From 84ed95682d8ce783feb70f343a3a62d6272d703d Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 20 Feb 2024 10:17:03 -0800 Subject: [PATCH 01/33] add colabfold --- tools/colabfold/colabfold_alphafold.xml | 189 +++ tools/colabfold/colabfold_msa.xml | 127 ++ tools/colabfold/test-data/test.a3m | 39 + tools/colabfold/test-data/test.fasta | 2 + tools/colabfold/test-data/test.pdb | 1436 +++++++++++++++++++++++ tools/colabfold/test-data/test_2.pdb | 1436 +++++++++++++++++++++++ 6 files changed, 3229 insertions(+) create mode 100644 tools/colabfold/colabfold_alphafold.xml create mode 100644 tools/colabfold/colabfold_msa.xml create mode 100644 tools/colabfold/test-data/test.a3m create mode 100644 tools/colabfold/test-data/test.fasta create mode 100644 tools/colabfold/test-data/test.pdb create mode 100644 tools/colabfold/test-data/test_2.pdb diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml new file mode 100644 index 00000000000..50455cbdadc --- /dev/null +++ b/tools/colabfold/colabfold_alphafold.xml @@ -0,0 +1,189 @@ + + This tool runs the alphafold step of the collabfold tool in Galaxy + + 1.5.3 + 12.2.2 + 1 + + + ghcr.io/sokrypton/colabfold:@VERSION@-cuda@CUDA_VERSION@ + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + +
+ + + + +
+ + + + + + + + + + + + + + output_options['save_all'] == "--save-all" + + + + + + + + + + + + + + + + + + + + + + + + + +
+ + + + +
+ + + + + + + + + + 10.1038/s41592-022-01488-1 + + \ No newline at end of file diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml new file mode 100644 index 00000000000..4862ce9cd24 --- /dev/null +++ b/tools/colabfold/colabfold_msa.xml @@ -0,0 +1,127 @@ + + This tool runs the alphafold step of the collabfold tool in Galaxy + + 1.5.3 + 12.2.2 + 1 + + + + + + + + + + + + + + + + + + + + ghcr.io/sokrypton/colabfold:@VERSION@-cuda@CUDA_VERSION@ + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + 10.1038/s41592-022-01488-1 + + \ No newline at end of file diff --git a/tools/colabfold/test-data/test.a3m b/tools/colabfold/test-data/test.a3m new file mode 100644 index 00000000000..c1b01db4382 --- /dev/null +++ b/tools/colabfold/test-data/test.a3m @@ -0,0 +1,39 @@ +#38 1 +>101 +MIPIKRSSRRWKKKGRMRWKWYKKRLRRLKRERKRARS +>UniRef100_N6VR80 62 0.971 1.153E-09 3 37 38 17 51 52 +---IKRSSRRWKKKGRMRWKWYKKRLRRLKRERRRARS +>UniRef100_A0A534JJZ5 55 0.722 4.940E-07 3 37 38 0 35 80 +---MKRSSRAWKKRGKMRWKWRKKRMRRRKREQKlRART +>UniRef100_A0A8T5HQN6 54 0.647 9.355E-07 3 36 38 14 47 48 +---MKRSSRRWKKKGQMRWKWQRKRMKKEKRKRAKSR- +>UniRef100_A0A2E4RG04 53 0.666 1.772E-06 3 35 38 36 68 71 +---MKRGSRAWKKQGNQRWKWRKKKLRRRKASRKRA-- +>UniRef100_R1E4G0 53 0.617 2.438E-06 3 36 38 0 33 38 +---MRRSSRRWKKYLRSRWKWQRRRIREEKRLRKIAR- +>UniRef100_A0A397WLW3 53 0.676 2.438E-06 3 36 38 0 33 38 +---MKRSSRRWKKYKRSRWKWQKKRMKEEKRLRKLAR- +>UniRef100_A0A2K3J9R6 52 0.700 4.619E-06 3 32 38 0 29 32 +---MKRSSRVWKKRHKMRWKWRKKRMRREKRSR----- +>UniRef100_A6VJM7 51 0.862 8.751E-06 3 31 38 5 33 39 +---IKRSSRRWKKKGQMRWKHYKKRIRRMKRE------ +>UniRef100_A0A7M3WK46 51 0.666 8.751E-06 3 35 38 30 62 66 +---MKRGSRAWKKQGKQRWKWRKKKLRRRKAARKRA-- +>UniRef100_A0A915SG42 51 0.617 1.205E-05 3 36 38 0 33 38 +---MKRSSRRWKKYLRSRWKWQRRRIREEKRLRKVTR- +>UniRef100_A0A510BD48 51 0.900 1.205E-05 3 32 38 31 60 64 +---IKRSSRRWKKKGRMRWRHYKKRLRRRKRER----- +>UniRef100_A0A075M0T1 50 0.638 1.658E-05 1 36 38 22 57 61 +-VIMKRRPRKWKKKGRMRWKWLKKRIRRLKRQHRKER- +>UniRef100_A4FYQ5 48 0.851 8.201E-05 3 29 38 5 31 39 +---IKRSSRRWKKKGQMRWKHYKKRIRRMK-------- +>UniRef100_A0A8J7USD9 48 0.888 8.201E-05 3 29 38 13 39 47 +---IKRSSRRWKKKGQMRWKHYKKRLRRMK-------- +>UniRef100_A0A2K3JJ52 48 0.700 1.129E-04 3 32 38 0 29 34 +---MKRSSRVWKKRRKMRWKWRKKRMRREKRMR----- +>UniRef100_A6UVG5 48 0.821 1.129E-04 3 30 38 9 36 42 +---IKRSSRRWKKKGQMRWSHYKKRIRRMKR------- +>UniRef100_A0A5E4HZQ2 43 0.750 7.251E-03 7 34 38 25 52 58 +-------PRKWKKKGRMRWKWVKKRRKRLKRKIKR--- +>UniRef100_A0A2H6JYE4 36 0.566 1.234E+00 4 33 38 3 32 37 +----KHSSRKWKKRGKCRWKTRKKKLKERRRQRK---- \ No newline at end of file diff --git a/tools/colabfold/test-data/test.fasta b/tools/colabfold/test-data/test.fasta new file mode 100644 index 00000000000..5cefe1c3817 --- /dev/null +++ b/tools/colabfold/test-data/test.fasta @@ -0,0 +1,2 @@ +>testing +MIPIKRSSRRWKKKGRMRWKWYKKRLRRLKRERKRARS diff --git a/tools/colabfold/test-data/test.pdb b/tools/colabfold/test-data/test.pdb new file mode 100644 index 00000000000..5228267a3ff --- /dev/null +++ b/tools/colabfold/test-data/test.pdb @@ -0,0 +1,1436 @@ +HEADER HYDROLASE 19-MAY-97 1AKI +TITLE THE STRUCTURE OF THE ORTHORHOMBIC FORM OF HEN EGG-WHITE +TITLE 2 LYSOZYME AT 1.5 ANGSTROMS RESOLUTION +COMPND MOL_ID: 1; +COMPND 2 MOLECULE: LYSOZYME; +COMPND 3 CHAIN: A; +COMPND 4 EC: 3.2.1.17 +SOURCE MOL_ID: 1; +SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; +SOURCE 3 ORGANISM_COMMON: CHICKEN; +SOURCE 4 ORGANISM_TAXID: 9031; +SOURCE 5 CELL: EGG +KEYWDS HYDROLASE, GLYCOSIDASE +EXPDTA X-RAY DIFFRACTION +AUTHOR D.CARTER,J.HE,J.R.RUBLE,B.WRIGHT +REVDAT 2 24-FEB-09 1AKI 1 VERSN +REVDAT 1 19-NOV-97 1AKI 0 +JRNL AUTH P.J.ARTYMIUK,C.C.F.BLAKE,D.W.RICE,K.S.WILSON +JRNL TITL THE STRUCTURES OF THE MONOCLINIC AND ORTHORHOMBIC +JRNL TITL 2 FORMS OF HEN EGG-WHITE LYSOZYME AT 6 ANGSTROMS +JRNL TITL 3 RESOLUTION +JRNL REF ACTA CRYSTALLOGR.,SECT.B V. 38 778 1982 +JRNL REFN ISSN 0108-7681 +REMARK 1 +REMARK 2 +REMARK 2 RESOLUTION. 1.50 ANGSTROMS. +REMARK 3 +REMARK 3 REFINEMENT. +REMARK 3 PROGRAM : GPRLSA, X-PLOR +REMARK 3 AUTHORS : FUREY +REMARK 3 +REMARK 3 DATA USED IN REFINEMENT. +REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.50 +REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 10.00 +REMARK 3 DATA CUTOFF (SIGMA(F)) : 1.000 +REMARK 3 COMPLETENESS FOR RANGE (%) : 91.1 +REMARK 3 NUMBER OF REFLECTIONS : 16327 +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 + TEST SET) : NULL +REMARK 3 R VALUE (WORKING SET) : 0.212 +REMARK 3 FREE R VALUE : NULL +REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL +REMARK 3 FREE R VALUE TEST SET COUNT : NULL +REMARK 3 +REMARK 3 FIT/AGREEMENT OF MODEL WITH ALL DATA. +REMARK 3 R VALUE (WORKING + TEST SET, NO CUTOFF) : NULL +REMARK 3 R VALUE (WORKING SET, NO CUTOFF) : NULL +REMARK 3 FREE R VALUE (NO CUTOFF) : NULL +REMARK 3 FREE R VALUE TEST SET SIZE (%, NO CUTOFF) : NULL +REMARK 3 FREE R VALUE TEST SET COUNT (NO CUTOFF) : NULL +REMARK 3 TOTAL NUMBER OF REFLECTIONS (NO CUTOFF) : NULL +REMARK 3 +REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. +REMARK 3 PROTEIN ATOMS : 1001 +REMARK 3 NUCLEIC ACID ATOMS : 0 +REMARK 3 HETEROGEN ATOMS : 0 +REMARK 3 SOLVENT ATOMS : 78 +REMARK 3 +REMARK 3 B VALUES. +REMARK 3 FROM WILSON PLOT (A**2) : NULL +REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL +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) : 10.00 +REMARK 3 +REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. +REMARK 3 DISTANCE RESTRAINTS. RMS SIGMA +REMARK 3 BOND LENGTH (A) : 0.009 ; 0.010 +REMARK 3 ANGLE DISTANCE (A) : 0.003 ; 0.025 +REMARK 3 INTRAPLANAR 1-4 DISTANCE (A) : 0.024 ; 0.020 +REMARK 3 H-BOND OR METAL COORDINATION (A) : NULL ; NULL +REMARK 3 +REMARK 3 PLANE RESTRAINT (A) : 0.033 ; 0.030 +REMARK 3 CHIRAL-CENTER RESTRAINT (A**3) : 0.212 ; 0.200 +REMARK 3 +REMARK 3 NON-BONDED CONTACT RESTRAINTS. +REMARK 3 SINGLE TORSION (A) : 0.183 ; 0.300 +REMARK 3 MULTIPLE TORSION (A) : 0.159 ; 0.300 +REMARK 3 H-BOND (X...Y) (A) : 0.299 ; 0.300 +REMARK 3 H-BOND (X-H...Y) (A) : NULL ; NULL +REMARK 3 +REMARK 3 CONFORMATIONAL TORSION ANGLE RESTRAINTS. +REMARK 3 SPECIFIED (DEGREES) : NULL ; NULL +REMARK 3 PLANAR (DEGREES) : 7.900 ; 5.000 +REMARK 3 STAGGERED (DEGREES) : 17.800; 15.000 +REMARK 3 TRANSVERSE (DEGREES) : 18.900; 15.000 +REMARK 3 +REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA +REMARK 3 MAIN-CHAIN BOND (A**2) : 2.500 ; 3.000 +REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.900 ; 4.000 +REMARK 3 SIDE-CHAIN BOND (A**2) : 3.200 ; 4.000 +REMARK 3 SIDE-CHAIN ANGLE (A**2) : 3.600 ; 3.000 +REMARK 3 +REMARK 3 OTHER REFINEMENT REMARKS: NULL +REMARK 4 +REMARK 4 1AKI 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 : NOV-95 +REMARK 200 TEMPERATURE (KELVIN) : 298 +REMARK 200 PH : 4.48 +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 : GRAPHITE(002) +REMARK 200 OPTICS : NULL +REMARK 200 +REMARK 200 DETECTOR TYPE : IMAGE PLATE +REMARK 200 DETECTOR MANUFACTURER : RIGAKU RAXIS IIC +REMARK 200 INTENSITY-INTEGRATION SOFTWARE : RIGAKU +REMARK 200 DATA SCALING SOFTWARE : BIOTEX +REMARK 200 +REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 20571 +REMARK 200 RESOLUTION RANGE HIGH (A) : 1.500 +REMARK 200 RESOLUTION RANGE LOW (A) : 15.000 +REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 1.000 +REMARK 200 +REMARK 200 OVERALL. +REMARK 200 COMPLETENESS FOR RANGE (%) : 91.1 +REMARK 200 DATA REDUNDANCY : 3.100 +REMARK 200 R MERGE (I) : 0.04400 +REMARK 200 R SYM (I) : NULL +REMARK 200 FOR THE DATA SET : 11.7000 +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: MOLECULAR REPLACEMENT +REMARK 200 SOFTWARE USED: X-PLOR +REMARK 200 STARTING MODEL: PDB ENTRY 2LZH +REMARK 200 +REMARK 200 REMARK: NULL +REMARK 280 +REMARK 280 CRYSTAL +REMARK 280 SOLVENT CONTENT, VS (%): 42.84 +REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.15 +REMARK 280 +REMARK 280 CRYSTALLIZATION CONDITIONS: PH 4.48 +REMARK 290 +REMARK 290 CRYSTALLOGRAPHIC SYMMETRY +REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 +REMARK 290 +REMARK 290 SYMOP SYMMETRY +REMARK 290 NNNMMM OPERATOR +REMARK 290 1555 X,Y,Z +REMARK 290 2555 -X+1/2,-Y,Z+1/2 +REMARK 290 3555 -X,Y+1/2,-Z+1/2 +REMARK 290 4555 X+1/2,-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 29.53100 +REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 +REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 15.25850 +REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 +REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 34.22550 +REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 15.25850 +REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 29.53100 +REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 34.22550 +REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 +REMARK 290 +REMARK 290 REMARK: NULL +REMARK 300 +REMARK 300 BIOMOLECULE: 1 +REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM +REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN +REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON +REMARK 300 BURIED SURFACE AREA. +REMARK 350 +REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN +REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE +REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS +REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND +REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. +REMARK 350 +REMARK 350 BIOMOLECULE: 1 +REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: 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 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT +REMARK 500 +REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. +REMARK 500 +REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE +REMARK 500 NH2 ARG A 45 NH2 ARG A 68 2.16 +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: CLOSE CONTACTS +REMARK 500 +REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC +REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 +REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A +REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 +REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE +REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. +REMARK 500 +REMARK 500 DISTANCE CUTOFF: +REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS +REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS +REMARK 500 +REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE +REMARK 500 OD1 ASN A 19 ND2 ASN A 39 1556 2.09 +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: COVALENT BOND ANGLES +REMARK 500 +REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES +REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE +REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN +REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). +REMARK 500 +REMARK 500 STANDARD TABLE: +REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) +REMARK 500 +REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 +REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 +REMARK 500 +REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 +REMARK 500 ARG A 14 NE - CZ - NH1 ANGL. DEV. = -4.2 DEGREES +REMARK 500 ASP A 18 CB - CG - OD1 ANGL. DEV. = 6.1 DEGREES +REMARK 500 ARG A 21 CD - NE - CZ ANGL. DEV. = 13.6 DEGREES +REMARK 500 ARG A 21 NE - CZ - NH2 ANGL. DEV. = 5.1 DEGREES +REMARK 500 ARG A 45 NE - CZ - NH1 ANGL. DEV. = 4.6 DEGREES +REMARK 500 ARG A 45 NE - CZ - NH2 ANGL. DEV. = -5.7 DEGREES +REMARK 500 ASP A 66 CB - CG - OD1 ANGL. DEV. = 6.6 DEGREES +REMARK 500 ASP A 66 CB - CG - OD2 ANGL. DEV. = -7.2 DEGREES +REMARK 500 ARG A 68 NE - CZ - NH1 ANGL. DEV. = 8.8 DEGREES +REMARK 500 ARG A 68 NE - CZ - NH2 ANGL. DEV. = -6.5 DEGREES +REMARK 500 ARG A 73 NE - CZ - NH2 ANGL. DEV. = -4.4 DEGREES +REMARK 500 ASP A 87 CB - CG - OD1 ANGL. DEV. = 8.6 DEGREES +REMARK 500 ARG A 112 NE - CZ - NH1 ANGL. DEV. = 4.4 DEGREES +REMARK 500 ARG A 125 NE - CZ - NH2 ANGL. DEV. = -5.0 DEGREES +REMARK 500 ARG A 128 NE - CZ - NH1 ANGL. DEV. = 3.0 DEGREES +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: PLANAR GROUPS +REMARK 500 +REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL +REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE +REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN +REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS +REMARK 500 AN RMSD GREATER THAN THIS VALUE +REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; +REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). +REMARK 500 +REMARK 500 M RES CSSEQI RMS TYPE +REMARK 500 ARG A 14 0.12 SIDE_CHAIN +REMARK 500 ARG A 21 0.21 SIDE_CHAIN +REMARK 500 ARG A 68 0.15 SIDE_CHAIN +REMARK 500 ARG A 73 0.25 SIDE_CHAIN +REMARK 500 ARG A 112 0.15 SIDE_CHAIN +REMARK 500 ARG A 114 0.13 SIDE_CHAIN +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 ARG A 128 10.17 +REMARK 500 +REMARK 500 REMARK: NULL +DBREF 1AKI A 1 129 UNP P00698 LYSC_CHICK 