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1BDR_clean.pdb
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1BDR_clean.pdb
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HEADER HYDROLASE 10-MAY-98 1BDR
TITLE HIV-1 (2: 31, 33-37) PROTEASE COMPLEXED WITH INHIBITOR
TITLE 2 SB203386
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: HIV-1 PROTEASE;
COMPND 3 CHAIN: A, B;
COMPND 4 EC: 3.4.23.16;
COMPND 5 ENGINEERED: YES;
COMPND 6 MUTATION: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1;
SOURCE 3 ORGANISM_TAXID: 11676;
SOURCE 4 STRAIN: IIIB;
SOURCE 5 GENE: HIV-1 PROTEASE;
SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
SOURCE 8 EXPRESSION_SYSTEM_VARIANT: BMH 71-18 MUTS;
SOURCE 9 EXPRESSION_SYSTEM_VECTOR: M13MP19PRO4;
SOURCE 10 EXPRESSION_SYSTEM_PLASMID: POTSKF33
KEYWDS HYDROLASE, AIDS, POLYPROTEIN, ASPARTYL PROTEASE, ACID
KEYWDS 2 PROTEASE, HYDROXYETHYLENE ISOSTERE INHIBITOR, SUBSTRATE
KEYWDS 3 ANALOGUE INHIBITOR
EXPDTA X-RAY DIFFRACTION
AUTHOR M.A.SWAIRJO,S.S.ABDEL-MEGUID
REVDAT 2 24-FEB-09 1BDR 1 VERSN
REVDAT 1 14-OCT-98 1BDR 0
JRNL AUTH M.A.SWAIRJO,E.M.TOWLER,C.DEBOUCK,S.S.ABDEL-MEGUID
JRNL TITL STRUCTURAL ROLE OF THE 30'S LOOP IN DETERMINING
JRNL TITL 2 THE LIGAND SPECIFICITY OF THE HUMAN
JRNL TITL 3 IMMUNODEFICIENCY VIRUS PROTEASE.
JRNL REF BIOCHEMISTRY V. 37 10928 1998
JRNL REFN ISSN 0006-2960
JRNL PMID 9692985
JRNL DOI 10.1021/BI980784H
REMARK 1
REMARK 1 REFERENCE 1
REMARK 1 AUTH E.M.TOWLER,S.K.THOMPSON,T.TOMASZEK,C.DEBOUCK
REMARK 1 TITL IDENTIFICATION OF A LOOP OUTSIDE THE ACTIVE SITE
REMARK 1 TITL 2 CAVITY OF THE HUMAN IMMUNODEFICIENCY VIRUS
REMARK 1 TITL 3 PROTEASES WHICH CONFERS INHIBITOR SPECIFICITY
REMARK 1 REF BIOCHEMISTRY V. 36 5128 1997
REMARK 1 REFN ISSN 0006-2960
REMARK 2
REMARK 2 RESOLUTION. 2.80 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) : 2.80
REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00
REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000
REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL
REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000
REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 95.6
REMARK 3 NUMBER OF REFLECTIONS : 4054
REMARK 3
REMARK 3 FIT TO DATA USED IN REFINEMENT.
REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT
REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM
REMARK 3 R VALUE (WORKING SET) : 0.201
REMARK 3 FREE R VALUE : 0.255
REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.000
REMARK 3 FREE R VALUE TEST SET COUNT : 412
REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.020
REMARK 3
REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN.
REMARK 3 TOTAL NUMBER OF BINS USED : 8
REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.80
REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.93
REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 74.00
REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 400
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 : 1502
REMARK 3 NUCLEIC ACID ATOMS : 0
REMARK 3 HETEROGEN ATOMS : 78
REMARK 3 SOLVENT ATOMS : 4
REMARK 3
REMARK 3 B VALUES.
REMARK 3 FROM WILSON PLOT (A**2) : NULL
REMARK 3 MEAN B VALUE (OVERALL, A**2) : 17.50
REMARK 3 OVERALL ANISOTROPIC B VALUE.
REMARK 3 B11 (A**2) : 17.50000
REMARK 3 B22 (A**2) : 17.50000
REMARK 3 B33 (A**2) : 17.50000
REMARK 3 B12 (A**2) : 17.50000
REMARK 3 B13 (A**2) : 17.50000
REMARK 3 B23 (A**2) : 17.50000
REMARK 3
REMARK 3 ESTIMATED COORDINATE ERROR.
REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.25
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) : 0.019
REMARK 3 BOND ANGLES (DEGREES) : 3.40
REMARK 3 DIHEDRAL ANGLES (DEGREES) : 29.20
REMARK 3 IMPROPER ANGLES (DEGREES) : 1.80
REMARK 3
REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED
REMARK 3
REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA
REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL
REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL
REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL
REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; 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 : PARHCSDX.PRO
REMARK 3 PARAMETER FILE 2 : PARAM19.SOL
REMARK 3 PARAMETER FILE 3 : IM1.PARAM
REMARK 3 PARAMETER FILE 4 : PARAM19X.PRO
REMARK 3 PARAMETER FILE 5 : NULL
REMARK 3 TOPOLOGY FILE 1 : TOPHCSDX.PRO
REMARK 3 TOPOLOGY FILE 2 : TOPH19.SOL
REMARK 3 TOPOLOGY FILE 3 : IM1.TOPOL
REMARK 3 TOPOLOGY FILE 4 : TOPH19X.PRO
REMARK 3 TOPOLOGY FILE 5 : NULL
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1BDR 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 : JUL-97
REMARK 200 TEMPERATURE (KELVIN) : 292
REMARK 200 PH : 5.2
REMARK 200 NUMBER OF CRYSTALS USED : 1
REMARK 200
REMARK 200 SYNCHROTRON (Y/N) : N
REMARK 200 RADIATION SOURCE : ROTATING ANODE
REMARK 200 BEAMLINE : NULL
REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RUH2R
REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M
REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418
REMARK 200 MONOCHROMATOR : NI FILTER
REMARK 200 OPTICS : MIRRORS
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 : 6058
REMARK 200 RESOLUTION RANGE HIGH (A) : 2.500
REMARK 200 RESOLUTION RANGE LOW (A) : 20.000
REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 1.000
REMARK 200
REMARK 200 OVERALL.
REMARK 200 COMPLETENESS FOR RANGE (%) : 99.8
REMARK 200 DATA REDUNDANCY : 7.400
REMARK 200 R MERGE (I) : 0.12000
REMARK 200 R SYM (I) : 0.12000
REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 9.0000
REMARK 200
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.
REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.50
REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.57
REMARK 200 COMPLETENESS FOR SHELL (%) : 67.1
REMARK 200 DATA REDUNDANCY IN SHELL : 7.30
REMARK 200 R MERGE FOR SHELL (I) : 0.53000
REMARK 200 R SYM FOR SHELL (I) : 0.53000
REMARK 200 <I/SIGMA(I)> FOR SHELL : 5.100
REMARK 200
REMARK 200 DIFFRACTION PROTOCOL: NULL
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: DIFFERENCE FOURIER
REMARK 200 SOFTWARE USED: X-PLOR 3.1
REMARK 200 STARTING MODEL: PDB ENTRY 1SBG
REMARK 200
REMARK 200 REMARK: NULL
REMARK 280
REMARK 280 CRYSTAL
REMARK 280 SOLVENT CONTENT, VS (%): 45.00
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.22
REMARK 280
REMARK 280 CRYSTALLIZATION CONDITIONS: HANGING DROP VAPOUR DIFFUSION, BY
REMARK 280 MIXING EQUAL VOLUMES OF RESERVOIR AND SAMPLE, 21 DEG. C
REMARK 280 RESERVOIR: 28% 3.5 MG/ML PROTEIN/INHIBITOR COMPLEX AT 1:5
REMARK 280 MOLAR RATIO., PH 5.2, VAPOR DIFFUSION - HANGING DROP,
REMARK 280 TEMPERATURE 294K
REMARK 290
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 61
REMARK 290
REMARK 290 SYMOP SYMMETRY
REMARK 290 NNNMMM OPERATOR
REMARK 290 1555 X,Y,Z
REMARK 290 2555 -Y,X-Y,Z+1/3
REMARK 290 3555 -X+Y,-X,Z+2/3
REMARK 290 4555 -X,-Y,Z+1/2
REMARK 290 5555 Y,-X+Y,Z+5/6
REMARK 290 6555 X-Y,X,Z+1/6
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 -0.500000 -0.866025 0.000000 0.00000
REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000
REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 27.83000
REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000
REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000
REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 55.66000
REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000
REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000
REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 41.74500
REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000
REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000
REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 69.57500
REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000
REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000
REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 13.91500
REMARK 290
REMARK 290 REMARK: NULL
REMARK 300
REMARK 300 BIOMOLECULE: 1
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
REMARK 300 BURIED SURFACE AREA.
REMARK 350
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
REMARK 350
REMARK 350 BIOMOLECULE: 1
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC
REMARK 350 SOFTWARE USED: PISA
REMARK 350 TOTAL BURIED SURFACE AREA: 4960 ANGSTROM**2
REMARK 350 SURFACE AREA OF THE COMPLEX: 9240 ANGSTROM**2
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -28.0 KCAL/MOL
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, 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 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: TORSION ANGLES
REMARK 500
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
REMARK 500
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
REMARK 500
REMARK 500 M RES CSSEQI PSI PHI
REMARK 500 PRO A 79 81.44 -69.38
REMARK 500 PRO B 79 31.00 -56.22
REMARK 500
REMARK 500 REMARK: NULL
REMARK 800
REMARK 800 SITE
REMARK 800 SITE_IDENTIFIER: IM1
REMARK 800 EVIDENCE_CODE: UNKNOWN
REMARK 800 SITE_DESCRIPTION: IM1 BINDING SITE.
