59 H new ATOM 0 HA ASP C 82 30.761 -6.013 -2.815 1.00 67.78 H new ATOM 0 HB2 ASP C 82 28.593 -5.309 -2.424 1.00 67.86 H new ATOM 0 HB3 ASP C 82 29.092 -6.009 -1.123 1.00 67.86 H new ATOM 2642 N ASP C 83 30.370 -4.066 -4.331 1.00 69.19 N ATOM 2643 CA ASP C 83 30.494 -2.996 -5.316 1.00 70.21 C ATOM 2644 C ASP C 83 29.732 -1.688 -5.034 1.00 66.14 C ATOM 2645 O ASP C 83 29.666 -0.814 -5.886 1.00 65.97 O ATOM 2646 CB ASP C 83 30.119 -3.521 -6.702 1.00 77.47 C ATOM 2647 CG ASP C 83 28.810 -4.295 -6.706 1.00 88.22 C ATOM 2648 OD1 ASP C 83 28.073 -4.298 -5.692 1.00 91.80 O ATOM 2649 OD2 ASP C 83 28.512 -4.907 -7.751 1.00 96.71 O ATOM 0 H ASP C 83 29.917 -4.740 -4.613 1.00 69.19 H new ATOM 0 HA ASP C 83 31.428 -2.739 -5.261 1.00 70.21 H new ATOM 0 HB2 ASP C 83 30.050 -2.775 -7.318 1.00 77.47 H new ATOM 0 HB3 ASP C 83 30.830 -4.094 -7.029 1.00 77.47 H new ATOM 2650 N ASP C 84 29.163 -1.556 -3.846 1.00 63.39 N ATOM 2651 CA ASP C 84 28.441 -0.347 -3.460 1.00 63.01 C ATOM 2652 C ASP C 84 29.289 0.366 -2.411 1.00 62.52 C ATOM 2653 O ASP C 84 29.385 -0.071 -1.248 1.00 62.78 O ATOM 2654 CB ASP C 84 27.090 -0.709 -2.860 1.00 66.83 C ATOM 2655 CG ASP C 84 26.183 0.474 -2.746 1.00 68.38 C ATOM 2656 OD1 ASP C 84 26.368 1.295 -1.825 1.00 68.55 O ATOM 2657 OD2 ASP C 84 25.282 0.586 -3.596 1.00 75.88 O ATOM 0 H ASP C 84 29.183 -2.164 -3.238 1.00 63.39 H new ATOM 0 HA ASP C 84 28.287 0.219 -4.233 1.00 63.01 H new ATOM 0 HB2 ASP C 84 26.666 -1.387 -3.409 1.00 66.83 H new ATOM 0 HB3 ASP C 84 27.223 -1.098 -1.981 1.00 66.83 H new ATOM 2658 N LEU C 85 29.924 1.453 -2.813 1.00 59.02 N ATOM 2659 CA LEU C 85 30.804 2.172 -1.910 1.00 57.67 C ATOM 2660 C LEU C 85 30.164 3.084 -0.895 1.00 55.68 C ATOM 2661 O LEU C 85 30.865 3.620 -0.044 1.00 59.34 O ATOM 2662 CB LEU C 85 31.845 2.962 -2.692 1.00 56.45 C ATOM 2663 CG LEU C 85 32.621 2.218 -3.768 1.00 52.31 C ATOM 2664 CD1 LEU C 85 33.724 3.120 -4.290 1.00 50.33 C ATOM 2665 CD2 LEU C 85 33.192 0.937 -3.202 1.00 52.11 C ATOM 0 H LEU C 85 29.860 1.791 -3.601 1.00 59.02 H new ATOM 0 HA LEU C 85 31.199 1.458 -1.385 1.00 57.67 H new ATOM 0 HB2 LEU C 85 31.399 3.715 -3.110 1.00 56.45 H new ATOM 0 HB3 LEU C 85 32.483 3.326 -2.059 1.00 56.45 H new ATOM 0 HG LEU C 85 32.031 1.983 -4.501 1.00 52.31 H new ATOM 0 HD11 LEU C 85 34.225 2.654 -4.977 1.00 50.33 H new ATOM 0 HD12 LEU C 85 33.334 3.925 -4.665 1.00 50.33 H new ATOM 0 HD13 LEU C 85 34.319 3.358 -3.562 1.00 50.33 H new ATOM 0 HD21 LEU C 85 33.685 0.469 -3.894 1.00 52.11 H new ATOM 0 HD22 LEU C 85 33.788 1.146 -2.466 1.00 52.11 H new ATOM 0 HD23 LEU C 85 32.470 0.374 -2.883 1.00 52.11 H new ATOM 2666 N THR C 86 28.849 3.216 -0.915 1.00 52.39 N ATOM 2667 CA THR C 86 28.198 4.115 0.029 1.00 58.25 C ATOM 2668 C THR C 86 28.625 3.918 1.489 1.00 61.17 C ATOM 2669 O THR C 86 28.879 4.896 2.214 1.00 63.39 O ATOM 2670 CB THR C 86 26.663 3.999 -0.047 1.00 58.53 C ATOM 2671 OG1 THR C 86 26.252 4.025 -1.422 1.00 57.24 O ATOM 2672 CG2 THR C 86 25.999 5.163 0.731 1.00 55.19 C ATOM 0 H THR C 86 28.321 2.804 -1.455 1.00 52.39 H new ATOM 0 HA THR C 86 28.490 4.999 -0.245 1.00 58.25 H new ATOM 0 HB THR C 86 26.384 3.162 0.356 1.00 58.53 H new ATOM 0 HG1 THR C 86 26.245 3.242 -1.727 1.00 57.24 H new ATOM 0 HG21 THR C 86 25.034 5.080 0.676 1.00 55.19 H new ATOM 0 HG22 THR C 86 26.274 5.130 1.661 1.00 55.19 H new ATOM 0 HG23 THR C 86 26.273 6.009 0.344 1.00 55.19 H new ATOM 2673 N ASP C 87 28.698 2.653 1.908 1.00 59.60 N ATOM 2674 CA ASP C 87 29.056 2.296 3.279 1.00 57.82 C ATOM 2675 C ASP C 87 30.549 2.294 3.632 1.00 57.20 C ATOM 2676 O ASP C 87 30.911 2.298 4.819 1.00 59.58 O ATOM 2677 CB ASP C 87 28.362 0.986 3.714 1.00 54.08 C ATOM 2678 CG ASP C 87 28.640 -0.190 2.785 1.00 53.52 C ATOM 2679 OD1 ASP C 87 28.785 -0.009 1.558 1.00 55.12 O ATOM 2680 OD2 ASP C 87 28.682 -1.322 3.295 1.00 58.41 O ATOM 0 H ASP C 87 28.540 1.976 1.401 1.00 59.60 H new ATOM 0 HA ASP C 87 28.714 3.038 3.802 1.00 57.82 H new ATOM 0 HB2 ASP C 87 28.654 0.756 4.610 1.00 54.08 H new ATOM 0 HB3 ASP C 87 27.404 1.135 3.757 1.00 54.08 H new ATOM 2681 N ASP C 88 31.412 2.280 2.617 1.00 51.32 N ATOM 2682 CA ASP C 88 32.853 2.307 2.854 1.00 49.96 C ATOM 2683 C ASP C 88 33.170 3.759 3.210 1.00 50.66 C ATOM 2684 O ASP C 88 33.855 4.044 4.194 1.00 51.28 O ATOM 2685 CB ASP C 88 33.634 1.930 1.586 1.00 49.91 C ATOM 2686 CG ASP C 88 33.378 0.510 1.120 1.00 46.73 C ATOM 2687 OD1 ASP C 88 32.200 0.182 0.889 1.00 46.40 O ATOM 2688 OD2 ASP C 88 34.359 -0.254 0.935 1.00 43.80 O ATOM 0 H ASP C 88 31.184 2.255 1.788 1.00 51.32 H new ATOM 0 HA ASP C 88 33.102 1.676 3.548 1.00 49.96 H new ATOM 0 HB2 ASP C 88 33.397 2.544 0.874 1.00 49.91 H new ATOM 0 HB3 ASP C 88 34.583 2.042 1.753 1.00 49.91 H new ATOM 2689 N ILE C 89 32.637 4.663 2.388 1.00 53.03 N ATOM 2690 CA ILE C 89 32.778 6.114 2.517 1.00 53.76 C ATOM 2691 C ILE C 89 32.314 6.643 3.892 1.00 56.92 C ATOM 2692 O ILE C 89 32.891 7.587 4.446 1.00 60.58 O ATOM 2693 CB ILE C 89 31.970 6.818 1.377 1.00 52.51 C ATOM 2694 CG1 ILE C 89 32.548 6.433 0.013 1.00 51.06 C ATOM 2695 CG2 ILE C 89 31.955 8.331 1.560 1.00 48.62 C ATOM 2696 CD1 ILE C 89 31.655 6.784 -1.179 1.00 48.96 C ATOM 0 H ILE C 89 32.161 4.436 1.708 1.00 53.03 H new ATOM 0 HA ILE C 89 33.723 6.320 2.441 1.00 53.76 H new ATOM 0 HB ILE C 89 31.050 6.515 1.421 1.00 52.51 H new ATOM 0 HG12 ILE C 89 33.404 6.874 -0.098 1.00 51.06 H new ATOM 0 HG13 ILE C 89 32.718 5.478 0.005 1.00 51.06 H new ATOM 0 HG21 ILE C 89 31.448 8.739 0.841 1.00 48.62 H new ATOM 0 HG22 ILE C 89 31.543 8.550 2.410 1.00 48.62 H new ATOM 0 HG23 ILE C 89 32.865 8.668 1.546 1.00 48.62 H new ATOM 0 HD11 ILE C 89 32.090 6.509 -2.001 1.00 48.96 H new ATOM 0 HD12 ILE C 89 30.805 6.324 -1.094 1.00 48.96 H new ATOM 0 HD13 ILE C 89 31.503 7.742 -1.199 1.00 48.96 H new ATOM 2697 N VAL C 90 31.272 6.045 4.451 1.00 56.56 N ATOM 2698 CA VAL C 90 30.789 6.483 5.746 1.00 53.50 C ATOM 2699 C VAL C 90 31.797 6.054 6.826 1.00 51.17 C ATOM 2700 O VAL C 90 32.062 6.807 7.766 1.00 51.02 O ATOM 2701 CB VAL C 90 29.370 5.931 6.019 1.00 56.64 C ATOM 2702 CG1 VAL C 90 29.422 4.495 6.610 1.00 58.03 C ATOM 2703 CG2 VAL C 90 28.594 6.900 6.903 1.00 56.92 C ATOM 0 H VAL C 90 30.836 5.392 4.101 1.00 56.56 H new ATOM 0 HA VAL C 90 30.716 7.450 5.761 1.00 53.50 H new ATOM 0 HB VAL C 90 28.895 5.857 5.176 1.00 56.64 H new ATOM 0 HG11 VAL C 90 28.519 4.178 6.770 1.00 58.03 H new ATOM 0 HG12 VAL C 90 29.866 3.903 5.983 1.00 58.03 H new ATOM 0 HG13 VAL C 90 29.913 4.507 7.447 1.00 58.03 H new ATOM 0 HG21 VAL C 90 27.706 6.547 7.069 1.00 56.92 H new ATOM 0 HG22 VAL C 90 29.060 7.013 7.746 1.00 56.92 H new ATOM 0 HG23 VAL C 90 28.522 7.758 6.457 1.00 56.92 H new ATOM 2704 N CYS C 91 32.389 4.871 6.666 1.00 48.38 N ATOM 2705 CA CYS C 91 33.383 4.370 7.618 1.00 49.65 C ATOM 2706 C CYS C 91 34.703 5.139 7.477 1.00 48.83 C ATOM 2707 O CYS C 91 35.416 5.379 8.452 1.00 46.06 O ATOM 2708 CB CYS C 91 33.602 2.864 7.416 1.00 51.89 C ATOM 2709 SG CYS C 91 34.693 2.056 8.641 1.00 57.59 S ATOM 0 H CYS C 91 32.228 4.340 6.009 1.00 48.38 H new ATOM 0 HA CYS C 91 33.049 4.512 8.518 1.00 49.65 H new ATOM 0 HB2 CYS C 91 32.739 2.422 7.434 1.00 51.89 H new ATOM 0 HB3 CYS C 91 33.975 2.723 6.532 1.00 51.89 H new ATOM 2710 N VAL C 92 35.016 5.546 6.250 1.00 48.90 N ATOM 2711 CA VAL C 92 36.217 6.322 5.958 1.00 46.41 C ATOM 2712 C VAL C 92 36.082 7.675 6.651 1.00 46.85 C ATOM 2713 O VAL C 92 37.014 8.145 7.311 1.00 45.24 O ATOM 2714 CB VAL C 92 36.379 6.527 4.440 1.00 45.46 C ATOM 2715 CG1 VAL C 92 37.407 7.604 4.143 1.00 45.32 C ATOM 2716 CG2 VAL C 92 36.788 5.234 3.792 1.00 42.69 C ATOM 0 H VAL C 92 34.533 5.378 5.558 1.00 48.90 H new ATOM 0 HA VAL C 92 37.000 5.848 6.280 1.00 46.41 H new ATOM 0 HB VAL C 92 35.526 6.814 4.078 1.00 45.46 H new ATOM 0 HG11 VAL C 92 37.492 7.715 3.183 1.00 45.32 H new ATOM 0 HG12 VAL C 92 37.123 8.442 4.541 1.00 45.32 H new ATOM 0 HG13 VAL C 92 38.265 7.344 4.515 1.00 45.32 H new ATOM 0 HG21 VAL C 92 36.889 5.368 2.837 1.00 42.69 H new ATOM 0 HG22 VAL C 92 37.632 4.937 4.167 1.00 42.69 H new ATOM 0 HG23 VAL C 92 36.108 4.561 3.954 1.00 42.69 H new ATOM 2717 N LYS C 93 34.907 8.282 6.496 1.00 45.87 N ATOM 2718 CA LYS C 93 34.586 9.569 7.091 1.00 44.17 C ATOM 2719 C LYS C 93 34.637 9.460 8.609 1.00 47.36 C ATOM 2720 O LYS C 93 34.872 10.443 9.309 1.00 51.43 O ATOM 2721 CB LYS C 93 33.191 10.007 6.662 1.00 44.04 C ATOM 2722 CG LYS C 93 33.121 10.927 5.468 1.00 42.72 C ATOM 2723 CD LYS C 93 31.684 10.953 4.965 1.00 46.33 C ATOM 2724 CE LYS C 93 31.169 12.362 4.742 1.00 49.69 C ATOM 2725 NZ LYS C 93 31.858 13.006 3.592 1.00 58.66 N ATOM 0 H LYS C 93 34.264 7.948 6.032 1.00 45.87 H new ATOM 0 HA LYS C 93 35.234 10.225 6.791 1.00 44.17 H new ATOM 0 HB2 LYS C 93 32.669 9.213 6.467 1.00 44.04 H new ATOM 0 HB3 LYS C 93 32.765 10.449 7.413 1.00 44.04 H new ATOM 0 HG2 LYS C 93 33.409 11.820 5.713 1.00 42.72 H new ATOM 0 HG3 LYS C 93 33.718 10.618 4.769 1.00 42.72 H new ATOM 0 HD2 LYS C 93 31.627 10.456 4.134 1.00 46.33 H new ATOM 0 HD3 LYS C 93 31.113 10.501 5.605 1.00 46.33 H new ATOM 0 HE2 LYS C 93 30.213 12.338 4.579 1.00 49.69 H new ATOM 0 HE3 LYS C 93 31.307 12.891 5.543 1.00 49.69 H new ATOM 0 HZ1 LYS C 93 32.348 13.689 3.884 1.00 58.66 H new ATOM 0 HZ2 LYS C 93 32.386 12.412 3.192 1.00 58.66 H new ATOM 0 HZ3 LYS C 93 31.252 13.303 3.011 1.00 58.66 H new ATOM 2726 N LYS C 94 34.383 8.272 9.138 1.00 49.55 N ATOM 2727 CA LYS C 94 34.450 8.110 10.570 1.00 49.93 C ATOM 2728 C LYS C 94 35.870 7.829 11.011 1.00 49.61 C ATOM 2729 O LYS C 94 36.193 8.051 12.171 1.00 52.86 O ATOM 2730 CB LYS C 94 33.482 7.034 11.076 1.00 57.19 C ATOM 2731 CG LYS C 94 32.098 7.609 11.426 1.00 64.76 C ATOM 2732 CD LYS C 94 31.320 6.723 12.410 1.00 66.94 C ATOM 2733 CE LYS C 94 30.498 5.645 11.709 1.00 70.79 C ATOM 2734 NZ LYS C 94 31.304 4.684 10.915 1.00 70.79 N ATOM 0 H LYS C 94 34.175 7.566 8.694 1.00 49.55 H new ATOM 0 HA LYS C 94 34.169 8.947 10.971 1.00 49.93 H new ATOM 0 HB2 LYS C 94 33.382 6.347 10.398 1.00 57.19 H new ATOM 0 HB3 LYS C 94 33.859 6.606 11.860 1.00 57.19 H new ATOM 0 HG2 LYS C 94 32.207 8.493 11.809 1.00 64.76 H new ATOM 0 HG3 LYS C 94 31.580 7.714 10.612 1.00 64.76 H new ATOM 0 HD2 LYS C 94 31.943 6.302 13.023 1.00 66.94 H new ATOM 0 HD3 LYS C 94 30.730 7.279 12.943 1.00 66.94 H new ATOM 0 HE2 LYS C 94 29.992 5.154 12.375 1.00 70.79 H new ATOM 0 HE3 LYS C 94 29.854 6.073 11.123 1.00 70.79 H new ATOM 0 HZ1 LYS C 94 30.888 3.897 10.890 1.00 70.79 H new ATOM 0 HZ2 LYS C 94 31.404 4.993 10.086 1.00 70.79 H new ATOM 0 HZ3 LYS C 94 32.104 4.584 11.292 1.00 70.79 H new ATOM 2735 N ILE C 95 36.722 7.354 10.094 1.00 48.80 N ATOM 2736 CA ILE C 95 38.131 7.080 10.420 1.00 42.28 C ATOM 2737 C ILE C 95 38.910 8.387 10.369 1.00 39.25 C ATOM 2738 O ILE C 95 39.820 8.607 11.155 1.00 39.05 O ATOM 2739 CB ILE C 95 38.819 6.088 9.450 1.00 41.67 C ATOM 2740 CG1 ILE C 95 38.094 4.748 9.395 1.00 42.46 C ATOM 2741 CG2 ILE C 95 40.230 5.805 9.926 1.00 46.41 C ATOM 2742 CD1 ILE C 95 38.707 3.762 8.432 1.00 39.56 C ATOM 0 H ILE C 95 36.506 7.184 9.279 1.00 48.80 H new ATOM 0 HA ILE C 95 38.132 6.676 11.302 1.00 42.28 H new ATOM 0 HB ILE C 95 38.808 6.501 8.572 1.00 41.67 H new ATOM 0 HG12 ILE C 95 38.086 4.358 10.283 1.00 42.46 H new ATOM 0 HG13 ILE C 95 37.170 4.900 9.144 1.00 42.46 H new ATOM 0 HG21 ILE C 95 40.659 5.184 9.317 1.00 46.41 H new ATOM 0 HG22 ILE C 95 40.735 6.633 9.951 1.00 46.41 H new ATOM 0 HG23 ILE C 95 40.200 5.417 10.815 1.00 46.41 H new ATOM 0 HD11 ILE C 95 38.199 2.936 8.447 1.00 39.56 H new ATOM 0 HD12 ILE C 95 38.693 4.133 7.536 1.00 39.56 H new ATOM 0 HD13 ILE C 95 39.624 3.582 8.693 1.00 39.56 H new ATOM 2743 N LEU C 96 38.551 9.256 9.432 1.00 41.56 N ATOM 2744 CA LEU C 96 39.218 10.545 9.286 1.00 45.24 C ATOM 2745 C LEU C 96 39.136 11.332 10.585 1.00 51.29 C ATOM 2746 O LEU C 96 40.125 11.934 11.010 1.00 55.44 O ATOM 2747 CB LEU C 96 38.636 11.363 8.108 1.00 32.45 C ATOM 2748 CG LEU C 96 39.036 10.963 6.673 1.00 28.89 C ATOM 2749 CD1 LEU C 96 38.321 11.831 5.645 1.00 27.75 C ATOM 2750 CD2 LEU C 96 40.542 11.102 6.474 1.00 26.14 C ATOM 0 H LEU C 96 37.918 9.117 8.866 1.00 41.56 H new ATOM 0 HA LEU C 96 40.151 10.374 9.083 1.00 45.24 H new ATOM 0 HB2 LEU C 96 37.669 11.321 8.168 1.00 32.45 H new ATOM 0 HB3 LEU C 96 38.889 12.290 8.238 1.00 32.45 H new ATOM 0 HG LEU C 96 38.776 10.037 6.547 1.00 28.89 H new ATOM 0 HD11 LEU C 96 38.588 11.562 4.752 1.00 27.75 H new ATOM 0 HD12 LEU C 96 37.362 11.724 5.742 1.00 27.75 H new ATOM 0 HD13 LEU C 96 38.558 12.761 5.786 1.00 27.75 H new ATOM 0 HD21 LEU C 96 40.774 10.846 5.567 1.00 26.14 H new ATOM 0 HD22 LEU C 96 40.805 12.023 6.627 1.00 26.14 H new ATOM 0 HD23 LEU C 96 41.006 10.525 7.101 1.00 26.14 H new ATOM 2751 N ASP C 97 37.974 11.260 11.241 1.00 57.65 N ATOM 2752 CA ASP C 97 37.702 11.958 12.509 1.00 56.20 C ATOM 2753 C ASP C 97 38.375 11.326 13.732 1.00 54.63 C ATOM 2754 O ASP C 97 38.636 11.996 14.725 1.00 58.27 O ATOM 2755 CB ASP C 97 36.182 12.075 12.724 1.00 52.73 C ATOM 2756 CG ASP C 97 35.484 12.785 11.559 1.00 54.50 C ATOM 2757 OD1 ASP C 97 36.056 13.767 11.023 1.00 54.90 O ATOM 2758 OD2 ASP C 97 34.376 12.353 11.167 1.00 50.46 O ATOM 0 H ASP C 97 37.308 10.796 10.958 1.00 57.65 H new ATOM 0 HA ASP C 97 38.097 12.840 12.425 1.00 56.20 H new ATOM 0 HB2 ASP C 97 35.804 11.189 12.834 1.00 52.73 H new ATOM 0 HB3 ASP C 97 36.010 12.560 13.546 1.00 52.73 H new ATOM 2759 N LYS C 98 38.685 10.046 13.647 1.00 55.64 N ATOM 2760 CA LYS C 98 39.323 9.361 14.753 1.00 59.33 C ATOM 2761 C LYS C 98 40.853 9.333 14.617 1.00 59.77 C ATOM 2762 O LYS C 98 41.571 9.596 15.579 1.00 64.84 O ATOM 2763 CB LYS C 98 38.825 7.911 14.835 1.00 66.20 C ATOM 2764 CG LYS C 98 37.306 7.708 14.831 1.00 77.16 C ATOM 2765 CD LYS C 98 36.634 8.148 16.126 1.00 84.38 C ATOM 2766 CE LYS C 98 35.150 7.766 16.144 1.00 86.66 C ATOM 2767 NZ LYS C 98 34.510 8.046 17.471 1.00 89.15 N ATOM 0 H LYS C 98 38.535 9.555 12.957 1.00 55.64 H new ATOM 0 HA LYS C 98 39.091 9.854 15.556 1.00 59.33 H new ATOM 0 HB2 LYS C 98 39.199 7.419 14.087 1.00 66.20 H new ATOM 0 HB3 LYS C 98 39.182 7.513 15.644 1.00 66.20 H new ATOM 0 HG2 LYS C 98 36.922 8.203 14.091 1.00 77.16 H new ATOM 0 HG3 LYS C 98 37.112 6.770 14.676 1.00 77.16 H new ATOM 0 HD2 LYS C 98 37.084 7.739 16.881 1.00 84.38 H new ATOM 0 HD3 LYS C 98 36.724 9.108 16.229 1.00 84.38 H new ATOM 0 HE2 LYS C 98 34.682 8.258 15.451 1.00 86.66 H new ATOM 0 HE3 LYS C 98 35.058 6.823 15.934 1.00 86.66 H new ATOM 0 HZ1 LYS C 98 33.652 7.812 17.442 1.00 89.15 H new ATOM 0 HZ2 LYS C 98 34.924 7.578 18.105 1.00 89.15 H new ATOM 0 HZ3 LYS C 98 34.574 8.915 17.654 1.00 89.15 H new ATOM 2768 N VAL C 99 41.351 9.010 13.425 1.00 54.99 N ATOM 2769 CA VAL C 99 42.786 8.882 13.200 1.00 45.64 C ATOM 2770 C VAL C 99 43.367 9.829 12.161 1.00 46.31 C ATOM 2771 O VAL C 99 44.538 10.192 12.235 1.00 51.97 O ATOM 2772 CB VAL C 99 43.120 7.450 12.800 1.00 42.46 C ATOM 2773 CG1 VAL C 99 44.598 7.288 12.556 1.00 42.26 C ATOM 2774 CG2 VAL C 99 42.648 6.506 13.879 1.00 37.91 C ATOM 0 H VAL C 99 40.869 8.860 12.729 1.00 54.99 H new ATOM 0 HA VAL C 99 43.195 9.127 14.045 1.00 45.64 H new ATOM 0 HB VAL C 99 42.663 7.240 11.971 1.00 42.46 H new ATOM 0 HG11 VAL C 99 44.786 6.371 12.303 1.00 42.26 H new ATOM 0 HG12 VAL C 99 44.875 7.883 11.842 1.00 42.26 H new ATOM 0 HG13 VAL C 99 45.086 7.506 13.366 1.00 42.26 H new ATOM 0 HG21 VAL C 99 42.860 5.594 13.626 1.00 37.91 H new ATOM 0 HG22 VAL C 99 43.092 6.721 14.714 1.00 37.91 H new ATOM 0 HG23 VAL C 99 41.689 6.596 13.991 1.00 37.91 H new ATOM 2775 N GLY C 100 42.555 10.252 11.205 1.00 45.25 N ATOM 2776 CA GLY C 100 43.054 11.149 10.185 1.00 42.85 C ATOM 2777 C GLY C 100 43.548 10.393 8.964 1.00 43.01 C ATOM 2778 O GLY C 100 43.708 9.173 9.000 1.00 45.59 O ATOM 0 H GLY C 100 41.726 10.035 11.131 1.00 45.25 H new ATOM 0 HA2 GLY C 100 42.351 11.764 9.923 1.00 42.85 H new ATOM 0 HA3 GLY C 100 43.777 11.683 10.549 1.00 42.85 H new ATOM 2779 N ILE C 101 43.802 11.119 7.878 1.00 38.86 N ATOM 2780 CA ILE C 101 44.270 10.534 6.633 1.00 35.17 C ATOM 2781 C ILE C 101 45.518 9.704 6.879 1.00 37.58 C ATOM 2782 O ILE C 101 45.865 8.856 6.068 1.00 43.08 O ATOM 2783 CB ILE C 101 44.533 11.644 5.544 1.00 31.92 C ATOM 2784 CG1 ILE C 101 44.756 11.028 4.166 1.00 28.37 C ATOM 2785 CG2 ILE C 101 45.744 12.487 5.893 1.00 27.27 C ATOM 2786 CD1 ILE C 101 43.594 10.221 3.644 1.00 28.48 C ATOM 0 H ILE C 101 43.705 11.973 7.847 1.00 38.86 H new ATOM 0 HA ILE C 101 43.575 9.950 6.291 1.00 35.17 H new ATOM 0 HB ILE C 101 43.742 12.205 5.526 1.00 31.92 H new ATOM 0 HG12 ILE C 101 44.951 11.738 3.535 1.00 28.37 H new ATOM 0 HG13 ILE C 101 45.540 10.458 4.202 1.00 28.37 H new ATOM 0 HG21 ILE C 101 45.880 13.159 5.207 1.00 27.27 H new ATOM 0 HG22 ILE C 101 45.600 12.923 6.747 1.00 27.27 H new ATOM 0 HG23 ILE C 101 46.529 11.919 5.949 1.00 27.27 H new ATOM 0 HD11 ILE C 101 43.814 9.866 2.769 1.00 28.48 H new ATOM 0 HD12 ILE C 101 43.409 9.489 4.253 1.00 28.48 H new ATOM 0 HD13 ILE C 101 42.811 10.789 3.575 1.00 28.48 H new ATOM 2787 N ASN C 102 46.146 9.917 8.035 1.00 40.35 N ATOM 2788 CA ASN C 102 47.387 9.247 8.453 1.00 42.58 C ATOM 2789 C ASN C 102 47.221 7.748 8.579 1.00 42.11 C ATOM 2790 O ASN C 102 48.200 7.037 8.843 1.00 39.05 O ATOM 2791 CB ASN C 102 47.884 9.820 9.798 1.00 49.68 C ATOM 2792 CG ASN C 102 47.697 11.343 9.899 1.00 54.00 C ATOM 2793 OD1 ASN C 102 48.429 12.126 9.268 1.00 55.89 O ATOM 2794 ND2 ASN C 102 46.673 11.762 10.654 1.00 56.51 N ATOM 0 H ASN C 102 45.854 10.475 8.621 1.00 40.35 H new ATOM 0 HA ASN C 102 48.042 9.417 7.758 1.00 42.58 H new ATOM 0 HB2 ASN C 102 47.406 9.390 10.525 1.00 49.68 H new ATOM 0 HB3 ASN C 102 48.823 9.605 9.910 1.00 49.68 H new ATOM 0 HD21 ASN C 102 46.500 12.602 10.716 1.00 56.51 H new ATOM 0 HD22 ASN C 102 46.188 11.191 11.076 1.00 56.51 H new ATOM 2795 N TYR C 103 45.963 7.298 8.480 1.00 37.21 N ATOM 2796 CA TYR C 103 45.594 5.885 8.547 1.00 35.33 C ATOM 2797 C TYR C 103 46.077 5.207 7.259 1.00 32.68 C ATOM 2798 O TYR C 103 46.489 4.046 7.254 1.00 34.18 O ATOM 2799 CB TYR C 103 44.060 5.734 8.731 1.00 37.69 C ATOM 2800 CG TYR C 103 43.541 4.297 8.652 1.00 39.16 C ATOM 2801 CD1 TYR C 103 43.580 3.449 9.752 1.00 37.57 C ATOM 2802 CD2 TYR C 103 43.058 3.777 7.453 1.00 44.33 C ATOM 2803 CE1 TYR C 103 43.161 2.121 9.653 1.00 37.68 C ATOM 2804 CE2 TYR C 103 42.635 2.452 7.342 1.00 40.89 C ATOM 2805 CZ TYR C 103 42.694 1.629 8.441 1.00 42.85 C ATOM 2806 OH TYR C 103 42.329 0.301 8.313 1.00 39.49 O ATOM 0 H TYR C 103 45.289 7.821 8.370 1.00 37.21 H new ATOM 0 HA TYR C 103 46.013 5.459 9.311 1.00 35.33 H new ATOM 0 HB2 TYR C 103 43.812 6.107 9.592 1.00 37.69 H new ATOM 0 HB3 TYR C 103 43.612 6.264 8.053 1.00 37.69 H new ATOM 0 HD1 TYR C 103 43.890 3.771 10.567 1.00 37.57 H new ATOM 0 HD2 TYR C 103 43.016 4.329 6.705 1.00 44.33 H new ATOM 0 HE1 TYR C 103 43.195 1.566 10.398 1.00 37.68 H new ATOM 0 HE2 TYR C 103 42.316 2.128 6.531 1.00 40.89 H new ATOM 0 HH TYR C 103 42.428 0.059 7.515 1.00 39.49 H new ATOM 2807 N TRP C 104 46.017 5.950 6.167 1.00 30.61 N ATOM 2808 CA TRP C 104 46.476 5.474 4.886 1.00 28.53 C ATOM 2809 C TRP C 104 47.918 5.957 4.663 1.00 29.91 