19 147 +SEQRES 1 A 129 LYS VAL PHE GLY ARG CYS GLU LEU ALA ALA ALA MET LYS +SEQRES 2 A 129 ARG HIS GLY LEU ASP ASN TYR ARG GLY TYR SER LEU GLY +SEQRES 3 A 129 ASN TRP VAL CYS ALA ALA LYS PHE GLU SER ASN PHE ASN +SEQRES 4 A 129 THR GLN ALA THR ASN ARG ASN THR ASP GLY SER THR ASP +SEQRES 5 A 129 TYR GLY ILE LEU GLN ILE ASN SER ARG TRP TRP CYS ASN +SEQRES 6 A 129 ASP GLY ARG THR PRO GLY SER ARG ASN LEU CYS ASN ILE +SEQRES 7 A 129 PRO CYS SER ALA LEU LEU SER SER ASP ILE THR ALA SER +SEQRES 8 A 129 VAL ASN CYS ALA LYS LYS ILE VAL SER ASP GLY ASN GLY +SEQRES 9 A 129 MET ASN ALA TRP VAL ALA TRP ARG ASN ARG CYS LYS GLY +SEQRES 10 A 129 THR ASP VAL GLN ALA TRP ILE ARG GLY CYS ARG LEU +FORMUL 2 HOH *78(H2 O) +HELIX 1 1 ARG A 5 ARG A 14 1 10 +HELIX 2 2 TYR A 20 GLY A 22 5 3 +HELIX 3 3 LEU A 25 SER A 36 1 12 +HELIX 4 4 CYS A 80 LEU A 84 5 5 +HELIX 5 5 THR A 89 ASP A 101 1 13 +HELIX 6 6 GLY A 104 ALA A 107 5 4 +HELIX 7 7 VAL A 109 ARG A 114 1 6 +HELIX 8 8 VAL A 120 TRP A 123 5 4 +SHEET 1 A 2 THR A 43 ARG A 45 0 +SHEET 2 A 2 THR A 51 TYR A 53 -1 N ASP A 52 O ASN A 44 +SSBOND 1 CYS A 6 CYS A 127 1555 1555 1.97 +SSBOND 2 CYS A 30 CYS A 115 1555 1555 2.00 +SSBOND 3 CYS A 64 CYS A 80 1555 1555 1.99 +SSBOND 4 CYS A 76 CYS A 94 1555 1555 2.02 +CRYST1 59.062 68.451 30.517 90.00 90.00 90.00 P 21 21 21 4 +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 0.016931 0.000000 0.000000 0.00000 +SCALE2 0.000000 0.014609 0.000000 0.00000 +SCALE3 0.000000 0.000000 0.032769 0.00000 +ATOM 1 N LYS A 1 35.365 22.342 -11.980 1.00 22.28 N +ATOM 2 CA LYS A 1 35.892 21.073 -11.427 1.00 21.12 C +ATOM 3 C LYS A 1 34.741 20.264 -10.844 1.00 16.85 C +ATOM 4 O LYS A 1 33.945 20.813 -10.081 1.00 18.94 O +ATOM 5 CB LYS A 1 36.872 21.435 -10.306 1.00 20.78 C +ATOM 6 CG LYS A 1 37.453 20.248 -9.565 1.00 18.47 C +ATOM 7 CD LYS A 1 38.688 20.649 -8.775 1.00 20.32 C +ATOM 8 CE LYS A 1 39.057 19.508 -7.837 1.00 24.76 C +ATOM 9 NZ LYS A 1 40.423 19.771 -7.299 1.00 28.27 N +ATOM 10 N VAL A 2 34.739 18.961 -11.042 1.00 19.96 N +ATOM 11 CA VAL A 2 33.903 17.998 -10.333 1.00 18.10 C +ATOM 12 C VAL A 2 34.800 17.312 -9.294 1.00 19.39 C +ATOM 13 O VAL A 2 35.759 16.605 -9.665 1.00 22.14 O +ATOM 14 CB VAL A 2 33.140 17.034 -11.232 1.00 16.81 C +ATOM 15 CG1 VAL A 2 32.251 16.084 -10.434 1.00 21.92 C +ATOM 16 CG2 VAL A 2 32.294 17.714 -12.290 1.00 19.46 C +ATOM 17 N PHE A 3 34.491 17.546 -8.038 1.00 19.89 N +ATOM 18 CA PHE A 3 35.185 16.903 -6.918 1.00 17.43 C +ATOM 19 C PHE A 3 34.742 15.441 -6.771 1.00 15.70 C +ATOM 20 O PHE A 3 33.525 15.162 -6.862 1.00 18.52 O +ATOM 21 CB PHE A 3 34.967 17.632 -5.594 1.00 17.94 C +ATOM 22 CG PHE A 3 35.944 18.737 -5.375 1.00 16.78 C +ATOM 23 CD1 PHE A 3 35.666 20.050 -5.798 1.00 15.97 C +ATOM 24 CD2 PHE A 3 37.000 18.557 -4.473 1.00 19.95 C +ATOM 25 CE1 PHE A 3 36.577 21.076 -5.568 1.00 17.32 C +ATOM 26 CE2 PHE A 3 37.869 19.589 -4.157 1.00 17.65 C +ATOM 27 CZ PHE A 3 37.636 20.873 -4.666 1.00 17.91 C +ATOM 28 N GLY A 4 35.724 14.639 -6.331 1.00 16.79 N +ATOM 29 CA GLY A 4 35.366 13.280 -5.870 1.00 16.34 C +ATOM 30 C GLY A 4 34.924 13.420 -4.415 1.00 11.91 C +ATOM 31 O GLY A 4 35.303 14.403 -3.781 1.00 16.23 O +ATOM 32 N ARG A 5 34.053 12.538 -3.973 1.00 14.65 N +ATOM 33 CA ARG A 5 33.565 12.538 -2.588 1.00 15.91 C +ATOM 34 C ARG A 5 34.665 12.734 -1.556 1.00 15.38 C +ATOM 35 O ARG A 5 34.669 13.651 -0.704 1.00 13.15 O +ATOM 36 CB ARG A 5 32.765 11.262 -2.331 1.00 17.38 C +ATOM 37 CG ARG A 5 32.213 11.203 -0.920 1.00 13.79 C +ATOM 38 CD ARG A 5 31.375 10.001 -0.722 1.00 15.84 C +ATOM 39 NE ARG A 5 32.059 