REMARK 800 SITE_IDENTIFIER: AC1
REMARK 800 EVIDENCE_CODE: SOFTWARE
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE IM1 B 400
DBREF 1BDR A 1 99 UNP P04587 POL_HV1B5 69 167
DBREF 1BDR B 1 99 UNP P04587 POL_HV1B5 69 167
SEQADV 1BDR SER A 31 UNP P04587 THR 99 ENGINEERED
SEQADV 1BDR VAL A 33 UNP P04587 LEU 101 ENGINEERED
SEQADV 1BDR ALA A 34 UNP P04587 GLU 102 CONFLICT
SEQADV 1BDR GLY A 35 UNP P04587 GLU 103 ENGINEERED
SEQADV 1BDR ILE A 36 UNP P04587 MET 104 ENGINEERED
SEQADV 1BDR GLU A 37 UNP P04587 SER 105 ENGINEERED
SEQADV 1BDR SER B 31 UNP P04587 THR 99 ENGINEERED
SEQADV 1BDR VAL B 33 UNP P04587 LEU 101 ENGINEERED
SEQADV 1BDR ALA B 34 UNP P04587 GLU 102 CONFLICT
SEQADV 1BDR GLY B 35 UNP P04587 GLU 103 ENGINEERED
SEQADV 1BDR ILE B 36 UNP P04587 MET 104 ENGINEERED
SEQADV 1BDR GLU B 37 UNP P04587 SER 105 ENGINEERED
SEQRES 1 A 99 PRO GLN ILE THR LEU TRP GLN ARG PRO LEU VAL THR ILE
SEQRES 2 A 99 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR
SEQRES 3 A 99 GLY ALA ASP ASP SER VAL VAL ALA GLY ILE GLU LEU PRO
SEQRES 4 A 99 GLY ARG TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY
SEQRES 5 A 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE LEU ILE GLU
SEQRES 6 A 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY
SEQRES 7 A 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR
SEQRES 8 A 99 GLN ILE GLY CYS THR LEU ASN PHE
SEQRES 1 B 99 PRO GLN ILE THR LEU TRP GLN ARG PRO LEU VAL THR ILE
SEQRES 2 B 99 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR
SEQRES 3 B 99 GLY ALA ASP ASP SER VAL VAL ALA GLY ILE GLU LEU PRO
SEQRES 4 B 99 GLY ARG TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY
SEQRES 5 B 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE LEU ILE GLU
SEQRES 6 B 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY
SEQRES 7 B 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR
SEQRES 8 B 99 GLN ILE GLY CYS THR LEU ASN PHE
HET IM1 B 400 39
HETNAM IM1 (2R,4S,5S,1'S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-
HETNAM 2 IM1 BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1'-IMIDAZO-
HETNAM 3 IM1 2-YL)-2'-METHYLPROPANAMIDE
FORMUL 3 IM1 C31 H42 N4 O4
HELIX 1 1 ARG A 87 ILE A 93 1 7
HELIX 2 2 ARG B 87 LEU B 90 1 4
SHEET 1 A 3 GLN A 2 THR A 4 0
SHEET 2 A 3 THR B 96 ASN B 98 -1 N LEU B 97 O ILE A 3
SHEET 3 A 3 THR A 96 ASN A 98 -1 N ASN A 98 O THR B 96
SHEET 1 B 2 LEU A 10 ILE A 15 0
SHEET 2 B 2 GLN A 18 LEU A 23 -1 N ALA A 22 O VAL A 11
SITE 1 IM1 2 ASP A 29 ASP B 29
SITE 1 AC1 16 ARG A 8 ASP A 25 GLY A 27 ALA A 28
SITE 2 AC1 16 ASP A 29 GLY A 48 GLY A 49 VAL A 82
SITE 3 AC1 16 ASP B 25 GLY B 27 ALA B 28 ASP B 29
CRYST1 62.680 62.680 83.490 90.00 90.00 120.00 P 61 12
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 0.015954 0.009211 0.000000 0.00000
SCALE2 0.000000 0.018422 0.000000 0.00000
SCALE3 0.000000 0.000000 0.011977 0.00000
ATOM 752 N PRO B 1 -26.874 30.220 24.458 1.00 9.16 N
ATOM 753 CA PRO B 1 -27.339 30.597 25.809 1.00 9.16 C
ATOM 754 C PRO B 1 -26.072 30.665 26.656 1.00 9.16 C
ATOM 755 O PRO B 1 -25.010 30.260 26.176 1.00 30.18 O
ATOM 756 CB PRO B 1 -28.310 29.492 26.232 1.00 30.18 C
ATOM 757 CG PRO B 1 -27.767 28.345 25.429 1.00 30.18 C
ATOM 758 CD PRO B 1 -27.561 28.981 24.073 1.00 30.18 C
ATOM 759 N GLN B 2 -26.188 31.144 27.885 1.00 7.62 N
ATOM 760 CA GLN B 2 -25.068 31.268 28.812 1.00 7.62 C
ATOM 761 C GLN B 2 -25.095 29.994 29.655 1.00 7.62 C
ATOM 762 O GLN B 2 -26.101 29.753 30.324 1.00 26.76 O
ATOM 763 CB GLN B 2 -25.320 32.545 29.622 1.00 26.76 C
ATOM 764 CG GLN B 2 -24.326 33.020 30.675 1.00 26.76 C
ATOM 765 CD GLN B 2 -24.802 34.257 31.433 1.00 26.76 C
ATOM 766 OE1 GLN B 2 -25.647 35.022 30.953 1.00 26.76 O
ATOM 767 NE2 GLN B 2 -24.357 34.482 32.660 1.00 26.76 N
ATOM 768 N ILE B 3 -24.074 29.160 29.573 1.00 15.60 N
ATOM 769 CA ILE B 3 -23.970 27.907 30.321 1.00 15.60 C
ATOM 770 C ILE B 3 -23.056 28.131 31.520 1.00 15.60 C
ATOM 771 O ILE B 3 -21.945 28.647 31.351 1.00 11.36 O
ATOM 772 CB ILE B 3 -23.363 26.767 29.451 1.00 11.36 C
ATOM 773 CG1 ILE B 3 -24.285 26.568 28.265 1.00 11.36 C
ATOM 774 CG2 ILE B 3 -23.220 25.454 30.194 1.00 11.36 C
ATOM 775 CD1 ILE B 3 -23.550 26.900 26.985 1.00 11.36 C
ATOM 776 N THR B 4 -23.520 27.800 32.709 1.00 16.20 N
ATOM 777 CA THR B 4 -22.739 27.943 33.929 1.00 16.20 C
ATOM 778 C THR B 4 -22.036 26.584 34.047 1.00 16.20 C
ATOM 779 O THR B 4 -22.613 25.561 33.668 1.00 23.59 O
ATOM 780 CB THR B 4 -23.693 28.232 35.092 1.00 23.59 C
ATOM 781 OG1 THR B 4 -24.856 27.382 35.037 1.00 23.59 O
ATOM 782 CG2 THR B 4 -24.113 29.694 35.012 1.00 23.59 C
ATOM 783 N LEU B 5 -20.849 26.527 34.616 1.00 7.04 N
ATOM 784 CA LEU B 5 -20.099 25.281 34.730 1.00 7.04 C
ATOM 785 C LEU B 5 -20.215 24.469 36.018 1.00 7.04 C
ATOM 786 O LEU B 5 -19.321 23.678 36.304 1.00 10.12 O
ATOM 787 CB LEU B 5 -18.643 25.676 34.426 1.00 10.12 C
ATOM 788 CG LEU B 5 -18.401 26.274 33.037 1.00 10.12 C
ATOM 789 CD1 LEU B 5 -17.113 27.058 33.048 1.00 10.12 C
ATOM 790 CD2 LEU B 5 -18.408 25.151 32.004 1.00 10.12 C
ATOM 791 N TRP B 6 -21.276 24.591 36.812 1.00 11.34 N
ATOM 792 CA TRP B 6 -21.398 23.823 38.058 1.00 11.34 C
ATOM 793 C TRP B 6 -21.699 22.353 37.731 1.00 11.34 C
ATOM 794 O TRP B 6 -21.407 21.419 38.488 1.00 21.66 O
ATOM 795 CB TRP B 6 -22.510 24.440 38.942 1.00 21.66 C
ATOM 796 CG TRP B 6 -22.304 25.888 39.279 1.00 21.66 C
ATOM 797 CD1 TRP B 6 -22.778 26.922 38.543 1.00 21.66 C
ATOM 798 CD2 TRP B 6 -21.566 26.486 40.363 1.00 21.66 C
ATOM 799 NE1 TRP B 6 -22.385 28.114 39.078 1.00 21.66 N
ATOM 800 CE2 TRP B 6 -21.643 27.898 40.192 1.00 21.66 C
ATOM 801 CE3 TRP B 6 -20.840 26.006 41.470 1.00 21.66 C