C ATOM 2810 O TRP C 104 48.154 7.097 4.230 1.00 31.72 O ATOM 2811 CB TRP C 104 45.552 6.008 3.811 1.00 27.03 C ATOM 2812 CG TRP C 104 44.205 5.429 3.901 1.00 26.57 C ATOM 2813 CD1 TRP C 104 43.746 4.297 3.261 1.00 25.58 C ATOM 2814 CD2 TRP C 104 43.114 5.940 4.646 1.00 31.71 C ATOM 2815 NE1 TRP C 104 42.423 4.087 3.581 1.00 31.52 N ATOM 2816 CE2 TRP C 104 42.011 5.078 4.430 1.00 32.16 C ATOM 2817 CE3 TRP C 104 42.953 7.048 5.492 1.00 34.84 C ATOM 2818 CZ2 TRP C 104 40.782 5.293 5.029 1.00 35.66 C ATOM 2819 CZ3 TRP C 104 41.724 7.255 6.088 1.00 35.75 C ATOM 2820 CH2 TRP C 104 40.657 6.383 5.857 1.00 36.84 C ATOM 0 H TRP C 104 45.705 6.751 6.153 1.00 30.61 H new ATOM 0 HA TRP C 104 46.466 4.505 4.853 1.00 28.53 H new ATOM 0 HB2 TRP C 104 45.493 6.973 3.887 1.00 27.03 H new ATOM 0 HB3 TRP C 104 45.928 5.815 2.938 1.00 27.03 H new ATOM 0 HD1 TRP C 104 44.253 3.757 2.699 1.00 25.58 H new ATOM 0 HE1 TRP C 104 41.936 3.439 3.294 1.00 31.52 H new ATOM 0 HE3 TRP C 104 43.660 7.632 5.648 1.00 34.84 H new ATOM 0 HZ2 TRP C 104 40.066 4.720 4.877 1.00 35.66 H new ATOM 0 HZ3 TRP C 104 41.605 7.985 6.651 1.00 35.75 H new ATOM 0 HH2 TRP C 104 39.842 6.544 6.274 1.00 36.84 H new ATOM 2821 N LEU C 105 48.880 5.082 4.945 1.00 26.14 N ATOM 2822 CA LEU C 105 50.293 5.410 4.803 1.00 26.76 C ATOM 2823 C LEU C 105 50.732 5.944 3.441 1.00 31.07 C ATOM 2824 O LEU C 105 51.715 6.688 3.351 1.00 37.69 O ATOM 2825 CB LEU C 105 51.128 4.194 5.107 1.00 22.64 C ATOM 2826 CG LEU C 105 51.244 3.717 6.529 1.00 23.66 C ATOM 2827 CD1 LEU C 105 51.989 2.404 6.428 1.00 29.36 C ATOM 2828 CD2 LEU C 105 52.005 4.688 7.406 1.00 20.13 C ATOM 0 H LEU C 105 48.731 4.282 5.224 1.00 26.14 H new ATOM 0 HA LEU C 105 50.429 6.135 5.432 1.00 26.76 H new ATOM 0 HB2 LEU C 105 50.775 3.459 4.581 1.00 22.64 H new ATOM 0 HB3 LEU C 105 52.026 4.369 4.784 1.00 22.64 H new ATOM 0 HG LEU C 105 50.370 3.631 6.941 1.00 23.66 H new ATOM 0 HD11 LEU C 105 52.105 2.028 7.315 1.00 29.36 H new ATOM 0 HD12 LEU C 105 51.482 1.785 5.879 1.00 29.36 H new ATOM 0 HD13 LEU C 105 52.858 2.555 6.025 1.00 29.36 H new ATOM 0 HD21 LEU C 105 52.053 4.339 8.310 1.00 20.13 H new ATOM 0 HD22 LEU C 105 52.902 4.805 7.057 1.00 20.13 H new ATOM 0 HD23 LEU C 105 51.548 5.543 7.415 1.00 20.13 H new ATOM 2829 N ALA C 106 50.053 5.491 2.384 1.00 30.59 N ATOM 2830 CA ALA C 106 50.363 5.874 1.012 1.00 25.63 C ATOM 2831 C ALA C 106 50.138 7.351 0.749 1.00 23.65 C ATOM 2832 O ALA C 106 50.747 7.913 -0.153 1.00 28.02 O ATOM 2833 CB ALA C 106 49.567 5.028 0.014 1.00 11.64 C ATOM 0 H ALA C 106 49.391 4.946 2.449 1.00 30.59 H new ATOM 0 HA ALA C 106 51.310 5.704 0.887 1.00 25.63 H new ATOM 0 HB1 ALA C 106 49.789 5.300 -0.890 1.00 11.64 H new ATOM 0 HB2 ALA C 106 49.790 4.091 0.133 1.00 11.64 H new ATOM 0 HB3 ALA C 106 48.618 5.156 0.166 1.00 11.64 H new ATOM 2834 N HIS C 107 49.289 7.987 1.536 1.00 22.84 N ATOM 2835 CA HIS C 107 49.016 9.398 1.335 1.00 27.45 C ATOM 2836 C HIS C 107 50.241 10.351 1.404 1.00 27.81 C ATOM 2837 O HIS C 107 50.498 11.092 0.454 1.00 26.03 O ATOM 2838 CB HIS C 107 47.906 9.868 2.286 1.00 28.48 C ATOM 2839 CG HIS C 107 47.437 11.265 2.013 1.00 34.18 C ATOM 2840 ND1 HIS C 107 47.816 12.342 2.791 1.00 32.97 N ATOM 2841 CD2 HIS C 107 46.664 11.769 1.024 1.00 33.43 C ATOM 2842 CE1 HIS C 107 47.302 13.449 2.285 1.00 31.22 C ATOM 2843 NE2 HIS C 107 46.595 13.131 1.215 1.00 32.89 N ATOM 0 H HIS C 107 48.862 7.624 2.188 1.00 22.84 H new ATOM 0 HA HIS C 107 48.724 9.459 0.412 1.00 27.45 H new ATOM 0 HB2 HIS C 107 47.152 9.262 2.216 1.00 28.48 H new ATOM 0 HB3 HIS C 107 48.229 9.815 3.199 1.00 28.48 H new ATOM 0 HD2 HIS C 107 46.255 11.286 0.342 1.00 33.43 H new ATOM 0 HE1 HIS C 107 47.418 14.307 2.625 1.00 31.22 H new ATOM 0 HE2 HIS C 107 46.162 13.684 0.719 1.00 32.89 H new ATOM 2844 N LYS C 108 50.972 10.391 2.514 1.00 28.90 N ATOM 2845 CA LYS C 108 52.103 11.310 2.555 1.00 24.00 C ATOM 2846 C LYS C 108 53.271 10.768 1.772 1.00 25.58 C ATOM 2847 O LYS C 108 53.992 11.511 1.113 1.00 26.15 O ATOM 2848 CB LYS C 108 52.540 11.634 3.994 1.00 26.96 C ATOM 2849 CG LYS C 108 53.502 12.843 4.052 1.00 33.49 C ATOM 2850 CD LYS C 108 53.893 13.345 5.447 1.00 36.01 C ATOM 2851 CE LYS C 108 54.699 14.663 5.338 1.00 42.17 C ATOM 2852 NZ LYS C 108 55.975 14.704 6.149 1.00 42.56 N ATOM 0 H LYS C 108 50.840 9.920 3.221 1.00 28.90 H new ATOM 0 HA LYS C 108 51.803 12.136 2.144 1.00 24.00 H new ATOM 0 HB2 LYS C 108 51.756 11.820 4.535 1.00 26.96 H new ATOM 0 HB3 LYS C 108 52.974 10.858 4.381 1.00 26.96 H new ATOM 0 HG2 LYS C 108 54.314 12.607 3.576 1.00 33.49 H new ATOM 0 HG3 LYS C 108 53.094 13.578 3.569 1.00 33.49 H new ATOM 0 HD2 LYS C 108 53.096 13.489 5.981 1.00 36.01 H new ATOM 0 HD3 LYS C 108 54.422 12.672 5.903 1.00 36.01 H new ATOM 0 HE2 LYS C 108 54.920 14.815 4.406 1.00 42.17 H new ATOM 0 HE3 LYS C 108 54.131 15.397 5.618 1.00 42.17 H new ATOM 0 HZ1 LYS C 108 56.376 15.490 6.032 1.00 42.56 H new ATOM 0 HZ2 LYS C 108 55.783 14.595 7.011 1.00 42.56 H new ATOM 0 HZ3 LYS C 108 56.518 14.052 5.882 1.00 42.56 H new ATOM 2853 N ALA C 109 53.421 9.452 1.801 1.00 27.34 N ATOM 2854 CA ALA C 109 54.521 8.786 1.122 1.00 24.78 C ATOM 2855 C ALA C 109 54.487 8.909 -0.387 1.00 24.87 C ATOM 2856 O ALA C 109 55.415 9.439 -0.995 1.00 28.81 O ATOM 2857 CB ALA C 109 54.582 7.296 1.533 1.00 15.63 C ATOM 0 H ALA C 109 52.888 8.919 2.215 1.00 27.34 H new ATOM 0 HA ALA C 109 55.325 9.247 1.409 1.00 24.78 H new ATOM 0 HB1 ALA C 109 55.319 6.863 1.074 1.00 15.63 H new ATOM 0 HB2 ALA C 109 54.715 7.230 2.492 1.00 15.63 H new ATOM 0 HB3 ALA C 109 53.750 6.859 1.292 1.00 15.63 H new ATOM 2858 N LEU C 110 53.369 8.497 -0.976 1.00 26.32 N ATOM 2859 CA LEU C 110 53.232 8.470 -2.414 1.00 23.74 C ATOM 2860 C LEU C 110 52.306 9.480 -3.092 1.00 29.61 C ATOM 2861 O LEU C 110 52.316 9.572 -4.322 1.00 35.41 O ATOM 2862 CB LEU C 110 52.897 7.027 -2.868 1.00 20.49 C ATOM 2863 CG LEU C 110 53.813 5.885 -2.348 1.00 17.79 C ATOM 2864 CD1 LEU C 110 53.407 4.528 -2.893 1.00 17.22 C ATOM 2865 CD2 LEU C 110 55.264 6.156 -2.664 1.00 11.36 C ATOM 0 H LEU C 110 52.673 8.227 -0.548 1.00 26.32 H new ATOM 0 HA LEU C 110 54.101 8.771 -2.723 1.00 23.74 H new ATOM 0 HB2 LEU C 110 51.987 6.830 -2.595 1.00 20.49 H new ATOM 0 HB3 LEU C 110 52.913 7.006 -3.838 1.00 20.49 H new ATOM 0 HG LEU C 110 53.702 5.863 -1.385 1.00 17.79 H new ATOM 0 HD11 LEU C 110 54.003 3.847 -2.544 1.00 17.22 H new ATOM 0 HD12 LEU C 110 52.497 4.330 -2.623 1.00 17.22 H new ATOM 0 HD13 LEU C 110 53.461 4.539 -3.861 1.00 17.22 H new ATOM 0 HD21 LEU C 110 55.810 5.428 -2.328 1.00 11.36 H new ATOM 0 HD22 LEU C 110 55.378 6.229 -3.625 1.00 11.36 H new ATOM 0 HD23 LEU C 110 55.538 6.986 -2.243 1.00 11.36 H new ATOM 2866 N CYS C 111 51.539 10.258 -2.334 1.00 26.47 N ATOM 2867 CA CYS C 111 50.626 11.235 -2.945 1.00 26.87 C ATOM 2868 C CYS C 111 50.822 12.676 -2.447 1.00 28.23 C ATOM 2869 O CYS C 111 49.881 13.377 -2.080 1.00 31.93 O ATOM 2870 CB CYS C 111 49.175 10.797 -2.748 1.00 25.30 C ATOM 2871 SG CYS C 111 48.828 9.072 -3.234 1.00 20.03 S ATOM 0 H CYS C 111 51.528 10.241 -1.474 1.00 26.47 H new ATOM 0 HA CYS C 111 50.845 11.250 -3.890 1.00 26.87 H new ATOM 0 HB2 CYS C 111 48.939 10.911 -1.814 1.00 25.30 H new ATOM 0 HB3 CYS C 111 48.599 11.387 -3.260 1.00 25.30 H new ATOM 2872 N SER C 112 52.073 13.097 -2.412 1.00 28.71 N ATOM 2873 CA SER C 112 52.436 14.436 -1.993 1.00 29.72 C ATOM 2874 C SER C 112 53.119 15.136 -3.163 1.00 33.57 C ATOM 2875 O SER C 112 53.724 16.192 -2.985 1.00 34.52 O ATOM 2876 CB SER C 112 53.413 14.343 -0.833 1.00 26.16 C ATOM 2877 OG SER C 112 52.781 13.743 0.275 1.00 31.38 O ATOM 0 H SER C 112 52.744 12.607 -2.634 1.00 28.71 H new ATOM 0 HA SER C 112 51.648 14.930 -1.718 1.00 29.72 H new ATOM 0 HB2 SER C 112 54.189 13.823 -1.094 1.00 26.16 H new ATOM 0 HB3 SER C 112 53.731 15.228 -0.595 1.00 26.16 H new ATOM 0 HG SER C 112 53.251 13.105 0.554 1.00 31.38 H new ATOM 2878 N GLU C 113 52.984 14.540 -4.355 1.00 35.26 N ATOM 2879 CA GLU C 113 53.605 14.999 -5.607 1.00 32.13 C ATOM 2880 C GLU C 113 52.708 14.681 -6.804 1.00 28.17 C ATOM 2881 O GLU C 113 51.893 13.761 -6.738 1.00 32.76 O ATOM 2882 CB GLU C 113 54.918 14.225 -5.820 1.00 37.39 C ATOM 2883 CG GLU C 113 54.660 12.711 -6.061 1.00 45.24 C ATOM 2884 CD GLU C 113 55.898 11.854 -6.307 1.00 47.75 C ATOM 2885 OE1 GLU C 113 56.961 12.358 -6.722 1.00 50.05 O ATOM 2886 OE2 GLU C 113 55.784 10.631 -6.088 1.00 51.58 O ATOM 0 H GLU C 113 52.510 13.830 -4.460 1.00 35.26 H new ATOM 0 HA GLU C 113 53.751 15.956 -5.541 1.00 32.13 H new ATOM 0 HB2 GLU C 113 55.394 14.597 -6.579 1.00 37.39 H new ATOM 0 HB3 GLU C 113 55.489 14.337 -5.044 1.00 37.39 H new ATOM 0 HG2 GLU C 113 54.189 12.355 -5.292 1.00 45.24 H new ATOM 0 HG3 GLU C 113 54.068 12.619 -6.824 1.00 45.24 H new ATOM 2887 N LYS C 114 52.893 15.415 -7.897 1.00 26.02 N ATOM 2888 CA LYS C 114 52.147 15.202 -9.138 1.00 26.29 C ATOM 2889 C LYS C 114 50.664 14.983 -8.951 1.00 29.45 C ATOM 2890 O LYS C 114 50.070 14.166 -9.658 1.00 34.56 O ATOM 2891 CB LYS C 114 52.673 13.965 -9.863 1.00 30.81 C ATOM 2892 CG LYS C 114 54.126 13.962 -10.195 1.00 43.69 C ATOM 2893 CD LYS C 114 54.504 12.639 -10.825 1.00 55.64 C ATOM 2894 CE LYS C 114 55.993 12.581 -11.139 1.00 69.04 C ATOM 2895 NZ LYS C 114 56.347 11.399 -11.988 1.00 77.57 N ATOM 0 H LYS C 114 53.462 16.059 -7.941 1.00 26.02 H new ATOM 0 HA LYS C 114 52.276 16.021 -9.641 1.00 26.29 H new ATOM 0 HB2 LYS C 114 52.484 13.187 -9.315 1.00 30.81 H new ATOM 0 HB3 LYS C 114 52.172 13.859 -10.687 1.00 30.81 H new ATOM 0 HG2 LYS C 114 54.329 14.689 -10.804 1.00 43.69 H new ATOM 0 HG3 LYS C 114 54.650 14.109 -9.392 1.00 43.69 H new ATOM 0 HD2 LYS C 114 54.269 11.914 -10.225 1.00 55.64 H new ATOM 0 HD3 LYS C 114 53.994 12.509 -11.640 1.00 55.64 H new ATOM 0 HE2 LYS C 114 56.258 13.395 -11.595 1.00 69.04 H new ATOM 0 HE3 LYS C 114 56.495 12.544 -10.310 1.00 69.04 H new ATOM 0 HZ1 LYS C 114 57.222 11.400 -12.149 1.00 77.57 H new ATOM 0 HZ2 LYS C 114 56.125 10.650 -11.562 1.00 77.57 H new ATOM 0 HZ3 LYS C 114 55.904 11.443 -12.759 1.00 77.57 H new ATOM 2896 N LEU C 115 50.031 15.757 -8.088 1.00 29.60 N ATOM 2897 CA LEU C 115 48.605 15.547 -7.854 1.00 31.08 C ATOM 2898 C LEU C 115 47.614 15.834 -9.004 1.00 30.55 C ATOM 2899 O LEU C 115 46.683 15.071 -9.222 1.00 32.26 O ATOM 2900 CB LEU C 115 48.189 16.255 -6.561 1.00 33.39 C ATOM 2901 CG LEU C 115 48.765 15.622 -5.287 1.00 36.22 C ATOM 2902 CD1 LEU C 115 48.564 16.529 -4.080 1.00 33.90 C ATOM 2903 CD2 LEU C 115 48.143 14.232 -5.037 1.00 38.25 C ATOM 0 H LEU C 115 50.391 16.394 -7.636 1.00 29.60 H new ATOM 0 HA LEU C 115 48.528 14.583 -7.780 1.00 31.08 H new ATOM 0 HB2 LEU C 115 48.471 17.182 -6.606 1.00 33.39 H new ATOM 0 HB3 LEU C 115 47.221 16.256 -6.501 1.00 33.39 H new ATOM 0 HG LEU C 115 49.720 15.510 -5.417 1.00 36.22 H new ATOM 0 HD11 LEU C 115 48.936 16.105 -3.291 1.00 33.90 H new ATOM 0 HD12 LEU C 115 49.011 17.376 -4.233 1.00 33.90 H new ATOM 0 HD13 LEU C 115 47.616 16.684 -3.946 1.00 33.90 H new ATOM 0 HD21 LEU C 115 48.519 13.849 -4.229 1.00 38.25 H new ATOM 0 HD22 LEU C 115 47.182 14.321 -4.935 1.00 38.25 H new ATOM 0 HD23 LEU C 115 48.336 13.651 -5.789 1.00 38.25 H new ATOM 2904 N ASP C 116 47.831 16.901 -9.766 1.00 32.15 N ATOM 2905 CA ASP C 116 46.918 17.246 -10.847 1.00 31.83 C ATOM 2906 C ASP C 116 46.846 16.174 -11.920 1.00 35.70 C ATOM 2907 O ASP C 116 46.133 16.313 -12.904 1.00 39.35 O ATOM 2908 CB ASP C 116 47.228 18.643 -11.433 1.00 27.29 C ATOM 2909 CG ASP C 116 48.687 18.807 -11.910 1.00 34.09 C ATOM 2910 OD1 ASP C 116 49.516 17.879 -11.774 1.00 36.72 O ATOM 2911 OD2 ASP C 116 49.017 19.894 -12.426 1.00 32.76 O ATOM 0 H ASP C 116 48.498 17.436 -9.674 1.00 32.15 H new ATOM 0 HA ASP C 116 46.031 17.291 -10.457 1.00 31.83 H new ATOM 0 HB2 ASP C 116 46.631 18.811 -12.179 1.00 27.29 H new ATOM 0 HB3 ASP C 116 47.038 19.316 -10.761 1.00 27.29 H new ATOM 2912 N GLN C 117 47.614 15.107 -11.750 1.00 37.33 N ATOM 2913 CA GLN C 117 47.591 14.018 -12.714 1.00 41.26 C ATOM 2914 C GLN C 117 46.418 13.109 -12.387 1.00 38.13 C ATOM 2915 O GLN C 117 45.912 12.388 -13.247 1.00 37.34 O ATOM 2916 CB GLN C 117 48.875 13.189 -12.627 1.00 45.10 C ATOM 2917 CG GLN C 117 50.107 13.894 -13.112 1.00 60.49 C ATOM 2918 CD GLN C 117 51.252 12.932 -13.376 1.00 72.30 C ATOM 2919 OE1 GLN C 117 51.183 11.733 -13.041 1.00 74.63 O ATOM 2920 NE2 GLN C 117 52.312 13.445 -14.001 1.00 75.22 N ATOM 0 H GLN C 117 48.152 14.994 -11.088 1.00 37.33 H new ATOM 0 HA GLN C 117 47.512 14.391 -13.606 1.00 41.26 H new ATOM 0 HB2 GLN C 117 49.012 12.922 -11.705 1.00 45.10 H new ATOM 0 HB3 GLN C 117 48.757 12.376 -13.143 1.00 45.10 H new ATOM 0 HG2 GLN C 117 49.901 14.380 -13.926 1.00 60.49 H new ATOM 0 HG3 GLN C 117 50.383 14.550 -12.453 1.00 60.49 H new ATOM 0 HE21 GLN C 117 52.323 14.278 -14.216 1.00 75.22 H new ATOM 0 HE22 GLN C 117 52.985 12.943 -14.189 1.00 75.22 H new ATOM 2921 N TRP C 118 46.001 13.122 -11.133 1.00 33.21 N ATOM 2922 CA TRP C 118 44.913 12.268 -10.714 1.00 31.11 C ATOM 2923 C TRP C 118 43.531 12.824 -10.989 1.00 32.39 C ATOM 2924 O TRP C 118 42.545 12.316 -10.486 1.00 35.11 O ATOM 2925 CB TRP C 118 45.110 11.905 -9.248 1.00 32.05 C ATOM 2926 CG TRP C 118 46.376 11.112 -9.060 1.00 28.73 C ATOM 2927 CD1 TRP C 118 47.616 11.601 -8.721 1.00 25.25 C ATOM 2928 CD2 TRP C 118 46.518 9.699 -9.174 1.00 26.12 C ATOM 2929 NE1 TRP C 118 48.501 10.562 -8.609 1.00 27.23 N ATOM 2930 CE2 TRP C 118 47.849 9.384 -8.879 1.00 29.00 C ATOM 2931 CE3 TRP C 118 45.638 8.659 -9.493 1.00 27.59 C ATOM 2932 CZ2 TRP C 118 48.315 8.063 -8.893 1.00 33.31 C ATOM 2933 CZ3 TRP C 118 46.104 7.358 -9.503 1.00 25.80 C ATOM 2934 CH2 TRP C 118 47.422 7.069 -9.207 1.00 27.52 C ATOM 0 H TRP C 118 46.334 13.616 -10.513 1.00 33.21 H new ATOM 0 HA TRP C 118 44.947 11.467 -11.260 1.00 31.11 H new ATOM 0 HB2 TRP C 118 45.147 12.713 -8.712 1.00 32.05 H new ATOM 0 HB3 TRP C 118 44.351 11.390 -8.933 1.00 32.05 H new ATOM 0 HD1 TRP C 118 47.822 12.498 -8.588 1.00 25.25 H new ATOM 0 HE1 TRP C 118 49.333 10.636 -8.402 1.00 27.23 H new ATOM 0 HE3 TRP C 118 44.749 8.841 -9.696 1.00 27.59 H new ATOM 0 HZ2 TRP C 118 49.202 7.866 -8.696 1.00 33.31 H new ATOM 0 HZ3 TRP C 118 45.520 6.665 -9.713 1.00 25.80 H new ATOM 0 HH2 TRP C 118 47.710 6.185 -9.221 1.00 27.52 H new ATOM 2935 N LEU C 119 43.477 13.890 -11.771 1.00 33.82 N ATOM 2936 CA LEU C 119 42.222 14.511 -12.155 1.00 39.07 C ATOM 2937 C LEU C 119 41.566 13.730 -13.288 1.00 47.31 C ATOM 2938 O LEU C 119 42.219 12.951 -13.998 1.00 51.30 O ATOM 2939 CB LEU C 119 42.459 15.932 -12.651 1.00 34.10 C ATOM 2940 CG LEU C 119 42.721 17.045 -11.653 1.00 28.01 C ATOM 2941 CD1 LEU C 119 42.918 18.336 -12.420 1.00 27.46 C ATOM 2942 CD2 LEU C 119 41.529 17.159 -10.725 1.00 30.02 C ATOM 0 H LEU C 119 44.173 14.276 -12.096 1.00 33.82 H new ATOM 0 HA LEU C 119 41.649 14.518 -11.373 1.00 39.07 H new ATOM 0 HB2 LEU C 119 43.215 15.904 -13.259 1.00 34.10 H new ATOM 0 HB3 LEU C 119 41.684 16.189 -13.174 1.00 34.10 H new ATOM 0 HG LEU C 119 43.514 16.859 -11.126 1.00 28.01 H new ATOM 0 HD11 LEU C 119 43.087 19.060 -11.797 1.00 27.46 H new ATOM 0 HD12 LEU C 119 43.674 18.244 -13.021 1.00 27.46 H new ATOM 0 HD13 LEU C 119 42.119 18.532 -12.934 1.00 27.46 H new ATOM 0 HD21 LEU C 119 41.686 17.868 -10.082 1.00 30.02 H new ATOM 0 HD22 LEU C 119 40.734 17.362 -11.242 1.00 30.02 H new ATOM 0 HD23 LEU C 119 41.403 16.320 -10.255 1.00 30.02 H new ATOM 2943 N CYS C 120 40.307 14.056 -13.541 1.00 55.89 N ATOM 2944 CA CYS C 120 39.543 13.409 -14.599 1.00 64.35 C ATOM 2945 C CYS C 120 38.710 14.402 -15.415 1.00 73.42 C ATOM 2946 O CYS C 120 38.079 15.300 -14.857 1.00 76.26 O ATOM 2947 CB CYS C 120 38.690 12.304 -13.992 1.00 60.89 C ATOM 2948 SG CYS C 120 39.683 10.838 -13.640 1.00 51.45 S ATOM 0 H CYS C 120 39.871 14.657 -13.106 1.00 55.89 H new ATOM 0 HA CYS C 120 40.163 13.017 -15.233 1.00 64.35 H new ATOM 0 HB2 CYS C 120 38.276 12.622 -13.174 1.00 60.89 H new ATOM 0 HB3 CYS C 120 37.972 12.073 -14.602 1.00 60.89 H new ATOM 2949 N GLU C 121 38.756 14.228 -16.735 1.00 82.84 N ATOM 2950 CA GLU C 121 38.085 15.095 -17.700 1.00 91.33 C ATOM 2951 C GLU C 121 36.637 14.682 -18.017 1.00 95.44 C ATOM 2952 O GLU C 121 36.364 14.258 -19.162 1.00 99.76 O ATOM 2953 CB GLU C 121 38.910 15.147 -18.995 1.00 93.27 C ATOM 2954 CG GLU C 121 40.393 15.463 -18.775 1.00101.95 C ATOM 2955 CD GLU C 121 40.637 16.871 -18.251 1.00105.04 C ATOM 2956 OE1 GLU C 121 40.652 17.084 -17.022 1.00102.11 O ATOM 2957 OE2 GLU C 121 40.837 17.783 -19.076 1.00108.46 O ATOM 0 H GLU C 121 39.191 13.584 -17.103 1.00 82.84 H new ATOM 0 HA GLU C 121 38.026 15.972 -17.289 1.00 91.33 H new ATOM 0 HB2 GLU C 121 38.834 14.294 -19.451 1.00 93.27 H new ATOM 0 HB3 GLU C 121 38.529 15.818 -19.584 1.00 93.27 H new ATOM 0 HG2 GLU C 121 40.764 14.823 -18.148 1.00101.95 H new ATOM 0 HG3 GLU C 121 40.869 15.349 -19.612 1.00101.95 H new TER 2958 GLU C 121 ATOM 2959 N MET D 1X 33.872 35.836 40.599 1.00101.55 N ATOM 2960 CA MET D 1X 33.796 35.672 42.082 1.00104.16 C ATOM 2961 C MET D 1X 32.895 34.521 42.523 1.00104.57 C ATOM 2962 O MET D 1X 32.975 34.080 43.666 1.00105.42 O ATOM 2963 CB MET D 1X 33.340 36.976 42.757 1.00105.81 C ATOM 2964 CG MET D 1X 31.925 37.484 42.394 1.00106.93 C ATOM 2965 SD MET D 1X 30.500 36.691 43.225 1.00105.84 S ATOM 2966 CE MET D 1X 30.152 37.859 44.513 1.00106.44 C ATOM 0 H1 MET D 1X 34.362 36.553 40.404 1.00101.55 H new ATOM 0 H2 MET D 1X 34.248 35.114 40.239 1.00101.55 H new ATOM 0 H3 MET D 1X 33.052 35.939 40.269 1.00101.55 H new ATOM 0 HA MET D 1X 34.697 35.452 42.367 1.00104.16 H new ATOM 0 HB2 MET D 1X 33.380 36.850 43.718 1.00105.81 H new ATOM 0 HB3 MET D 1X 33.978 37.672 42.535 1.00105.81 H new ATOM 0 HG2 MET D 1X 31.891 38.435 42.584 1.00106.93 H new ATOM 0 HG3 MET D 1X 31.807 37.382 41.437 1.00106.93 H new ATOM 0 HE1 MET D 1X 29.398 37.547 45.038 1.00106.44 H new ATOM 0 HE2 MET D 1X 30.929 37.950 45.086 1.00106.44 H new ATOM 0 HE3 MET D 1X 29.938 38.720 44.120 1.00106.44 H new ATOM 2967 N GLU D 1 32.065 34.018 41.612 1.00104.45 N ATOM 2968 CA GLU D 1 31.139 32.930 41.928 1.00104.25 C ATOM 2969 C GLU D 1 31.847 31.587 42.022 1.00 98.87 C ATOM 2970 O GLU D 1 32.161 30.973 41.002 1.00 98.18 O ATOM 2971 CB GLU D 1 30.021 32.872 40.886 1.00111.34 C ATOM 2972 CG GLU D 1 28.992 33.994 41.027 1.00120.20 C ATOM 2973 CD GLU D 1 28.178 34.219 39.761 1.00124.38 C ATOM 2974 OE1 GLU D 1 28.057 33.280 38.940 1.00126.56 O ATOM 2975 OE2 GLU D 1 27.657 35.347 39.590 1.00126.18 O ATOM 0 H GLU D 1 32.022 34.295 40.799 1.00104.45 H new ATOM 0 HA GLU D 1 30.756 33.115 42.800 1.00104.25 H new ATOM 0 HB2 GLU D 1 30.413 32.913 40.000 1.00111.34 H new ATOM 0 HB3 GLU D 1 29.568 32.017 40.957 1.00111.34 H new ATOM 0 HG2 GLU D 1 28.391 33.784 41.759 1.00120.20 H new ATOM 0 HG3 GLU D 1 29.449 34.817 41.262 1.00120.20 H new ATOM 2976 N GLN D 2 32.047 31.132 43.257 1.00 93.13 N ATOM 2977 CA GLN D 2 32.753 29.883 43.552 1.00 85.94 C ATOM 2978 C GLN D 2 31.916 28.807 44.274 1.00 79.43 C ATOM 2979 O GLN D 2 31.221 29.088 45.253 1.00 78.83 O ATOM 2980 CB GLN D 2 33.996 30.220 44.369 1.00 84.39 C ATOM 2981 CG GLN D 2 34.956 29.099 44.583 1.00 