8.749 -0.958 1.00 18.74 N +ATOM 40 CZ ARG A 5 32.733 8.011 -0.097 1.00 15.19 C +ATOM 41 NH1 ARG A 5 32.836 8.332 1.187 1.00 17.50 N +ATOM 42 NH2 ARG A 5 33.245 6.836 -0.526 1.00 23.44 N +ATOM 43 N CYS A 6 35.674 11.853 -1.612 1.00 14.07 N +ATOM 44 CA CYS A 6 36.781 11.870 -0.654 1.00 14.62 C +ATOM 45 C CYS A 6 37.747 13.050 -0.777 1.00 10.99 C +ATOM 46 O CYS A 6 38.148 13.609 0.264 1.00 16.34 O +ATOM 47 CB CYS A 6 37.491 10.532 -0.621 1.00 16.90 C +ATOM 48 SG CYS A 6 36.540 9.205 0.140 1.00 18.61 S +ATOM 49 N GLU A 7 37.861 13.481 -2.019 1.00 14.24 N +ATOM 50 CA GLU A 7 38.685 14.686 -2.311 1.00 13.83 C +ATOM 51 C GLU A 7 38.049 15.926 -1.658 1.00 14.86 C +ATOM 52 O GLU A 7 38.744 16.729 -1.011 1.00 15.01 O +ATOM 53 CB GLU A 7 38.784 14.846 -3.818 1.00 14.85 C +ATOM 54 CG GLU A 7 39.540 16.051 -4.379 1.00 18.50 C +ATOM 55 CD GLU A 7 39.576 16.242 -5.870 1.00 20.16 C +ATOM 56 OE1 GLU A 7 38.672 15.644 -6.491 1.00 26.20 O +ATOM 57 OE2 GLU A 7 40.415 16.953 -6.381 1.00 25.49 O +ATOM 58 N LEU A 8 36.743 16.049 -1.819 1.00 15.18 N +ATOM 59 CA LEU A 8 35.964 17.158 -1.255 1.00 12.72 C +ATOM 60 C LEU A 8 36.051 17.132 0.266 1.00 9.45 C +ATOM 61 O LEU A 8 36.159 18.166 0.920 1.00 13.45 O +ATOM 62 CB LEU A 8 34.528 17.172 -1.811 1.00 14.31 C +ATOM 63 CG LEU A 8 33.718 18.354 -1.305 1.00 15.95 C +ATOM 64 CD1 LEU A 8 34.297 19.656 -1.841 1.00 16.56 C +ATOM 65 CD2 LEU A 8 32.246 18.143 -1.596 1.00 15.88 C +ATOM 66 N ALA A 9 35.754 15.980 0.828 1.00 14.24 N +ATOM 67 CA ALA A 9 35.838 15.757 2.284 1.00 13.25 C +ATOM 68 C ALA A 9 37.144 16.314 2.840 1.00 12.89 C +ATOM 69 O ALA A 9 37.151 16.978 3.897 1.00 14.78 O +ATOM 70 CB ALA A 9 35.656 14.287 2.623 1.00 13.89 C +ATOM 71 N ALA A 10 38.272 15.983 2.204 1.00 12.54 N +ATOM 72 CA ALA A 10 39.610 16.431 2.616 1.00 16.58 C +ATOM 73 C ALA A 10 39.736 17.944 2.459 1.00 15.35 C +ATOM 74 O ALA A 10 40.193 18.499 3.469 1.00 17.40 O +ATOM 75 CB ALA A 10 40.708 15.706 1.842 1.00 15.49 C +ATOM 76 N ALA A 11 39.227 18.519 1.385 1.00 13.54 N +ATOM 77 CA ALA A 11 39.264 19.982 1.223 1.00 15.23 C +ATOM 78 C ALA A 11 38.491 20.702 2.321 1.00 15.68 C +ATOM 79 O ALA A 11 38.946 21.658 2.953 1.00 16.87 O +ATOM 80 CB ALA A 11 38.869 20.421 -0.175 1.00 14.12 C +ATOM 81 N MET A 12 37.288 20.214 2.590 1.00 15.47 N +ATOM 82 CA MET A 12 36.398 20.781 3.612 1.00 13.69 C +ATOM 83 C MET A 12 36.990 20.715 5.007 1.00 12.55 C +ATOM 84 O MET A 12 36.906 21.637 5.840 1.00 17.69 O +ATOM 85 CB MET A 12 34.993 20.213 3.515 1.00 11.18 C +ATOM 86 CG MET A 12 34.320 20.724 2.265 1.00 15.06 C +ATOM 87 SD MET A 12 32.634 19.986 2.235 1.00 17.81 S +ATOM 88 CE MET A 12 31.788 21.135 1.138 1.00 18.08 C +ATOM 89 N LYS A 13 37.688 19.628 5.314 1.00 12.42 N +ATOM 90 CA LYS A 13 38.387 19.385 6.579 1.00 14.58 C +ATOM 91 C LYS A 13 39.460 20.467 6.731 1.00 14.55 C +ATOM 92 O LYS A 13 39.507 21.137 7.776 1.00 16.49 O +ATOM 93 CB LYS A 13 38.934 17.952 6.572 1.00 15.36 C +ATOM 94 CG LYS A 13 39.742 17.555 7.798 1.00 20.46 C +ATOM 95 CD LYS A 13 38.973 16.777 8.834 1.00 23.53 C +ATOM 96 CE LYS A 13 39.293 15.305 8.751 1.00 26.37 C +ATOM 97 NZ LYS A 13 38.077 14.461 8.946 1.00 30.88 N +ATOM 98 N ARG A 14 40.267 20.629 5.688 1.00 18.91 N +ATOM 99 CA ARG A 14 41.387 21.577 5.713 1.00 17.66 C +ATOM 100 C ARG A 14 40.927 23.017 5.881 1.00 16.78 C +ATOM 101 O ARG A 14 41.557 23.834 6.584 1.00 20.06 O +ATOM 102 CB ARG A 14 42.388 21.351 4.601 1.00 20.89 C +ATOM 103 CG ARG A 14 42.173 22.079 3.289 1.00 25.07 C +ATOM 104 CD ARG A 14 43.444 22.075 2.490 1.00 23.98 C +ATOM 105 NE ARG A 14 43.687 20.710 2.012 1.00 31.92 