ATOM 802 CZ2 TRP B 6 -21.037 28.824 41.059 1.00 21.66 C
ATOM 803 CZ3 TRP B 6 -20.232 26.920 42.340 1.00 21.66 C
ATOM 804 CH2 TRP B 6 -20.333 28.316 42.131 1.00 21.66 C
ATOM 805 N GLN B 7 -22.328 22.115 36.595 1.00 6.05 N
ATOM 806 CA GLN B 7 -22.672 20.781 36.136 1.00 6.05 C
ATOM 807 C GLN B 7 -21.900 20.705 34.817 1.00 6.05 C
ATOM 808 O GLN B 7 -21.450 21.720 34.272 1.00 27.91 O
ATOM 809 CB GLN B 7 -24.199 20.677 35.935 1.00 27.91 C
ATOM 810 CG GLN B 7 -25.074 20.579 37.203 1.00 27.91 C
ATOM 811 CD GLN B 7 -25.212 19.179 37.815 1.00 27.91 C
ATOM 812 OE1 GLN B 7 -26.252 18.536 37.661 1.00 27.91 O
ATOM 813 NE2 GLN B 7 -24.234 18.633 38.531 1.00 27.91 N
ATOM 814 N ARG B 8 -21.720 19.491 34.319 1.00 8.91 N
ATOM 815 CA ARG B 8 -20.996 19.231 33.070 1.00 8.91 C
ATOM 816 C ARG B 8 -21.732 19.892 31.907 1.00 8.91 C
ATOM 817 O ARG B 8 -22.933 19.633 31.791 1.00 23.47 O
ATOM 818 CB ARG B 8 -20.910 17.721 32.883 1.00 23.47 C
ATOM 819 CG ARG B 8 -19.539 17.158 32.611 1.00 23.47 C
ATOM 820 CD ARG B 8 -19.339 15.852 33.360 1.00 23.47 C
ATOM 821 NE ARG B 8 -18.676 14.852 32.519 1.00 23.47 N
ATOM 822 CZ ARG B 8 -17.923 13.842 32.954 1.00 23.47 C
ATOM 823 NH1 ARG B 8 -17.683 13.638 34.245 1.00 23.47 N
ATOM 824 NH2 ARG B 8 -17.418 12.993 32.079 1.00 23.47 N
ATOM 825 N PRO B 9 -21.098 20.726 31.048 1.00 6.53 N
ATOM 826 CA PRO B 9 -21.759 21.435 29.948 1.00 5.53 C
ATOM 827 C PRO B 9 -22.108 20.533 28.767 1.00 6.53 C
ATOM 828 O PRO B 9 -21.475 20.605 27.716 1.00 10.55 O
ATOM 829 CB PRO B 9 -20.767 22.564 29.660 1.00 10.55 C
ATOM 830 CG PRO B 9 -19.462 21.878 29.847 1.00 10.55 C
ATOM 831 CD PRO B 9 -19.705 21.205 31.153 1.00 10.55 C
ATOM 832 N LEU B 10 -23.054 19.625 28.990 1.00 11.92 N
ATOM 833 CA LEU B 10 -23.549 18.659 28.005 1.00 11.92 C
ATOM 834 C LEU B 10 -24.580 19.380 27.155 1.00 11.92 C
ATOM 835 O LEU B 10 -25.320 20.240 27.657 1.00 15.18 O
ATOM 836 CB LEU B 10 -24.216 17.452 28.689 1.00 15.18 C
ATOM 837 CG LEU B 10 -23.412 16.295 29.318 1.00 15.18 C
ATOM 838 CD1 LEU B 10 -23.655 15.063 28.476 1.00 15.18 C
ATOM 839 CD2 LEU B 10 -21.913 16.556 29.325 1.00 15.18 C
ATOM 840 N VAL B 11 -24.626 19.018 25.881 1.00 8.82 N
ATOM 841 CA VAL B 11 -25.531 19.596 24.898 1.00 8.82 C
ATOM 842 C VAL B 11 -26.006 18.439 24.018 1.00 8.82 C
ATOM 843 O VAL B 11 -25.430 17.345 24.053 1.00 6.26 O
ATOM 844 CB VAL B 11 -24.658 20.711 24.212 1.00 6.26 C
ATOM 845 CG1 VAL B 11 -24.017 20.227 22.934 1.00 6.26 C
ATOM 846 CG2 VAL B 11 -25.517 21.938 24.019 1.00 6.26 C
ATOM 847 N THR B 12 -27.084 18.596 23.284 1.00 6.26 N
ATOM 848 CA THR B 12 -27.573 17.529 22.424 1.00 6.26 C
ATOM 849 C THR B 12 -27.069 17.892 21.028 1.00 6.26 C
ATOM 850 O THR B 12 -27.082 19.084 20.679 1.00 28.79 O
ATOM 851 CB THR B 12 -29.120 17.481 22.457 1.00 28.79 C
ATOM 852 OG1 THR B 12 -29.568 17.482 23.829 1.00 28.79 O
ATOM 853 CG2 THR B 12 -29.641 16.223 21.764 1.00 28.79 C
ATOM 854 N ILE B 13 -26.638 16.889 20.262 1.00 6.25 N
ATOM 855 CA ILE B 13 -26.124 17.058 18.903 1.00 6.25 C
ATOM 856 C ILE B 13 -26.910 16.096 18.009 1.00 6.25 C
ATOM 857 O ILE B 13 -27.432 15.085 18.497 1.00 10.50 O
ATOM 858 CB ILE B 13 -24.575 16.720 18.751 1.00 10.50 C
ATOM 859 CG1 ILE B 13 -24.251 15.235 18.998 1.00 10.50 C
ATOM 860 CG2 ILE B 13 -23.825 17.584 19.746 1.00 10.50 C
ATOM 861 CD1 ILE B 13 -22.833 14.723 18.785 1.00 10.50 C
ATOM 862 N LYS B 14 -27.050 16.458 16.743 1.00 8.08 N
ATOM 863 CA LYS B 14 -27.747 15.655 15.756 1.00 8.08 C
ATOM 864 C LYS B 14 -26.675 15.589 14.671 1.00 8.08 C
ATOM 865 O LYS B 14 -26.290 16.626 14.116 1.00 18.45 O
ATOM 866 CB LYS B 14 -29.008 16.335 15.216 1.00 18.45 C
ATOM 867 CG LYS B 14 -29.782 15.372 14.301 1.00 18.45 C
ATOM 868 CD LYS B 14 -30.986 16.008 13.627 1.00 18.45 C
ATOM 869 CE LYS B 14 -31.643 15.053 12.645 1.00 18.45 C
ATOM 870 NZ LYS B 14 -32.839 15.667 12.004 1.00 18.45 N
ATOM 871 N ILE B 15 -26.182 14.371 14.452 1.00 12.08 N
ATOM 872 CA ILE B 15 -25.142 14.060 13.481 1.00 12.08 C
ATOM 873 C ILE B 15 -25.493 12.725 12.803 1.00 12.08 C
ATOM 874 O ILE B 15 -25.855 11.749 13.472 1.00 19.87 O
ATOM 875 CB ILE B 15 -23.787 14.035 14.251 1.00 19.87 C
ATOM 876 CG1 ILE B 15 -22.670 13.828 13.250 1.00 19.87 C
ATOM 877 CG2 ILE B 15 -23.767 12.941 15.317 1.00 19.87 C
ATOM 878 CD1 ILE B 15 -21.315 13.876 13.895 1.00 19.87 C
ATOM 879 N GLY B 16 -25.532 12.708 11.470 1.00 20.16 N
ATOM 880 CA GLY B 16 -25.861 11.515 10.699 1.00 20.16 C
ATOM 881 C GLY B 16 -27.243 10.915 10.967 1.00 20.16 C
ATOM 882 O GLY B 16 -27.449 9.726 10.692 1.00 20.11 O
ATOM 883 N GLY B 17 -28.173 11.715 11.486 1.00 9.60 N
ATOM 884 CA GLY B 17 -29.527 11.291 11.814 1.00 9.60 C
ATOM 885 C GLY B 17 -29.657 10.757 13.237 1.00 9.60 C
ATOM 886 O GLY B 17 -30.766 10.490 13.711 1.00 29.34 O
ATOM 887 N GLN B 18 -28.511 10.592 13.905 1.00 16.45 N
ATOM 888 CA GLN B 18 -28.403 10.054 15.248 1.00 16.45 C
ATOM 889 C GLN B 18 -28.386 11.227 16.213 1.00 16.45 C
ATOM 890 O GLN B 18 -27.783 12.263 15.918 1.00 9.72 O
ATOM 891 CB GLN B 18 -27.118 9.244 15.375 1.00 9.72 C
ATOM 892 CG GLN B 18 -27.237 7.843 14.835 1.00 9.72 C
ATOM 893 CD GLN B 18 -25.991 7.449 14.090 1.00 9.72 C
ATOM 894 OE1 GLN B 18 -25.208 6.623 14.542 1.00 9.72 O
ATOM 895 NE2 GLN B 18 -25.774 8.029 12.921 1.00 9.72 N
ATOM 896 N LEU B 19 -29.043 11.003 17.341 1.00 11.79 N
ATOM 897 CA LEU B 19 -29.183 11.962 18.429 1.00 11.79 C
ATOM 898 C LEU B 19 -28.267 11.432 19.509 1.00 11.79 C
ATOM 899 O LEU B 19 -28.368 10.241 19.798 1.00 17.27 O
ATOM 900 CB LEU B 19 -30.612 11.961 18.901 1.00 17.27 C
ATOM 901 CG LEU B 19 -31.288 13.295 19.048 1.00 17.27 C
ATOM 902 CD1 LEU B 19 -31.151 14.147 17.797 1.00 17.27 C
ATOM 903 CD2 LEU B 19 -32.752 13.009 19.293 1.00 17.27 C