83.76 C ATOM 2982 CD GLN D 2 36.064 29.524 45.491 1.00 84.17 C ATOM 2983 OE1 GLN D 2 37.089 30.038 45.046 1.00 85.67 O ATOM 2984 NE2 GLN D 2 35.842 29.372 46.789 1.00 84.38 N ATOM 0 H GLN D 2 31.773 31.546 43.959 1.00 93.13 H new ATOM 0 HA GLN D 2 32.976 29.482 42.697 1.00 85.94 H new ATOM 0 HB2 GLN D 2 34.465 30.945 43.928 1.00 84.39 H new ATOM 0 HB3 GLN D 2 33.713 30.551 45.236 1.00 84.39 H new ATOM 0 HG2 GLN D 2 34.492 28.337 44.965 1.00 83.76 H new ATOM 0 HG3 GLN D 2 35.321 28.812 43.731 1.00 83.76 H new ATOM 0 HE21 GLN D 2 35.112 29.007 47.061 1.00 84.38 H new ATOM 0 HE22 GLN D 2 36.428 29.638 47.360 1.00 84.38 H new ATOM 2985 N LEU D 3 32.007 27.572 43.784 1.00 72.78 N ATOM 2986 CA LEU D 3 31.278 26.441 44.345 1.00 63.56 C ATOM 2987 C LEU D 3 32.125 25.680 45.347 1.00 59.04 C ATOM 2988 O LEU D 3 33.068 26.214 45.925 1.00 59.92 O ATOM 2989 CB LEU D 3 30.857 25.468 43.244 1.00 61.34 C ATOM 2990 CG LEU D 3 30.049 25.997 42.065 1.00 66.47 C ATOM 2991 CD1 LEU D 3 31.003 26.579 41.035 1.00 67.13 C ATOM 2992 CD2 LEU D 3 29.212 24.881 41.437 1.00 65.56 C ATOM 0 H LEU D 3 32.499 27.367 43.109 1.00 72.78 H new ATOM 0 HA LEU D 3 30.495 26.803 44.789 1.00 63.56 H new ATOM 0 HB2 LEU D 3 31.662 25.061 42.889 1.00 61.34 H new ATOM 0 HB3 LEU D 3 30.341 24.760 43.660 1.00 61.34 H new ATOM 0 HG LEU D 3 29.442 26.686 42.378 1.00 66.47 H new ATOM 0 HD11 LEU D 3 30.497 26.918 40.280 1.00 67.13 H new ATOM 0 HD12 LEU D 3 31.510 27.303 41.436 1.00 67.13 H new ATOM 0 HD13 LEU D 3 31.612 25.888 40.731 1.00 67.13 H new ATOM 0 HD21 LEU D 3 28.706 25.237 40.690 1.00 65.56 H new ATOM 0 HD22 LEU D 3 29.798 24.175 41.123 1.00 65.56 H new ATOM 0 HD23 LEU D 3 28.601 24.523 42.100 1.00 65.56 H new ATOM 2993 N THR D 4 31.779 24.414 45.542 1.00 55.31 N ATOM 2994 CA THR D 4 32.503 23.560 46.457 1.00 49.74 C ATOM 2995 C THR D 4 32.643 22.210 45.792 1.00 46.14 C ATOM 2996 O THR D 4 31.848 21.868 44.908 1.00 45.07 O ATOM 2997 CB THR D 4 31.745 23.347 47.752 1.00 49.15 C ATOM 2998 OG1 THR D 4 30.506 22.701 47.455 1.00 45.49 O ATOM 2999 CG2 THR D 4 31.481 24.669 48.443 1.00 55.75 C ATOM 0 H THR D 4 31.119 24.031 45.146 1.00 55.31 H new ATOM 0 HA THR D 4 33.355 23.976 46.662 1.00 49.74 H new ATOM 0 HB THR D 4 32.277 22.796 48.347 1.00 49.15 H new ATOM 0 HG1 THR D 4 29.966 23.262 47.139 1.00 45.49 H new ATOM 0 HG21 THR D 4 30.996 24.512 49.268 1.00 55.75 H new ATOM 0 HG22 THR D 4 32.325 25.104 48.642 1.00 55.75 H new ATOM 0 HG23 THR D 4 30.953 25.239 47.862 1.00 55.75 H new ATOM 3000 N LYS D 5 33.632 21.445 46.255 1.00 42.87 N ATOM 3001 CA LYS D 5 33.953 20.122 45.737 1.00 36.03 C ATOM 3002 C LYS D 5 32.770 19.221 45.491 1.00 32.59 C ATOM 3003 O LYS D 5 32.476 18.893 44.354 1.00 34.74 O ATOM 3004 CB LYS D 5 34.938 19.406 46.664 1.00 33.59 C ATOM 3005 CG LYS D 5 35.360 18.048 46.157 1.00 34.92 C ATOM 3006 CD LYS D 5 36.764 17.709 46.631 1.00 42.06 C ATOM 3007 CE LYS D 5 36.732 17.147 48.010 1.00 41.73 C ATOM 3008 NZ LYS D 5 35.860 15.966 48.007 1.00 44.62 N ATOM 0 H LYS D 5 34.147 21.692 46.898 1.00 42.87 H new ATOM 0 HA LYS D 5 34.347 20.293 44.867 1.00 36.03 H new ATOM 0 HB2 LYS D 5 35.726 19.960 46.778 1.00 33.59 H new ATOM 0 HB3 LYS D 5 34.533 19.305 47.540 1.00 33.59 H new ATOM 0 HG2 LYS D 5 34.737 17.373 46.469 1.00 34.92 H new ATOM 0 HG3 LYS D 5 35.329 18.036 45.188 1.00 34.92 H new ATOM 0 HD2 LYS D 5 37.169 17.069 46.025 1.00 42.06 H new ATOM 0 HD3 LYS D 5 37.317 18.505 46.614 1.00 42.06 H new ATOM 0 HE2 LYS D 5 37.627 16.906 48.297 1.00 41.73 H new ATOM 0 HE3 LYS D 5 36.402 17.809 48.637 1.00 41.73 H new ATOM 0 HZ1 LYS D 5 36.165 15.370 48.594 1.00 44.62 H new ATOM 0 HZ2 LYS D 5 35.033 16.207 48.232 1.00 44.62 H new ATOM 0 HZ3 LYS D 5 35.853 15.604 47.194 1.00 44.62 H new ATOM 3009 N CYS D 6 32.040 18.885 46.540 1.00 33.21 N ATOM 3010 CA CYS D 6 30.924 17.984 46.378 1.00 35.20 C ATOM 3011 C CYS D 6 29.734 18.469 45.580 1.00 39.08 C ATOM 3012 O CYS D 6 28.821 17.695 45.313 1.00 40.62 O ATOM 3013 CB CYS D 6 30.516 17.408 47.718 1.00 43.39 C ATOM 3014 SG CYS D 6 31.795 16.286 48.371 1.00 54.45 S ATOM 0 H CYS D 6 32.173 19.164 47.342 1.00 33.21 H new ATOM 0 HA CYS D 6 31.273 17.288 45.799 1.00 35.20 H new ATOM 0 HB2 CYS D 6 30.362 18.128 48.349 1.00 43.39 H new ATOM 0 HB3 CYS D 6 29.678 16.928 47.625 1.00 43.39 H new ATOM 3015 N GLU D 7 29.752 19.738 45.180 1.00 43.30 N ATOM 3016 CA GLU D 7 28.687 20.318 44.355 1.00 43.70 C ATOM 3017 C GLU D 7 29.066 20.092 42.904 1.00 46.06 C ATOM 3018 O GLU D 7 28.237 19.677 42.087 1.00 45.05 O ATOM 3019 CB GLU D 7 28.562 21.813 44.600 1.00 44.51 C ATOM 3020 CG GLU D 7 28.078 22.146 45.982 1.00 49.65 C ATOM 3021 CD GLU D 7 27.792 23.604 46.138 1.00 50.69 C ATOM 3022 OE1 GLU D 7 28.745 24.398 46.210 1.00 53.42 O ATOM 3023 OE2 GLU D 7 26.605 23.964 46.177 1.00 59.91 O ATOM 0 H GLU D 7 30.381 20.290 45.378 1.00 43.30 H new ATOM 0 HA GLU D 7 27.839 19.902 44.576 1.00 43.70 H new ATOM 0 HB2 GLU D 7 29.425 22.232 44.456 1.00 44.51 H new ATOM 0 HB3 GLU D 7 27.951 22.192 43.949 1.00 44.51 H new ATOM 0 HG2 GLU D 7 27.275 21.637 46.174 1.00 49.65 H new ATOM 0 HG3 GLU D 7 28.746 21.877 46.632 1.00 49.65 H new ATOM 3024 N VAL D 8 30.332 20.379 42.591 1.00 48.51 N ATOM 3025 CA VAL D 8 30.890 20.199 41.249 1.00 49.22 C ATOM 3026 C VAL D 8 30.841 18.710 40.879 1.00 51.07 C ATOM 3027 O VAL D 8 30.758 18.357 39.702 1.00 54.04 O ATOM 3028 CB VAL D 8 32.326 20.744 41.196 1.00 45.28 C ATOM 3029 CG1 VAL D 8 32.965 20.495 39.838 1.00 40.83 C ATOM 3030 CG2 VAL D 8 32.299 22.221 41.493 1.00 46.61 C ATOM 0 H VAL D 8 30.898 20.688 43.160 1.00 48.51 H new ATOM 0 HA VAL D 8 30.364 20.696 40.603 1.00 49.22 H new ATOM 0 HB VAL D 8 32.860 20.280 41.860 1.00 45.28 H new ATOM 0 HG11 VAL D 8 33.868 20.849 39.835 1.00 40.83 H new ATOM 0 HG12 VAL D 8 32.991 19.541 39.663 1.00 40.83 H new ATOM 0 HG13 VAL D 8 32.443 20.936 39.149 1.00 40.83 H new ATOM 0 HG21 VAL D 8 33.202 22.574 41.462 1.00 46.61 H new ATOM 0 HG22 VAL D 8 31.752 22.674 40.832 1.00 46.61 H new ATOM 0 HG23 VAL D 8 31.926 22.367 42.376 1.00 46.61 H new ATOM 3031 N PHE D 9 30.877 17.853 41.897 1.00 52.18 N ATOM 3032 CA PHE D 9 30.787 16.401 41.747 1.00 51.12 C ATOM 3033 C PHE D 9 29.349 16.038 41.308 1.00 56.99 C ATOM 3034 O PHE D 9 29.165 15.192 40.435 1.00 61.61 O ATOM 3035 CB PHE D 9 31.111 15.744 43.098 1.00 46.51 C ATOM 3036 CG PHE D 9 31.353 14.263 43.030 1.00 43.21 C ATOM 3037 CD1 PHE D 9 30.302 13.363 43.130 1.00 43.58 C ATOM 3038 CD2 PHE D 9 32.639 13.768 42.892 1.00 39.25 C ATOM 3039 CE1 PHE D 9 30.533 12.005 43.096 1.00 38.70 C ATOM 3040 CE2 PHE D 9 32.867 12.418 42.860 1.00 37.46 C ATOM 3041 CZ PHE D 9 31.812 11.536 42.962 1.00 38.06 C ATOM 0 H PHE D 9 30.956 18.106 42.715 1.00 52.18 H new ATOM 0 HA PHE D 9 31.416 16.085 41.080 1.00 51.12 H new ATOM 0 HB2 PHE D 9 31.897 16.172 43.472 1.00 46.51 H new ATOM 0 HB3 PHE D 9 30.378 15.912 43.710 1.00 46.51 H new ATOM 0 HD1 PHE D 9 29.432 13.680 43.221 1.00 43.58 H new ATOM 0 HD2 PHE D 9 33.354 14.358 42.820 1.00 39.25 H new ATOM 0 HE1 PHE D 9 29.822 11.409 43.164 1.00 38.70 H new ATOM 0 HE2 PHE D 9 33.735 12.096 42.769 1.00 37.46 H new ATOM 0 HZ PHE D 9 31.970 10.620 42.940 1.00 38.06 H new ATOM 3042 N ARG D 10 28.332 16.650 41.919 1.00 58.14 N ATOM 3043 CA ARG D 10 26.947 16.373 41.536 1.00 60.39 C ATOM 3044 C ARG D 10 26.598 17.074 40.219 1.00 60.42 C ATOM 3045 O ARG D 10 25.741 16.588 39.475 1.00 63.39 O ATOM 3046 CB ARG D 10 25.955 16.764 42.661 1.00 65.98 C ATOM 3047 CG ARG D 10 24.485 17.038 42.211 1.00 73.40 C ATOM 3048 CD ARG D 10 23.410 16.300 43.031 1.00 81.87 C ATOM 3049 NE ARG D 10 23.010 15.027 42.409 1.00 94.41 N ATOM 3050 CZ ARG D 10 21.976 14.264 42.789 1.00 96.72 C ATOM 3051 NH1 ARG D 10 21.192 14.621 43.808 1.00 97.71 N ATOM 3052 NH2 ARG D 10 21.741 13.108 42.165 1.00 95.92 N ATOM 0 H ARG D 10 28.422 17.224 42.553 1.00 58.14 H new ATOM 0 HA ARG D 10 26.863 15.416 41.400 1.00 60.39 H new ATOM 0 HB2 ARG D 10 25.945 16.053 43.321 1.00 65.98 H new ATOM 0 HB3 ARG D 10 26.292 17.558 43.104 1.00 65.98 H new ATOM 0 HG2 ARG D 10 24.316 17.992 42.264 1.00 73.40 H new ATOM 0 HG3 ARG D 10 24.393 16.785 41.279 1.00 73.40 H new ATOM 0 HD2 ARG D 10 23.748 16.129 43.924 1.00 81.87 H new ATOM 0 HD3 ARG D 10 22.631 16.870 43.127 1.00 81.87 H new ATOM 0 HE ARG D 10 23.480 14.749 41.745 1.00 94.41 H new ATOM 0 HH11 ARG D 10 21.346 15.352 44.234 1.00 97.71 H new ATOM 0 HH12 ARG D 10 20.532 14.120 44.039 1.00 97.71 H new ATOM 0 HH21 ARG D 10 22.252 12.855 41.521 1.00 95.92 H new ATOM 0 HH22 ARG D 10 21.078 12.616 42.406 1.00 95.92 H new ATOM 3053 N GLU D 11 27.280 18.181 39.914 1.00 57.63 N ATOM 3054 CA GLU D 11 27.029 18.942 38.679 1.00 54.31 C ATOM 3055 C GLU D 11 27.736 18.430 37.407 1.00 54.68 C ATOM 3056 O GLU D 11 27.257 18.665 36.295 1.00 60.13 O ATOM 3057 CB GLU D 11 27.340 20.429 38.879 1.00 56.54 C ATOM 3058 CG GLU D 11 26.436 21.163 39.884 1.00 66.29 C ATOM 3059 CD GLU D 11 24.934 21.030 39.590 1.00 71.96 C ATOM 3060 OE1 GLU D 11 24.524 21.287 38.434 1.00 74.04 O ATOM 3061 OE2 GLU D 11 24.165 20.684 40.527 1.00 73.47 O ATOM 0 H GLU D 11 27.898 18.512 40.412 1.00 57.63 H new ATOM 0 HA GLU D 11 26.083 18.804 38.514 1.00 54.31 H new ATOM 0 HB2 GLU D 11 28.260 20.515 39.173 1.00 56.54 H new ATOM 0 HB3 GLU D 11 27.273 20.876 38.021 1.00 56.54 H new ATOM 0 HG2 GLU D 11 26.613 20.820 40.774 1.00 66.29 H new ATOM 0 HG3 GLU D 11 26.673 22.104 39.890 1.00 66.29 H new ATOM 3062 N LEU D 12 28.876 17.752 37.549 1.00 51.82 N ATOM 3063 CA LEU D 12 29.611 17.217 36.392 1.00 46.23 C ATOM 3064 C LEU D 12 29.263 15.774 36.082 1.00 45.72 C ATOM 3065 O LEU D 12 29.947 15.137 35.303 1.00 47.88 O ATOM 3066 CB LEU D 12 31.117 17.271 36.638 1.00 41.88 C ATOM 3067 CG LEU D 12 31.811 18.603 36.872 1.00 35.23 C ATOM 3068 CD1 LEU D 12 33.264 18.371 36.618 1.00 26.98 C ATOM 3069 CD2 LEU D 12 31.276 19.656 35.913 1.00 37.46 C ATOM 0 H LEU D 12 29.245 17.589 38.309 1.00 51.82 H new ATOM 0 HA LEU D 12 29.351 17.775 35.642 1.00 46.23 H new ATOM 0 HB2 LEU D 12 31.302 16.712 37.409 1.00 41.88 H new ATOM 0 HB3 LEU D 12 31.547 16.854 35.875 1.00 41.88 H new ATOM 0 HG LEU D 12 31.655 18.924 37.774 1.00 35.23 H new ATOM 0 HD11 LEU D 12 33.753 19.198 36.755 1.00 26.98 H new ATOM 0 HD12 LEU D 12 33.596 17.694 37.229 1.00 26.98 H new ATOM 0 HD13 LEU D 12 33.389 18.070 35.704 1.00 26.98 H new ATOM 0 HD21 LEU D 12 31.727 20.499 36.074 1.00 37.46 H new ATOM 0 HD22 LEU D 12 31.436 19.373 34.999 1.00 37.46 H new ATOM 0 HD23 LEU D 12 30.323 19.768 36.054 1.00 37.46 H new ATOM 3070 N LYS D 13 28.199 15.264 36.682 1.00 49.00 N ATOM 3071 CA LYS D 13 27.774 13.878 36.514 1.00 57.31 C ATOM 3072 C LYS D 13 27.797 13.301 35.082 1.00 58.83 C ATOM 3073 O LYS D 13 28.015 12.096 34.880 1.00 54.90 O ATOM 3074 CB LYS D 13 26.389 13.708 37.147 1.00 66.76 C ATOM 3075 CG LYS D 13 25.862 12.275 37.164 1.00 85.21 C ATOM 3076 CD LYS D 13 24.427 12.205 37.693 1.00 98.15 C ATOM 3077 CE LYS D 13 23.793 10.831 37.423 1.00105.86 C ATOM 3078 NZ LYS D 13 22.421 10.694 38.023 1.00111.99 N ATOM 0 H LYS D 13 27.693 15.719 37.208 1.00 49.00 H new ATOM 0 HA LYS D 13 28.451 13.351 36.966 1.00 57.31 H new ATOM 0 HB2 LYS D 13 26.422 14.038 38.059 1.00 66.76 H new ATOM 0 HB3 LYS D 13 25.757 14.265 36.666 1.00 66.76 H new ATOM 0 HG2 LYS D 13 25.895 11.907 36.267 1.00 85.21 H new ATOM 0 HG3 LYS D 13 26.438 11.725 37.717 1.00 85.21 H new ATOM 0 HD2 LYS D 13 24.424 12.382 38.647 1.00 98.15 H new ATOM 0 HD3 LYS D 13 23.892 12.897 37.274 1.00 98.15 H new ATOM 0 HE2 LYS D 13 23.738 10.687 36.465 1.00105.86 H new ATOM 0 HE3 LYS D 13 24.369 10.138 37.782 1.00105.86 H new ATOM 0 HZ1 LYS D 13 22.096 9.886 37.841 1.00111.99 H new ATOM 0 HZ2 LYS D 13 22.470 10.802 38.905 1.00111.99 H new ATOM 0 HZ3 LYS D 13 21.883 11.314 37.679 1.00111.99 H new ATOM 3079 N ASP D 14 27.579 14.164 34.095 1.00 62.33 N ATOM 3080 CA ASP D 14 27.573 13.737 32.704 1.00 64.66 C ATOM 3081 C ASP D 14 28.947 13.304 32.205 1.00 64.69 C ATOM 3082 O ASP D 14 29.061 12.376 31.409 1.00 68.80 O ATOM 3083 CB ASP D 14 27.056 14.861 31.800 1.00 70.05 C ATOM 3084 CG ASP D 14 25.540 14.978 31.791 1.00 76.75 C ATOM 3085 OD1 ASP D 14 24.840 14.110 32.359 1.00 80.91 O ATOM 3086 OD2 ASP D 14 25.042 15.952 31.184 1.00 82.83 O ATOM 0 H ASP D 14 27.432 15.003 34.212 1.00 62.33 H new ATOM 0 HA ASP D 14 26.984 12.967 32.664 1.00 64.66 H new ATOM 0 HB2 ASP D 14 27.437 15.704 32.092 1.00 70.05 H new ATOM 0 HB3 ASP D 14 27.367 14.708 30.894 1.00 70.05 H new ATOM 3087 N LEU D 15 29.984 14.005 32.653 1.00 63.27 N ATOM 3088 CA LEU D 15 31.359 13.732 32.237 1.00 57.91 C ATOM 3089 C LEU D 15 31.881 12.414 32.745 1.00 56.81 C ATOM 3090 O LEU D 15 33.045 12.061 32.503 1.00 56.33 O ATOM 3091 CB LEU D 15 32.306 14.836 32.719 1.00 57.05 C ATOM 3092 CG LEU D 15 32.259 16.246 32.131 1.00 51.15 C ATOM 3093 CD1 LEU D 15 31.890 16.179 30.645 1.00 50.94 C ATOM 3094 CD2 LEU D 15 31.291 17.102 32.900 1.00 49.96 C ATOM 0 H LEU D 15 29.911 14.656 33.210 1.00 63.27 H new ATOM 0 HA LEU D 15 31.334 13.699 31.268 1.00 57.91 H new ATOM 0 HB2 LEU D 15 32.170 14.925 33.675 1.00 57.05 H new ATOM 0 HB3 LEU D 15 33.210 14.508 32.590 1.00 57.05 H new ATOM 0 HG LEU D 15 33.136 16.654 32.206 1.00 51.15 H new ATOM 0 HD11 LEU D 15 31.862 17.076 30.278 1.00 50.94 H new ATOM 0 HD12 LEU D 15 32.555 15.656 30.170 1.00 50.94 H new ATOM 0 HD13 LEU D 15 31.020 15.762 30.546 1.00 50.94 H new ATOM 0 HD21 LEU D 15 31.271 17.993 32.517 1.00 49.96 H new ATOM 0 HD22 LEU D 15 30.405 16.711 32.853 1.00 49.96 H new ATOM 0 HD23 LEU D 15 31.572 17.156 33.827 1.00 49.96 H new ATOM 3095 N LYS D 16 31.051 11.736 33.530 1.00 55.36 N ATOM 3096 CA LYS D 16 31.409 10.462 34.106 1.00 55.28 C ATOM 3097 C LYS D 16 31.697 9.458 33.001 1.00 56.21 C ATOM 3098 O LYS D 16 30.855 9.227 32.130 1.00 57.60 O ATOM 3099 CB LYS D 16 30.290 9.947 35.018 1.00 56.00 C ATOM 3100 CG LYS D 16 30.745 8.786 35.886 1.00 63.09 C ATOM 3101 CD LYS D 16 29.626 8.119 36.664 1.00 68.50 C ATOM 3102 CE LYS D 16 30.161 6.813 37.266 1.00 78.37 C ATOM 3103 NZ LYS D 16 29.177 6.002 38.048 1.00 81.43 N ATOM 0 H LYS D 16 30.263 12.009 33.740 1.00 55.36 H new ATOM 0 HA LYS D 16 32.208 10.577 34.644 1.00 55.28 H new ATOM 0 HB2 LYS D 16 29.979 10.670 35.585 1.00 56.00 H new ATOM 0 HB3 LYS D 16 29.536 9.667 34.476 1.00 56.00 H new ATOM 0 HG2 LYS D 16 31.175 8.123 35.323 1.00 63.09 H new ATOM 0 HG3 LYS D 16 31.415 9.105 36.511 1.00 63.09 H new ATOM 0 HD2 LYS D 16 29.306 8.707 37.366 1.00 68.50 H new ATOM 0 HD3 LYS D 16 28.872 7.937 36.081 1.00 68.50 H new ATOM 0 HE2 LYS D 16 30.507 6.263 36.546 1.00 78.37 H new ATOM 0 HE3 LYS D 16 30.910 7.027 37.844 1.00 78.37 H new ATOM 0 HZ1 LYS D 16 29.575 5.268 38.356 1.00 81.43 H new ATOM 0 HZ2 LYS D 16 28.872 6.483 38.732 1.00 81.43 H new ATOM 0 HZ3 LYS D 16 28.497 5.772 37.522 1.00 81.43 H new ATOM 3104 N GLY D 17 32.931 8.949 32.998 1.00 56.16 N ATOM 3105 CA GLY D 17 33.377 7.954 32.032 1.00 53.73 C ATOM 3106 C GLY D 17 33.682 8.439 30.624 1.00 55.65 C ATOM 3107 O GLY D 17 34.558 7.896 29.936 1.00 54.44 O ATOM 0 H GLY D 17 33.536 9.177 33.565 1.00 56.16 H new ATOM 0 HA2 GLY D 17 34.176 7.531 32.384 1.00 53.73 H new ATOM 0 HA3 GLY D 17 32.695 7.267 31.972 1.00 53.73 H new ATOM 3108 N TYR D 18 32.936 9.442 30.183 1.00 54.33 N ATOM 3109 CA TYR D 18 33.081 9.991 28.857 1.00 53.42 C ATOM 3110 C TYR D 18 34.522 10.379 28.651 1.00 51.71 C ATOM 3111 O TYR D 18 35.051 11.213 29.367 1.00 53.25 O ATOM 3112 CB TYR D 18 32.156 11.198 28.705 1.00 60.91 C ATOM 3113 CG TYR D 18 31.948 11.667 27.280 1.00 69.90 C ATOM 3114 CD1 TYR D 18 32.801 12.603 26.707 1.00 72.98 C ATOM 3115 CD2 TYR D 18 30.887 11.183 26.507 1.00 72.59 C ATOM 3116 CE1 TYR D 18 32.614 13.038 25.405 1.00 76.86 C ATOM 3117 CE2 TYR D 18 30.695 11.614 25.202 1.00 73.96 C ATOM 3118 CZ TYR D 18 31.560 12.542 24.662 1.00 75.98 C ATOM 3119 OH TYR D 18 31.393 12.964 23.361 1.00 83.60 O ATOM 0 H TYR D 18 32.326 9.823 30.655 1.00 54.33 H new ATOM 0 HA TYR D 18 32.835 9.336 28.186 1.00 53.42 H new ATOM 0 HB2 TYR D 18 31.293 10.978 29.088 1.00 60.91 H new ATOM 0 HB3 TYR D 18 32.517 11.933 29.224 1.00 60.91 H new ATOM 0 HD1 TYR D 18 33.509 12.943 27.206 1.00 72.98 H new ATOM 0 HD2 TYR D 18 30.300 10.562 26.874 1.00 72.59 H new ATOM 0 HE1 TYR D 18 33.195 13.661 25.033 1.00 76.86 H new ATOM 0 HE2 TYR D 18 29.989 11.280 24.696 1.00 73.96 H new ATOM 0 HH TYR D 18 32.070 13.397 23.118 1.00 83.60 H new ATOM 3120 N GLY D 19 35.165 9.698 27.718 1.00 52.80 N ATOM 3121 CA GLY D 19 36.556 9.969 27.407 1.00 54.53 C ATOM 3122 C GLY D 19 37.530 9.273 28.339 1.00 54.63 C ATOM 3123 O GLY D 19 38.725 9.561 28.318 1.00 55.34 O ATOM 0 H GLY D 19 34.811 9.070 27.250 1.00 52.80 H new ATOM 0 HA2 GLY D 19 36.736 9.691 26.495 1.00 54.53 H new ATOM 0 HA3 GLY D 19 36.709 10.926 27.447 1.00 54.53 H new ATOM 3124 N GLY D 20 37.018 8.359 29.157 1.00 54.82 N ATOM 3125 CA GLY D 20 37.852 7.638 30.106 1.00 50.83 C ATOM 3126 C GLY D 20 38.116 8.374 31.412 1.00 48.70 C ATOM 3127 O GLY D 20 38.686 7.790 32.334 1.00 50.32 O ATOM 0 H GLY D 20 36.186 8.142 29.177 1.00 54.82 H new ATOM 0 HA2 GLY D 20 37.430 6.788 30.308 1.00 50.83 H new ATOM 0 HA3 GLY D 20 38.702 7.439 29.684 1.00 50.83 H new ATOM 3128 N VAL D 21 37.688 9.640 31.495 1.00 46.07 N ATOM 3129 CA VAL D 21 37.890 10.491 32.678 1.00 40.07 C ATOM 3130 C VAL D 21 36.833 10.223 33.731 1.00 39.21 C ATOM 3131 O VAL D 21 35.652 10.341 33.458 1.00 44.45 O ATOM 3132 CB VAL D 21 37.890 12.000 32.330 1.00 36.39 C ATOM 3133 CG1 VAL D 21 38.564 12.809 33.448 1.00 31.04 C ATOM 3134 CG2 VAL D 21 38.609 12.237 31.019 1.00 30.34 C ATOM 0 H VAL D 21 37.267 10.034 30.857 1.00 46.07 H new ATOM 0 HA VAL D 21 38.765 10.261 33.028 1.00 40.07 H new ATOM 0 HB VAL D 21 36.970 12.293 32.243 1.00 36.39 H new ATOM 0 HG11 VAL D 21 38.556 13.751 33.216 1.00 31.04 H new ATOM 0 HG12 VAL D 21 38.081 12.677 34.279 1.00 31.04 H new ATOM 0 HG13 VAL D 21 39.481 12.511 33.556 1.00 31.04 H new ATOM 0 HG21 VAL D 21 38.602 13.185 30.813 1.00 30.34 H new ATOM 0 HG22 VAL D 21 39.526 11.929 31.092 1.00 30.34 H new ATOM 0 HG23 VAL D 21 38.160 11.749 30.311 1.00 30.34 H new ATOM 3135 N SER D 22 37.262 9.884 34.940 1.00 36.98 N ATOM 3136 CA SER D 22 36.340 9.581 36.026 1.00 38.43 C ATOM 3137 C SER D 22 35.869 10.835 36.744 1.00 38.02 C ATOM 3138 O SER D 22 36.456 11.898 36.572 1.00 42.21 O ATOM 3139 CB SER D 22 37.003 8.631 37.043 1.00 37.72 C ATOM 3140 OG SER D 22 38.093 9.251 37.702 1.00 35.86 O ATOM 0 H SER D 22 38.093 9.823 35.154 1.00 36.98 H new ATOM 0 HA SER D 22 35.566 9.153 35.629 1.00 38.43 H new ATOM 0 HB2 SER D 22 36.346 8.348 37.698 1.00 37.72 H new ATOM 0 HB3 SER D 22 37.311 7.832 36.587 1.00 37.72 H new ATOM 0 HG SER D 22 38.433 8.712 38.249 1.00 35.86 H new ATOM 3141 N LEU D 23 34.854 10.698 37.594 1.00 39.55 N ATOM 3142 CA LEU D 23 34.339 11.836 38.342 1.00 35.86 C ATOM 3143 C LEU D 23 35.396 12.445 39.249 1.00 37.97 C ATOM 3144 O LEU D 23 35.494 13.677 39.317 1.00 42.44 O ATOM 3145 CB LEU D 23 33.088 11.464 39.115 1.00 33.05 C ATOM 3146 CG LEU D 23 31.848 11.856 38.340 1.00 31.51 C ATOM 3147 CD1 LEU D 23 30.618 11.456 39.117 1.00 31.16 C ATOM 3148 CD2 LEU D 23 31.863 13.368 38.094 1.00 37.07 C ATOM 0 H LEU D 23 34.451 9.954 37.750 1.00 39.55 H