N +ATOM 106 CZ ARG A 14 43.098 20.255 0.892 1.00 26.04 C +ATOM 107 NH1 ARG A 14 42.695 21.186 0.018 1.00 33.46 N +ATOM 108 NH2 ARG A 14 42.949 18.957 0.689 1.00 25.91 N +ATOM 109 N HIS A 15 39.681 23.247 5.463 1.00 17.84 N +ATOM 110 CA HIS A 15 39.075 24.591 5.526 1.00 15.99 C +ATOM 111 C HIS A 15 38.310 24.861 6.814 1.00 17.70 C +ATOM 112 O HIS A 15 37.608 25.875 6.952 1.00 22.68 O +ATOM 113 CB HIS A 15 38.223 24.918 4.285 1.00 19.19 C +ATOM 114 CG HIS A 15 39.085 25.388 3.171 1.00 20.14 C +ATOM 115 ND1 HIS A 15 39.457 24.635 2.091 1.00 24.53 N +ATOM 116 CD2 HIS A 15 39.739 26.570 2.993 1.00 24.44 C +ATOM 117 CE1 HIS A 15 40.211 25.312 1.258 1.00 20.68 C +ATOM 118 NE2 HIS A 15 40.524 26.419 1.889 1.00 27.34 N +ATOM 119 N GLY A 16 38.296 23.927 7.720 1.00 17.50 N +ATOM 120 CA GLY A 16 37.765 24.025 9.072 1.00 18.71 C +ATOM 121 C GLY A 16 36.264 23.799 9.210 1.00 18.40 C +ATOM 122 O GLY A 16 35.646 24.400 10.127 1.00 21.57 O +ATOM 123 N LEU A 17 35.665 23.073 8.274 1.00 17.56 N +ATOM 124 CA LEU A 17 34.238 22.795 8.298 1.00 15.38 C +ATOM 125 C LEU A 17 33.845 21.682 9.266 1.00 18.28 C +ATOM 126 O LEU A 17 32.643 21.594 9.552 1.00 18.24 O +ATOM 127 CB LEU A 17 33.648 22.647 6.901 1.00 15.02 C +ATOM 128 CG LEU A 17 33.451 23.889 6.060 1.00 16.08 C +ATOM 129 CD1 LEU A 17 32.933 23.420 4.705 1.00 13.83 C +ATOM 130 CD2 LEU A 17 32.556 24.946 6.679 1.00 18.60 C +ATOM 131 N ASP A 18 34.785 20.814 9.605 1.00 16.36 N +ATOM 132 CA ASP A 18 34.492 19.722 10.526 1.00 16.25 C +ATOM 133 C ASP A 18 34.015 20.222 11.901 1.00 17.32 C +ATOM 134 O ASP A 18 34.826 20.778 12.658 1.00 20.27 O +ATOM 135 CB ASP A 18 35.557 18.633 10.598 1.00 19.37 C +ATOM 136 CG ASP A 18 35.017 17.408 11.311 1.00 20.25 C +ATOM 137 OD1 ASP A 18 33.805 17.154 11.455 1.00 21.00 O +ATOM 138 OD2 ASP A 18 35.925 16.603 11.662 1.00 27.06 O +ATOM 139 N ASN A 19 32.746 19.990 12.205 1.00 18.55 N +ATOM 140 CA ASN A 19 32.123 20.431 13.448 1.00 17.19 C +ATOM 141 C ASN A 19 31.854 21.941 13.497 1.00 16.61 C +ATOM 142 O ASN A 19 31.426 22.398 14.573 1.00 18.56 O +ATOM 143 CB ASN A 19 32.767 20.004 14.770 1.00 18.92 C +ATOM 144 CG ASN A 19 32.162 20.512 16.064 1.00 24.64 C +ATOM 145 OD1 ASN A 19 30.967 20.273 16.355 1.00 32.53 O +ATOM 146 ND2 ASN A 19 32.847 21.361 16.852 1.00 24.14 N +ATOM 147 N TYR A 20 31.969 22.650 12.406 1.00 16.84 N +ATOM 148 CA TYR A 20 31.707 24.099 12.411 1.00 15.54 C +ATOM 149 C TYR A 20 30.231 24.343 12.759 1.00 15.81 C +ATOM 150 O TYR A 20 29.288 23.874 12.118 1.00 16.89 O +ATOM 151 CB TYR A 20 32.070 24.736 11.066 1.00 18.16 C +ATOM 152 CG TYR A 20 32.061 26.250 11.144 1.00 20.28 C +ATOM 153 CD1 TYR A 20 33.141 26.886 11.760 1.00 21.42 C +ATOM 154 CD2 TYR A 20 30.979 27.004 10.691 1.00 20.44 C +ATOM 155 CE1 TYR A 20 33.206 28.277 11.794 1.00 22.24 C +ATOM 156 CE2 TYR A 20 31.018 28.399 10.779 1.00 21.36 C +ATOM 157 CZ TYR A 20 32.102 29.017 11.383 1.00 19.38 C +ATOM 158 OH TYR A 20 32.136 30.371 11.525 1.00 26.77 O +ATOM 159 N ARG A 21 30.088 25.142 13.803 1.00 18.43 N +ATOM 160 CA ARG A 21 28.774 25.553 14.319 1.00 15.68 C +ATOM 161 C ARG A 21 27.964 24.312 14.623 1.00 15.17 C +ATOM 162 O ARG A 21 26.733 24.333 14.606 1.00 18.36 O +ATOM 163 CB ARG A 21 28.014 26.565 13.453 1.00 19.21 C +ATOM 164 CG ARG A 21 28.507 27.995 13.535 1.00 21.50 C +ATOM 165 CD ARG A 21 28.110 28.755 14.765 1.00 25.00 C +ATOM 166 NE ARG A 21 29.319 29.321 15.324 1.00 30.37 N +ATOM 167 CZ ARG A 21 30.215 30.234 14.978 1.00 29.02 C +ATOM 168 NH1 ARG A 21 31.501 29.856 14.846 1.00 29.04 N +ATOM 169 NH2 ARG A 21 29.938 31.437 14.495 1.00 31.89 