ATOM 904 N LYS B 20 -27.406 12.277 20.062 1.00 9.85 N
ATOM 905 CA LYS B 20 -26.442 11.936 21.110 1.00 9.85 C
ATOM 906 C LYS B 20 -26.206 13.163 21.985 1.00 9.85 C
ATOM 907 O LYS B 20 -26.652 14.266 21.636 1.00 27.05 O
ATOM 908 CB LYS B 20 -25.067 11.520 20.505 1.00 27.05 C
ATOM 909 CG LYS B 20 -24.934 10.218 19.718 1.00 27.05 C
ATOM 910 CD LYS B 20 -25.330 9.059 20.628 1.00 27.05 C
ATOM 911 CE LYS B 20 -25.630 7.746 19.919 1.00 27.05 C
ATOM 912 NZ LYS B 20 -26.536 6.906 20.760 1.00 27.05 N
ATOM 913 N GLU B 21 -25.542 12.969 23.120 1.00 10.43 N
ATOM 914 CA GLU B 21 -25.215 14.057 24.033 1.00 10.43 C
ATOM 915 C GLU B 21 -23.703 14.262 23.906 1.00 10.43 C
ATOM 916 O GLU B 21 -22.962 13.293 23.679 1.00 17.05 O
ATOM 917 CB GLU B 21 -25.566 13.704 25.466 1.00 17.05 C
ATOM 918 CG GLU B 21 -27.060 13.680 25.717 1.00 17.05 C
ATOM 919 CD GLU B 21 -27.444 14.134 27.113 1.00 17.05 C
ATOM 920 OE1 GLU B 21 -27.641 15.356 27.296 1.00 17.05 O
ATOM 921 OE2 GLU B 21 -27.567 13.281 28.024 1.00 17.05 O
ATOM 922 N ALA B 22 -23.235 15.504 23.979 1.00 6.24 N
ATOM 923 CA ALA B 22 -21.818 15.816 23.869 1.00 6.24 C
ATOM 924 C ALA B 22 -21.426 16.971 24.793 1.00 6.24 C
ATOM 925 O ALA B 22 -22.268 17.787 25.177 1.00 10.17 O
ATOM 926 CB ALA B 22 -21.517 16.145 22.414 1.00 10.17 C
ATOM 927 N LEU B 23 -20.149 16.992 25.127 1.00 6.86 N
ATOM 928 CA LEU B 23 -19.482 17.958 25.993 1.00 6.86 C
ATOM 929 C LEU B 23 -18.952 19.137 25.209 1.00 6.86 C
ATOM 930 O LEU B 23 -18.323 18.915 24.174 1.00 8.44 O
ATOM 931 CB LEU B 23 -18.251 17.356 26.672 1.00 8.44 C
ATOM 932 CG LEU B 23 -17.998 17.203 28.163 1.00 8.44 C
ATOM 933 CD1 LEU B 23 -16.526 16.845 28.285 1.00 8.44 C
ATOM 934 CD2 LEU B 23 -18.288 18.457 28.950 1.00 8.44 C
ATOM 935 N LEU B 24 -19.154 20.346 25.700 1.00 6.95 N
ATOM 936 CA LEU B 24 -18.676 21.582 25.091 1.00 6.95 C
ATOM 937 C LEU B 24 -17.311 21.580 25.765 1.00 6.95 C
ATOM 938 O LEU B 24 -17.247 21.812 26.981 1.00 7.01 O
ATOM 939 CB LEU B 24 -19.551 22.729 25.557 1.00 7.01 C
ATOM 940 CG LEU B 24 -20.675 23.247 24.664 1.00 7.01 C
ATOM 941 CD1 LEU B 24 -21.060 22.247 23.581 1.00 7.01 C
ATOM 942 CD2 LEU B 24 -21.820 23.601 25.584 1.00 7.01 C
ATOM 943 N ASP B 25 -16.266 21.269 24.998 1.00 8.19 N
ATOM 944 CA ASP B 25 -14.882 21.177 25.458 1.00 8.19 C
ATOM 945 C ASP B 25 -13.837 22.158 24.925 1.00 8.19 C
ATOM 946 O ASP B 25 -13.219 21.920 23.883 1.00 8.74 O
ATOM 947 CB ASP B 25 -14.479 19.739 25.170 1.00 8.74 C
ATOM 948 CG ASP B 25 -13.324 19.138 25.936 1.00 8.74 C
ATOM 949 OD1 ASP B 25 -12.314 19.804 26.224 1.00 8.74 O
ATOM 950 OD2 ASP B 25 -13.427 17.938 26.231 1.00 8.74 O
ATOM 951 N THR B 26 -13.516 23.179 25.716 1.00 5.70 N
ATOM 952 CA THR B 26 -12.532 24.193 25.331 1.00 6.70 C
ATOM 953 C THR B 26 -11.074 23.714 25.274 1.00 6.70 C
ATOM 954 O THR B 26 -10.234 24.345 24.626 1.00 10.11 O
ATOM 955 CB THR B 26 -12.660 25.406 26.289 1.00 10.11 C
ATOM 956 OG1 THR B 26 -12.683 24.993 27.666 1.00 10.11 O
ATOM 957 CG2 THR B 26 -13.961 26.129 26.018 1.00 10.11 C
ATOM 958 N GLY B 27 -10.771 22.586 25.919 1.00 6.00 N
ATOM 959 CA GLY B 27 -9.444 21.994 25.887 1.00 6.00 C
ATOM 960 C GLY B 27 -9.314 20.974 24.779 1.00 6.00 C
ATOM 961 O GLY B 27 -8.374 20.161 24.756 1.00 11.47 O
ATOM 962 N ALA B 28 -10.271 20.927 23.873 1.00 16.71 N
ATOM 963 CA ALA B 28 -10.203 20.006 22.771 1.00 16.71 C
ATOM 964 C ALA B 28 -10.169 20.830 21.507 1.00 16.71 C
ATOM 965 O ALA B 28 -10.993 21.708 21.276 1.00 13.44 O
ATOM 966 CB ALA B 28 -11.407 19.100 22.758 1.00 13.44 C
ATOM 967 N ASP B 29 -9.140 20.571 20.729 1.00 6.37 N
ATOM 968 CA ASP B 29 -8.960 21.262 19.460 1.00 6.37 C
ATOM 969 C ASP B 29 -9.896 20.690 18.411 1.00 6.37 C
ATOM 970 O ASP B 29 -10.439 21.421 17.577 1.00 14.77 O
ATOM 971 CB ASP B 29 -7.548 21.101 18.909 1.00 14.77 C
ATOM 972 CG ASP B 29 -6.424 21.676 19.732 1.00 14.77 C
ATOM 973 OD1 ASP B 29 -6.685 22.420 20.702 1.00 14.77 O
ATOM 974 OD2 ASP B 29 -5.263 21.357 19.403 1.00 14.77 O
ATOM 975 N ASP B 30 -10.007 19.372 18.540 1.00 8.20 N
ATOM 976 CA ASP B 30 -10.801 18.514 17.687 1.00 8.20 C
ATOM 977 C ASP B 30 -11.957 17.914 18.467 1.00 8.20 C
ATOM 978 O ASP B 30 -11.885 17.744 19.689 1.00 17.90 O
ATOM 979 CB ASP B 30 -9.893 17.407 17.137 1.00 17.90 C
ATOM 980 CG ASP B 30 -8.686 17.909 16.375 1.00 17.90 C
ATOM 981 OD1 ASP B 30 -8.876 18.681 15.417 1.00 17.90 O
ATOM 982 OD2 ASP B 30 -7.553 17.537 16.735 1.00 17.90 O
ATOM 983 N SER B 31 -12.986 17.602 17.702 1.00 7.28 N
ATOM 984 CA SER B 31 -14.212 17.013 18.196 1.00 7.28 C
ATOM 985 C SER B 31 -14.106 15.512 17.937 1.00 7.28 C
ATOM 986 O SER B 31 -13.691 15.113 16.839 1.00 13.96 O
ATOM 987 CB SER B 31 -15.395 17.623 17.446 1.00 13.96 C
ATOM 988 OG SER B 31 -15.379 19.029 17.594 1.00 13.96 O
ATOM 989 N VAL B 32 -14.440 14.678 18.907 1.00 7.76 N
ATOM 990 CA VAL B 32 -14.375 13.237 18.746 1.00 7.76 C
ATOM 991 C VAL B 32 -15.657 12.700 19.360 1.00 7.76 C
ATOM 992 O VAL B 32 -16.028 13.014 20.494 1.00 8.02 O
ATOM 993 CB VAL B 32 -13.078 12.642 19.424 1.00 8.02 C
ATOM 994 CG1 VAL B 32 -12.957 12.985 20.876 1.00 8.02 C
ATOM 995 CG2 VAL B 32 -13.117 11.138 19.243 1.00 8.02 C
ATOM 996 N VAL B 33 -16.350 11.953 18.529 1.00 11.57 N
ATOM 997 CA VAL B 33 -17.610 11.342 18.877 1.00 11.57 C
ATOM 998 C VAL B 33 -17.356 9.835 18.767 1.00 11.57 C
ATOM 999 O VAL B 33 -16.536 9.399 17.951 1.00 26.41 O
ATOM 1000 CB VAL B 33 -18.699 11.859 17.875 1.00 26.41 C
ATOM 1001 CG1 VAL B 33 -20.075 11.390 18.321 1.00 26.41 C
ATOM 1002 CG2 VAL B 33 -18.757 13.385 17.859 1.00 26.41 C
ATOM 1003 N ALA B 34 -18.003 9.037 19.598 1.00 13.79 N
ATOM 1004 CA ALA B 34 -17.846 7.586 19.585 1.00 13.79 C
ATOM 1005 C ALA B 34 -19.197 6.966 19.258 1.00 13.79 C