new ATOM 0 HA LEU D 23 34.095 12.518 37.697 1.00 35.86 H new ATOM 0 HB2 LEU D 23 33.080 10.509 39.287 1.00 33.05 H new ATOM 0 HB3 LEU D 23 33.090 11.908 39.977 1.00 33.05 H new ATOM 0 HG LEU D 23 31.834 11.399 37.485 1.00 31.51 H new ATOM 0 HD11 LEU D 23 29.824 11.708 38.619 1.00 31.16 H new ATOM 0 HD12 LEU D 23 30.621 10.496 39.256 1.00 31.16 H new ATOM 0 HD13 LEU D 23 30.617 11.907 39.976 1.00 31.16 H new ATOM 0 HD21 LEU D 23 31.070 13.623 37.597 1.00 37.07 H new ATOM 0 HD22 LEU D 23 31.876 13.834 38.944 1.00 37.07 H new ATOM 0 HD23 LEU D 23 32.653 13.605 37.584 1.00 37.07 H new ATOM 3149 N PRO D 24 36.172 11.620 39.981 1.00 35.98 N ATOM 3150 CA PRO D 24 37.205 12.196 40.851 1.00 33.50 C ATOM 3151 C PRO D 24 38.255 12.963 40.036 1.00 32.81 C ATOM 3152 O PRO D 24 38.792 13.967 40.497 1.00 37.48 O ATOM 3153 CB PRO D 24 37.819 10.968 41.516 1.00 30.78 C ATOM 3154 CG PRO D 24 36.623 10.099 41.689 1.00 37.33 C ATOM 3155 CD PRO D 24 35.944 10.199 40.334 1.00 33.91 C ATOM 0 HA PRO D 24 36.852 12.839 41.485 1.00 33.50 H new ATOM 0 HB2 PRO D 24 38.496 10.551 40.960 1.00 30.78 H new ATOM 0 HB3 PRO D 24 38.240 11.183 42.363 1.00 30.78 H new ATOM 0 HG2 PRO D 24 36.869 9.185 41.903 1.00 37.33 H new ATOM 0 HG3 PRO D 24 36.049 10.414 42.405 1.00 37.33 H new ATOM 0 HD2 PRO D 24 36.338 9.596 39.685 1.00 33.91 H new ATOM 0 HD3 PRO D 24 34.999 9.984 40.384 1.00 33.91 H new ATOM 3156 N GLU D 25 38.546 12.498 38.829 1.00 31.79 N ATOM 3157 CA GLU D 25 39.528 13.166 37.988 1.00 30.87 C ATOM 3158 C GLU D 25 38.998 14.450 37.417 1.00 35.02 C ATOM 3159 O GLU D 25 39.775 15.333 37.071 1.00 42.18 O ATOM 3160 CB GLU D 25 39.982 12.256 36.861 1.00 30.72 C ATOM 3161 CG GLU D 25 40.791 11.104 37.377 1.00 36.10 C ATOM 3162 CD GLU D 25 41.296 10.191 36.294 1.00 39.50 C ATOM 3163 OE1 GLU D 25 40.471 9.481 35.684 1.00 45.96 O ATOM 3164 OE2 GLU D 25 42.533 10.153 36.088 1.00 43.91 O ATOM 0 H GLU D 25 38.187 11.799 38.479 1.00 31.79 H new ATOM 0 HA GLU D 25 40.286 13.378 38.555 1.00 30.87 H new ATOM 0 HB2 GLU D 25 39.208 11.921 36.383 1.00 30.72 H new ATOM 0 HB3 GLU D 25 40.510 12.765 36.226 1.00 30.72 H new ATOM 0 HG2 GLU D 25 41.547 11.448 37.878 1.00 36.10 H new ATOM 0 HG3 GLU D 25 40.250 10.590 37.997 1.00 36.10 H new ATOM 3165 N TRP D 26 37.678 14.555 37.297 1.00 36.72 N ATOM 3166 CA TRP D 26 37.043 15.772 36.782 1.00 36.29 C ATOM 3167 C TRP D 26 36.985 16.875 37.839 1.00 36.13 C ATOM 3168 O TRP D 26 37.209 18.047 37.541 1.00 37.50 O ATOM 3169 CB TRP D 26 35.640 15.479 36.234 1.00 31.66 C ATOM 3170 CG TRP D 26 35.651 15.209 34.765 1.00 34.53 C ATOM 3171 CD1 TRP D 26 35.245 14.058 34.130 1.00 33.50 C ATOM 3172 CD2 TRP D 26 36.096 16.097 33.744 1.00 38.30 C ATOM 3173 NE1 TRP D 26 35.419 14.192 32.771 1.00 35.02 N ATOM 3174 CE2 TRP D 26 35.934 15.431 32.503 1.00 35.48 C ATOM 3175 CE3 TRP D 26 36.622 17.412 33.752 1.00 41.47 C ATOM 3176 CZ2 TRP D 26 36.268 16.027 31.294 1.00 39.22 C ATOM 3177 CZ3 TRP D 26 36.955 18.007 32.541 1.00 39.01 C ATOM 3178 CH2 TRP D 26 36.775 17.312 31.327 1.00 41.18 C ATOM 0 H TRP D 26 37.126 13.930 37.509 1.00 36.72 H new ATOM 0 HA TRP D 26 37.596 16.091 36.052 1.00 36.29 H new ATOM 0 HB2 TRP D 26 35.267 14.714 36.699 1.00 31.66 H new ATOM 0 HB3 TRP D 26 35.059 16.234 36.418 1.00 31.66 H new ATOM 0 HD1 TRP D 26 34.905 13.304 34.554 1.00 33.50 H new ATOM 0 HE1 TRP D 26 35.233 13.592 32.184 1.00 35.02 H new ATOM 0 HE3 TRP D 26 36.742 17.869 34.553 1.00 41.47 H new ATOM 0 HZ2 TRP D 26 36.154 15.576 30.489 1.00 39.22 H new ATOM 0 HZ3 TRP D 26 37.299 18.871 32.531 1.00 39.01 H new ATOM 0 HH2 TRP D 26 37.003 17.729 30.528 1.00 41.18 H new ATOM 3179 N VAL D 27 36.712 16.474 39.081 1.00 34.83 N ATOM 3180 CA VAL D 27 36.610 17.360 40.245 1.00 31.55 C ATOM 3181 C VAL D 27 37.999 17.911 40.636 1.00 30.58 C ATOM 3182 O VAL D 27 38.144 19.022 41.125 1.00 34.53 O ATOM 3183 CB VAL D 27 35.936 16.560 41.404 1.00 29.98 C ATOM 3184 CG1 VAL D 27 35.820 17.364 42.674 1.00 30.39 C ATOM 3185 CG2 VAL D 27 34.573 16.133 40.953 1.00 29.45 C ATOM 0 H VAL D 27 36.576 15.648 39.277 1.00 34.83 H new ATOM 0 HA VAL D 27 36.063 18.134 40.040 1.00 31.55 H new ATOM 0 HB VAL D 27 36.495 15.794 41.607 1.00 29.98 H new ATOM 0 HG11 VAL D 27 35.397 16.825 43.361 1.00 30.39 H new ATOM 0 HG12 VAL D 27 36.704 17.629 42.971 1.00 30.39 H new ATOM 0 HG13 VAL D 27 35.284 18.155 42.508 1.00 30.39 H new ATOM 0 HG21 VAL D 27 34.139 15.634 41.662 1.00 29.45 H new ATOM 0 HG22 VAL D 27 34.043 16.916 40.738 1.00 29.45 H new ATOM 0 HG23 VAL D 27 34.653 15.572 40.166 1.00 29.45 H new ATOM 3186 N CYS D 28 39.028 17.130 40.386 1.00 31.06 N ATOM 3187 CA CYS D 28 40.389 17.532 40.682 1.00 30.38 C ATOM 3188 C CYS D 28 40.867 18.475 39.580 1.00 31.08 C ATOM 3189 O CYS D 28 41.421 19.546 39.833 1.00 36.48 O ATOM 3190 CB CYS D 28 41.273 16.280 40.719 1.00 26.17 C ATOM 3191 SG CYS D 28 43.039 16.589 40.917 1.00 31.26 S ATOM 0 H CYS D 28 38.959 16.347 40.038 1.00 31.06 H new ATOM 0 HA CYS D 28 40.436 17.985 41.539 1.00 30.38 H new ATOM 0 HB2 CYS D 28 40.975 15.713 41.448 1.00 26.17 H new ATOM 0 HB3 CYS D 28 41.137 15.782 39.898 1.00 26.17 H new ATOM 3192 N THR D 29 40.644 18.075 38.337 1.00 29.94 N ATOM 3193 CA THR D 29 41.052 18.880 37.205 1.00 28.10 C ATOM 3194 C THR D 29 40.494 20.313 37.332 1.00 30.08 C ATOM 3195 O THR D 29 41.240 21.289 37.413 1.00 32.08 O ATOM 3196 CB THR D 29 40.622 18.162 35.888 1.00 26.58 C ATOM 3197 OG1 THR D 29 41.439 17.005 35.709 1.00 28.37 O ATOM 3198 CG2 THR D 29 40.776 19.036 34.653 1.00 25.28 C ATOM 0 H THR D 29 40.256 17.336 38.130 1.00 29.94 H new ATOM 0 HA THR D 29 42.017 18.972 37.184 1.00 28.10 H new ATOM 0 HB THR D 29 39.682 17.940 35.981 1.00 26.58 H new ATOM 0 HG1 THR D 29 41.230 16.423 36.278 1.00 28.37 H new ATOM 0 HG21 THR D 29 40.495 18.540 33.868 1.00 25.28 H new ATOM 0 HG22 THR D 29 40.226 19.830 34.747 1.00 25.28 H new ATOM 0 HG23 THR D 29 41.705 19.297 34.555 1.00 25.28 H new ATOM 3199 N THR D 30 39.186 20.437 37.486 1.00 34.61 N ATOM 3200 CA THR D 30 38.580 21.754 37.577 1.00 30.90 C ATOM 3201 C THR D 30 39.077 22.573 38.729 1.00 30.44 C ATOM 3202 O THR D 30 39.167 23.785 38.603 1.00 40.34 O ATOM 3203 CB THR D 30 37.030 21.702 37.539 1.00 28.51 C ATOM 3204 OG1 THR D 30 36.532 20.735 38.466 1.00 28.73 O ATOM 3205 CG2 THR D 30 36.571 21.317 36.134 1.00 27.98 C ATOM 0 H THR D 30 38.636 19.778 37.540 1.00 34.61 H new ATOM 0 HA THR D 30 38.874 22.216 36.776 1.00 30.90 H new ATOM 0 HB THR D 30 36.688 22.577 37.780 1.00 28.51 H new ATOM 0 HG1 THR D 30 36.666 19.963 38.164 1.00 28.73 H new ATOM 0 HG21 THR D 30 35.602 21.284 36.108 1.00 27.98 H new ATOM 0 HG22 THR D 30 36.889 21.976 35.497 1.00 27.98 H new ATOM 0 HG23 THR D 30 36.930 20.446 35.903 1.00 27.98 H new ATOM 3206 N PHE D 31 39.474 21.934 39.824 1.00 31.82 N ATOM 3207 CA PHE D 31 39.969 22.690 40.968 1.00 31.40 C ATOM 3208 C PHE D 31 41.243 23.454 40.594 1.00 38.10 C ATOM 3209 O PHE D 31 41.377 24.644 40.907 1.00 44.84 O ATOM 3210 CB PHE D 31 40.233 21.801 42.201 1.00 25.60 C ATOM 3211 CG PHE D 31 40.825 22.560 43.357 1.00 18.96 C ATOM 3212 CD1 PHE D 31 40.068 23.476 44.058 1.00 25.68 C ATOM 3213 CD2 PHE D 31 42.172 22.485 43.635 1.00 24.80 C ATOM 3214 CE1 PHE D 31 40.660 24.317 45.012 1.00 27.40 C ATOM 3215 CE2 PHE D 31 42.769 23.321 44.583 1.00 20.82 C ATOM 3216 CZ PHE D 31 42.014 24.236 45.263 1.00 20.80 C ATOM 0 H PHE D 31 39.466 21.080 39.925 1.00 31.82 H new ATOM 0 HA PHE D 31 39.270 23.318 41.210 1.00 31.40 H new ATOM 0 HB2 PHE D 31 39.400 21.391 42.482 1.00 25.60 H new ATOM 0 HB3 PHE D 31 40.833 21.081 41.952 1.00 25.60 H new ATOM 0 HD1 PHE D 31 39.154 23.537 43.896 1.00 25.68 H new ATOM 0 HD2 PHE D 31 42.696 21.864 43.182 1.00 24.80 H new ATOM 0 HE1 PHE D 31 40.138 24.931 45.477 1.00 27.40 H new ATOM 0 HE2 PHE D 31 43.681 23.255 44.751 1.00 20.82 H new ATOM 0 HZ PHE D 31 42.410 24.799 45.889 1.00 20.80 H new ATOM 3217 N HIS D 32 42.166 22.801 39.898 1.00 37.81 N ATOM 3218 CA HIS D 32 43.406 23.466 39.522 1.00 33.81 C ATOM 3219 C HIS D 32 43.293 24.309 38.273 1.00 36.67 C ATOM 3220 O HIS D 32 44.284 24.880 37.826 1.00 36.25 O ATOM 3221 CB HIS D 32 44.508 22.446 39.332 1.00 31.11 C ATOM 3222 CG HIS D 32 44.776 21.648 40.554 1.00 32.02 C ATOM 3223 ND1 HIS D 32 45.455 22.163 41.636 1.00 33.04 N ATOM 3224 CD2 HIS D 32 44.415 20.391 40.895 1.00 32.52 C ATOM 3225 CE1 HIS D 32 45.498 21.260 42.597 1.00 26.56 C ATOM 3226 NE2 HIS D 32 44.874 20.176 42.173 1.00 36.68 N ATOM 0 H HIS D 32 42.096 21.985 39.637 1.00 37.81 H new ATOM 0 HA HIS D 32 43.615 24.069 40.253 1.00 33.81 H new ATOM 0 HB2 HIS D 32 44.267 21.848 38.608 1.00 31.11 H new ATOM 0 HB3 HIS D 32 45.321 22.902 39.065 1.00 31.11 H new ATOM 0 HD1 HIS D 32 45.798 22.951 41.679 1.00 33.04 H new ATOM 0 HD2 HIS D 32 43.946 19.787 40.366 1.00 32.52 H new ATOM 0 HE1 HIS D 32 45.899 21.368 43.429 1.00 26.56 H new ATOM 3227 N THR D 33 42.103 24.333 37.680 1.00 37.09 N ATOM 3228 CA THR D 33 41.845 25.109 36.470 1.00 38.66 C ATOM 3229 C THR D 33 41.208 26.470 36.830 1.00 40.47 C ATOM 3230 O THR D 33 41.752 27.552 36.537 1.00 38.24 O ATOM 3231 CB THR D 33 40.887 24.315 35.538 1.00 39.74 C ATOM 3232 OG1 THR D 33 41.385 22.985 35.369 1.00 40.98 O ATOM 3233 CG2 THR D 33 40.765 24.956 34.172 1.00 36.17 C ATOM 0 H THR D 33 41.420 23.898 37.969 1.00 37.09 H new ATOM 0 HA THR D 33 42.686 25.268 36.014 1.00 38.66 H new ATOM 0 HB THR D 33 40.011 24.311 35.955 1.00 39.74 H new ATOM 0 HG1 THR D 33 41.173 22.519 36.035 1.00 40.98 H new ATOM 0 HG21 THR D 33 40.161 24.433 33.622 1.00 36.17 H new ATOM 0 HG22 THR D 33 40.418 25.857 34.267 1.00 36.17 H new ATOM 0 HG23 THR D 33 41.638 24.989 33.751 1.00 36.17 H new ATOM 3234 N SER D 34 40.089 26.401 37.538 1.00 38.03 N ATOM 3235 CA SER D 34 39.369 27.588 37.914 1.00 37.02 C ATOM 3236 C SER D 34 39.219 27.799 39.412 1.00 42.15 C ATOM 3237 O SER D 34 38.833 28.872 39.854 1.00 49.36 O ATOM 3238 CB SER D 34 37.990 27.535 37.261 1.00 33.68 C ATOM 3239 OG SER D 34 37.387 26.275 37.464 1.00 32.91 O ATOM 0 H SER D 34 39.734 25.666 37.809 1.00 38.03 H new ATOM 0 HA SER D 34 39.894 28.343 37.604 1.00 37.02 H new ATOM 0 HB2 SER D 34 37.425 28.232 37.631 1.00 33.68 H new ATOM 0 HB3 SER D 34 38.071 27.710 36.310 1.00 33.68 H new ATOM 0 HG SER D 34 37.361 25.856 36.736 1.00 32.91 H new ATOM 3240 N GLY D 35 39.536 26.798 40.216 1.00 42.80 N ATOM 3241 CA GLY D 35 39.368 26.964 41.653 1.00 39.47 C ATOM 3242 C GLY D 35 37.887 26.951 41.977 1.00 38.58 C ATOM 3243 O GLY D 35 37.448 27.351 43.055 1.00 39.93 O ATOM 0 H GLY D 35 39.841 26.035 39.963 1.00 42.80 H new ATOM 0 HA2 GLY D 35 39.822 26.251 42.129 1.00 39.47 H new ATOM 0 HA3 GLY D 35 39.768 27.799 41.944 1.00 39.47 H new ATOM 3244 N TYR D 36 37.131 26.431 41.019 1.00 37.57 N ATOM 3245 CA TYR D 36 35.691 26.317 41.088 1.00 42.39 C ATOM 3246 C TYR D 36 34.914 27.582 40.720 1.00 45.92 C ATOM 3247 O TYR D 36 33.691 27.572 40.764 1.00 49.86 O ATOM 3248 CB TYR D 36 35.251 25.774 42.450 1.00 39.58 C ATOM 3249 CG TYR D 36 35.619 24.325 42.650 1.00 37.55 C ATOM 3250 CD1 TYR D 36 35.600 23.441 41.586 1.00 37.26 C ATOM 3251 CD2 TYR D 36 36.042 23.851 43.888 1.00 38.90 C ATOM 3252 CE1 TYR D 36 35.996 22.118 41.736 1.00 38.58 C ATOM 3253 CE2 TYR D 36 36.443 22.534 44.052 1.00 39.09 C ATOM 3254 CZ TYR D 36 36.417 21.673 42.964 1.00 38.61 C ATOM 3255 OH TYR D 36 36.809 20.360 43.094 1.00 36.25 O ATOM 0 H TYR D 36 37.459 26.125 40.285 1.00 37.57 H new ATOM 0 HA TYR D 36 35.460 25.681 40.394 1.00 42.39 H new ATOM 0 HB2 TYR D 36 35.657 26.306 43.152 1.00 39.58 H new ATOM 0 HB3 TYR D 36 34.290 25.874 42.538 1.00 39.58 H new ATOM 0 HD1 TYR D 36 35.316 23.739 40.752 1.00 37.26 H new ATOM 0 HD2 TYR D 36 36.056 24.427 44.618 1.00 38.90 H new ATOM 0 HE1 TYR D 36 35.976 21.538 41.009 1.00 38.58 H new ATOM 0 HE2 TYR D 36 36.727 22.230 44.884 1.00 39.09 H new ATOM 0 HH TYR D 36 37.204 20.115 42.394 1.00 36.25 H new ATOM 3256 N ASP D 37 35.604 28.655 40.334 1.00 48.78 N ATOM 3257 CA ASP D 37 34.918 29.891 39.964 1.00 50.66 C ATOM 3258 C ASP D 37 34.266 29.813 38.587 1.00 53.46 C ATOM 3259 O ASP D 37 34.938 29.745 37.556 1.00 53.37 O ATOM 3260 CB ASP D 37 35.868 31.095 40.012 1.00 56.46 C ATOM 3261 CG ASP D 37 35.134 32.425 40.190 1.00 58.25 C ATOM 3262 OD1 ASP D 37 33.969 32.529 39.765 1.00 59.65 O ATOM 3263 OD2 ASP D 37 35.727 33.376 40.760 1.00 58.78 O ATOM 0 H ASP D 37 36.462 28.688 40.280 1.00 48.78 H new ATOM 0 HA ASP D 37 34.215 30.010 40.621 1.00 50.66 H new ATOM 0 HB2 ASP D 37 36.496 30.977 40.742 1.00 56.46 H new ATOM 0 HB3 ASP D 37 36.387 31.124 39.193 1.00 56.46 H new ATOM 3264 N THR D 38 32.940 29.843 38.595 1.00 58.11 N ATOM 3265 CA THR D 38 32.125 29.787 37.387 1.00 59.03 C ATOM 3266 C THR D 38 32.316 31.052 36.549 1.00 60.66 C ATOM 3267 O THR D 38 32.125 31.034 35.336 1.00 59.53 O ATOM 3268 CB THR D 38 30.602 29.638 37.748 1.00 58.68 C ATOM 3269 OG1 THR D 38 30.301 30.394 38.931 1.00 55.97 O ATOM 3270 CG2 THR D 38 30.231 28.190 37.993 1.00 50.91 C ATOM 0 H THR D 38 32.478 29.898 39.318 1.00 58.11 H new ATOM 0 HA THR D 38 32.411 29.014 36.875 1.00 59.03 H new ATOM 0 HB THR D 38 30.090 29.971 36.995 1.00 58.68 H new ATOM 0 HG1 THR D 38 30.409 29.909 39.609 1.00 55.97 H new ATOM 0 HG21 THR D 38 29.288 28.130 38.213 1.00 50.91 H new ATOM 0 HG22 THR D 38 30.410 27.670 37.194 1.00 50.91 H new ATOM 0 HG23 THR D 38 30.757 27.841 38.729 1.00 50.91 H new ATOM 3271 N GLN D 39 32.690 32.146 37.209 1.00 61.51 N ATOM 3272 CA GLN D 39 32.858 33.462 36.509 1.00 66.27 C ATOM 3273 C GLN D 39 34.311 33.799 36.169 1.00 67.92 C ATOM 3274 O GLN D 39 34.671 34.983 35.956 1.00 72.53 O ATOM 3275 CB GLN D 39 32.317 34.550 37.431 1.00 66.87 C ATOM 3276 CG GLN D 39 30.861 34.872 37.185 1.00 74.39 C ATOM 3277 CD GLN D 39 30.529 36.190 37.823 1.00 77.56 C ATOM 3278 OE1 GLN D 39 30.972 36.525 38.905 1.00 82.54 O ATOM 3279 NE2 GLN D 39 29.701 36.951 37.078 1.00 81.39 N ATOM 0 H GLN D 39 32.854 32.167 38.053 1.00 61.51 H new ATOM 0 HA GLN D 39 32.379 33.406 35.667 1.00 66.27 H new ATOM 0 HB2 GLN D 39 32.428 34.269 38.353 1.00 66.87 H new ATOM 0 HB3 GLN D 39 32.844 35.356 37.314 1.00 66.87 H new ATOM 0 HG2 GLN D 39 30.684 34.908 36.232 1.00 74.39 H new ATOM 0 HG3 GLN D 39 30.298 34.172 37.552 1.00 74.39 H new ATOM 0 HE21 GLN D 39 29.418 36.662 36.319 1.00 81.39 H new ATOM 0 HE22 GLN D 39 29.456 37.725 37.362 1.00 81.39 H new ATOM 3280 N ALA D 40 35.202 32.825 36.060 1.00 65.66 N ATOM 3281 CA ALA D 40 36.580 33.144 35.737 1.00 61.37 C ATOM 3282 C ALA D 40 36.807 33.456 34.263 1.00 60.50 C ATOM 3283 O ALA D 40 36.088 32.963 33.401 1.00 59.32 O ATOM 3284 CB ALA D 40 37.488 32.039 36.201 1.00 65.93 C ATOM 0 H ALA D 40 35.033 31.989 36.167 1.00 65.66 H new ATOM 0 HA ALA D 40 36.795 33.962 36.213 1.00 61.37 H new ATOM 0 HB1 ALA D 40 38.406 32.261 35.981 1.00 65.93 H new ATOM 0 HB2 ALA D 40 37.403 31.932 37.161 1.00 65.93 H new ATOM 0 HB3 ALA D 40 37.241 31.211 35.760 1.00 65.93 H new ATOM 3285 N ILE D 41 37.795 34.308 33.996 1.00 63.81 N ATOM 3286 CA ILE D 41 38.186 34.727 32.641 1.00 66.02 C ATOM 3287 C ILE D 41 39.686 34.996 32.703 1.00 66.63 C ATOM 3288 O ILE D 41 40.104 35.827 33.497 1.00 68.02 O ATOM 3289 CB ILE D 41 37.503 36.059 32.244 1.00 66.46 C ATOM 3290 CG1 ILE D 41 36.024 35.818 31.897 1.00 68.78 C ATOM 3291 CG2 ILE D 41 38.252 36.722 31.102 1.00 62.80 C ATOM 3292 CD1 ILE D 41 35.184 37.091 31.787 1.00 69.39 C ATOM 0 H ILE D 41 38.272 34.671 34.613 1.00 63.81 H new ATOM 0 HA ILE D 41 37.935 34.044 32.000 1.00 66.02 H new ATOM 0 HB ILE D 41 37.531 36.667 33.000 1.00 66.46 H new ATOM 0 HG12 ILE D 41 35.975 35.338 31.056 1.00 68.78 H new ATOM 0 HG13 ILE D 41 35.634 35.244 32.575 1.00 68.78 H new ATOM 0 HG21 ILE D 41 37.812 37.554 30.866 1.00 62.80 H new ATOM 0 HG22 ILE D 41 39.164 36.906 31.376 1.00 62.80 H new ATOM 0 HG23 ILE D 41 38.259 36.131 30.333 1.00 62.80 H new ATOM 0 HD11 ILE D 41 34.269 36.857 31.567 1.00 69.39 H new ATOM 0 HD12 ILE D 41 35.202 37.565 32.633 1.00 69.39 H new ATOM 0 HD13 ILE D 41 35.548 37.660 31.091 1.00 69.39 H new ATOM 3293 N VAL D 42 40.498 34.303 31.909 1.00 67.85 N ATOM 3294 CA VAL D 42 41.945 34.531 31.951 1.00 71.20 C ATOM 3295 C VAL D 42 42.488 34.956 30.598 1.00 76.32 C ATOM 3296 O VAL D 42 42.396 34.206 29.622 1.00 75.79 O ATOM 3297 CB VAL D 42 42.745 33.279 32.406 1.00 70.57 C ATOM 3298 CG1 VAL D 42 44.208 33.643 32.599 1.00 69.66 C ATOM 3299 CG2 VAL D 42 42.176 32.703 33.683 1.00 71.89 C ATOM 0 H VAL D 42 40.240 33.706 31.347 1.00 67.85 H new ATOM 0 HA VAL D 42 42.065 35.239 32.603 1.00 71.20 H new ATOM 0 HB VAL D 42 42.672 32.602 31.715 1.00 70.57 H new ATOM 0 HG11 VAL D 42 44.702 32.858 32.883 1.00 69.66 H new ATOM 0 HG12 VAL D 42 44.574 33.970 31.762 1.00 69.66 H new ATOM 0 HG13 VAL D 42 44.283 34.334 33.276 1.00 69.66 H new ATOM 0 HG21 VAL D 42 42.692 31.924 33.945 1.00 71.89 H new ATOM 0 HG22 VAL D 42 42.218 33.370 34.386 1.00 71.89 H new ATOM 0 HG23 VAL D 42 41.252 32.445 33.538 1.00 71.89 H new ATOM 3300 N GLN D 43 43.088 36.144 30.558 1.00 81.47 N ATOM 3301 CA GLN D 43 43.646 36.696 29.325 1.00 85.96 C ATOM 3302 C GLN D 43 45.118 36.311 29.179 1.00 87.76 C ATOM 3303 O GLN D 43 45.980 36.790 29.918 1.00 86.10 O ATOM 3304 CB GLN D 43 43.511 38.227 29.283 1.00 87.87 C ATOM 3305 CG GLN D 43 42.380 38.823 30.126 1.00 95.40 C ATOM 3306 CD GLN D 43 42.704 38.875 31.619 1.00 99.53 C ATOM 3307 OE1 GLN D 43 43.401 39.779 32.085 1.00103.32 O ATOM 3308 NE2 GLN D 43 42.167 37.928 32.376 1.00100.08 N ATOM 0 H GLN D 43 43.183 36.653 31.245 1.00 81.47 H new ATOM 0 HA GLN D 43 43.141 36.321 28.587 1.00 85.96 H new ATOM 0 HB2 GLN D 43 44.349 38.616 29.577 1.00 87.87 H new ATOM 0 HB3 GLN D 43 43.380 38.498 28.361 1.00 87.87 H new ATOM 0 HG2 GLN D 43 42.188 39.720 29.811 1.00 95.40 H new ATOM 0 HG3 GLN D 43 41.575 38.298 29.994 1.00 95.40 H new ATOM 0 HE21 GLN D 43 41.686 37.312 32.017 1.00100.08 H new ATOM 0 HE22 GLN D 43 42.300 37.930 33.226 1.00100.08 H new ATOM 3309 N ASN D 44 45.392 35.384 28.271 1.00 91.69 N ATOM 3310 CA ASN D 44 46.760 34.938 28.031 1.00 96.97 C ATOM 3311 C ASN D 44 47.352 35.812 26.921 1.00 99.61 C ATOM 3312 O ASN D 44 46.768 36.853 26.599 1.00102.51 O ATOM 3313 CB ASN D 44 46.783 33.442 27.674 1.00 97.17 C ATOM 3314 CG ASN D 44 46.358 32.554 28.847 1.00 97.22 C ATOM 3315 OD1 ASN D 44 47.190 31.954 29.528 1.00 96.75 O ATOM 3316 ND2 ASN D 44 45.053 32.479 29.090 1.00 97.33 N ATOM 0 H ASN D 44 44.799 34.999 27.781 1.00 91.69 H new ATOM 0 HA ASN D 44 47.301 35.035 28.830 1.00 96.97 H new ATOM 0 HB2 ASN D 44 46.193 33.283 26.921 1.00 97.17 H new ATOM 0 HB3 ASN D 44 47.677 33.194 27.391 1.00 97.17 H new ATOM 0 HD21 ASN D 44 44.764 31.999 29.742 1.00 97.33 H new ATOM 0 HD22 ASN D 44 44.498 32.911 28.595 1.00 97.33 H new ATOM 3317 N ASN D 45 48.476 35.408 26.317 1.00100.26 N ATOM 3318 CA ASN D 45 49.115 36.227 25.262 1.00 98.44 C ATOM 3319 C ASN D 45 48.227 36.415 24.026 1.00 97.51 C ATOM 3320 O ASN D 45 48.215 37.490 23.424 1.00 98.46 O ATOM 3321 CB ASN D 45 50.483 35.652 24.780 1.00 94.94 C ATOM 3322 CG ASN D 45 51.208 34.837 25.838 1.00 92.27 C ATOM 3323 OD1 ASN D 45 50.960 33.641 25.996 1.00 88.02 O ATOM 3324 ND2 ASN D 45 52.117 35.474 26.560 1.00 90.60 N ATOM 0 H ASN D 45 48.884 34.673 26.497 1.00100.26 H new ATOM 