ATOM 1006 O ALA B 34 -20.240 7.600 19.441 1.00 22.15 O
ATOM 1007 CB ALA B 34 -17.412 7.044 20.940 1.00 22.15 C
ATOM 1008 N GLY B 35 -19.124 5.751 18.717 1.00 26.20 N
ATOM 1009 CA GLY B 35 -20.284 4.918 18.436 1.00 26.20 C
ATOM 1010 C GLY B 35 -21.340 5.437 17.474 1.00 26.20 C
ATOM 1011 O GLY B 35 -22.506 5.088 17.666 1.00 32.13 O
ATOM 1012 N ILE B 36 -20.989 6.207 16.447 1.00 39.98 N
ATOM 1013 CA ILE B 36 -21.980 6.679 15.485 1.00 39.98 C
ATOM 1014 C ILE B 36 -21.582 6.177 14.106 1.00 39.98 C
ATOM 1015 O ILE B 36 -20.394 6.021 13.804 1.00 23.71 O
ATOM 1016 CB ILE B 36 -22.121 8.244 15.387 1.00 23.71 C
ATOM 1017 CG1 ILE B 36 -20.764 8.951 15.266 1.00 23.71 C
ATOM 1018 CG2 ILE B 36 -22.926 8.694 16.589 1.00 23.71 C
ATOM 1019 CD1 ILE B 36 -20.868 10.395 14.853 1.00 23.71 C
ATOM 1020 N GLU B 37 -22.578 5.850 13.307 1.00 31.31 N
ATOM 1021 CA GLU B 37 -22.341 5.367 11.961 1.00 31.31 C
ATOM 1022 C GLU B 37 -22.309 6.635 11.120 1.00 31.31 C
ATOM 1023 O GLU B 37 -23.317 7.348 11.004 1.00 24.70 O
ATOM 1024 CB GLU B 37 -23.476 4.434 11.510 1.00 24.70 C
ATOM 1025 CG GLU B 37 -23.431 4.093 10.020 1.00 24.70 C
ATOM 1026 CD GLU B 37 -23.786 2.669 9.656 1.00 24.70 C
ATOM 1027 OE1 GLU B 37 -24.898 2.205 9.994 1.00 24.70 O
ATOM 1028 OE2 GLU B 37 -22.936 2.022 9.008 1.00 24.70 O
ATOM 1029 N LEU B 38 -21.134 6.913 10.591 1.00 21.27 N
ATOM 1030 CA LEU B 38 -20.906 8.077 9.755 1.00 21.27 C
ATOM 1031 C LEU B 38 -20.448 7.500 8.429 1.00 21.27 C
ATOM 1032 O LEU B 38 -19.607 6.594 8.415 1.00 13.98 O
ATOM 1033 CB LEU B 38 -19.816 8.961 10.339 1.00 13.98 C
ATOM 1034 CG LEU B 38 -20.099 10.451 10.377 1.00 13.98 C
ATOM 1035 CD1 LEU B 38 -21.335 10.732 11.206 1.00 13.98 C
ATOM 1036 CD2 LEU B 38 -18.919 11.154 11.011 1.00 13.98 C
ATOM 1037 N PRO B 39 -21.030 7.948 7.310 1.00 26.83 N
ATOM 1038 CA PRO B 39 -20.696 7.459 5.973 1.00 26.83 C
ATOM 1039 C PRO B 39 -19.491 8.135 5.307 1.00 26.83 C
ATOM 1040 O PRO B 39 -19.154 9.284 5.638 1.00 25.06 O
ATOM 1041 CB PRO B 39 -22.025 7.650 5.256 1.00 25.06 C
ATOM 1042 CG PRO B 39 -22.398 9.013 5.755 1.00 25.06 C
ATOM 1043 CD PRO B 39 -22.185 8.867 7.229 1.00 25.06 C
ATOM 1044 N GLY B 40 -18.869 7.423 4.369 1.00 24.14 N
ATOM 1045 CA GLY B 40 -17.796 8.010 3.595 1.00 24.14 C
ATOM 1046 C GLY B 40 -16.406 7.544 3.966 1.00 24.14 C
ATOM 1047 O GLY B 40 -16.200 6.485 4.567 1.00 31.82 O
ATOM 1048 N ARG B 41 -15.471 8.383 3.532 1.00 24.83 N
ATOM 1049 CA ARG B 41 -14.050 8.139 3.721 1.00 24.83 C
ATOM 1050 C ARG B 41 -13.486 8.761 4.986 1.00 24.83 C
ATOM 1051 O ARG B 41 -14.121 9.626 5.602 1.00 46.47 O
ATOM 1052 CB ARG B 41 -13.229 8.647 2.492 1.00 46.47 C
ATOM 1053 CG ARG B 41 -13.442 9.986 1.754 1.00 46.47 C
ATOM 1054 CD ARG B 41 -13.563 11.334 2.498 1.00 46.47 C
ATOM 1055 NE ARG B 41 -12.656 11.504 3.637 1.00 46.47 N
ATOM 1056 CZ ARG B 41 -12.128 12.642 4.089 1.00 46.47 C
ATOM 1057 NH1 ARG B 41 -12.369 13.814 3.514 1.00 46.47 N
ATOM 1058 NH2 ARG B 41 -11.380 12.587 5.181 1.00 46.47 N
ATOM 1059 N TRP B 42 -12.264 8.306 5.269 1.00 28.41 N
ATOM 1060 CA TRP B 42 -11.476 8.733 6.404 1.00 28.41 C
ATOM 1061 C TRP B 42 -9.999 8.519 6.103 1.00 28.41 C
ATOM 1062 O TRP B 42 -9.600 7.738 5.236 1.00 62.80 O
ATOM 1063 CB TRP B 42 -11.883 7.954 7.673 1.00 62.80 C
ATOM 1064 CG TRP B 42 -12.032 6.465 7.602 1.00 62.80 C
ATOM 1065 CD1 TRP B 42 -13.169 5.789 7.290 1.00 62.80 C
ATOM 1066 CD2 TRP B 42 -11.040 5.466 7.873 1.00 62.80 C
ATOM 1067 NE1 TRP B 42 -12.956 4.438 7.357 1.00 62.80 N
ATOM 1068 CE2 TRP B 42 -11.661 4.193 7.713 1.00 62.80 C
ATOM 1069 CE3 TRP B 42 -9.682 5.526 8.247 1.00 62.80 C
ATOM 1070 CZ2 TRP B 42 -10.961 2.989 7.910 1.00 62.80 C
ATOM 1071 CZ3 TRP B 42 -8.988 4.329 8.446 1.00 62.80 C
ATOM 1072 CH2 TRP B 42 -9.631 3.076 8.274 1.00 62.80 C
ATOM 1073 N LYS B 43 -9.260 9.325 6.831 1.00 26.96 N
ATOM 1074 CA LYS B 43 -7.808 9.429 6.839 1.00 26.96 C
ATOM 1075 C LYS B 43 -7.482 8.957 8.276 1.00 26.96 C
ATOM 1076 O LYS B 43 -8.325 9.142 9.173 1.00 15.95 O
ATOM 1077 CB LYS B 43 -7.529 10.901 6.560 1.00 15.95 C
ATOM 1078 CG LYS B 43 -6.167 11.540 6.759 1.00 15.95 C
ATOM 1079 CD LYS B 43 -6.423 13.045 6.700 1.00 15.95 C
ATOM 1080 CE LYS B 43 -5.284 13.941 7.174 1.00 15.95 C
ATOM 1081 NZ LYS B 43 -4.882 13.622 8.568 1.00 15.95 N
ATOM 1082 N PRO B 44 -6.355 8.282 8.587 1.00 29.03 N
ATOM 1083 CA PRO B 44 -5.869 8.097 9.968 1.00 29.03 C
ATOM 1084 C PRO B 44 -5.407 9.406 10.591 1.00 29.03 C
ATOM 1085 O PRO B 44 -4.999 10.357 9.908 1.00 28.56 O
ATOM 1086 CB PRO B 44 -4.752 7.052 9.830 1.00 28.56 C
ATOM 1087 CG PRO B 44 -5.236 6.273 8.655 1.00 28.56 C
ATOM 1088 CD PRO B 44 -5.562 7.400 7.705 1.00 28.56 C
ATOM 1089 N LYS B 45 -5.551 9.429 11.901 1.00 20.58 N
ATOM 1090 CA LYS B 45 -5.149 10.569 12.720 1.00 20.58 C
ATOM 1091 C LYS B 45 -5.049 9.907 14.110 1.00 20.58 C
ATOM 1092 O LYS B 45 -5.666 8.867 14.406 1.00 20.34 O
ATOM 1093 CB LYS B 45 -6.197 11.723 12.758 1.00 20.34 C
ATOM 1094 CG LYS B 45 -5.542 13.087 13.057 1.00 20.34 C
ATOM 1095 CD LYS B 45 -6.486 14.252 13.378 1.00 20.34 C
ATOM 1096 CE LYS B 45 -5.771 15.573 13.728 1.00 20.34 C
ATOM 1097 NZ LYS B 45 -4.898 15.507 14.945 1.00 20.34 N
ATOM 1098 N MET B 46 -4.171 10.492 14.907 1.00 14.02 N
ATOM 1099 CA MET B 46 -3.874 10.078 16.265 1.00 14.02 C
ATOM 1100 C MET B 46 -3.873 11.394 17.016 1.00 14.02 C
ATOM 1101 O MET B 46 -3.144 12.313 16.632 1.00 26.74 O
ATOM 1102 CB MET B 46 -2.529 9.397 16.236 1.00 26.74 C
ATOM 1103 CG MET B 46 -2.599 7.925 15.946 1.00 26.74 C
ATOM 1104 SD MET B 46 -1.895 6.997 17.316 1.00 26.74 S
ATOM 1105 CE MET B 46 -0.648 6.039 16.467 1.00 26.74 C
ATOM 1106 N ILE B 47 -4.745 11.493 18.016 1.00 25.78 N
ATOM 1107 CA ILE B 47 -4.900 12.694 18.854 1.00 25.78 C
ATOM 1108 C ILE B 47 -4.466 12.347 20.290 1.00 25.78 C
ATOM 1109 O ILE B 47 -4.629 11.202 20.741 1.00 16.11 O
ATOM 1110 CB ILE B 47 -6.381 13.199 18.932 1.00 16.11 C
ATOM 1111 CG1 ILE B 47 -7.362 12.035 18.986 1.00 16.11 C
ATOM 1112 CG2 ILE B 47 -6.664 14.066 17.732 1.00 16.11 C
ATOM 1113 CD1 ILE B 47 -8.582 12.308 19.807 1.00 16.11 C
ATOM 1114 N GLY B 48 -3.853 13.312 20.981 1.00 16.91 N
ATOM 1115 CA GLY B 48 -3.377 13.142 22.359 1.00 16.91 C
ATOM 1116 C GLY B 48 -4.140 13.949 23.366 1.00 16.91 C
ATOM 1117 O GLY B 48 -4.553 15.083 23.083 1.00 7.80 O
ATOM 1118 N GLY B 49 -4.322 13.248 24.461 1.00 6.00 N
ATOM 1119 CA GLY B 49 -4.934 13.753 25.655 1.00 6.00 C
ATOM 1120 C GLY B 49 -4.024 13.426 26.843 1.00 6.00 C
ATOM 1121 O GLY B 49 -2.829 13.133 26.666 1.00 16.69 O
ATOM 1122 N ILE B 50 -4.544 13.498 28.066 1.00 18.47 N
ATOM 1123 CA ILE B 50 -3.764 13.178 29.269 1.00 18.47 C
ATOM 1124 C ILE B 50 -3.815 11.647 29.371 1.00 18.47 C
ATOM 1125 O ILE B 50 -4.885 11.055 29.205 1.00 23.48 O
ATOM 1126 CB ILE B 50 -4.376 13.846 30.554 1.00 23.48 C
ATOM 1127 CG1 ILE B 50 -5.865 13.537 30.758 1.00 23.48 C
ATOM 1128 CG2 ILE B 50 -4.220 15.346 30.399 1.00 23.48 C
ATOM 1129 CD1 ILE B 50 -6.135 12.509 31.836 1.00 23.48 C
ATOM 1130 N GLY B 51 -2.703 10.970 29.594 1.00 22.12 N
ATOM 1131 CA GLY B 51 -2.727 9.514 29.569 1.00 22.12 C
ATOM 1132 C GLY B 51 -2.487 8.958 28.161 1.00 22.12 C
ATOM 1133 O GLY B 51 -2.464 7.733 27.970 1.00 24.03 O
ATOM 1134 N GLY B 52 -2.330 9.816 27.147 1.00 10.29 N
ATOM 1135 CA GLY B 52 -1.929 9.350 25.827 1.00 10.29 C
ATOM 1136 C GLY B 52 -2.859 9.587 24.655 1.00 10.29 C
ATOM 1137 O GLY B 52 -3.797 10.386 24.659 1.00 28.42 O
ATOM 1138 N PHE B 53 -2.478 8.822 23.653 1.00 19.53 N
ATOM 1139 CA PHE B 53 -3.009 8.889 22.301 1.00 19.53 C
ATOM 1140 C PHE B 53 -3.961 7.766 22.000 1.00 19.53 C
ATOM 1141 O PHE B 53 -3.819 6.643 22.497 1.00 44.91 O
ATOM 1142 CB PHE B 53 -1.962 8.707 21.162 1.00 44.91 C
ATOM 1143 CG PHE B 53 -1.422 9.802 20.263 1.00 44.91 C
ATOM 1144 CD1 PHE B 53 -1.522 11.158 20.570 1.00 44.91 C
ATOM 1145 CD2 PHE B 53 -0.716 9.463 19.093 1.00 44.91 C
ATOM 1146 CE1 PHE B 53 -0.939 12.142 19.761 1.00 44.91 C
ATOM 1147 CE2 PHE B 53 -0.125 10.439 18.281 1.00 44.91 C
ATOM 1148 CZ PHE B 53 -0.241 11.785 18.617 1.00 44.91 C
ATOM 1149 N ILE B 54 -4.839 8.116 21.082 1.00 24.58 N
ATOM 1150 CA ILE B 54 -5.820 7.170 20.596 1.00 24.58 C
ATOM 1151 C ILE B 54 -5.854 7.413 19.095 1.00 24.58 C
ATOM 1152 O ILE B 54 -5.557 8.521 18.607 1.00 15.52 O
ATOM 1153 CB ILE B 54 -7.344 7.287 21.093 1.00 15.52 C
ATOM 1154 CG1 ILE B 54 -7.932 8.704 20.958 1.00 15.52 C
ATOM 1155 CG2 ILE B 54 -7.381 6.743 22.519 1.00 15.52 C
ATOM 1156 CD1 ILE B 54 -9.437 8.764 21.219 1.00 15.52 C
ATOM 1157 N LYS B 55 -6.166 6.321 18.411 1.00 12.57 N
ATOM 1158 CA LYS B 55 -6.255 6.325 16.962 1.00 12.57 C
ATOM 1159 C LYS B 55 -7.738 6.360 16.692 1.00 12.57 C
ATOM 1160 O LYS B 55 -8.516 5.555 17.225 1.00 26.15 O
ATOM 1161 CB LYS B 55 -5.671 5.051 16.320 1.00 26.15 C
ATOM 1162 CG LYS B 55 -5.040 5.400 14.972 1.00 26.15 C
ATOM 1163 CD LYS B 55 -4.693 4.246 14.043 1.00 26.15 C
ATOM 1164 CE LYS B 55 -5.939 3.633 13.423 1.00 26.15 C
ATOM 1165 NZ LYS B 55 -6.738 4.622 12.624 1.00 26.15 N
ATOM 1166 N VAL B 56 -8.036 7.348 15.884 1.00 15.06 N
ATOM 1167 CA VAL B 56 -9.393 7.633 15.469 1.00 15.06 C
ATOM 1168 C VAL B 56 -9.359 7.800 13.951 1.00 15.06 C
ATOM 1169 O VAL B 56 -8.292 7.740 13.314 1.00 11.24 O
ATOM 1170 CB VAL B 56 -9.897 8.956 16.137 1.00 11.24 C
ATOM 1171 CG1 VAL B 56 -9.913 8.821 17.643 1.00 11.24 C
ATOM 1172 CG2 VAL B 56 -8.968 10.106 15.802 1.00 11.24 C
ATOM 1173 N ARG B 57 -10.537 8.044 13.403 1.00 11.59 N
ATOM 1174 CA ARG B 57 -10.727 8.249 11.973 1.00 11.59 C
ATOM 1175 C ARG B 57 -11.181 9.673 11.691 1.00 11.59 C
ATOM 1176 O ARG B 57 -12.162 10.114 12.304 1.00 27.37 O
ATOM 1177 CB ARG B 57 -11.775 7.258 11.488 1.00 27.37 C
ATOM 1178 CG ARG B 57 -11.359 5.806 11.615 1.00 27.37 C
ATOM 1179 CD ARG B 57 -12.539 4.914 11.965 1.00 27.37 C
ATOM 1180 NE ARG B 57 -12.541 4.568 13.391 1.00 27.37 N
ATOM 1181 CZ ARG B 57 -12.575 3.317 13.858 1.00 27.37 C
ATOM 1182 NH1 ARG B 57 -12.617 2.266 13.023 1.00 27.37 N
ATOM 1183 NH2 ARG B 57 -12.518 3.106 15.171 1.00 27.37 N
ATOM 1184 N GLN B 58 -10.472 10.378 10.806 1.00 11.23 N
ATOM 1185 CA GLN B 58 -10.804 11.756 10.450 1.00 11.23 C
ATOM 1186 C GLN B 58 -11.805 11.795 9.305 1.00 11.23 C
ATOM 1187 O GLN B 58 -11.484 11.382 8.176 1.00 17.85 O
ATOM 1188 CB GLN B 58 -9.530 12.540 10.042 1.00 17.85 C
ATOM 1189 CG GLN B 58 -9.824 14.011 9.750 1.00 17.85 C
ATOM 1190 CD GLN B 58 -8.652 14.933 9.427 1.00 17.85 C
ATOM 1191 OE1 GLN B 58 -8.829 15.934 8.732 1.00 17.85 O
ATOM 1192 NE2 GLN B 58 -7.444 14.700 9.909 1.00 17.85 N
ATOM 1193 N TYR B 59 -13.009 12.242 9.637 1.00 8.40 N
ATOM 1194 CA TYR B 59 -14.096 12.365 8.670 1.00 8.40 C
ATOM 1195 C TYR B 59 -14.243 13.870 8.441 1.00 8.40 C
ATOM 1196 O TYR B 59 -14.269 14.655 9.402 1.00 27.24 O
ATOM 1197 CB TYR B 59 -15.408 11.825 9.212 1.00 27.24 C
ATOM 1198 CG TYR B 59 -15.647 10.342 9.140 1.00 27.24 C
ATOM 1199 CD1 TYR B 59 -15.160 9.460 10.119 1.00 27.24 C
ATOM 1200 CD2 TYR B 59 -16.457 9.831 8.119 1.00 27.24 C
ATOM 1201 CE1 TYR B 59 -15.510 8.102 10.094 1.00 27.24 C
ATOM 1202 CE2 TYR B 59 -16.805 8.480 8.094 1.00 27.24 C
ATOM 1203 CZ TYR B 59 -16.331 7.619 9.076 1.00 27.24 C
ATOM 1204 OH TYR B 59 -16.750 6.309 9.077 1.00 27.24 O
ATOM 1205 N ASP B 60 -14.295 14.293 7.188 1.00 38.94 N
ATOM 1206 CA ASP B 60 -14.428 15.705 6.848 1.00 38.94 C
ATOM 1207 C ASP B 60 -15.831 15.971 6.343 1.00 38.94 C