0 HA ASN D 45 49.259 37.084 25.693 1.00 98.44 H new ATOM 0 HB2 ASN D 45 50.334 35.095 24.000 1.00 94.94 H new ATOM 0 HB3 ASN D 45 51.053 36.385 24.501 1.00 94.94 H new ATOM 0 HD21 ASN D 45 52.559 35.052 27.165 1.00 90.60 H new ATOM 0 HD22 ASN D 45 52.266 36.310 26.424 1.00 90.60 H new ATOM 3325 N ASP D 46 47.462 35.382 23.678 1.00 95.90 N ATOM 3326 CA ASP D 46 46.619 35.403 22.485 1.00 91.90 C ATOM 3327 C ASP D 46 45.106 35.222 22.668 1.00 89.37 C ATOM 3328 O ASP D 46 44.307 35.831 21.948 1.00 90.01 O ATOM 3329 CB ASP D 46 47.132 34.336 21.510 1.00 90.84 C ATOM 3330 CG ASP D 46 47.280 32.956 22.163 1.00 89.74 C ATOM 3331 OD1 ASP D 46 46.262 32.262 22.384 1.00 88.90 O ATOM 3332 OD2 ASP D 46 48.427 32.552 22.443 1.00 88.25 O ATOM 0 H ASP D 46 47.417 34.650 24.127 1.00 95.90 H new ATOM 0 HA ASP D 46 46.701 36.312 22.156 1.00 91.90 H new ATOM 0 HB2 ASP D 46 46.522 34.270 20.759 1.00 90.84 H new ATOM 0 HB3 ASP D 46 47.990 34.615 21.154 1.00 90.84 H new ATOM 3333 N SER D 47 44.712 34.389 23.625 1.00 84.81 N ATOM 3334 CA SER D 47 43.297 34.100 23.835 1.00 78.91 C ATOM 3335 C SER D 47 42.782 34.399 25.234 1.00 75.24 C ATOM 3336 O SER D 47 43.557 34.676 26.155 1.00 76.03 O ATOM 3337 CB SER D 47 43.059 32.627 23.529 1.00 78.94 C ATOM 3338 OG SER D 47 44.052 31.833 24.162 1.00 78.15 O ATOM 0 H SER D 47 45.246 33.982 24.162 1.00 84.81 H new ATOM 0 HA SER D 47 42.807 34.691 23.241 1.00 78.91 H new ATOM 0 HB2 SER D 47 42.178 32.363 23.837 1.00 78.94 H new ATOM 0 HB3 SER D 47 43.080 32.481 22.570 1.00 78.94 H new ATOM 0 HG SER D 47 44.745 31.821 23.688 1.00 78.15 H new ATOM 3339 N THR D 48 41.465 34.333 25.381 1.00 68.56 N ATOM 3340 CA THR D 48 40.826 34.557 26.668 1.00 63.74 C ATOM 3341 C THR D 48 39.928 33.341 26.950 1.00 61.67 C ATOM 3342 O THR D 48 39.034 33.023 26.164 1.00 61.63 O ATOM 3343 CB THR D 48 40.047 35.901 26.692 1.00 60.00 C ATOM 3344 OG1 THR D 48 40.961 36.981 26.463 1.00 62.00 O ATOM 3345 CG2 THR D 48 39.379 36.129 28.032 1.00 56.64 C ATOM 0 H THR D 48 40.919 34.158 24.740 1.00 68.56 H new ATOM 0 HA THR D 48 41.489 34.639 27.372 1.00 63.74 H new ATOM 0 HB THR D 48 39.367 35.863 26.001 1.00 60.00 H new ATOM 0 HG1 THR D 48 40.543 37.709 26.474 1.00 62.00 H new ATOM 0 HG21 THR D 48 38.902 36.973 28.016 1.00 56.64 H new ATOM 0 HG22 THR D 48 38.754 35.408 28.209 1.00 56.64 H new ATOM 0 HG23 THR D 48 40.052 36.151 28.730 1.00 56.64 H new ATOM 3346 N GLU D 49 40.256 32.606 28.009 1.00 59.80 N ATOM 3347 CA GLU D 49 39.530 31.403 28.400 1.00 55.60 C ATOM 3348 C GLU D 49 38.482 31.789 29.410 1.00 52.84 C ATOM 3349 O GLU D 49 38.746 32.637 30.287 1.00 46.97 O ATOM 3350 CB GLU D 49 40.496 30.395 29.006 1.00 60.02 C ATOM 3351 CG GLU D 49 41.651 30.067 28.065 1.00 64.41 C ATOM 3352 CD GLU D 49 42.805 29.366 28.750 1.00 63.72 C ATOM 3353 OE1 GLU D 49 43.167 29.751 29.878 1.00 64.73 O ATOM 3354 OE2 GLU D 49 43.352 28.423 28.142 1.00 66.90 O ATOM 0 H GLU D 49 40.916 32.795 28.527 1.00 59.80 H new ATOM 0 HA GLU D 49 39.108 30.998 27.626 1.00 55.60 H new ATOM 0 HB2 GLU D 49 40.849 30.747 29.838 1.00 60.02 H new ATOM 0 HB3 GLU D 49 40.017 29.580 29.223 1.00 60.02 H new ATOM 0 HG2 GLU D 49 41.323 29.507 27.344 1.00 64.41 H new ATOM 0 HG3 GLU D 49 41.974 30.888 27.662 1.00 64.41 H new ATOM 3355 N TYR D 50 37.305 31.166 29.276 1.00 48.62 N ATOM 3356 CA TYR D 50 36.149 31.442 30.124 1.00 46.20 C ATOM 3357 C TYR D 50 35.646 30.302 31.012 1.00 43.58 C ATOM 3358 O TYR D 50 35.823 29.126 30.704 1.00 44.88 O ATOM 3359 CB TYR D 50 34.970 31.891 29.245 1.00 51.74 C ATOM 3360 CG TYR D 50 35.108 33.258 28.622 1.00 49.94 C ATOM 3361 CD1 TYR D 50 36.056 33.500 27.648 1.00 51.27 C ATOM 3362 CD2 TYR D 50 34.312 34.317 29.043 1.00 51.52 C ATOM 3363 CE1 TYR D 50 36.220 34.760 27.112 1.00 56.41 C ATOM 3364 CE2 TYR D 50 34.461 35.579 28.517 1.00 57.86 C ATOM 3365 CZ TYR D 50 35.430 35.797 27.547 1.00 58.19 C ATOM 3366 OH TYR D 50 35.633 37.061 27.024 1.00 63.14 O ATOM 0 H TYR D 50 37.158 30.563 28.680 1.00 48.62 H new ATOM 0 HA TYR D 50 36.472 32.125 30.732 1.00 46.20 H new ATOM 0 HB2 TYR D 50 34.849 31.240 28.536 1.00 51.74 H new ATOM 0 HB3 TYR D 50 34.163 31.878 29.783 1.00 51.74 H new ATOM 0 HD1 TYR D 50 36.593 32.802 27.348 1.00 51.27 H new ATOM 0 HD2 TYR D 50 33.665 34.169 29.694 1.00 51.52 H new ATOM 0 HE1 TYR D 50 36.864 34.908 26.457 1.00 56.41 H new ATOM 0 HE2 TYR D 50 33.920 36.277 28.807 1.00 57.86 H new ATOM 0 HH TYR D 50 36.040 36.999 26.292 1.00 63.14 H new ATOM 3367 N GLY D 51 34.956 30.676 32.082 1.00 44.76 N ATOM 3368 CA GLY D 51 34.359 29.712 32.992 1.00 47.60 C ATOM 3369 C GLY D 51 35.209 28.714 33.766 1.00 50.29 C ATOM 3370 O GLY D 51 36.445 28.712 33.707 1.00 52.72 O ATOM 0 H GLY D 51 34.821 31.497 32.300 1.00 44.76 H new ATOM 0 HA2 GLY D 51 33.853 30.219 33.647 1.00 47.60 H new ATOM 0 HA3 GLY D 51 33.719 29.197 32.476 1.00 47.60 H new ATOM 3371 N LEU D 52 34.513 27.841 34.486 1.00 47.28 N ATOM 3372 CA LEU D 52 35.117 26.796 35.300 1.00 47.12 C ATOM 3373 C LEU D 52 36.027 25.851 34.506 1.00 45.33 C ATOM 3374 O LEU D 52 37.024 25.359 35.055 1.00 47.37 O ATOM 3375 CB LEU D 52 34.006 25.998 35.994 1.00 47.40 C ATOM 3376 CG LEU D 52 34.241 24.834 36.959 1.00 47.60 C ATOM 3377 CD1 LEU D 52 33.870 25.233 38.371 1.00 47.76 C ATOM 3378 CD2 LEU D 52 33.342 23.677 36.536 1.00 51.69 C ATOM 0 H LEU D 52 33.653 27.841 34.515 1.00 47.28 H new ATOM 0 HA LEU D 52 35.687 27.233 35.952 1.00 47.12 H new ATOM 0 HB2 LEU D 52 33.475 26.647 36.482 1.00 47.40 H new ATOM 0 HB3 LEU D 52 33.445 25.648 35.284 1.00 47.40 H new ATOM 0 HG LEU D 52 35.177 24.582 36.935 1.00 47.60 H new ATOM 0 HD11 LEU D 52 34.024 24.486 38.970 1.00 47.76 H new ATOM 0 HD12 LEU D 52 34.414 25.987 38.648 1.00 47.76 H new ATOM 0 HD13 LEU D 52 32.933 25.483 38.401 1.00 47.76 H new ATOM 0 HD21 LEU D 52 33.476 22.927 37.136 1.00 51.69 H new ATOM 0 HD22 LEU D 52 32.414 23.958 36.572 1.00 51.69 H new ATOM 0 HD23 LEU D 52 33.563 23.409 35.630 1.00 51.69 H new ATOM 3379 N PHE D 53 35.709 25.619 33.227 1.00 39.85 N ATOM 3380 CA PHE D 53 36.503 24.715 32.374 1.00 36.62 C ATOM 3381 C PHE D 53 37.591 25.428 31.597 1.00 37.87 C ATOM 3382 O PHE D 53 38.383 24.778 30.915 1.00 38.59 O ATOM 3383 CB PHE D 53 35.611 23.940 31.371 1.00 31.87 C ATOM 3384 CG PHE D 53 34.721 22.885 32.007 1.00 36.03 C ATOM 3385 CD1 PHE D 53 35.202 21.610 32.280 1.00 39.04 C ATOM 3386 CD2 PHE D 53 33.410 23.180 32.363 1.00 34.97 C ATOM 3387 CE1 PHE D 53 34.398 20.661 32.895 1.00 32.94 C ATOM 3388 CE2 PHE D 53 32.608 22.232 32.976 1.00 33.11 C ATOM 3389 CZ PHE D 53 33.100 20.976 33.245 1.00 33.29 C ATOM 0 H PHE D 53 35.035 25.976 32.830 1.00 39.85 H new ATOM 0 HA PHE D 53 36.923 24.096 32.991 1.00 36.62 H new ATOM 0 HB2 PHE D 53 35.052 24.574 30.895 1.00 31.87 H new ATOM 0 HB3 PHE D 53 36.180 23.513 30.712 1.00 31.87 H new ATOM 0 HD1 PHE D 53 36.075 21.390 32.047 1.00 39.04 H new ATOM 0 HD2 PHE D 53 33.067 24.026 32.187 1.00 34.97 H new ATOM 0 HE1 PHE D 53 34.734 19.812 33.072 1.00 32.94 H new ATOM 0 HE2 PHE D 53 31.733 22.446 33.207 1.00 33.11 H new ATOM 0 HZ PHE D 53 32.561 20.342 33.661 1.00 33.29 H new ATOM 3390 N GLN D 54 37.631 26.757 31.720 1.00 39.27 N ATOM 3391 CA GLN D 54 38.580 27.626 31.012 1.00 40.01 C ATOM 3392 C GLN D 54 38.757 27.282 29.536 1.00 42.19 C ATOM 3393 O GLN D 54 39.847 26.955 29.069 1.00 42.44 O ATOM 3394 CB GLN D 54 39.921 27.704 31.722 1.00 42.45 C ATOM 3395 CG GLN D 54 39.860 28.365 33.092 1.00 42.52 C ATOM 3396 CD GLN D 54 39.690 29.865 33.064 1.00 36.32 C ATOM 3397 OE1 GLN D 54 40.463 30.576 32.453 1.00 46.42 O ATOM 3398 NE2 GLN D 54 38.716 30.352 33.784 1.00 35.57 N ATOM 0 H GLN D 54 37.093 27.191 32.231 1.00 39.27 H new ATOM 0 HA GLN D 54 38.175 28.507 31.033 1.00 40.01 H new ATOM 0 HB2 GLN D 54 40.276 26.807 31.822 1.00 42.45 H new ATOM 0 HB3 GLN D 54 40.544 28.195 31.164 1.00 42.45 H new ATOM 0 HG2 GLN D 54 39.124 27.978 33.591 1.00 42.52 H new ATOM 0 HG3 GLN D 54 40.674 28.153 33.576 1.00 42.52 H new ATOM 0 HE21 GLN D 54 38.186 29.822 34.205 1.00 35.57 H new ATOM 0 HE22 GLN D 54 38.605 31.203 33.838 1.00 35.57 H new ATOM 3399 N ILE D 55 37.640 27.366 28.821 1.00 49.99 N ATOM 3400 CA ILE D 55 37.554 27.110 27.384 1.00 50.97 C ATOM 3401 C ILE D 55 38.065 28.367 26.669 1.00 55.52 C ATOM 3402 O ILE D 55 37.765 29.497 27.099 1.00 50.47 O ATOM 3403 CB ILE D 55 36.084 26.835 26.974 1.00 45.41 C ATOM 3404 CG1 ILE D 55 35.593 25.548 27.627 1.00 34.71 C ATOM 3405 CG2 ILE D 55 35.948 26.727 25.475 1.00 43.22 C ATOM 3406 CD1 ILE D 55 34.336 25.715 28.374 1.00 38.87 C ATOM 0 H ILE D 55 36.884 27.581 29.170 1.00 49.99 H new ATOM 0 HA ILE D 55 38.083 26.333 27.144 1.00 50.97 H new ATOM 0 HB ILE D 55 35.543 27.581 27.278 1.00 45.41 H new ATOM 0 HG12 ILE D 55 35.467 24.873 26.942 1.00 34.71 H new ATOM 0 HG13 ILE D 55 36.278 25.217 28.229 1.00 34.71 H new ATOM 0 HG21 ILE D 55 35.021 26.555 25.245 1.00 43.22 H new ATOM 0 HG22 ILE D 55 36.234 27.557 25.063 1.00 43.22 H new ATOM 0 HG23 ILE D 55 36.501 25.999 25.151 1.00 43.22 H new ATOM 0 HD11 ILE D 55 34.076 24.866 28.764 1.00 38.87 H new ATOM 0 HD12 ILE D 55 34.463 26.369 29.079 1.00 38.87 H new ATOM 0 HD13 ILE D 55 33.640 26.020 27.772 1.00 38.87 H new ATOM 3407 N ASN D 56 38.871 28.174 25.621 1.00 59.61 N ATOM 3408 CA ASN D 56 39.405 29.312 24.877 1.00 63.99 C ATOM 3409 C ASN D 56 38.616 29.759 23.634 1.00 66.84 C ATOM 3410 O ASN D 56 38.006 28.948 22.915 1.00 64.62 O ATOM 3411 CB ASN D 56 40.902 29.149 24.557 1.00 57.75 C ATOM 3412 CG ASN D 56 41.165 28.175 23.454 1.00 55.14 C ATOM 3413 OD1 ASN D 56 40.270 27.821 22.702 1.00 54.17 O ATOM 3414 ND2 ASN D 56 42.419 27.754 23.329 1.00 60.49 N ATOM 0 H ASN D 56 39.116 27.403 25.330 1.00 59.61 H new ATOM 0 HA ASN D 56 39.289 30.045 25.502 1.00 63.99 H new ATOM 0 HB2 ASN D 56 41.271 30.012 24.313 1.00 57.75 H new ATOM 0 HB3 ASN D 56 41.368 28.857 25.356 1.00 57.75 H new ATOM 0 HD21 ASN D 56 42.629 27.209 22.698 1.00 60.49 H new ATOM 0 HD22 ASN D 56 43.021 28.027 23.879 1.00 60.49 H new ATOM 3415 N ASN D 57 38.618 31.080 23.442 1.00 70.45 N ATOM 3416 CA ASN D 57 37.947 31.768 22.340 1.00 70.63 C ATOM 3417 C ASN D 57 38.788 31.746 21.063 1.00 69.54 C ATOM 3418 O ASN D 57 38.582 32.549 20.155 1.00 67.72 O ATOM 3419 CB ASN D 57 37.637 33.217 22.724 1.00 69.88 C ATOM 3420 CG ASN D 57 38.890 34.051 22.923 1.00 71.38 C ATOM 3421 OD1 ASN D 57 39.823 34.010 22.125 1.00 73.43 O ATOM 3422 ND2 ASN D 57 38.921 34.794 24.008 1.00 70.13 N ATOM 0 H ASN D 57 39.027 31.620 23.972 1.00 70.45 H new ATOM 0 HA ASN D 57 37.119 31.294 22.166 1.00 70.63 H new ATOM 0 HB2 ASN D 57 37.090 33.621 22.032 1.00 69.88 H new ATOM 0 HB3 ASN D 57 37.114 33.226 23.541 1.00 69.88 H new ATOM 0 HD21 ASN D 57 39.613 35.275 24.180 1.00 70.13 H new ATOM 0 HD22 ASN D 57 38.249 34.799 24.545 1.00 70.13 H new ATOM 3423 N LYS D 58 39.766 30.858 21.011 1.00 70.48 N ATOM 3424 CA LYS D 58 40.579 30.774 19.822 1.00 72.78 C ATOM 3425 C LYS D 58 40.076 29.619 18.960 1.00 71.86 C ATOM 3426 O LYS D 58 40.130 29.700 17.743 1.00 79.15 O ATOM 3427 CB LYS D 58 42.067 30.581 20.182 1.00 75.88 C ATOM 3428 CG LYS D 58 43.005 31.445 19.328 1.00 77.90 C ATOM 3429 CD LYS D 58 44.481 31.055 19.421 1.00 76.42 C ATOM 3430 CE LYS D 58 45.313 32.029 18.574 1.00 77.58 C ATOM 3431 NZ LYS D 58 46.719 31.609 18.277 1.00 72.91 N ATOM 0 H LYS D 58 39.970 30.308 21.640 1.00 70.48 H new ATOM 0 HA LYS D 58 40.507 31.604 19.325 1.00 72.78 H new ATOM 0 HB2 LYS D 58 42.199 30.797 21.118 1.00 75.88 H new ATOM 0 HB3 LYS D 58 42.304 29.647 20.070 1.00 75.88 H new ATOM 0 HG2 LYS D 58 42.725 31.389 18.401 1.00 77.90 H new ATOM 0 HG3 LYS D 58 42.909 32.372 19.598 1.00 77.90 H new ATOM 0 HD2 LYS D 58 44.776 31.079 20.345 1.00 76.42 H new ATOM 0 HD3 LYS D 58 44.607 30.146 19.107 1.00 76.42 H new ATOM 0 HE2 LYS D 58 44.853 32.171 17.732 1.00 77.58 H new ATOM 0 HE3 LYS D 58 45.340 32.884 19.031 1.00 77.58 H new ATOM 0 HZ1 LYS D 58 47.118 32.234 17.784 1.00 72.91 H new ATOM 0 HZ2 LYS D 58 47.165 31.504 19.040 1.00 72.91 H new ATOM 0 HZ3 LYS D 58 46.711 30.839 17.830 1.00 72.91 H new ATOM 3432 N ILE D 59 39.532 28.576 19.580 1.00 68.25 N ATOM 3433 CA ILE D 59 39.065 27.418 18.826 1.00 65.37 C ATOM 3434 C ILE D 59 37.636 27.041 19.193 1.00 65.04 C ATOM 3435 O ILE D 59 36.836 26.694 18.321 1.00 68.41 O ATOM 3436 CB ILE D 59 39.982 26.166 19.085 1.00 65.88 C ATOM 3437 CG1 ILE D 59 41.440 26.465 18.729 1.00 70.23 C ATOM 3438 CG2 ILE D 59 39.521 24.969 18.285 1.00 65.48 C ATOM 3439 CD1 ILE D 59 41.694 26.775 17.262 1.00 74.82 C ATOM 0 H ILE D 59 39.425 28.519 20.431 1.00 68.25 H new ATOM 0 HA ILE D 59 39.101 27.671 17.890 1.00 65.37 H new ATOM 0 HB ILE D 59 39.916 25.962 20.031 1.00 65.88 H new ATOM 0 HG12 ILE D 59 41.741 27.218 19.261 1.00 70.23 H new ATOM 0 HG13 ILE D 59 41.984 25.703 18.983 1.00 70.23 H new ATOM 0 HG21 ILE D 59 40.104 24.215 18.465 1.00 65.48 H new ATOM 0 HG22 ILE D 59 38.612 24.742 18.537 1.00 65.48 H new ATOM 0 HG23 ILE D 59 39.550 25.181 17.339 1.00 65.48 H new ATOM 0 HD11 ILE D 59 42.638 26.951 17.127 1.00 74.82 H new ATOM 0 HD12 ILE D 59 41.426 26.017 16.720 1.00 74.82 H new ATOM 0 HD13 ILE D 59 41.180 27.555 17.002 1.00 74.82 H new ATOM 3440 N TRP D 60 37.287 27.202 20.462 1.00 61.19 N ATOM 3441 CA TRP D 60 35.977 26.786 20.934 1.00 59.40 C ATOM 3442 C TRP D 60 34.790 27.758 20.950 1.00 60.68 C ATOM 3443 O TRP D 60 33.700 27.400 20.497 1.00 56.53 O ATOM 3444 CB TRP D 60 36.139 26.085 22.309 1.00 55.74 C ATOM 3445 CG TRP D 60 37.390 25.240 22.340 1.00 45.46 C ATOM 3446 CD1 TRP D 60 38.623 25.648 22.763 1.00 38.56 C ATOM 3447 CD2 TRP D 60 37.585 23.975 21.704 1.00 44.25 C ATOM 3448 NE1 TRP D 60 39.575 24.739 22.387 1.00 35.73 N ATOM 3449 CE2 TRP D 60 38.974 23.697 21.740 1.00 42.24 C ATOM 3450 CE3 TRP D 60 36.725 23.051 21.088 1.00 44.97 C ATOM 3451 CZ2 TRP D 60 39.529 22.535 21.170 1.00 43.04 C ATOM 3452 CZ3 TRP D 60 37.287 21.880 20.512 1.00 42.73 C ATOM 3453 CH2 TRP D 60 38.676 21.642 20.561 1.00 36.08 C ATOM 0 H TRP D 60 37.793 27.549 21.064 1.00 61.19 H new ATOM 0 HA TRP D 60 35.686 26.200 20.218 1.00 59.40 H new ATOM 0 HB2 TRP D 60 36.177 26.751 23.013 1.00 55.74 H new ATOM 0 HB3 TRP D 60 35.364 25.529 22.486 1.00 55.74 H new ATOM 0 HD1 TRP D 60 38.791 26.430 23.238 1.00 38.56 H new ATOM 0 HE1 TRP D 60 40.419 24.812 22.535 1.00 35.73 H new ATOM 0 HE3 TRP D 60 35.808 23.202 21.058 1.00 44.97 H new ATOM 0 HZ2 TRP D 60 40.445 22.375 21.204 1.00 43.04 H new ATOM 0 HZ3 TRP D 60 36.731 21.261 20.097 1.00 42.73 H new ATOM 0 HH2 TRP D 60 39.022 20.869 20.176 1.00 36.08 H new ATOM 3454 N CYS D 61 34.973 28.974 21.450 1.00 65.32 N ATOM 3455 CA CYS D 61 33.850 29.914 21.499 1.00 71.43 C ATOM 3456 C CYS D 61 34.039 31.310 20.865 1.00 75.98 C ATOM 3457 O CYS D 61 35.162 31.814 20.738 1.00 78.01 O ATOM 3458 CB CYS D 61 33.378 30.065 22.954 1.00 69.09 C ATOM 3459 SG CYS D 61 34.693 30.594 24.102 1.00 71.77 S ATOM 0 H CYS D 61 35.718 29.273 21.760 1.00 65.32 H new ATOM 0 HA CYS D 61 33.186 29.502 20.925 1.00 71.43 H new ATOM 0 HB2 CYS D 61 32.654 30.710 22.985 1.00 69.09 H new ATOM 0 HB3 CYS D 61 33.016 29.218 23.258 1.00 69.09 H new ATOM 3460 N LYS D 62 32.915 31.910 20.461 1.00 79.43 N ATOM 3461 CA LYS D 62 32.858 33.244 19.845 1.00 80.20 C ATOM 3462 C LYS D 62 33.033 34.315 20.923 1.00 78.09 C ATOM 3463 O LYS D 62 32.217 34.433 21.851 1.00 77.08 O ATOM 3464 CB LYS D 62 31.493 33.438 19.148 1.00 83.95 C ATOM 3465 CG LYS D 62 31.442 34.544 18.067 1.00 88.57 C ATOM 3466 CD LYS D 62 31.295 35.987 18.608 1.00 90.67 C ATOM 3467 CE LYS D 62 29.864 36.330 19.037 1.00 89.89 C ATOM 3468 NZ LYS D 62 29.718 37.764 19.443 1.00 88.20 N ATOM 0 H LYS D 62 32.142 31.542 20.540 1.00 79.43 H new ATOM 0 HA LYS D 62 33.569 33.323 19.190 1.00 80.20 H new ATOM 0 HB2 LYS D 62 31.235 32.597 18.739 1.00 83.95 H new ATOM 0 HB3 LYS D 62 30.829 33.640 19.825 1.00 83.95 H new ATOM 0 HG2 LYS D 62 32.252 34.494 17.535 1.00 88.57 H new ATOM 0 HG3 LYS D 62 30.699 34.360 17.471 1.00 88.57 H new ATOM 0 HD2 LYS D 62 31.890 36.104 19.365 1.00 90.67 H new ATOM 0 HD3 LYS D 62 31.580 36.613 17.924 1.00 90.67 H new ATOM 0 HE2 LYS D 62 29.256 36.140 18.306 1.00 89.89 H new ATOM 0 HE3 LYS D 62 29.605 35.759 19.777 1.00 89.89 H new ATOM 0 HZ1 LYS D 62 28.876 37.920 19.684 1.00 88.20 H new ATOM 0 HZ2 LYS D 62 30.259 37.935 20.129 1.00 88.20 H new ATOM 0 HZ3 LYS D 62 29.933 38.290 18.758 1.00 88.20 H new ATOM 3469 N ASP D 63 34.062 35.127 20.787 1.00 76.30 N ATOM 3470 CA ASP D 63 34.190 36.152 21.765 1.00 81.00 C ATOM 3471 C ASP D 63 34.395 37.525 21.140 1.00 85.69 C ATOM 3472 O ASP D 63 34.311 37.632 19.916 1.00 86.30 O ATOM 3473 CB ASP D 63 35.368 35.786 22.604 1.00 78.49 C ATOM 3474 CG ASP D 63 35.399 36.639 23.849 1.00 79.44 C ATOM 3475 OD1 ASP D 63 34.342 37.180 24.225 1.00 83.83 O ATOM 3476 OD2 ASP D 63 36.448 36.743 24.453 1.00 78.28 O ATOM 0 H ASP D 63 34.660 35.100 20.170 1.00 76.30 H new ATOM 0 HA ASP D 63 33.375 36.215 22.288 1.00 81.00 H new ATOM 0 HB2 ASP D 63 35.323 34.848 22.846 1.00 78.49 H new ATOM 0 HB3 ASP D 63 36.186 35.909 22.098 1.00 78.49 H new ATOM 3477 N ASP D 64 33.941 38.547 21.867 1.00 90.86 N ATOM 3478 CA ASP D 64 34.018 39.944 21.425 1.00 94.48 C ATOM 3479 C ASP D 64 35.494 40.372 21.429 1.00 95.76 C ATOM 3480 O ASP D 64 35.809 41.536 21.188 1.00 98.08 O ATOM 3481 CB ASP D 64 33.225 40.862 22.379 1.00 95.44 C ATOM 3482 CG ASP D 64 31.731 40.952 22.036 1.00 96.90 C ATOM 3483 OD1 ASP D 64 31.129 39.950 21.579 1.00 97.22 O ATOM 3484 OD2 ASP D 64 31.151 42.039 22.241 1.00 94.34 O ATOM 0 H ASP D 64 33.575 38.449 22.639 1.00 90.86 H new ATOM 0 HA ASP D 64 33.638 40.020 20.536 1.00 94.48 H new ATOM 0 HB2 ASP D 64 33.322 40.535 23.287 1.00 95.44 H new ATOM 0 HB3 ASP D 64 33.610 41.752 22.355 1.00 95.44 H new ATOM 3485 N GLN D 65 36.378 39.435 21.776 1.00 95.53 N ATOM 3486 CA GLN D 65 37.816 39.655 21.820 1.00 95.94 C ATOM 3487 C GLN D 65 38.411 39.071 20.529 1.00 96.61 C ATOM 3488 O GLN D 65 39.047 39.781 19.753 1.00 97.51 O ATOM 3489 CB GLN D 65 38.410 38.965 23.061 1.00 95.65 C ATOM 3490 CG GLN D 65 39.881 39.293 23.349 1.00 98.69 C ATOM 3491 CD GLN D 65 40.812 38.066 23.315 1.00100.59 C ATOM 3492 OE1 GLN D 65 40.361 36.924 23.185 1.00 99.50 O ATOM 3493 NE2 GLN D 65 42.115 38.309 23.439 1.00101.22 N ATOM 0 H GLN D 65 36.148 38.636 21.997 1.00 95.53 H new ATOM 0 HA GLN D 65 38.024 40.601 21.882 1.00 95.94 H new ATOM 0 HB2 GLN D 65 37.881 39.212 23.835 1.00 95.65 H new ATOM 0 HB3 GLN D 65 38.323 38.005 22.953 1.00 95.65 H new ATOM 0 HG2 GLN D 65 40.192 39.942 22.699 1.00 98.69 H new ATOM 0 HG3 GLN D 65 39.945 39.713 24.221 1.00 98.69 H new ATOM 0 HE21 GLN D 65 42.395 39.117 23.528 1.00101.22 H new ATOM 0 HE22 GLN D 65 42.677 37.658 23.430 1.00101.22 H new ATOM 3494 N ASN D 66 38.195 37.779 20.297 1.00 98.47 N ATOM 3495 CA ASN D 66 38.656 37.198 19.046 1.00101.51 C ATOM 3496 C ASN D 66 37.559 36.467 18.293 1.00105.04 C ATOM 3497 O ASN D 66 36.987 35.437 18.803 1.00105.93 O ATOM 3498 CB ASN D 66 39.838 36.226 19.364 1.00101.37 C ATOM 3499 CG ASN D 66 41.105 37.049 19.385 1.00103.63 C ATOM 3500 OD1 ASN D 66 41.410 37.807 18.478 1.00103.02 O ATOM 3501 ND2 ASN D 66 41.879 36.873 20.473 1.00103.14 N ATOM 0 H ASN D 66 37.796 37.238 20.834 1.00 98.47 H new ATOM 0 HA ASN