ATOM 1208 O ASP B 60 -16.555 15.046 5.971 1.00 25.44 O
ATOM 1209 CB ASP B 60 -13.478 16.131 5.723 1.00 25.44 C
ATOM 1210 CG ASP B 60 -12.014 16.253 6.067 1.00 25.44 C
ATOM 1211 OD1 ASP B 60 -11.506 15.440 6.871 1.00 25.44 O
ATOM 1212 OD2 ASP B 60 -11.375 17.172 5.507 1.00 25.44 O
ATOM 1213 N GLN B 61 -16.136 17.266 6.351 1.00 6.00 N
ATOM 1214 CA GLN B 61 -17.414 17.812 5.894 1.00 6.00 C
ATOM 1215 C GLN B 61 -18.660 17.043 6.331 1.00 6.00 C
ATOM 1216 O GLN B 61 -19.474 16.550 5.541 1.00 41.71 O
ATOM 1217 CB GLN B 61 -17.339 17.917 4.359 1.00 41.71 C
ATOM 1218 CG GLN B 61 -16.275 18.886 3.861 1.00 41.71 C
ATOM 1219 CD GLN B 61 -15.787 18.572 2.461 1.00 41.71 C
ATOM 1220 OE1 GLN B 61 -15.109 17.564 2.250 1.00 41.71 O
ATOM 1221 NE2 GLN B 61 -16.111 19.411 1.491 1.00 41.71 N
ATOM 1222 N ILE B 62 -18.770 16.961 7.649 1.00 7.59 N
ATOM 1223 CA ILE B 62 -19.888 16.283 8.289 1.00 7.59 C
ATOM 1224 C ILE B 62 -20.693 17.427 8.876 1.00 7.59 C
ATOM 1225 O ILE B 62 -20.114 18.381 9.398 1.00 11.61 O
ATOM 1226 CB ILE B 62 -19.434 15.360 9.414 1.00 11.61 C
ATOM 1227 CG1 ILE B 62 -18.391 14.358 8.898 1.00 11.61 C
ATOM 1228 CG2 ILE B 62 -20.664 14.675 9.975 1.00 11.61 C
ATOM 1229 CD1 ILE B 62 -18.840 13.449 7.762 1.00 11.61 C
ATOM 1230 N LEU B 63 -21.995 17.347 8.686 1.00 12.82 N
ATOM 1231 CA LEU B 63 -22.941 18.337 9.172 1.00 12.82 C
ATOM 1232 C LEU B 63 -23.233 17.934 10.598 1.00 12.82 C
ATOM 1233 O LEU B 63 -23.398 16.737 10.870 1.00 10.70 O
ATOM 1234 CB LEU B 63 -24.227 18.295 8.352 1.00 10.70 C
ATOM 1235 CG LEU B 63 -25.401 19.187 8.778 1.00 10.70 C
ATOM 1236 CD1 LEU B 63 -25.039 20.664 8.645 1.00 10.70 C
ATOM 1237 CD2 LEU B 63 -26.594 18.829 7.924 1.00 10.70 C
ATOM 1238 N ILE B 64 -23.302 18.926 11.466 1.00 7.28 N
ATOM 1239 CA ILE B 64 -23.567 18.746 12.887 1.00 7.28 C
ATOM 1240 C ILE B 64 -24.558 19.832 13.299 1.00 7.28 C
ATOM 1241 O ILE B 64 -24.488 20.962 12.801 1.00 8.52 O
ATOM 1242 CB ILE B 64 -22.337 18.984 13.805 1.00 8.52 C
ATOM 1243 CG1 ILE B 64 -21.003 18.693 13.124 1.00 8.52 C
ATOM 1244 CG2 ILE B 64 -22.497 18.060 15.007 1.00 8.52 C
ATOM 1245 CD1 ILE B 64 -20.659 17.245 12.820 1.00 8.52 C
ATOM 1246 N GLU B 65 -25.504 19.506 14.156 1.00 10.06 N
ATOM 1247 CA GLU B 65 -26.471 20.479 14.638 1.00 10.06 C
ATOM 1248 C GLU B 65 -26.176 20.352 16.122 1.00 10.06 C
ATOM 1249 O GLU B 65 -26.398 19.292 16.719 1.00 11.84 O
ATOM 1250 CB GLU B 65 -27.915 20.091 14.369 1.00 11.84 C
ATOM 1251 CG GLU B 65 -28.297 20.187 12.921 1.00 11.84 C
ATOM 1252 CD GLU B 65 -29.796 20.043 12.696 1.00 11.84 C
ATOM 1253 OE1 GLU B 65 -30.553 20.967 13.080 1.00 11.84 O
ATOM 1254 OE2 GLU B 65 -30.225 19.024 12.108 1.00 11.84 O
ATOM 1255 N ILE B 66 -25.592 21.392 16.691 1.00 17.16 N
ATOM 1256 CA ILE B 66 -25.222 21.448 18.108 1.00 17.16 C
ATOM 1257 C ILE B 66 -26.229 22.408 18.719 1.00 17.16 C
ATOM 1258 O ILE B 66 -26.214 23.596 18.361 1.00 15.73 O
ATOM 1259 CB ILE B 66 -23.803 22.027 18.309 1.00 15.73 C
ATOM 1260 CG1 ILE B 66 -22.764 21.308 17.446 1.00 15.73 C
ATOM 1261 CG2 ILE B 66 -23.442 21.870 19.777 1.00 15.73 C
ATOM 1262 CD1 ILE B 66 -21.432 22.031 17.387 1.00 15.73 C
ATOM 1263 N CYS B 67 -27.109 21.876 19.564 1.00 25.47 N
ATOM 1264 CA CYS B 67 -28.157 22.635 20.253 1.00 25.47 C
ATOM 1265 C CYS B 67 -28.867 23.604 19.292 1.00 25.47 C
ATOM 1266 O CYS B 67 -28.857 24.834 19.443 1.00 32.04 O
ATOM 1267 CB CYS B 67 -27.526 23.397 21.431 1.00 32.04 C
ATOM 1268 SG CYS B 67 -28.702 24.318 22.460 1.00 32.04 S
ATOM 1269 N GLY B 68 -29.382 23.010 18.219 1.00 10.82 N
ATOM 1270 CA GLY B 68 -30.104 23.742 17.195 1.00 10.82 C
ATOM 1271 C GLY B 68 -29.297 24.803 16.475 1.00 10.82 C
ATOM 1272 O GLY B 68 -29.879 25.799 16.060 1.00 15.78 O
ATOM 1273 N HIS B 69 -27.973 24.688 16.351 1.00 13.64 N
ATOM 1274 CA HIS B 69 -27.145 25.610 15.561 1.00 13.64 C
ATOM 1275 C HIS B 69 -26.451 24.702 14.526 1.00 13.64 C
ATOM 1276 O HIS B 69 -25.996 23.617 14.899 1.00 35.41 O
ATOM 1277 CB HIS B 69 -26.092 26.323 16.451 1.00 35.41 C
ATOM 1278 CG HIS B 69 -26.554 27.310 17.491 1.00 35.41 C
ATOM 1279 ND1 HIS B 69 -27.622 27.145 18.349 1.00 35.41 N
ATOM 1280 CD2 HIS B 69 -26.037 28.520 17.829 1.00 35.41 C
ATOM 1281 CE1 HIS B 69 -27.760 28.173 19.159 1.00 35.41 C
ATOM 1282 NE2 HIS B 69 -26.800 29.020 18.855 1.00 35.41 N
ATOM 1283 N LYS B 70 -26.420 25.118 13.255 1.00 17.95 N
ATOM 1284 CA LYS B 70 -25.819 24.408 12.119 1.00 17.95 C
ATOM 1285 C LYS B 70 -24.332 24.704 11.937 1.00 17.95 C
ATOM 1286 O LYS B 70 -23.935 25.877 11.924 1.00 26.12 O
ATOM 1287 CB LYS B 70 -26.510 24.795 10.815 1.00 26.12 C
ATOM 1288 CG LYS B 70 -27.961 24.419 10.669 1.00 26.12 C
ATOM 1289 CD LYS B 70 -28.114 22.958 10.321 1.00 26.12 C
ATOM 1290 CE LYS B 70 -29.581 22.632 10.090 1.00 26.12 C
ATOM 1291 NZ LYS B 70 -30.217 23.521 9.074 1.00 26.12 N
ATOM 1292 N ALA B 71 -23.563 23.648 11.711 1.00 6.58 N
ATOM 1293 CA ALA B 71 -22.129 23.697 11.514 1.00 6.58 C
ATOM 1294 C ALA B 71 -21.756 22.515 10.634 1.00 6.58 C
ATOM 1295 O ALA B 71 -22.509 21.538 10.585 1.00 10.05 O
ATOM 1296 CB ALA B 71 -21.412 23.573 12.850 1.00 10.05 C
ATOM 1297 N ILE B 72 -20.629 22.629 9.935 1.00 16.50 N
ATOM 1298 CA ILE B 72 -20.060 21.614 9.038 1.00 16.50 C
ATOM 1299 C ILE B 72 -18.569 21.724 9.352 1.00 16.50 C
ATOM 1300 O ILE B 72 -18.019 22.826 9.257 1.00 14.07 O
ATOM 1301 CB ILE B 72 -20.244 21.890 7.510 1.00 14.07 C
ATOM 1302 CG1 ILE B 72 -21.701 21.603 7.168 1.00 14.07 C
ATOM 1303 CG2 ILE B 72 -19.345 20.993 6.643 1.00 14.07 C
ATOM 1304 CD1 ILE B 72 -22.055 21.547 5.706 1.00 14.07 C
ATOM 1305 N GLY B 73 -17.947 20.615 9.725 1.00 6.00 N
ATOM 1306 CA GLY B 73 -16.544 20.599 10.103 1.00 6.00 C
ATOM 1307 C GLY B 73 -16.021 19.187 10.193 1.00 6.00 C
ATOM 1308 O GLY B 73 -16.643 18.257 9.671 1.00 12.60 O
ATOM 1309 N THR B 74 -14.886 19.023 10.840 1.00 13.38 N
ATOM 1310 CA THR B 74 -14.236 17.727 10.982 1.00 13.38 C
ATOM 1311 C THR B 74 -14.651 17.039 12.283 1.00 13.38 C
ATOM 1312 O THR B 74 -14.637 17.650 13.367 1.00 11.60 O
ATOM 1313 CB THR B 74 -12.699 17.909 10.966 1.00 11.60 C
ATOM 1314 OG1 THR B 74 -12.342 18.899 9.983 1.00 11.60 O
ATOM 1315 CG2 THR B 74 -12.003 16.612 10.607 1.00 11.60 C
ATOM 1316 N VAL B 75 -14.988 15.764 12.139 1.00 8.07 N
ATOM 1317 CA VAL B 75 -15.408 14.906 13.227 1.00 8.07 C
ATOM 1318 C VAL B 75 -14.550 13.660 13.188 1.00 8.07 C
ATOM 1319 O VAL B 75 -14.383 13.039 12.136 1.00 6.21 O
ATOM 1320 CB VAL B 75 -16.903 14.517 13.099 1.00 6.21 C
ATOM 1321 CG1 VAL B 75 -17.331 13.383 14.023 1.00 6.21 C
ATOM 1322 CG2 VAL B 75 -17.689 15.723 13.584 1.00 6.21 C
ATOM 1323 N LEU B 76 -13.966 13.394 14.339 1.00 16.45 N
ATOM 1324 CA LEU B 76 -13.107 12.243 14.550 1.00 16.45 C
ATOM 1325 C LEU B 76 -14.032 11.248 15.212 1.00 16.45 C
ATOM 1326 O LEU B 76 -14.849 11.637 16.050 1.00 8.51 O
ATOM 1327 CB LEU B 76 -11.945 12.552 15.494 1.00 8.51 C
ATOM 1328 CG LEU B 76 -10.911 13.558 14.994 1.00 8.51 C
ATOM 1329 CD1 LEU B 76 -9.915 13.801 16.091 1.00 8.51 C
ATOM 1330 CD2 LEU B 76 -10.180 13.034 13.780 1.00 8.51 C
ATOM 1331 N VAL B 77 -13.963 10.005 14.794 1.00 6.81 N
ATOM 1332 CA VAL B 77 -14.793 8.937 15.355 1.00 6.81 C
ATOM 1333 C VAL B 77 -13.784 7.912 15.881 1.00 6.81 C
ATOM 1334 O VAL B 77 -12.766 7.662 15.211 1.00 15.30 O
ATOM 1335 CB VAL B 77 -15.701 8.304 14.270 1.00 15.30 C
ATOM 1336 CG1 VAL B 77 -16.631 7.311 14.941 1.00 15.30 C
ATOM 1337 CG2 VAL B 77 -16.582 9.349 13.585 1.00 15.30 C
ATOM 1338 N GLY B 78 -14.016 7.371 17.070 1.00 7.87 N
ATOM 1339 CA GLY B 78 -13.110 6.384 17.639 1.00 7.87 C
ATOM 1340 C GLY B 78 -13.279 6.190 19.142 1.00 7.87 C
ATOM 1341 O GLY B 78 -14.268 6.711 19.685 1.00 22.17 O
ATOM 1342 N PRO B 79 -12.356 5.484 19.864 1.00 9.24 N
ATOM 1343 CA PRO B 79 -12.463 5.083 21.280 1.00 9.24 C
ATOM 1344 C PRO B 79 -12.696 6.098 22.414 1.00 9.24 C
ATOM 1345 O PRO B 79 -12.242 5.814 23.535 1.00 23.95 O
ATOM 1346 CB PRO B 79 -11.177 4.270 21.502 1.00 23.95 C
ATOM 1347 CG PRO B 79 -10.956 3.671 20.175 1.00 23.95 C
ATOM 1348 CD PRO B 79 -11.110 4.895 19.332 1.00 23.95 C
ATOM 1349 N THR B 80 -13.385 7.235 22.264 1.00 12.72 N
ATOM 1350 CA THR B 80 -13.572 8.182 23.372 1.00 12.72 C
ATOM 1351 C THR B 80 -14.602 7.692 24.375 1.00 12.72 C
ATOM 1352 O THR B 80 -15.515 6.951 24.031 1.00 16.31 O
ATOM 1353 CB THR B 80 -13.996 9.596 22.875 1.00 16.31 C
ATOM 1354 OG1 THR B 80 -14.101 10.425 24.037 1.00 16.31 O
ATOM 1355 CG2 THR B 80 -15.316 9.622 22.137 1.00 16.31 C
ATOM 1356 N PRO B 81 -14.389 8.037 25.653 1.00 21.56 N
ATOM 1357 CA PRO B 81 -15.356 7.870 26.740 1.00 21.56 C
ATOM 1358 C PRO B 81 -16.610 8.733 26.641 1.00 21.56 C
ATOM 1359 O PRO B 81 -17.706 8.254 26.938 1.00 15.15 O
ATOM 1360 CB PRO B 81 -14.550 8.158 28.014 1.00 15.15 C
ATOM 1361 CG PRO B 81 -13.220 7.650 27.618 1.00 15.15 C
ATOM 1362 CD PRO B 81 -13.085 8.327 26.280 1.00 15.15 C
ATOM 1363 N VAL B 82 -16.430 10.007 26.299 1.00 17.96 N
ATOM 1364 CA VAL B 82 -17.543 10.941 26.181 1.00 17.96 C
ATOM 1365 C VAL B 82 -17.376 11.657 24.855 1.00 17.96 C
ATOM 1366 O VAL B 82 -16.244 11.849 24.410 1.00 23.62 O
ATOM 1367 CB VAL B 82 -17.584 12.033 27.307 1.00 23.62 C
ATOM 1368 CG1 VAL B 82 -17.863 11.360 28.643 1.00 23.62 C
ATOM 1369 CG2 VAL B 82 -16.262 12.780 27.409 1.00 23.62 C
ATOM 1370 N ASN B 83 -18.489 12.035 24.252 1.00 16.89 N
ATOM 1371 CA ASN B 83 -18.485 12.729 22.979 1.00 16.89 C
ATOM 1372 C ASN B 83 -18.074 14.144 23.322 1.00 16.89 C
ATOM 1373 O ASN B 83 -18.635 14.752 24.235 1.00 8.82 O
ATOM 1374 CB ASN B 83 -19.879 12.651 22.365 1.00 8.82 C
ATOM 1375 CG ASN B 83 -20.306 11.244 21.989 1.00 8.82 C
ATOM 1376 OD1 ASN B 83 -19.493 10.343 21.779 1.00 8.82 O
ATOM 1377 ND2 ASN B 83 -21.594 11.009 21.898 1.00 8.82 N
ATOM 1378 N ILE B 84 -17.051 14.591 22.612 1.00 12.32 N
ATOM 1379 CA ILE B 84 -16.412 15.894 22.724 1.00 12.32 C
ATOM 1380 C ILE B 84 -16.642 16.793 21.505 1.00 12.32 C
ATOM 1381 O ILE B 84 -16.378 16.358 20.375 1.00 9.73 O
ATOM 1382 CB ILE B 84 -14.904 15.609 22.934 1.00 9.73 C
ATOM 1383 CG1 ILE B 84 -14.699 14.878 24.255 1.00 9.73 C
ATOM 1384 CG2 ILE B 84 -14.117 16.899 22.931 1.00 9.73 C
ATOM 1385 CD1 ILE B 84 -13.401 14.106 24.292 1.00 9.73 C
ATOM 1386 N ILE B 85 -17.105 18.028 21.720 1.00 6.00 N
ATOM 1387 CA ILE B 85 -17.373 19.038 20.694 1.00 6.00 C
ATOM 1388 C ILE B 85 -16.245 19.988 21.046 1.00 6.00 C
ATOM 1389 O ILE B 85 -16.293 20.617 22.096 1.00 7.34 O
ATOM 1390 CB ILE B 85 -18.717 19.775 20.895 1.00 7.34 C
ATOM 1391 CG1 ILE B 85 -19.854 18.788 20.687 1.00 7.34 C
ATOM 1392 CG2 ILE B 85 -18.858 20.931 19.925 1.00 7.34 C
ATOM 1393 CD1 ILE B 85 -19.962 18.111 19.321 1.00 7.34 C
ATOM 1394 N GLY B 86 -15.223 19.993 20.225 1.00 6.73 N
ATOM 1395 CA GLY B 86 -14.051 20.799 20.443 1.00 6.73 C
ATOM 1396 C GLY B 86 -14.151 22.118 19.718 1.00 6.73 C
ATOM 1397 O GLY B 86 -15.121 22.427 19.013 1.00 12.03 O
ATOM 1398 N ARG B 87 -13.085 22.878 19.851 1.00 12.56 N
ATOM 1399 CA ARG B 87 -13.009 24.217 19.317 1.00 12.56 C
ATOM 1400 C ARG B 87 -13.239 24.319 17.824 1.00 12.56 C
ATOM 1401 O ARG B 87 -13.847 25.313 17.427 1.00 12.88 O
ATOM 1402 CB ARG B 87 -11.669 24.833 19.672 1.00 12.88 C
ATOM 1403 CG ARG B 87 -11.607 25.252 21.130 1.00 12.88 C
ATOM 1404 CD ARG B 87 -10.409 26.120 21.484 1.00 12.88 C
ATOM 1405 NE ARG B 87 -9.107 25.513 21.190 1.00 12.88 N
ATOM 1406 CZ ARG B 87 -8.428 25.695 20.049 1.00 12.88 C
ATOM 1407 NH1 ARG B 87 -8.904 26.464 19.072 1.00 12.88 N