D 66 38.946 37.919 18.465 1.00101.51 H new ATOM 0 HB2 ASN D 66 39.700 35.789 20.219 1.00101.37 H new ATOM 0 HB3 ASN D 66 39.896 35.527 18.694 1.00101.37 H new ATOM 0 HD21 ASN D 66 42.620 37.303 20.548 1.00103.14 H new ATOM 0 HD22 ASN D 66 41.632 36.330 21.093 1.00103.14 H new ATOM 3502 N PRO D 67 36.795 37.262 17.519 1.00108.01 N ATOM 3503 CA PRO D 67 35.671 36.782 16.698 1.00109.96 C ATOM 3504 C PRO D 67 36.134 36.091 15.404 1.00111.70 C ATOM 3505 O PRO D 67 35.650 36.417 14.319 1.00110.84 O ATOM 3506 CB PRO D 67 34.902 38.068 16.368 1.00108.33 C ATOM 3507 CG PRO D 67 35.469 39.112 17.326 1.00108.64 C ATOM 3508 CD PRO D 67 36.898 38.731 17.431 1.00108.07 C ATOM 0 HA PRO D 67 35.145 36.114 17.164 1.00109.96 H new ATOM 0 HB2 PRO D 67 35.033 38.330 15.443 1.00108.33 H new ATOM 0 HB3 PRO D 67 33.948 37.952 16.498 1.00108.33 H new ATOM 0 HG2 PRO D 67 35.362 40.012 16.980 1.00108.64 H new ATOM 0 HG3 PRO D 67 35.026 39.085 18.189 1.00108.64 H new ATOM 0 HD2 PRO D 67 37.411 39.017 16.659 1.00108.07 H new ATOM 0 HD3 PRO D 67 37.324 39.116 18.213 1.00108.07 H new ATOM 3509 N HIS D 68 37.084 35.167 15.524 1.00113.15 N ATOM 3510 CA HIS D 68 37.623 34.432 14.381 1.00114.24 C ATOM 3511 C HIS D 68 37.952 33.009 14.794 1.00112.13 C ATOM 3512 O HIS D 68 38.695 32.286 14.119 1.00112.29 O ATOM 3513 CB HIS D 68 38.844 35.147 13.822 1.00119.66 C ATOM 3514 CG HIS D 68 38.540 36.540 13.387 1.00127.59 C ATOM 3515 ND1 HIS D 68 38.667 37.622 14.230 1.00130.87 N ATOM 3516 CD2 HIS D 68 37.974 37.010 12.250 1.00131.59 C ATOM 3517 CE1 HIS D 68 38.179 38.698 13.637 1.00133.25 C ATOM 3518 NE2 HIS D 68 37.752 38.352 12.437 1.00134.76 N ATOM 0 H HIS D 68 37.437 34.947 16.277 1.00113.15 H new ATOM 0 HA HIS D 68 36.956 34.396 13.677 1.00114.24 H new ATOM 0 HB2 HIS D 68 39.541 35.167 14.497 1.00119.66 H new ATOM 0 HB3 HIS D 68 39.193 34.645 13.069 1.00119.66 H new ATOM 0 HD2 HIS D 68 37.774 36.517 11.487 1.00131.59 H new ATOM 0 HE1 HIS D 68 38.143 39.552 14.003 1.00133.25 H new ATOM 0 HE2 HIS D 68 37.392 38.882 11.864 1.00134.76 H new ATOM 3519 N SER D 69 37.429 32.645 15.955 1.00108.19 N ATOM 3520 CA SER D 69 37.588 31.315 16.501 1.00102.27 C ATOM 3521 C SER D 69 36.747 30.418 15.617 1.00 98.37 C ATOM 3522 O SER D 69 35.634 30.800 15.237 1.00 98.25 O ATOM 3523 CB SER D 69 37.023 31.297 17.922 1.00101.79 C ATOM 3524 OG SER D 69 35.794 32.020 17.973 1.00100.81 O ATOM 0 H SER D 69 36.966 33.173 16.452 1.00108.19 H new ATOM 0 HA SER D 69 38.515 31.032 16.530 1.00102.27 H new ATOM 0 HB2 SER D 69 36.879 30.381 18.209 1.00101.79 H new ATOM 0 HB3 SER D 69 37.663 31.690 18.537 1.00101.79 H new ATOM 0 HG SER D 69 35.382 31.925 17.247 1.00100.81 H new ATOM 3525 N SER D 70 37.253 29.237 15.281 1.00 94.19 N ATOM 3526 CA SER D 70 36.473 28.327 14.455 1.00 90.96 C ATOM 3527 C SER D 70 35.088 28.145 15.103 1.00 89.39 C ATOM 3528 O SER D 70 34.126 27.764 14.433 1.00 93.80 O ATOM 3529 CB SER D 70 37.190 26.979 14.280 1.00 89.06 C ATOM 3530 OG SER D 70 38.352 26.886 15.084 1.00 85.92 O ATOM 0 H SER D 70 38.029 28.949 15.515 1.00 94.19 H new ATOM 0 HA SER D 70 36.368 28.703 13.567 1.00 90.96 H new ATOM 0 HB2 SER D 70 36.582 26.258 14.508 1.00 89.06 H new ATOM 0 HB3 SER D 70 37.433 26.861 13.348 1.00 89.06 H new ATOM 0 HG SER D 70 38.716 26.139 14.965 1.00 85.92 H new ATOM 3531 N ASN D 71 35.003 28.420 16.411 1.00 82.86 N ATOM 3532 CA ASN D 71 33.753 28.341 17.157 1.00 75.54 C ATOM 3533 C ASN D 71 33.068 26.994 16.898 1.00 73.59 C ATOM 3534 O ASN D 71 31.953 26.930 16.377 1.00 71.17 O ATOM 3535 CB ASN D 71 32.869 29.524 16.756 1.00 73.74 C ATOM 3536 CG ASN D 71 31.645 29.688 17.642 1.00 77.25 C ATOM 3537 OD1 ASN D 71 31.720 29.653 18.877 1.00 80.43 O ATOM 3538 ND2 ASN D 71 30.501 29.892 17.012 1.00 78.55 N ATOM 0 H ASN D 71 35.678 28.659 16.888 1.00 82.86 H new ATOM 0 HA ASN D 71 33.922 28.393 18.111 1.00 75.54 H new ATOM 0 HB2 ASN D 71 33.395 30.338 16.788 1.00 73.74 H new ATOM 0 HB3 ASN D 71 32.582 29.408 15.837 1.00 73.74 H new ATOM 0 HD21 ASN D 71 29.777 30.006 17.462 1.00 78.55 H new ATOM 0 HD22 ASN D 71 30.481 29.911 16.152 1.00 78.55 H new ATOM 3539 N ILE D 72 33.766 25.923 17.288 1.00 71.75 N ATOM 3540 CA ILE D 72 33.312 24.537 17.118 1.00 68.11 C ATOM 3541 C ILE D 72 32.082 24.232 17.970 1.00 67.98 C ATOM 3542 O ILE D 72 31.172 23.535 17.535 1.00 67.33 O ATOM 3543 CB ILE D 72 34.472 23.523 17.430 1.00 63.60 C ATOM 3544 CG1 ILE D 72 35.694 23.839 16.564 1.00 59.03 C ATOM 3545 CG2 ILE D 72 34.038 22.087 17.150 1.00 62.40 C ATOM 3546 CD1 ILE D 72 36.860 22.926 16.797 1.00 58.67 C ATOM 0 H ILE D 72 34.535 25.984 17.668 1.00 71.75 H new ATOM 0 HA ILE D 72 33.055 24.431 16.189 1.00 68.11 H new ATOM 0 HB ILE D 72 34.694 23.612 18.370 1.00 63.60 H new ATOM 0 HG12 ILE D 72 35.438 23.789 15.630 1.00 59.03 H new ATOM 0 HG13 ILE D 72 35.972 24.753 16.734 1.00 59.03 H new ATOM 0 HG21 ILE D 72 34.770 21.483 17.350 1.00 62.40 H new ATOM 0 HG22 ILE D 72 33.275 21.865 17.706 1.00 62.40 H new ATOM 0 HG23 ILE D 72 33.793 21.999 16.216 1.00 62.40 H new ATOM 0 HD11 ILE D 72 37.594 23.184 16.218 1.00 58.67 H new ATOM 0 HD12 ILE D 72 37.142 22.990 17.723 1.00 58.67 H new ATOM 0 HD13 ILE D 72 36.600 22.012 16.601 1.00 58.67 H new ATOM 3547 N CYS D 73 32.062 24.740 19.196 1.00 69.26 N ATOM 3548 CA CYS D 73 30.922 24.524 20.069 1.00 70.19 C ATOM 3549 C CYS D 73 29.817 25.448 19.603 1.00 71.95 C ATOM 3550 O CYS D 73 28.646 25.240 19.912 1.00 77.16 O ATOM 3551 CB CYS D 73 31.300 24.823 21.512 1.00 66.10 C ATOM 3552 SG CYS D 73 32.543 23.669 22.159 1.00 62.45 S ATOM 0 H CYS D 73 32.696 25.210 19.538 1.00 69.26 H new ATOM 0 HA CYS D 73 30.628 23.600 20.031 1.00 70.19 H new ATOM 0 HB2 CYS D 73 31.642 25.729 21.573 1.00 66.10 H new ATOM 0 HB3 CYS D 73 30.505 24.782 22.067 1.00 66.10 H new ATOM 3553 N ASN D 74 30.217 26.462 18.838 1.00 73.63 N ATOM 3554 CA ASN D 74 29.320 27.457 18.256 1.00 76.67 C ATOM 3555 C ASN D 74 28.557 28.151 19.365 1.00 76.37 C ATOM 3556 O ASN D 74 27.355 27.931 19.540 1.00 82.13 O ATOM 3557 CB ASN D 74 28.355 26.812 17.238 1.00 80.48 C ATOM 3558 CG ASN D 74 28.026 27.738 16.051 1.00 80.71 C ATOM 3559 OD1 ASN D 74 27.993 27.296 14.897 1.00 76.91 O ATOM 3560 ND2 ASN D 74 27.771 29.021 16.337 1.00 82.44 N ATOM 0 H ASN D 74 31.043 26.593 18.638 1.00 73.63 H new ATOM 0 HA ASN D 74 29.847 28.113 17.773 1.00 76.67 H new ATOM 0 HB2 ASN D 74 28.748 25.991 16.902 1.00 80.48 H new ATOM 0 HB3 ASN D 74 27.532 26.568 17.690 1.00 80.48 H new ATOM 0 HD21 ASN D 74 27.575 29.572 15.706 1.00 82.44 H new ATOM 0 HD22 ASN D 74 27.803 29.294 17.152 1.00 82.44 H new ATOM 3561 N ILE D 75 29.240 29.039 20.074 1.00 71.24 N ATOM 3562 CA ILE D 75 28.602 29.734 21.178 1.00 68.74 C ATOM 3563 C ILE D 75 29.459 30.892 21.610 1.00 67.02 C ATOM 3564 O ILE D 75 30.662 30.875 21.368 1.00 63.67 O ATOM 3565 CB ILE D 75 28.470 28.772 22.379 1.00 68.74 C ATOM 3566 CG1 ILE D 75 27.517 29.331 23.439 1.00 67.47 C ATOM 3567 CG2 ILE D 75 29.857 28.507 22.984 1.00 70.66 C ATOM 3568 CD1 ILE D 75 27.043 28.271 24.426 1.00 63.71 C ATOM 0 H ILE D 75 30.062 29.251 19.934 1.00 71.24 H new ATOM 0 HA ILE D 75 27.730 30.047 20.890 1.00 68.74 H new ATOM 0 HB ILE D 75 28.095 27.935 22.063 1.00 68.74 H new ATOM 0 HG12 ILE D 75 27.962 30.043 23.925 1.00 67.47 H new ATOM 0 HG13 ILE D 75 26.747 29.725 23.000 1.00 67.47 H new ATOM 0 HG21 ILE D 75 29.771 27.903 23.738 1.00 70.66 H new ATOM 0 HG22 ILE D 75 30.432 28.107 22.313 1.00 70.66 H new ATOM 0 HG23 ILE D 75 30.245 29.344 23.284 1.00 70.66 H new ATOM 0 HD11 ILE D 75 26.445 28.676 25.073 1.00 63.71 H new ATOM 0 HD12 ILE D 75 26.574 27.569 23.947 1.00 63.71 H new ATOM 0 HD13 ILE D 75 27.808 27.892 24.886 1.00 63.71 H new ATOM 3569 N SER D 76 28.826 31.913 22.186 1.00 67.64 N ATOM 3570 CA SER D 76 29.543 33.071 22.716 1.00 68.88 C ATOM 3571 C SER D 76 30.098 32.646 24.091 1.00 68.67 C ATOM 3572 O SER D 76 29.384 32.028 24.906 1.00 66.60 O ATOM 3573 CB SER D 76 28.631 34.323 22.799 1.00 67.74 C ATOM 3574 OG SER D 76 27.344 34.060 23.349 1.00 63.08 O ATOM 0 H SER D 76 27.972 31.954 22.280 1.00 67.64 H new ATOM 0 HA SER D 76 30.268 33.334 22.128 1.00 68.88 H new ATOM 0 HB2 SER D 76 29.072 34.999 23.337 1.00 67.74 H new ATOM 0 HB3 SER D 76 28.524 34.694 21.909 1.00 67.74 H new ATOM 0 HG SER D 76 26.898 34.771 23.370 1.00 63.08 H new ATOM 3575 N CYS D 77 31.372 32.953 24.330 1.00 66.21 N ATOM 3576 CA CYS D 77 32.041 32.563 25.564 1.00 67.30 C ATOM 3577 C CYS D 77 31.343 33.029 26.847 1.00 67.78 C ATOM 3578 O CYS D 77 31.714 32.627 27.949 1.00 69.58 O ATOM 3579 CB CYS D 77 33.503 33.048 25.568 1.00 68.95 C ATOM 3580 SG CYS D 77 34.567 32.622 24.132 1.00 69.92 S ATOM 0 H CYS D 77 31.869 33.392 23.782 1.00 66.21 H new ATOM 0 HA CYS D 77 32.003 31.594 25.572 1.00 67.30 H new ATOM 0 HB2 CYS D 77 33.494 34.014 25.653 1.00 68.95 H new ATOM 0 HB3 CYS D 77 33.929 32.697 26.366 1.00 68.95 H new ATOM 3581 N ASP D 78 30.338 33.884 26.706 1.00 67.73 N ATOM 3582 CA ASP D 78 29.601 34.417 27.850 1.00 66.10 C ATOM 3583 C ASP D 78 28.635 33.421 28.450 1.00 64.01 C ATOM 3584 O ASP D 78 28.278 33.520 29.626 1.00 63.68 O ATOM 3585 CB ASP D 78 28.870 35.694 27.446 1.00 66.66 C ATOM 3586 CG ASP D 78 29.826 36.797 27.054 1.00 67.74 C ATOM 3587 OD1 ASP D 78 30.482 36.687 25.985 1.00 67.88 O ATOM 3588 OD2 ASP D 78 29.954 37.755 27.842 1.00 71.54 O ATOM 0 H ASP D 78 30.062 34.173 25.945 1.00 67.73 H new ATOM 0 HA ASP D 78 30.253 34.615 28.541 1.00 66.10 H new ATOM 0 HB2 ASP D 78 28.276 35.504 26.703 1.00 66.66 H new ATOM 0 HB3 ASP D 78 28.316 35.995 28.183 1.00 66.66 H new ATOM 3589 N LYS D 79 28.211 32.460 27.635 1.00 64.31 N ATOM 3590 CA LYS D 79 27.291 31.428 28.085 1.00 64.24 C ATOM 3591 C LYS D 79 28.061 30.406 28.921 1.00 62.53 C ATOM 3592 O LYS D 79 27.505 29.458 29.519 1.00 62.30 O ATOM 3593 CB LYS D 79 26.616 30.773 26.887 1.00 69.18 C ATOM 3594 CG LYS D 79 25.362 31.508 26.438 1.00 76.42 C ATOM 3595 CD LYS D 79 24.413 30.553 25.724 1.00 82.10 C ATOM 3596 CE LYS D 79 23.028 31.153 25.550 1.00 85.88 C ATOM 3597 NZ LYS D 79 22.114 30.215 24.830 1.00 89.66 N ATOM 0 H LYS D 79 28.448 32.390 26.811 1.00 64.31 H new ATOM 0 HA LYS D 79 26.595 31.818 28.636 1.00 64.24 H new ATOM 0 HB2 LYS D 79 27.244 30.734 26.149 1.00 69.18 H new ATOM 0 HB3 LYS D 79 26.386 29.858 27.112 1.00 69.18 H new ATOM 0 HG2 LYS D 79 24.918 31.901 27.206 1.00 76.42 H new ATOM 0 HG3 LYS D 79 25.602 32.237 25.846 1.00 76.42 H new ATOM 0 HD2 LYS D 79 24.778 30.325 24.854 1.00 82.10 H new ATOM 0 HD3 LYS D 79 24.346 29.727 26.228 1.00 82.10 H new ATOM 0 HE2 LYS D 79 22.655 31.367 26.419 1.00 85.88 H new ATOM 0 HE3 LYS D 79 23.094 31.986 25.057 1.00 85.88 H new ATOM 0 HZ1 LYS D 79 21.312 30.591 24.742 1.00 89.66 H new ATOM 0 HZ2 LYS D 79 22.447 30.035 24.024 1.00 89.66 H new ATOM 0 HZ3 LYS D 79 22.038 29.459 25.294 1.00 89.66 H new ATOM 3598 N PHE D 80 29.362 30.630 28.974 1.00 58.83 N ATOM 3599 CA PHE D 80 30.245 29.798 29.736 1.00 55.99 C ATOM 3600 C PHE D 80 30.551 30.510 31.027 1.00 57.22 C ATOM 3601 O PHE D 80 31.396 30.065 31.785 1.00 62.91 O ATOM 3602 CB PHE D 80 31.508 29.519 28.938 1.00 48.45 C ATOM 3603 CG PHE D 80 31.289 28.562 27.801 1.00 44.66 C ATOM 3604 CD1 PHE D 80 30.251 27.631 27.851 1.00 40.07 C ATOM 3605 CD2 PHE D 80 32.126 28.570 26.697 1.00 41.99 C ATOM 3606 CE1 PHE D 80 30.058 26.718 26.825 1.00 39.36 C ATOM 3607 CE2 PHE D 80 31.938 27.656 25.660 1.00 44.37 C ATOM 3608 CZ PHE D 80 30.902 26.730 25.722 1.00 38.98 C ATOM 0 H PHE D 80 29.753 31.276 28.563 1.00 58.83 H new ATOM 0 HA PHE D 80 29.834 28.942 29.932 1.00 55.99 H new ATOM 0 HB2 PHE D 80 31.854 30.355 28.588 1.00 48.45 H new ATOM 0 HB3 PHE D 80 32.185 29.158 29.531 1.00 48.45 H new ATOM 0 HD1 PHE D 80 29.679 27.623 28.584 1.00 40.07 H new ATOM 0 HD2 PHE D 80 32.818 29.189 26.647 1.00 41.99 H new ATOM 0 HE1 PHE D 80 29.365 26.099 26.875 1.00 39.36 H new ATOM 0 HE2 PHE D 80 32.507 27.666 24.925 1.00 44.37 H new ATOM 0 HZ PHE D 80 30.775 26.123 25.029 1.00 38.98 H new ATOM 3609 N LEU D 81 29.815 31.585 31.299 1.00 57.67 N ATOM 3610 CA LEU D 81 30.008 32.348 32.528 1.00 58.38 C ATOM 3611 C LEU D 81 28.815 32.235 33.509 1.00 59.79 C ATOM 3612 O LEU D 81 28.890 32.695 34.652 1.00 60.66 O ATOM 3613 CB LEU D 81 30.338 33.815 32.203 1.00 56.46 C ATOM 3614 CG LEU D 81 31.686 34.129 31.526 1.00 57.10 C ATOM 3615 CD1 LEU D 81 31.727 35.589 31.107 1.00 57.54 C ATOM 3616 CD2 LEU D 81 32.873 33.829 32.452 1.00 52.56 C ATOM 0 H LEU D 81 29.198 31.889 30.783 1.00 57.67 H new ATOM 0 HA LEU D 81 30.765 31.954 32.990 1.00 58.38 H new ATOM 0 HB2 LEU D 81 29.633 34.157 31.631 1.00 56.46 H new ATOM 0 HB3 LEU D 81 30.299 34.317 33.032 1.00 56.46 H new ATOM 0 HG LEU D 81 31.762 33.558 30.746 1.00 57.10 H new ATOM 0 HD11 LEU D 81 32.578 35.780 30.682 1.00 57.54 H new ATOM 0 HD12 LEU D 81 31.007 35.767 30.482 1.00 57.54 H new ATOM 0 HD13 LEU D 81 31.623 36.153 31.889 1.00 57.54 H new ATOM 0 HD21 LEU D 81 33.702 34.038 31.994 1.00 52.56 H new ATOM 0 HD22 LEU D 81 32.802 34.370 33.254 1.00 52.56 H new ATOM 0 HD23 LEU D 81 32.866 32.890 32.694 1.00 52.56 H new ATOM 3617 N ASP D 82 27.728 31.603 33.078 1.00 61.25 N ATOM 3618 CA ASP D 82 26.559 31.451 33.948 1.00 65.10 C ATOM 3619 C ASP D 82 26.492 30.102 34.641 1.00 66.96 C ATOM 3620 O ASP D 82 26.706 29.061 34.004 1.00 70.18 O ATOM 3621 CB ASP D 82 25.273 31.643 33.153 1.00 69.29 C ATOM 3622 CG ASP D 82 25.086 30.576 32.097 1.00 69.07 C ATOM 3623 OD1 ASP D 82 25.929 30.503 31.188 1.00 71.38 O ATOM 3624 OD2 ASP D 82 24.096 29.821 32.167 1.00 71.77 O ATOM 0 H ASP D 82 27.644 31.257 32.295 1.00 61.25 H new ATOM 0 HA ASP D 82 26.652 32.134 34.631 1.00 65.10 H new ATOM 0 HB2 ASP D 82 24.516 31.631 33.759 1.00 69.29 H new ATOM 0 HB3 ASP D 82 25.284 32.516 32.730 1.00 69.29 H new ATOM 3625 N ASP D 83 26.022 30.141 35.881 1.00 70.07 N ATOM 3626 CA ASP D 83 25.881 28.975 36.759 1.00 73.92 C ATOM 3627 C ASP D 83 25.348 27.712 36.113 1.00 71.34 C ATOM 3628 O ASP D 83 25.637 26.604 36.563 1.00 73.13 O ATOM 3629 CB ASP D 83 24.993 29.307 37.966 1.00 78.75 C ATOM 3630 CG ASP D 83 25.466 30.533 38.737 1.00 85.28 C ATOM 3631 OD1 ASP D 83 26.650 30.939 38.596 1.00 85.38 O ATOM 3632 OD2 ASP D 83 24.632 31.086 39.493 1.00 92.15 O ATOM 0 H ASP D 83 25.765 30.873 36.253 1.00 70.07 H new ATOM 0 HA ASP D 83 26.795 28.780 37.020 1.00 73.92 H new ATOM 0 HB2 ASP D 83 24.084 29.454 37.661 1.00 78.75 H new ATOM 0 HB3 ASP D 83 24.971 28.544 38.564 1.00 78.75 H new ATOM 3633 N ASP D 84 24.501 27.866 35.109 1.00 69.19 N ATOM 3634 CA ASP D 84 23.969 26.692 34.442 1.00 68.10 C ATOM 3635 C ASP D 84 25.086 26.091 33.592 1.00 64.18 C ATOM 3636 O ASP D 84 25.457 26.628 32.534 1.00 62.62 O ATOM 3637 CB ASP D 84 22.744 27.061 33.602 1.00 70.49 C ATOM 3638 CG ASP D 84 22.237 25.907 32.766 1.00 72.34 C ATOM 3639 OD1 ASP D 84 21.957 24.821 33.327 1.00 73.34 O ATOM 3640 OD2 ASP D 84 22.111 26.097 31.537 1.00 76.67 O ATOM 0 H ASP D 84 24.227 28.622 34.804 1.00 69.19 H new ATOM 0 HA ASP D 84 23.671 26.034 35.089 1.00 68.10 H new ATOM 0 HB2 ASP D 84 22.034 27.366 34.189 1.00 70.49 H new ATOM 0 HB3 ASP D 84 22.968 27.803 33.019 1.00 70.49 H new ATOM 3641 N LEU D 85 25.675 25.018 34.102 1.00 59.31 N ATOM 3642 CA LEU D 85 26.763 24.359 33.414 1.00 55.41 C ATOM 3643 C LEU D 85 26.312 23.525 32.213 1.00 57.57 C ATOM 3644 O LEU D 85 27.149 22.930 31.536 1.00 61.25 O ATOM 3645 CB LEU D 85 27.588 23.515 34.395 1.00 48.80 C ATOM 3646 CG LEU D 85 28.160 24.157 35.664 1.00 42.97 C ATOM 3647 CD1 LEU D 85 29.127 23.198 36.319 1.00 42.95 C ATOM 3648 CD2 LEU D 85 28.861 25.465 35.366 1.00 42.27 C ATOM 0 H LEU D 85 25.455 24.657 34.851 1.00 59.31 H new ATOM 0 HA LEU D 85 27.324 25.062 33.051 1.00 55.41 H new ATOM 0 HB2 LEU D 85 27.032 22.771 34.674 1.00 48.80 H new ATOM 0 HB3 LEU D 85 28.334 23.142 33.899 1.00 48.80 H new ATOM 0 HG LEU D 85 27.421 24.349 36.263 1.00 42.97 H new ATOM 0 HD11 LEU D 85 29.490 23.603 37.122 1.00 42.95 H new ATOM 0 HD12 LEU D 85 28.663 22.379 36.552 1.00 42.95 H new ATOM 0 HD13 LEU D 85 29.850 22.996 35.704 1.00 42.95 H new ATOM 0 HD21 LEU D 85 29.209 25.841 36.190 1.00 42.27 H new ATOM 0 HD22 LEU D 85 29.593 25.307 34.749 1.00 42.27 H new ATOM 0 HD23 LEU D 85 28.231 26.086 34.968 1.00 42.27 H new ATOM 3649 N THR D 86 25.015 23.526 31.911 1.00 55.62 N ATOM 3650 CA THR D 86 24.463 22.777 30.770 1.00 60.91 C ATOM 3651 C THR D 86 25.324 22.884 29.488 1.00 59.63 C ATOM 3652 O THR D 86 25.815 21.877 28.959 1.00 56.85 O ATOM 3653 CB THR D 86 22.972 23.242 30.491 1.00 66.13 C ATOM 3654 OG1 THR D 86 22.081 22.629 31.437 1.00 66.50 O ATOM 3655 CG2 THR D 86 22.511 22.933 29.050 1.00 68.02 C ATOM 0 H THR D 86 24.425 23.961 32.361 1.00 55.62 H new ATOM 0 HA THR D 86 24.472 21.839 31.017 1.00 60.91 H new ATOM 0 HB THR D 86 22.950 24.206 30.595 1.00 66.13 H new ATOM 0 HG1 THR D 86 21.940 23.159 32.073 1.00 66.50 H new ATOM 0 HG21 THR D 86 21.597 23.235 28.931 1.00 68.02 H new ATOM 0 HG22 THR D 86 23.088 23.392 28.420 1.00 68.02 H new ATOM 0 HG23 THR D 86 22.558 21.977 28.893 1.00 68.02 H new ATOM 3656 N ASP D 87 25.505 24.118 29.024 1.00 58.45 N ATOM 3657 CA ASP D 87 26.281 24.433 27.818 1.00 59.73 C ATOM 3658 C ASP D 87 27.789 24.112 27.896 1.00 58.97 C ATOM 3659 O ASP D 87 28.409 23.710 26.905 1.00 57.54 O ATOM 3660 CB ASP D 87 26.056 25.914 27.434 1.00 61.04 C ATOM 3661 CG ASP D 87 25.852 26.829 28.657 1.00 62.48 C ATOM 3662 OD1 ASP D 87 26.657 26.761 29.606 1.00 61.73 O ATOM 3663 OD2 ASP D 87 24.893 27.632 28.663 1.00 63.72 O ATOM 0 H ASP D 87 25.174 24.813 29.408 1.00 58.45 H new ATOM 0 HA ASP D 87 25.946 23.840 27.127 1.00 59.73 H new ATOM 0 HB2 ASP D 87 26.818 26.230 26.924 1.00 61.04 H new ATOM 0 HB3 ASP D 87 25.280 25.979 26.855 1.00 61.04 H new ATOM 3664 N ASP D 88 28.361 24.328 29.080 1.00 58.38 N ATOM 3665 CA ASP D 88 29.777 24.085 29.359 1.00 53.90 C ATOM 3666 C ASP D 88 30.108 22.607 29.065 1.00 51.28 C ATOM 3667 O ASP D 88 31.020 22.297 28.294 1.00 46.99 O ATOM 3668 CB ASP D 88 30.104 24.406 30.853 1.00 55.42 C ATOM 3669 CG ASP D 88 29.881 25.901 31.246 1.00 54.24 C ATOM 3670 OD1 ASP D 88 28.721 26.345 31.379 1.00 53.83 O ATOM 3671 OD2 ASP D 88 30.870 26.626 31.494 1.00 52.05 O ATOM 0 H ASP D 88 27.926 24.627 29.759 1.00 58.38 H new ATOM 0 HA ASP D 88 30.312 24.663 28.793 1.00 53.90 H new ATOM 0 HB2 ASP D 88 29.553 23.846 31.422 1.00 55.42 H new ATOM 0 HB3 ASP D 88 31.028 24.169 31.030 1.00 55.42 H new ATOM 3672 N ILE D 89 29.343 21.700 29.668 1.00 46.96 N ATOM 3673 CA ILE D 89 29.549 20.266 29.501 1.00 48.49 C ATOM 3674 C ILE D 89 29.572 19.832 28.034 1.00 51.32 C ATOM 3675 O ILE D 89 30.540 19.212 27.584 1.00 53.41 O ATOM 3676 CB ILE D 89 28.453 19.425 30.253 1.00 50.17 C ATOM 3677 CG1 ILE D 89 28.295 19.894 31.701 1.00 50.84 C ATOM 3678 CG2 ILE D 89 28.804 17.936 30.251 1.00 42.30 C ATOM 3679 CD1 ILE D 89 29.610 20.044 32.426 1.00 54.54 C ATOM 0 H ILE D 89 28.688 21.901 30.187 1.00 46.96 H new ATOM 0 HA ILE D 89 30.421 20.091 29.889 1.00 48.49 H new ATOM 0 HB ILE D 89 27.617 19.559 29.779 1.00 50.17 H new ATOM 0 HG12 ILE D 89 27.829 20.745 31.710 1.00 50.84 H new ATOM 0 HG13 ILE D 89 27.739 19.261 32.181 1.00 50.84 H new ATOM 0 HG21 ILE D 89 28.114 17.440 30.720 1.00 42.30 H new ATOM 0 HG22 ILE D 89 28.865 17.619 29.336 1.00 42.30 H new ATOM 0 HG23 ILE D 89 29.656 17.804 30.696 1.00 42.30 H new ATOM 0 HD11 ILE D 89 29.447 20.342 33.334 1.00 54.54 H new ATOM 0 HD12 ILE D 89 30.069 19.190 32.444 1.00 54.54 H new ATOM 0 HD13 ILE D 89 30.161 20.697 31.966 1.00 54.54 H new ATOM 3680 N VAL D 90 28.514 20.154 27.289 1.00 53.83 N ATOM 3681 CA VAL D 90 28.389 19.773 25.870 1.00 53.87 C ATOM 3682 C VAL D 90 29.624 20.154 25.065 1.00 51.46 C ATOM 3683 O VAL D 90 30.141 19.357 24.285 1.00 50.14 O ATOM 3684 CB VAL D 90 27.099 20.389 25.227 1.00 55.64 C ATOM 3685 CG1 VAL D 90 27.132 20.318 23.704 1.00 52.70 C ATOM 3686 CG2 VAL D 90 25.878 19.633 25.728 1.00 60.12 C ATOM 0 H VAL D 90 27.843 20.601 27.589 1.00 53.83 H new ATOM 0 HA VAL D 90 28.311 18.806 25.845 1.00 53.87 H new ATOM 0 HB VAL D 90 27.057 21.323 25.485 1.00 55.64 H new ATOM 0 HG11 VAL D 90 26.320 20.707 23.344 1.00 52.70 H new ATOM 0 HG12 VAL D 90 27.900 20.810 23.373 1.00 52.70 H new ATOM 0 HG13 VAL D 90 27.197 19.391 23.424 1.00 52.70 H new ATOM 0 HG21 VAL D 90 25.078 20.012 25.332 1.00 60.12 H new ATOM 0 HG22 VAL D 90 25.951 18.699 25.478 1.00 60.12 H new ATOM 0 HG23 VAL D 90 25.826 19.706 26.694 1.00 60.12 H new ATOM 3687 N CYS D 91 30.096 21.370 25.292 1.00 53.94 N ATOM 3688 CA CYS D 91 31.268 21.913 24.633 1.00 52.53 C ATOM 3689 C CYS D 91 32.545 21.247 25.185 1.00 55.96 C ATOM 3690 O CYS D 91 33.566 21.134 24.487 1.00 57.94 O ATOM 3691 CB CYS D 91 31.292 23.426 24.851 1.00 49.12 C ATOM 3692 SG CYS D 91 32.702 24.259 24.090 1.00 53.76 S ATOM 0 H CYS D 91 29.733 21.916 25.849 1.00 53.94 H new ATOM 0 HA CYS D 91 31.233 21.730 23.681 1.00 52.53 H new ATOM 0 HB2 CYS D 91 30.474 23.807 24.496 1.00 49.12 H new ATOM 0 HB3 CYS D 91 31.299 23.606 25.804 1.00 49.12 H new ATOM 3693 N VAL D 92 32.485 20.796 26.440 1.00 54.54 N ATOM 3694 CA VAL D 92 33.603 20.121 27.093 1.00 50.07 C ATOM 3695 C VAL D 92 33.714 18.691 26.540 1.00 52.82 C ATOM 3696 O VAL D 92 34.794 18.087 26.534 1.00 56.21 O ATOM 3697 CB VAL D 92 33.429 20.160 28.626 1.00 42.97 C ATOM 3698 CG1 VAL D 92 34.465 19.311 29.303 1.00 44.62 C ATOM 3699 CG2 VAL D 92 33.581 21.580 29.115 1.00 41.54 C ATOM 0 H VAL D 92 31.788 20.875 26.938 1.00 54.54 H new ATOM 0 HA VAL D 92 34.436 20.579 26.900 1.00 50.07 H new ATOM 0 HB VAL D 92 32.546 19.818 28.839 1.00 42.97 H new ATOM 0 HG11 VAL D 92 34.338 19.350 30.264 1.00 44.62 H new ATOM 0 HG12 VAL D 92 34.378 18.393 29.002 1.00 44.62 H new ATOM 0 HG13 VAL D 92 35.350 19.641 29.081 1.00 44.62 H new ATOM 0 HG21 VAL D 92 33.472 21.604 30.079 1.00 41.54 H new ATOM 0 HG22 VAL D 92 34.463 21.910 28.882 1.00 41.54 H new ATOM 0 HG23 VAL D 92 32.906 22.140 28.699 1.00 41.54 H new ATOM 3700 N LYS D 93 32.601 18.165 26.041 1.00 52.78 N ATOM 3701 CA LYS D 93 32.585 16.834 25.443 1.00 53.02 C ATOM 3702 C LYS D 93 33.168 16.886 24.019 1.00 56.18 C ATOM 3703 O LYS D 93 33.931 16.001 23.620 1.00 56.88 O ATOM 3704 CB LYS D 93 31.168 16.286 25.421 1.00 49.33 C ATOM 3705 CG LYS D 93 30.667 15.889 26.775 1.00 51.56 C ATOM 3706 CD LYS D 93 29.213 15.520 26.705 1.00 57.63 C ATOM 3707 CE LYS D 93 28.768 14.842 27.975 1.00 64.06 C ATOM 3708 NZ LYS D 93 27.307 14.536 27.976 1.00 71.94 N ATOM 0 H LYS D 93 31.840 18.565 26.039 1.00 52.78 H new ATOM 0 HA LYS D 93 33.135 16.241 25.979 1.00 53.02 H new ATOM 0 HB2 LYS D 93 30.574 16.956 25.047 1.00 49.33 H new ATOM 0 HB3 LYS D 93 31.134 15.516 24.832 1.00 49.33 H new ATOM 0 HG2 LYS D 93 31.182 15.138 27.110 1.00 51.56 H new ATOM 0 HG3 LYS D 93 30.792 16.620 27.400 1.00 51.56 H new ATOM 0 HD2 LYS D 93 28.680 16.317 26.556 1.00 57.63 H new ATOM 0 HD3 LYS D 93 29.061 14.931 25.949 1.00 57.63 H new ATOM 0 HE2 LYS D 93 29.268 14.019 28.091 1.00 64.06 H new ATOM 0 HE3 LYS D 93 28.977 15.411 28.732 1.00 64.06 H new ATOM 0 HZ1 LYS D 93 27.093 14.112 28.729 1.00 71.94 H new ATOM 0 HZ2 LYS D 93 26.845 15.294 27.922 1.00 71.94 H new ATOM 0 HZ3 LYS D 93 27.111 14.019 27.279 1.00 71.94 H new ATOM 3709 N LYS D 94 32.850 17.943 23.268 1.00 56.28 N ATOM 3710 CA LYS D 94 33.371 18.095 21.910 1.00 56.49 C ATOM 3711 C LYS D 94 34.863 18.269 21.956 1.00 54.50 C ATOM 3712 O LYS D 94 35.556 17.904 21.031 1.00 60.73 O ATOM 3713 CB LYS D 94 32.747 19.291 21.190 1.00 60.62 C ATOM 3714 CG LYS D 94 31.223 19.193 21.072 1.00 70.39 C ATOM 3715 CD LYS D 94 30.703 19.783 19.764 1.00 73.07 C ATOM 3716 CE LYS D 94 29.187 19.803 19.745 1.00 72.21 C ATOM 3717 NZ LYS D 94 28.630 20.777 20.728 1.00 72.12 N ATOM 0 H LYS D 94 32.335 18.581 23.527 1.00 56.28 H new ATOM 0 HA LYS D 94 33.140 17.293 21.416 1.00 56.49 H new ATOM 0 HB2 LYS D 94 32.978 20.104 21.666 1.00 60.62 H new ATOM 0 HB3 LYS D 94 33.131 19.363 20.302 1.00 60.62 H new ATOM 0 HG2 LYS D 94 30.955 18.263 21.134 1.00 70.39 H new ATOM 0 HG3 LYS D 94 30.813 19.656 21.819 1.00 70.39 H new ATOM 0 HD2 LYS D 94 31.044 20.684 19.653 1.00 73.07 H new ATOM 0 HD3 LYS D 94 31.033 19.261 19.016 1.00 73.07 H new ATOM 0 HE2 LYS D 94 28.878 20.031 18.854 1.00 72.21 H new ATOM 0 HE3 LYS D 94 28.850 18.915 19.943 1.00 72.21 H new ATOM 0 HZ1 LYS D 94 27.931 20.414 21.142 1.00 72.12 H new ATOM 0 HZ2 LYS D 94 29.254 20.984 21.327 1.00 72.12 H new ATOM 0 HZ3 LYS D 94 28.372 21.515 20.302 1.00 72.12 H new ATOM 3718 N ILE D 95 35.360 18.847 23.038 1.00 54.31 N ATOM 3719 CA ILE D 95 36.793 19.036 23.207 1.00 50.33 C ATOM 3720 C ILE D 95 37.375 17.671 23.466 1.00 48.81 C ATOM 3721 O ILE D 95 38.456 17.367 22.990 1.00 48.18 O ATOM 3722 CB ILE D 95 37.135 19.928 24.428 1.00 52.47 C ATOM 3723 CG1 ILE D 95 36.651 21.372 24.201 1.00 49.85 C ATOM 3724 CG2 ILE D 95 38.640 19.852 24.734 1.00 51.08 C ATOM 3725 CD1 ILE D 95 36.760 22.258 25.411 1.00 47.05 C ATOM 0 H ILE D 95 34.882 19.139 23.691 1.00 54.31 H new ATOM 0 HA ILE D 95 37.148 19.469 22.415 1.00 50.33 H new ATOM 0 HB ILE D 95 36.664 19.596 25.209 1.00 52.47 H new ATOM 0 HG12 ILE D 95 37.165 21.765 23.478 1.00 49.85 H new ATOM 0 HG13 ILE D 95 35.726 21.350 23.911 1.00 49.85 H new ATOM 0 HG21 ILE D 95 38.844 20.413 25.499 1.00 51.08 H new ATOM 0 HG22 ILE D 95 38.884 18.934 24.932 1.00 51.08 H new ATOM 0 HG23 ILE D 95 39.143 20.161 23.964 1.00 51.08 H new ATOM 0 HD11 ILE D 95 36.438 23.146 25.192 1.00 47.05 H new ATOM 0 HD12 ILE D 95 36.225 21.889 26.131 1.00 47.05 H new ATOM 0 HD13 ILE D 95 37.687 22.310 25.691 1.00 47.05 H new ATOM 3726 N LEU D 96 36.680 16.873 24.273 1.00 51.73 N ATOM 3727 CA LEU D 96 37.150 15.533 24.597 1.00 58.74 C ATOM 3728 C LEU D 96 37.357 14.741 23.327 1.00 58.48 C ATOM 3729 O LEU D 96 38.273 13.915 23.250 1.00 59.71 O ATOM 3730 CB LEU D 96 36.198 14.794 25.559 1.00 59.06 C ATOM 3731 CG LEU D 96 36.471 14.966 27.066 1.00 59.51 C ATOM 3732 CD1 LEU D 96 35.520 14.086 27.844 1.00 55.14 C ATOM 3733 CD2 LEU D 96 37.946 14.613 27.427 1.00 58.55 C ATOM 0 H LEU D 96 35.934 17.090 24.642 1.00 51.73 H new ATOM 0 HA LEU D 96 37.998 15.621 25.060 1.00 58.74 H new ATOM 0 HB2 LEU D 96 35.293 15.092 25.379 1.00 59.06 H new ATOM 0 HB3 LEU D 96 36.231 13.847 25.351 1.00 59.06 H new ATOM 0 HG LEU D 96 36.330 15.897 27.300 1.00 59.51 H new ATOM 0 HD11 LEU D 96 35.687 14.190 28.794 1.00 55.14 H new ATOM 0 HD12 LEU D 96 34.606 14.343 27.647 1.00 55.14 H new ATOM 0 HD13 LEU D 96 35.656 13.159 27.591 1.00 55.14 H new ATOM 0 HD21 LEU D 96 38.083 14.732 28.380 1.00 58.55 H new ATOM 0 HD22 LEU D 96 38.126 13.691 27.187 1.00 58.55 H new ATOM 0 HD23 LEU D 96 38.547 15.197 26.939 1.00 58.55 H new ATOM 3734 N ASP D 97 36.497 14.999 22.341 1.00 59.21 N ATOM 3735 CA ASP D 97 36.563 14.349 21.033 1.00 59.09 C ATOM 3736 C ASP D 97 37.653 14.982 20.163 1.00 57.89 C ATOM 3737 O ASP D 97 38.558 14.304 19.673 1.00 57.09 O ATOM 3738 CB ASP D 97 35.216 14.473 20.331 1.00 59.77 C ATOM 3739 CG ASP D 97 34.085 13.913 21.156 1.00 64.29 C ATOM 3740 OD1 ASP D 97 34.201 12.749 21.619 1.00 66.54 O ATOM 3741 OD2 ASP D 97 33.087 14.638 21.343 1.00 62.58 O ATOM 0 H ASP D 97 35.852 15.563 22.415 1.00 59.21 H new ATOM 0 HA ASP D 97 36.780 13.413 21.167 1.00 59.09 H new ATOM 0 HB2 ASP D 97 35.040 15.407 20.137 1.00 59.77 H new ATOM 0 HB3 ASP D 97 35.253 14.009 19.480 1.00 59.77 H new ATOM 3742 N LYS D 98 37.564 16.289 19.982 1.00 57.18 N ATOM 3743 CA LYS D 98 38.525 17.005 19.181 1.00 63.25 C ATOM 3744 C LYS D 98 39.959 16.945 19.709 1.00 65.18 C ATOM 3745 O LYS D 98 40.841 16.406 19.039 1.00 67.42 O ATOM 3746 CB LYS D 98 38.080 18.459 19.013 1.00 69.85 C ATOM 3747 CG LYS D 98 36.644 18.626 18.443 1.00 84.98 C ATOM 3748 CD LYS D 98 36.511 18.152 16.981 1.00 93.35 C ATOM 3749 CE LYS D 98 35.096 18.344 16.404 1.00 93.03 C ATOM 3750 NZ LYS D 98 35.042 17.946 14.952 1.00 92.17 N ATOM 0 H LYS D 98 36.945 16.781 20.321 1.00 57.18 H new ATOM 0 HA LYS D 98 38.547 16.555 18.322 1.00 63.25 H new ATOM 0 HB2 LYS D 98 38.129 18.903 19.874 1.00 69.85 H new ATOM 0 HB3 LYS D 98 38.705 18.912 18.425 1.00 69.85 H new ATOM 0 HG2 LYS D 98 36.023 18.127 18.996 1.00 84.98 H new ATOM 0 HG3 LYS D 98 36.387 19.560 18.499 1.00 84.98 H new ATOM 0 HD2 LYS D 98 37.146 18.637 16.431 1.00 93.35 H new ATOM 0 HD3 LYS D 98 36.750 17.213 16.929 1.00 93.35 H new ATOM 0 HE2 LYS D 98 34.462 17.813 16.911 1.00 93.03 H new ATOM 0 HE3 LYS D 98 34.829 19.272 16.498 1.00 93.03 H new ATOM 0 HZ1 LYS D 98 34.216 18.065 14.642 1.00 92.17 H new ATOM 0 HZ2 LYS D 98 35.610 18.448 14.485 1.00 92.17 H new ATOM 0 HZ3 LYS D 98 35.268 17.089 14.870 1.00 92.17 H new ATOM 3751 N VAL D 99 40.189 17.460 20.916 1.00 65.49 N ATOM 3752 CA VAL D 99 41.543 17.496 21.492 1.00 64.85 C ATOM 3753 C VAL D 99 41.989 16.426 22.508 1.00 63.07 C ATOM 3754 O VAL D 99 43.056 15.833 22.352 1.00 65.25 O ATOM 3755 CB VAL D 99 41.839 18.887 22.064 1.00 66.01 C ATOM 3756 CG1 VAL D 99 43.205 18.919 22.715 1.00 67.66 C ATOM 3757 CG2 VAL D 99 41.775 19.915 20.948 1.00 68.11 C ATOM 0 H VAL D 99 39.578 17.795 21.421 1.00 65.49 H new ATOM 0 HA VAL D 99 42.074 17.267 20.714 1.00 64.85 H new ATOM 0 HB VAL D 99 41.174 19.096 22.739 1.00 66.01 H new ATOM 0 HG11 VAL D 99 43.374 19.806 23.070 1.00 67.66 H new ATOM 0 HG12 VAL D 99 43.235 18.271 23.436 1.00 67.66 H new ATOM 0 HG13 VAL D 99 43.883 18.701 22.056 1.00 67.66 H new ATOM 0 HG21 VAL D 99 41.962 20.796 21.308 1.00 68.11 H new ATOM 0 HG22 VAL D 99 42.433 19.697 20.269 1.00 68.11 H new ATOM 0 HG23 VAL D 99 40.889 19.909 20.553 1.00 68.11 H new ATOM 3758 N GLY D 100 41.201 16.184 23.546 1.00 59.78 N ATOM 3759 CA GLY D 100 41.590 15.196 24.537 1.00 56.32 C ATOM 3760 C GLY D 100 41.737 15.821 25.915 1.00 54.32 C ATOM 3761 O GLY D 100 41.903 17.040 26.042 1.00 53.20 O ATOM 0 H GLY D 100 40.449 16.574 23.693 1.00 59.78 H new ATOM 0 HA2 GLY D 100 40.926 14.489 24.570 1.00 56.32 H new ATOM 0 HA3 GLY D 100 42.429 14.785 24.275 1.00 56.32 H new ATOM 3762 N ILE D 101 41.694 14.999 26.961 1.00 49.20 N ATOM 3763 CA ILE D 101 41.809 15.533 28.315 1.00 46.50 C ATOM 3764 C ILE D 101 43.046 16.389 28.488 1.00 47.47 C ATOM 3765 O ILE D 101 43.096 17.226 29.398 1.00 49.04 O ATOM 3766 CB ILE D 101 41.746 14.441 29.429 1.00 42.25 C ATOM 3767 CG1 ILE D 101 41.626 15.085 30.814 1.00 32.95 C ATOM 3768 CG2 ILE D 101 42.959 13.533 29.388 1.00 39.60 C ATOM 3769 CD1 ILE D 101 40.303 15.789 31.073 1.00 26.71 C ATOM 0 H ILE D 101 41.601 14.146 26.911 1.00 49.20 H new ATOM 0 HA ILE D 101 41.026 16.094 28.427 1.00 46.50 H new ATOM 0 HB ILE D 101 40.957 13.902 29.260 1.00 42.25 H new ATOM 0 HG12 ILE D 101 41.751 14.399 31.488 1.00 32.95 H new ATOM 0 HG13 ILE D 101 42.346 15.725 30.923 1.00 32.95 H new ATOM 0 HG21 ILE D 101 42.889 12.868 30.091 1.00 39.60 H new ATOM 0 HG22 ILE D 101 43.002 13.089 28.526 1.00 39.60 H new ATOM 0 HG23 ILE D 101 43.763 14.060 29.521 1.00 39.60 H new ATOM 0 HD11 ILE D 101 40.307 16.168 31.966 1.00 26.71 H new ATOM 0 HD12 ILE D 101 40.181 16.498 30.422 1.00 26.71 H new ATOM 0 HD13 ILE D 101 39.576 15.151 30.996 1.00 26.71 H new ATOM 3770 N ASN D 102 44.020 16.225 27.596 1.00 45.03 N ATOM 3771 CA ASN D 102 45.236 17.013 27.693 1.00 47.31 C ATOM 3772 C ASN D 102 45.019 18.502 27.384 1.00 48.06 C ATOM 3773 O ASN D 102 45.977 19.284 27.341 1.00 47.73 O ATOM 3774 CB ASN D 102 46.365 16.406 26.872 1.00 48.72 C ATOM 3775 CG ASN D 102 45.942 16.073 25.486 1.00 53.76 C ATOM 3776 OD1 ASN D 102 45.061 15.235 25.288 1.00 56.14 O ATOM 3777 ND2 ASN D 102 46.560 16.719 24.500 1.00 57.05 N ATOM 0 H ASN D 102 43.995 15.671 26.939 1.00 45.03 H new ATOM 0 HA ASN D 102 45.509 16.981 28.623 1.00 47.31 H new ATOM 0 HB2 ASN D 102 47.109 17.028 26.840 1.00 48.72 H new ATOM 0 HB3 ASN D 102 46.686 15.603 27.311 1.00 48.72 H new ATOM 0 HD21 ASN D 102 46.349 16.558 23.682 1.00 57.05 H new ATOM 0 HD22 ASN D 102 47.170 17.297 24.681 1.00 57.05 H new ATOM 3778 N TYR D 103 43.757 18.882 27.157 1.00 47.00 N ATOM 3779 CA TYR D 103 43.385 20.281 26.937 1.00 43.74 C ATOM 3780 C TYR D 103 43.464 20.938 28.328 1.00 44.76 C ATOM 3781 O TYR D 103 43.529 22.156 28.460 1.00 47.28 O ATOM 3782 CB TYR D 103 41.962 20.394 26.353 1.00 38.54 C ATOM 3783 CG TYR D 103 41.431 21.814 26.335 1.00 38.80 C ATOM 3784 CD1 TYR D 103 41.855 22.746 25.389 1.00 42.14 C ATOM 3785 CD2 TYR D 103 40.577 22.252 27.315 1.00 42.41 C ATOM 3786 CE1 TYR D 103 41.442 24.083 25.447 1.00 36.64 C ATOM 3787 CE2 TYR D 103 40.161 23.578 27.377 1.00 46.85 C ATOM 3788 CZ TYR D 103 40.598 24.487 26.449 1.00 40.47 C ATOM 3789 OH TYR D 103 40.185 25.799 26.568 1.00 42.64 O ATOM 0 H TYR D 103 43.094 18.335 27.127 1.00 47.00 H new ATOM 0 HA TYR D 103 43.971 20.714 26.296 1.00 43.74 H new ATOM 0 HB2 TYR D 103 41.962 20.044 25.448 1.00 38.54 H new ATOM 0 HB3 TYR D 103 41.361 19.837 26.873 1.00 38.54 H new ATOM 0 HD1 TYR D 103 42.424 22.474 24.705 1.00 42.14 H new ATOM 0 HD2 TYR D 103 40.269 21.649 27.952 1.00 42.41 H new ATOM 0 HE1 TYR D 103 41.738 24.693 24.810 1.00 36.64 H new ATOM 0 HE2 TYR D 103 39.582 23.849 28.053 1.00 46.85 H new ATOM 0 HH TYR D 103 40.168 26.015 27.380 1.00 42.64 H new ATOM 3790 N TRP D 104 43.443 20.104 29.362 1.00 43.42 N ATOM 3791 CA TRP D 104 43.560 20.539 30.745 1.00 40.15 C ATOM 3792 C TRP D 104 44.871 19.945 31.298 1.00 41.41 C ATOM 3793 O TRP D 104 44.894 18.792 31.753 1.00 44.34 O ATOM 3794 CB TRP D 104 42.361 20.028 31.539 1.00 38.64 C ATOM 3795 CG TRP D 104 41.080 20.672 31.152 1.00 35.73 C ATOM 3796 CD1 TRP D 104 40.556 21.829 31.681 1.00 34.21 C ATOM 3797 CD2 TRP D 104 40.153 20.227 30.155 1.00 37.02 C ATOM 3798 NE1 TRP D 104 39.361 22.123 31.059 1.00 39.96 N ATOM 3799 CE2 TRP D 104 39.089 21.161 30.122 1.00 38.91 C ATOM 3800 CE3 TRP D 104 40.122 19.132 29.272 1.00 39.12 C ATOM 3801 CZ2 TRP D 104 38.009 21.030 29.239 1.00 33.84 C ATOM 3802 CZ3 TRP D 104 39.034 19.009 28.388 1.00 35.14 C ATOM 3803 CH2 TRP D 104 38.000 19.957 28.383 1.00 33.58 C ATOM 0 H TRP D 104 43.359 19.253 29.276 1.00 43.42 H new ATOM 0 HA TRP D 104 43.575 21.506 30.813 1.00 40.15 H new ATOM 0 HB2 TRP D 104 42.284 19.069 31.414 1.00 38.64 H new ATOM 0 HB3 TRP D 104 42.519 20.179 32.484 1.00 38.64 H new ATOM 0 HD1 TRP D 104 40.948 22.336 32.355 1.00 34.21 H new ATOM 0 HE1 TRP D 104 38.864 22.803 31.232 1.00 39.96 H new ATOM 0 HE3 TRP D 104 40.806 18.502 29.273 1.00 39.12 H new ATOM 0 HZ2 TRP D 104 37.318 21.652 29.233 1.00 33.84 H new ATOM 0 HZ3 TRP D 104 39.000 18.290 27.799 1.00 35.14 H new ATOM 0 HH2 TRP D 104 37.293 19.856 27.787 1.00 33.58 H new ATOM 3804 N LEU D 105 45.956 20.724 31.240 1.00 40.20 N ATOM 3805 CA LEU D 105 47.291 20.294 31.708 1.00 39.39 C ATOM 3806 C LEU D 105 47.402 19.893 33.172 1.00 40.38 C ATOM 3807 O LEU D 105 48.364 19.239 33.559 1.00 40.51 O ATOM 3808 CB LEU D 105 48.345 21.365 31.419 1.00 39.61 C ATOM 3809 CG LEU D 105 48.809 21.396 29.966 1.00 44.05 C ATOM 3810 CD1 LEU D 105 47.769 22.114 29.146 1.00 50.84 C ATOM 3811 CD2 LEU D 105 50.139 22.084 29.833 1.00 43.79 C ATOM 0 H LEU D 105 45.943 21.525 30.926 1.00 40.20 H new ATOM 0 HA LEU D 105 47.448 19.483 31.199 1.00 39.39 H new ATOM 0 HB2 LEU D 105 47.983 22.234 31.653 1.00 39.61 H new ATOM 0 HB3 LEU D 105 49.113 21.214 31.992 1.00 39.61 H new ATOM 0 HG LEU D 105 48.918 20.486 29.648 1.00 44.05 H new ATOM 0 HD11 LEU D 105 48.051 22.142 28.218 1.00 50.84 H new ATOM 0 HD12 LEU D 105 46.923 21.644 29.213 1.00 50.84 H new ATOM 0 HD13 LEU D 105 47.663 23.019 29.478 1.00 50.84 H new ATOM 0 HD21 LEU D 105 50.409 22.089 28.901 1.00 43.79 H new ATOM 0 HD22 LEU D 105 50.065 22.997 30.153 1.00 43.79 H new ATOM 0 HD23 LEU D 105 50.802 21.611 30.359 1.00 43.79 H new ATOM 3812 N ALA D 106 46.450 20.346 33.992 1.00 42.83 N ATOM 3813 CA ALA D 106 46.417 20.045 35.424 1.00 37.13 C ATOM 3814 C ALA D 106 46.153 18.550 35.638 1.00 32.81 C ATOM 3815 O ALA D 106 46.698 17.938 36.545 1.00 37.69 O ATOM 3816 CB ALA D 106 45.319 20.901 36.131 1.00 23.22 C ATOM 0 H ALA D 106 45.799 20.842 33.728 1.00 42.83 H new ATOM 0 HA ALA D 106 47.277 20.268 35.813 1.00 37.13 H new ATOM 0 HB1 ALA D 106 45.307 20.693 37.078 1.00 23.22 H new ATOM 0 HB2 ALA D 106 45.515 21.843 36.010 1.00 23.22 H new ATOM 0 HB3 ALA D 106 44.452 20.699 35.745 1.00 23.22 H new ATOM 3817 N HIS D 107 45.341 17.965 34.774 1.00 30.86 N ATOM 3818 CA HIS D 107 44.975 16.567 34.884 1.00 29.23 C ATOM 3819 C HIS D 107 46.149 15.595 35.076 1.00 25.71 C ATOM 3820 O HIS D 107 46.264 14.927 36.095 1.00 28.10 O ATOM 3821 CB HIS D 107 44.147 16.167 33.663 1.00 31.22 C ATOM 3822 CG HIS D 107 43.520 14.818 33.783 1.00 38.82 C ATOM 3823 ND1 HIS D 107 42.410 14.581 34.576 1.00 42.70 N ATOM 3824 CD2 HIS D 107 43.847 13.636 33.229 1.00 35.40 C ATOM 3825 CE1 HIS D 107 42.086 13.306 34.505 1.00 39.19 C ATOM 3826 NE2 HIS D 107 42.934 12.707 33.700 1.00 41.28 N ATOM 0 H HIS D 107 44.985 18.370 34.104 1.00 30.86 H new ATOM 0 HA HIS D 107 44.457 16.491 35.701 1.00 29.23 H new ATOM 0 HB2 HIS D 107 43.451 16.828 33.523 1.00 31.22 H new ATOM 0 HB3 HIS D 107 44.715 16.183 32.877 1.00 31.22 H new ATOM 0 HD1 HIS D 107 41.997 15.174 35.042 1.00 42.70 H new ATOM 0 HD2 HIS D 107 44.551 13.474 32.643 1.00 35.40 H new ATOM 0 HE1 HIS D 107 41.377 12.899 34.949 1.00 39.19 H new ATOM 3827 N LYS D 108 47.021 15.490 34.101 1.00 25.23 N ATOM 3828 CA LYS D 108 48.129 14.580 34.266 1.00 24.00 C ATOM 3829 C LYS D 108 49.135 15.068 35.294 1.00 26.05 C ATOM 3830 O LYS D 108 49.673 14.289 36.065 1.00 33.64 O ATOM 3831 CB LYS D 108 48.805 14.329 32.920 1.00 21.14 C ATOM 3832 CG LYS D 108 50.002 13.414 33.014 1.00 25.31 C ATOM 3833 CD LYS D 108 50.332 12.816 31.676 1.00 38.20 C ATOM 3834 CE LYS D 108 51.668 12.103 31.701 1.00 43.47 C ATOM 3835 NZ LYS D 108 51.627 10.986 32.666 1.00 52.90 N ATOM 0 H LYS D 108 46.995 15.921 33.357 1.00 25.23 H new ATOM 0 HA LYS D 108 47.771 13.744 34.604 1.00 24.00 H new ATOM 0 HB2 LYS D 108 48.159 13.944 32.308 1.00 21.14 H new ATOM 0 HB3 LYS D 108 49.084 15.178 32.542 1.00 21.14 H new ATOM 0 HG2 LYS D 108 50.766 13.910 33.347 1.00 25.31 H new ATOM 0 HG3 LYS D 108 49.822 12.706 33.652 1.00 25.31 H new ATOM 0 HD2 LYS D 108 49.636 12.192 31.419 1.00 38.20 H new ATOM 0 HD3 LYS D 108 50.349 13.515 31.003 1.00 38.20 H new ATOM 0 HE2 LYS D 108 51.881 11.768 30.816 1.00 43.47 H new ATOM 0 HE3 LYS D 108 52.371 12.725 31.945 1.00 43.47 H new ATOM 0 HZ1 LYS D 108 52.350 10.477 32.563 1.00 52.90 H new ATOM 0 HZ2 LYS D 108 51.609 11.310 33.495 1.00 52.90 H new ATOM 0 HZ3 LYS D 108 50.898 10.497 32.523 1.00 52.90 H new ATOM 3836 N ALA D 109 49.345 16.375 35.339 1.00 28.75 N ATOM 3837 CA ALA D 109 50.314 16.997 36.241 1.00 26.28 C ATOM 3838 C ALA D 109 50.014 16.960 37.724 1.00 28.70 C ATOM 3839 O ALA D 109 50.904 16.689 38.522 1.00 30.07 O ATOM 3840 CB ALA D 109 50.557 18.443 35.820 1.00 24.32 C ATOM 0 H ALA D 109 48.925 16.937 34.841 1.00 28.75 H new ATOM 0 HA ALA D 109 51.101 16.438 36.143 1.00 26.28 H new ATOM 0 HB1 ALA D 109 51.200 18.851 36.421 1.00 24.32 H new ATOM 0 HB2 ALA D 109 50.904 18.463 34.914 1.00 24.32 H new ATOM 0 HB3 ALA D 109 49.722 18.936 35.857 1.00 24.32 H new ATOM 3841 N LEU D 110 48.778 17.310 38.090 1.00 29.04 N ATOM 3842 CA LEU D 110 48.357 17.385 39.488 1.00 25.64 C ATOM 3843 C LEU D 110 47.237 16.439 39.894 1.00 27.50 C ATOM 3844 O LEU D 110 46.916 16.332 41.087 1.00 32.80 O ATOM 3845 CB LEU D 110 47.941 18.828 39.834 1.00 23.89 C ATOM 3846 CG LEU D 110 48.942 19.951 39.501 1.00 22.43 C ATOM 3847 CD1 LEU D 110 48.386 21.303 39.899 1.00 23.08 C ATOM 3848 CD2 LEU D 110 50.263 19.701 40.193 1.00 18.96 C ATOM 0 H LEU D 110 48.158 17.511 37.529 1.00 29.04 H new ATOM 0 HA LEU D 110 49.135 17.100 39.992 1.00 25.64 H new ATOM 0 HB2 LEU D 110 47.110 19.020 39.372 1.00 23.89 H new ATOM 0 HB3 LEU D 110 47.752 18.866 40.785 1.00 23.89 H new ATOM 0 HG LEU D 110 49.088 19.953 38.542 1.00 22.43 H new ATOM 0 HD11 LEU D 110 49.030 21.995 39.681 1.00 23.08 H new ATOM 0 HD12 LEU D 110 47.560 21.468 39.418 1.00 23.08 H new ATOM 0 HD13 LEU D 110 48.211 21.313 40.853 1.00 23.08 H new ATOM 0 HD21 LEU D 110 50.883 20.415 39.975 1.00 18.96 H new ATOM 0 HD22 LEU D 110 50.126 19.675 41.153 1.00 18.96 H new ATOM 0 HD23 LEU D 110 50.629 18.853 39.896 1.00 18.96 H new ATOM 3849 N CYS D 111 46.637 15.758 38.922 1.00 29.96 N ATOM 3850 CA CYS D 111 45.531 14.841 39.198 1.00 32.06 C ATOM 3851 C CYS D 111 45.811 13.372 38.865 1.00 32.87 C ATOM 3852 O CYS D 111 44.918 12.628 38.470 1.00 38.33 O ATOM 3853 CB CYS D 111 44.252 15.328 38.493 1.00 31.24 C ATOM 3854 SG CYS D 111 43.706 16.985 39.060 1.00 32.58 S ATOM 0 H CYS D 111 46.855 15.812 38.092 1.00 29.96 H new ATOM 0 HA CYS D 111 45.411 14.858 40.160 1.00 32.06 H new ATOM 0 HB2 CYS D 111 44.407 15.354 37.536 1.00 31.24 H new ATOM 0 HB3 CYS D 111 43.540 14.688 38.648 1.00 31.24 H new ATOM 3855 N SER D 112 47.055 12.950 39.040 1.00 34.30 N ATOM 3856 CA SER D 112 47.447 11.566 38.786 1.00 33.09 C ATOM 3857 C SER D 112 47.627 10.830 40.111 1.00 32.82 C ATOM 3858 O SER D 112 47.876 9.631 40.122 1.00 35.56 O ATOM 3859 CB SER D 112 48.779 11.501 38.016 1.00 37.47 C ATOM 3860 OG SER D 112 48.653 11.870 36.661 1.00 34.32 O ATOM 0 H SER D 112 47.697 13.455 39.309 1.00 34.30 H new ATOM 0 HA SER D 112 46.748 11.152 38.256 1.00 33.09 H new ATOM 0 HB2 SER D 112 49.424 12.084 38.446 1.00 37.47 H new ATOM 0 HB3 SER D 112 49.133 10.599 38.069 1.00 37.47 H new ATOM 0 HG SER D 112 48.988 12.631 36.545 1.00 34.32 H new ATOM 3861 N GLU D 113 47.568 11.565 41.220 1.00 29.77 N ATOM 3862 CA GLU D 113 47.733 10.969 42.530 1.00 31.87 C ATOM 3863 C GLU D 113 46.578 11.340 43.452 1.00 30.12 C ATOM 3864 O GLU D 113 45.790 12.228 43.147 1.00 26.22 O ATOM 3865 CB GLU D 113 49.071 11.388 43.174 1.00 30.54 C ATOM 3866 CG GLU D 113 49.148 12.864 43.528 1.00 41.23 C ATOM 3867 CD GLU D 113 50.384 13.231 44.325 1.00 43.07 C ATOM 3868 OE1 GLU D 113 51.065 12.324 44.858 1.00 47.19 O ATOM 3869 OE2 GLU D 113 50.644 14.450 44.440 1.00 46.69 O ATOM 0 H GLU D 113 47.432 12.414 41.229 1.00 29.77 H new ATOM 0 HA GLU D 113 47.738 10.007 42.407 1.00 31.87 H new ATOM 0 HB2 GLU D 113 49.211 10.864 43.978 1.00 30.54 H new ATOM 0 HB3 GLU D 113 49.795 11.172 42.565 1.00 30.54 H new ATOM 0 HG2 GLU D 113 49.132 13.386 42.711 1.00 41.23 H new ATOM 0 HG3 GLU D 113 48.359 13.109 44.037 1.00 41.23 H new ATOM 3870 N LYS D 114 46.431 10.571 44.527 1.00 28.99 N ATOM 3871 CA LYS D 114 45.397 10.814 45.509 1.00 31.50 C ATOM 3872 C LYS D 114 44.030 11.041 44.881 1.00 37.21 C ATOM 3873 O LYS D 114 43.255 11.892 45.327 1.00 43.53 O ATOM 3874 CB LYS D 114 45.806 12.008 46.372 1.00 35.00 C ATOM 3875 CG LYS D 114 46.875 11.669 47.370 1.00 38.94 C ATOM 3876 CD LYS D 114 47.717 12.869 47.734 1.00 50.64 C ATOM 3877 CE LYS D 114 48.853 12.462 48.712 1.00 62.69 C ATOM 3878 NZ LYS D 114 49.759 11.335 48.262 1.00 62.98 N ATOM 0 H LYS D 114 46.932 9.894 44.702 1.00 28.99 H new ATOM 0 HA LYS D 114 45.310 10.019 46.059 1.00 31.50 H new ATOM 0 HB2 LYS D 114 46.121 12.723 45.798 1.00 35.00 H new ATOM 0 HB3 LYS D 114 45.026 12.344 46.842 1.00 35.00 H new ATOM 0 HG2 LYS D 114 46.464 11.309 48.172 1.00 38.94 H new ATOM 0 HG3 LYS D 114 47.446 10.974 47.007 1.00 38.94 H new ATOM 0 HD2 LYS D 114 48.098 13.259 46.932 1.00 50.64 H new ATOM 0 HD3 LYS D 114 47.160 13.550 48.143 1.00 50.64 H new ATOM 0 HE2 LYS D 114 49.402 13.243 48.882 1.00 62.69 H new ATOM 0 HE3 LYS D 114 48.450 12.209 49.557 1.00 62.69 H new ATOM 0 HZ1 LYS D 114 50.447 11.265 48.822 1.00 62.98 H new ATOM 0 HZ2 LYS D 114 49.303 10.571 48.257 1.00 62.98 H new ATOM 0 HZ3 LYS D 114 50.061 11.506 47.442 1.00 62.98 H new ATOM 3879 N LEU D 115 43.674 10.187 43.935 1.00 33.54 N ATOM 3880 CA LEU D 115 42.397 10.349 43.280 1.00 31.87 C ATOM 3881 C LEU D 115 41.189 10.011 44.142 1.00 31.67 C ATOM 3882 O LEU D 115 40.142 10.622 43.991 1.00 33.51 O ATOM 3883 CB LEU D 115 42.371 9.563 41.973 1.00 26.12 C ATOM 3884 CG LEU D 115 43.176 10.200 40.853 1.00 26.52 C ATOM 3885 CD1 LEU D 115 43.090 9.326 39.650 1.00 21.58 C ATOM 3886 CD2 LEU D 115 42.653 11.633 40.568 1.00 27.12 C ATOM 0 H LEU D 115 44.148 9.522 43.664 1.00 33.54 H new ATOM 0 HA LEU D 115 42.315 11.298 43.098 1.00 31.87 H new ATOM 0 HB2 LEU D 115 42.712 8.670 42.137 1.00 26.12 H new ATOM 0 HB3 LEU D 115 41.451 9.466 41.683 1.00 26.12 H new ATOM 0 HG LEU D 115 44.108 10.283 41.109 1.00 26.52 H new ATOM 0 HD11 LEU D 115 43.600 9.721 38.926 1.00 21.58 H new ATOM 0 HD12 LEU D 115 43.451 8.450 39.859 1.00 21.58 H new ATOM 0 HD13 LEU D 115 42.163 9.237 39.380 1.00 21.58 H new ATOM 0 HD21 LEU D 115 43.173 12.031 39.852 1.00 27.12 H new ATOM 0 HD22 LEU D 115 41.720 11.591 40.305 1.00 27.12 H new ATOM 0 HD23 LEU D 115 42.739 12.174 41.368 1.00 27.12 H new ATOM 3887 N ASP D 116 41.316 9.042 45.043 1.00 35.54 N ATOM 3888 CA ASP D 116 40.168 8.664 45.873 1.00 37.55 C ATOM 3889 C ASP D 116 39.781 9.690 46.931 1.00 37.34 C ATOM 3890 O ASP D 116 38.765 9.540 47.608 1.00 40.11 O ATOM 3891 CB ASP D 116 40.280 7.222 46.441 1.00 37.03 C ATOM 3892 CG ASP D 116 41.488 6.999 47.357 1.00 38.45 C ATOM 3893 OD1 ASP D 116 42.317 7.894 47.563 1.00 51.73 O ATOM 3894 OD2 ASP D 116 41.618 5.890 47.892 1.00 42.29 O ATOM 0 H ASP D 116 42.038 8.598 45.190 1.00 35.54 H new ATOM 0 HA ASP D 116 39.418 8.660 45.257 1.00 37.55 H new ATOM 0 HB2 ASP D 116 39.471 7.016 46.934 1.00 37.03 H new ATOM 0 HB3 ASP D 116 40.328 6.597 45.701 1.00 37.03 H new ATOM 3895 N GLN D 117 40.570 10.753 47.050 1.00 37.16 N ATOM 3896 CA GLN D 117 40.241 11.794 48.008 1.00 37.90 C ATOM 3897 C GLN D 117 39.339 12.850 47.381 1.00 35.00 C ATOM 3898 O GLN D 117 38.925 13.784 48.043 1.00 38.39 O ATOM 3899 CB GLN D 117 41.492 12.416 48.653 1.00 36.47 C ATOM 3900 CG GLN D 117 42.262 13.388 47.814 1.00 40.16 C ATOM 3901 CD GLN D 117 43.503 13.888 48.541 1.00 45.44 C ATOM 3902 OE1 GLN D 117 43.924 15.039 48.361 1.00 48.14 O ATOM 3903 NE2 GLN D 117 44.096 13.033 49.363 1.00 48.37 N ATOM 0 H GLN D 117 41.287 10.887 46.594 1.00 37.16 H new ATOM 0 HA GLN D 117 39.746 11.373 48.729 1.00 37.90 H new ATOM 0 HB2 GLN D 117 41.221 12.866 49.468 1.00 36.47 H new ATOM 0 HB3 GLN D 117 42.090 11.697 48.911 1.00 36.47 H new ATOM 0 HG2 GLN D 117 42.522 12.964 46.981 1.00 40.16 H new ATOM 0 HG3 GLN D 117 41.694 14.140 47.584 1.00 40.16 H new ATOM 0 HE21 GLN D 117 43.776 12.241 49.464 1.00 48.37 H new ATOM 0 HE22 GLN D 117 44.801 13.270 49.795 1.00 48.37 H new ATOM 3904 N TRP D 118 38.973 12.663 46.125 1.00 32.71 N ATOM 3905 CA TRP D 118 38.111 13.619 45.470 1.00 30.79 C ATOM 3906 C TRP D 118 36.725 13.022 45.303 1.00 35.45 C ATOM 3907 O TRP D 118 35.911 13.533 44.526 1.00 41.09 O ATOM 3908 CB TRP D 118 38.709 14.045 44.125 1.00 29.09 C ATOM 3909 CG TRP D 118 40.075 14.765 44.231 1.00 26.09 C ATOM 3910 CD1 TRP D 118 41.313 14.177 44.183 1.00 23.78 C ATOM 3911 CD2 TRP D 118 40.315 16.177 44.352 1.00 23.16 C ATOM 3912 NE1 TRP D 118 42.294 15.134 44.262 1.00 22.00 N ATOM 3913 CE2 TRP D 118 41.714 16.368 44.370 1.00 22.10 C ATOM 3914 CE3 TRP D 118 39.484 17.303 44.429 1.00 25.81 C ATOM 3915 CZ2 TRP D 118 42.299 17.634 44.468 1.00 24.58 C ATOM 3916 CZ3 TRP D 118 40.075 18.567 44.515 1.00 21.77 C ATOM 3917 CH2 TRP D 118 41.465 18.717 44.536 1.00 19.55 C ATOM 0 H TRP D 118 39.212 11.994 45.640 1.00 32.71 H new ATOM 0 HA TRP D 118 38.035 14.416 46.018 1.00 30.79 H new ATOM 0 HB2 TRP D 118 38.813 13.259 43.566 1.00 29.09 H new ATOM 0 HB3 TRP D 118 38.081 14.632 43.676 1.00 29.09 H new ATOM 0 HD1 TRP D 118 41.466 13.263 44.108 1.00 23.78 H new ATOM 0 HE1 TRP D 118 43.140 14.982 44.246 1.00 22.00 H new ATOM 0 HE3 TRP D 118 38.559 17.211 44.423 1.00 25.81 H new ATOM 0 HZ2 TRP D 118 43.223 17.737 44.486 1.00 24.58 H new ATOM 0 HZ3 TRP D 118 39.534 19.322 44.559 1.00 21.77 H new ATOM 0 HH2 TRP D 118 41.830 19.570 44.597 1.00 19.55 H new ATOM 3918 N LEU D 119 36.478 11.922 46.015 1.00 33.57 N ATOM 3919 CA LEU D 119 35.183 11.239 45.995 1.00 38.44 C ATOM 3920 C LEU D 119 34.207 12.017 46.878 1.00 45.09 C ATOM 3921 O LEU D 119 34.632 12.807 47.704 1.00 49.49 O ATOM 3922 CB LEU D 119 35.329 9.835 46.565 1.00 37.69 C ATOM 3923 CG LEU D 119 35.678 8.653 45.672 1.00 34.08 C ATOM 3924 CD1 LEU D 119 35.581 7.383 46.490 1.00 37.75 C ATOM 3925 CD2 LEU D 119 34.721 8.588 44.497 1.00 35.48 C ATOM 0 H LEU D 119 37.060 11.549 46.526 1.00 33.57 H new ATOM 0 HA LEU D 119 34.860 11.189 45.082 1.00 38.44 H new ATOM 0 HB2 LEU D 119 36.009 9.879 47.255 1.00 37.69 H new ATOM 0 HB3 LEU D 119 34.492 9.620 47.005 1.00 37.69 H new ATOM 0 HG LEU D 119 36.579 8.756 45.328 1.00 34.08 H new ATOM 0 HD11 LEU D 119 35.801 6.621 45.932 1.00 37.75 H new ATOM 0 HD12 LEU D 119 36.202 7.429 47.234 1.00 37.75 H new ATOM 0 HD13 LEU D 119 34.678 7.284 46.829 1.00 37.75 H new ATOM 0 HD21 LEU D 119 34.951 7.832 43.934 1.00 35.48 H new ATOM 0 HD22 LEU D 119 33.814 8.483 44.824 1.00 35.48 H new ATOM 0 HD23 LEU D 119 34.786 9.407 43.981 1.00 35.48 H new ATOM 3926 N CYS D 120 32.909 11.749 46.791 1.00 54.04 N ATOM 3927 CA CYS D 120 31.998 12.514 47.635 1.00 62.90 C ATOM 3928 C CYS D 120 30.915 11.827 48.472 1.00 72.74 C ATOM 3929 O CYS D 120 31.028 11.776 49.694 1.00 74.43 O ATOM 3930 CB CYS D 120 31.365 13.672 46.838 1.00 61.70 C ATOM 3931 SG CYS D 120 32.351 15.208 46.740 1.00 55.77 S ATOM 0 H CYS D 120 32.548 11.160 46.278 1.00 54.04 H new ATOM 0 HA CYS D 120 32.619 12.793 48.326 1.00 62.90 H new ATOM 0 HB2 CYS D 120 31.190 13.363 45.935 1.00 61.70 H new ATOM 0 HB3 CYS D 120 30.506 13.884 47.236 1.00 61.70 H new ATOM 3932 N GLU D 121 29.888 11.294 47.804 1.00 83.75 N ATOM 3933 CA GLU D 121 28.696 10.685 48.432 1.00 94.77 C ATOM 3934 C GLU D 121 28.567 10.145 49.856 1.00 99.95 C ATOM 3935 O GLU D 121 27.441 9.881 50.292 1.00101.10 O ATOM 3936 CB GLU D 121 27.953 9.769 47.461 1.00 97.35 C ATOM 3937 CG GLU D 121 26.939 10.535 46.612 1.00103.89 C ATOM 3938 CD GLU D 121 26.131 11.571 47.418 1.00106.50 C ATOM 3939 OE1 GLU D 121 25.234 11.175 48.206 1.00105.03 O ATOM 3940 OE2 GLU D 121 26.399 12.783 47.242 1.00107.13 O ATOM 0 H GLU D 121 29.860 11.274 46.945 1.00 83.75 H new ATOM 0 HA GLU D 121 28.318 11.554 48.639 1.00 94.77 H new ATOM 0 HB2 GLU D 121 28.593 9.328 46.880 1.00 97.35 H new ATOM 0 HB3 GLU D 121 27.496 9.073 47.959 1.00 97.35 H new ATOM 0 HG2 GLU D 121 27.405 10.987 45.891 1.00103.89 H new ATOM 0 HG3 GLU D 121 26.327 9.904 46.202 1.00103.89 H new ATOM 3941 N LYS D 122 29.682 9.957 50.563 1.00106.74 N ATOM 3942 CA LYS D 122 29.672 9.510 51.960 1.00114.14 C ATOM 3943 C LYS D 122 31.078 9.314 52.555 1.00116.16 C ATOM 3944 O LYS D 122 32.103 9.516 51.881 1.00117.73 O ATOM 3945 CB LYS D 122 28.822 8.234 52.163 1.00115.53 C ATOM 3946 CG LYS D 122 27.877 8.274 53.388 1.00112.40 C ATOM 3947 CD LYS D 122 27.280 6.905 53.657 1.00113.88 C ATOM 3948 CE LYS D 122 27.790 6.331 54.967 1.00115.14 C ATOM 3949 NZ LYS D 122 27.560 4.854 55.072 1.00117.28 N ATOM 0 H LYS D 122 30.471 10.086 50.245 1.00106.74 H new ATOM 0 HA LYS D 122 29.256 10.237 52.448 1.00114.14 H new ATOM 0 HB2 LYS D 122 28.291 8.084 51.365 1.00115.53 H new ATOM 0 HB3 LYS D 122 29.418 7.474 52.254 1.00115.53 H new ATOM 0 HG2 LYS D 122 28.366 8.577 54.169 1.00112.40 H new ATOM 0 HG3 LYS D 122 27.167 8.916 53.232 1.00112.40 H new ATOM 0 HD2 LYS D 122 26.313 6.971 53.685 1.00113.88 H new ATOM 0 HD3 LYS D 122 27.502 6.304 52.929 1.00113.88 H new ATOM 0 HE2 LYS D 122 28.739 6.515 55.050 1.00115.14 H new ATOM 0 HE3 LYS D 122 27.349 6.778 55.706 1.00115.14 H new ATOM 0 HZ1 LYS D 122 27.872 4.559 55.852 1.00117.28 H new ATOM 0 HZ2 LYS D 122 26.688 4.685 55.019 1.00117.28 H new ATOM 0 HZ3 LYS D 122 27.983 4.439 54.408 1.00117.28 H new ATOM 3950 N LEU D 123 31.084 8.937 53.834 1.00115.35 N ATOM 3951 CA LEU D 123 32.266 8.660 54.654 1.00114.40 C ATOM 3952 C LEU D 123 31.671 8.285 56.017 1.00116.26 C ATOM 3953 O LEU D 123 30.509 8.678 56.277 1.00116.65 O ATOM 3954 CB LEU D 123 33.173 9.907 54.754 1.00110.92 C ATOM 3955 CG LEU D 123 34.392 10.043 55.693 1.00108.29 C ATOM 3956 CD1 LEU D 123 35.226 8.780 55.806 1.00104.90 C ATOM 3957 CD2 LEU D 123 35.262 11.180 55.181 1.00108.83 C ATOM 3958 OXT LEU D 123 32.326 7.539 56.765 1.00118.04 O ATOM 0 H LEU D 123 30.353 8.829 54.274 1.00115.35 H new ATOM 0 HA LEU D 123 32.831 7.961 54.288 1.00114.40 H new ATOM 0 HB2 LEU D 123 33.508 10.065 53.858 1.00110.92 H new ATOM 0 HB3 LEU D 123 32.585 10.647 54.972 1.00110.92 H new ATOM 0 HG LEU D 123 34.051 10.220 56.584 1.00108.29 H new ATOM 0 HD11 LEU D 123 35.970 8.936 56.408 1.00104.90 H new ATOM 0 HD12 LEU D 123 34.677 8.059 56.152 1.00104.90 H new ATOM 0 HD13 LEU D 123 35.565 8.536 54.930 1.00104.90 H new ATOM 0 HD21 LEU D 123 36.035 11.282 55.758 1.00108.83 H new ATOM 0 HD22 LEU D 123 35.557 10.981 54.279 1.00108.83 H new ATOM 0 HD23 LEU D 123 34.750 12.004 55.179 1.00108.83 H new TER 3959 LEU D 123 HETATM 3960 CA CA A 124 9.684 8.003 14.506 1.00 35.18 CA HETATM 3961 CA CA B 124 8.198 17.782 26.546 1.00 43.38 CA HETATM 3962 CA CA C 124 30.373 -1.600 0.097 1.00 63.11 CA HETATM 3963 CA CA D 124 26.644 28.121 31.513 1.00 56.12 CA HETATM 3964 O HOH A 125 10.036 1.867 -10.178 1.00 44.86 O HETATM 3965 O HOH A 126 2.378 -5.247 3.682 1.00 38.64 O HETATM 3966 O HOH A 127 5.368 6.059 12.170 1.00 36.53 O HETATM 3967 O HOH A 128 2.098 -9.431 9.844 1.00 48.55 O HETATM 3968 O HOH A 129 4.701 -6.315 8.502 1.00 47.86 O HETATM 3969 O HOH A 130 6.925 2.723 11.115 1.00 27.61 O HETATM 3970 O HOH A 131 15.097 -13.275 17.402 1.00 45.02 O HETATM 3971 O HOH A 132 12.641 -10.919 1.907 1.00 35.65 O HETATM 3972 O HOH A 133 5.969 -10.585 8.484 1.00 45.78 O HETATM 3973 O HOH A 134 -8.840 9.034 5.403 1.00 30.12 O HETATM 3974 O HOH A 135 -5.668 3.582 11.288 1.00 56.39 O HETATM 3975 O HOH A 136 -4.511 0.877 13.735 1.00 44.75 O HETATM 3976 O HOH A 137 5.336 -9.160 11.817 1.00 38.97 O HETATM 3977 O HOH A 138 21.284 -0.667 8.558 1.00 45.47 O HETATM 3978 O HOH A 139 10.692 -15.873 25.326 1.00 48.97 O HETATM 3979 O HOH A 140 -2.089 17.074 2.863 1.00 29.90 O HETATM 3980 O HOH A 141 -5.086 0.407 3.235 1.00 47.77 O HETATM 3981 O HOH A 142 9.695 2.020 30.812 1.00 55.87 O HETATM 3982 O HOH A 143 15.305 -9.804 25.965 1.00 60.52 O HETATM 3983 O HOH A 144 18.199 -9.220 2.852 1.00 45.07 O HETATM 3984 O HOH A 145 14.813 -7.213 -0.152 1.00 35.65 O HETATM 3985 O HOH A 146 6.216 -9.455 0.033 1.00 36.12 O HETATM 3986 O HOH A 147 9.517 -14.825 -0.004 1.00 34.96 O HETATM 3987 O HOH A 148 -0.977 12.898 -3.070 1.00 47.09 O HETATM 3988 O HOH A 149 11.148 9.451 16.358 1.00 31.68 O HETATM 3989 O HOH A 150 -3.222 4.220 -6.298 1.00 43.97 O HETATM 3990 O HOH B 125 -6.217 12.908 40.725 1.00 33.89 O HETATM 3991 O HOH B 126 -8.036 26.278 33.909 1.00 39.76 O HETATM 3992 O HOH B 127 -1.098 31.251 35.194 1.00 29.74 O HETATM 3993 O HOH B 128 -7.227 22.264 26.055 1.00 45.86 O HETATM 3994 O HOH B 129 0.809 15.396 24.890 1.00 40.17 O HETATM 3995 O HOH B 130 -5.295 24.365 23.439 1.00 45.66 O HETATM 3996 O HOH B 131 3.588 19.823 28.359 1.00 34.98 O HETATM 3997 O HOH B 132 4.644 23.350 29.097 1.00 30.25 O HETATM 3998 O HOH B 133 1.225 35.143 39.904 1.00 28.53 O HETATM 3999 O HOH B 134 -2.335 30.898 28.203 1.00 47.49 O HETATM 4000 O HOH B 135 -1.986 30.690 30.854 1.00 40.26 O HETATM 4001 O HOH B 136 9.817 33.385 42.229 1.00 32.39 O HETATM 4002 O HOH B 137 -2.152 37.771 39.223 1.00 36.62 O HETATM 4003 O HOH B 138 -11.725 16.851 30.716 1.00 29.74 O HETATM 4004 O HOH B 139 9.953 16.501 25.533 1.00 35.34 O HETATM 4005 O HOH B 140 6.094 18.440 26.825 1.00 27.87 O HETATM 4006 O HOH B 141 3.929 38.116 33.850 1.00 36.64 O HETATM 4007 O HOH B 142 3.225 35.351 44.242 1.00 34.67 O HETATM 4008 O HOH B 143 -1.380 6.243 42.973 1.00 52.19 O HETATM 4009 O HOH B 144 -3.927 38.896 24.466 1.00 55.50 O HETATM 4010 O HOH C 125 55.256 11.715 -2.593 1.00 28.68 O HETATM 4011 O HOH C 126 45.473 16.926 3.142 1.00 38.38 O HETATM 4012 O HOH C 127 49.683 14.147 4.328 1.00 37.75 O HETATM 4013 O HOH C 128 24.230 -2.568 -2.486 1.00 46.24 O HETATM 4014 O HOH C 129 53.745 17.590 -0.504 1.00 31.44 O HETATM 4015 O HOH C 130 51.547 -0.309 -2.177 1.00 44.59 O HETATM 4016 O HOH C 131 48.116 3.077 2.218 1.00 34.08 O HETATM 4017 O HOH C 132 34.844 -1.510 -14.184 1.00 37.72 O HETATM 4018 O HOH D 125 45.536 18.059 43.903 1.00 35.65 O HETATM 4019 O HOH D 126 45.217 14.989 44.229 1.00 37.07 O HETATM 4020 O HOH D 127 49.778 13.828 39.672 1.00 34.10 O HETATM 4021 O HOH D 128 31.630 28.074 34.265 1.00 49.11 O HETATM 4022 O HOH D 129 34.545 14.507 51.060 1.00 59.25 O HETATM 4023 O HOH D 130 53.918 9.445 32.220 1.00 59.58 O CONECT 56 973 CONECT 233 896 CONECT 501 622 CONECT 594 734 CONECT 622 501 CONECT 634 3960 CONECT 665 3960 CONECT 678 3960 CONECT 704 3960 CONECT 712 3960 CONECT 734 594 CONECT 896 233 CONECT 973 56 CONECT 1048 1965 CONECT 1225 1888 CONECT 1493 1614 CONECT 1586 1726 CONECT 1614 1493 CONECT 1626 3961 CONECT 1657 3961 CONECT 1658 3961 CONECT 1670 3961 CONECT 1696 3961 CONECT 1704 3961 CONECT 1726 1586 CONECT 1888 1225 CONECT 1965 1048 CONECT 2031 2948 CONECT 2208 2871 CONECT 2476 2597 CONECT 2569 2709 CONECT 2597 2476 CONECT 2609 3962 CONECT 2637 3962 CONECT 2640 3962 CONECT 2641 3962 CONECT 2653 3962 CONECT 2679 3962 CONECT 2687 3962 CONECT 2709 2569 CONECT 2871 2208 CONECT 2948 2031 CONECT 3014 3931 CONECT 3191 3854 CONECT 3459 3580 CONECT 3552 3692 CONECT 3580 3459 CONECT 3592 3963 CONECT 3620 3963 CONECT 3623 3963 CONECT 3624 3963 CONECT 3636 3963 CONECT 3662 3963 CONECT 3663 3963 CONECT 3670 3963 CONECT 3692 3552 CONECT 3854 3191 CONECT 3931 3014 CONECT 3960 634 665 678 704 CONECT 3960 712 3988 CONECT 3961 1626 1657 1658 1670 CONECT 3961 1696 1704 4004 4005 CONECT 3962 2609 2637 2640 2641 CONECT 3962 2653 2679 2687 CONECT 3963 3592 3620 3623 3624 CONECT 3963 3636 3662 3663 3670 CONECT 3988 3960 CONECT 4004 3961 CONECT 4005 3961 END