N +ATOM 170 N GLY A 22 28.689 23.250 14.998 1.00 17.81 N +ATOM 171 CA GLY A 22 28.103 22.021 15.519 1.00 17.72 C +ATOM 172 C GLY A 22 27.748 21.018 14.436 1.00 18.89 C +ATOM 173 O GLY A 22 27.085 20.022 14.784 1.00 23.26 O +ATOM 174 N TYR A 23 28.209 21.230 13.216 1.00 18.20 N +ATOM 175 CA TYR A 23 27.887 20.318 12.111 1.00 15.42 C +ATOM 176 C TYR A 23 29.124 19.533 11.628 1.00 16.30 C +ATOM 177 O TYR A 23 30.045 20.191 11.139 1.00 16.66 O +ATOM 178 CB TYR A 23 27.351 21.107 10.913 1.00 15.82 C +ATOM 179 CG TYR A 23 26.001 21.745 11.127 1.00 15.96 C +ATOM 180 CD1 TYR A 23 24.846 20.962 11.139 1.00 14.81 C +ATOM 181 CD2 TYR A 23 25.897 23.096 11.458 1.00 16.60 C +ATOM 182 CE1 TYR A 23 23.600 21.518 11.422 1.00 17.08 C +ATOM 183 CE2 TYR A 23 24.647 23.673 11.726 1.00 19.34 C +ATOM 184 CZ TYR A 23 23.518 22.881 11.701 1.00 19.21 C +ATOM 185 OH TYR A 23 22.289 23.438 11.912 1.00 25.61 O +ATOM 186 N SER A 24 29.029 18.223 11.810 1.00 15.35 N +ATOM 187 CA SER A 24 30.143 17.347 11.414 1.00 16.89 C +ATOM 188 C SER A 24 30.359 17.379 9.895 1.00 15.61 C +ATOM 189 O SER A 24 29.442 17.687 9.139 1.00 13.88 O +ATOM 190 CB SER A 24 29.922 15.934 11.907 1.00 17.54 C +ATOM 191 OG SER A 24 28.799 15.336 11.308 1.00 19.85 O +ATOM 192 N LEU A 25 31.593 17.028 9.540 1.00 16.08 N +ATOM 193 CA LEU A 25 32.035 17.092 8.138 1.00 13.16 C +ATOM 194 C LEU A 25 31.030 16.437 7.183 1.00 13.39 C +ATOM 195 O LEU A 25 30.874 16.924 6.056 1.00 15.34 O +ATOM 196 CB LEU A 25 33.410 16.409 8.084 1.00 13.47 C +ATOM 197 CG LEU A 25 34.015 16.477 6.689 1.00 12.91 C +ATOM 198 CD1 LEU A 25 34.174 17.929 6.289 1.00 13.04 C +ATOM 199 CD2 LEU A 25 35.398 15.810 6.752 1.00 14.54 C +ATOM 200 N GLY A 26 30.501 15.280 7.576 1.00 13.10 N +ATOM 201 CA GLY A 26 29.539 14.561 6.756 1.00 13.88 C +ATOM 202 C GLY A 26 28.338 15.378 6.277 1.00 12.12 C +ATOM 203 O GLY A 26 27.886 15.250 5.120 1.00 13.13 O +ATOM 204 N ASN A 27 27.905 16.281 7.161 1.00 12.16 N +ATOM 205 CA ASN A 27 26.827 17.227 6.857 1.00 14.74 C +ATOM 206 C ASN A 27 27.164 18.015 5.597 1.00 15.43 C +ATOM 207 O ASN A 27 26.317 18.208 4.720 1.00 15.27 O +ATOM 208 CB ASN A 27 26.484 18.126 8.054 1.00 12.34 C +ATOM 209 CG ASN A 27 25.681 17.267 9.048 1.00 12.22 C +ATOM 210 OD1 ASN A 27 24.511 16.933 8.820 1.00 17.40 O +ATOM 211 ND2 ASN A 27 26.348 17.052 10.169 1.00 18.27 N +ATOM 212 N TRP A 28 28.344 18.591 5.583 1.00 16.78 N +ATOM 213 CA TRP A 28 28.831 19.475 4.513 1.00 16.49 C +ATOM 214 C TRP A 28 28.940 18.741 3.183 1.00 12.99 C +ATOM 215 O TRP A 28 28.742 19.321 2.090 1.00 13.97 O +ATOM 216 CB TRP A 28 30.104 20.145 5.023 1.00 14.55 C +ATOM 217 CG TRP A 28 29.941 20.978 6.251 1.00 11.93 C +ATOM 218 CD1 TRP A 28 30.176 20.624 7.546 1.00 14.42 C +ATOM 219 CD2 TRP A 28 29.319 22.284 6.287 1.00 13.11 C +ATOM 220 NE1 TRP A 28 29.924 21.690 8.365 1.00 16.94 N +ATOM 221 CE2 TRP A 28 29.337 22.679 7.641 1.00 14.07 C +ATOM 222 CE3 TRP A 28 28.894 23.168 5.295 1.00 15.97 C +ATOM 223 CZ2 TRP A 28 28.913 23.943 8.038 1.00 18.07 C +ATOM 224 CZ3 TRP A 28 28.398 24.404 5.682 1.00 18.26 C +ATOM 225 CH2 TRP A 28 28.431 24.766 7.025 1.00 17.18 C +ATOM 226 N VAL A 29 29.572 17.543 3.261 1.00 13.00 N +ATOM 227 CA VAL A 29 29.729 16.711 2.047 1.00 14.15 C +ATOM 228 C VAL A 29 28.379 16.340 1.429 1.00 10.43 C +ATOM 229 O VAL A 29 28.166 16.496 0.228 1.00 13.40 O +ATOM 230 CB VAL A 29 30.649 15.492 2.359 1.00 12.76 C +ATOM 231 CG1 VAL A 29 30.782 14.596 1.136 1.00 15.37 C +ATOM 232 CG2 VAL A 29 32.010 16.050 2.772 1.00 14.18 C +ATOM 233 N CYS A 30 27.501 15.906 2.299 1.00 15.32 N +ATOM 234 CA CYS A 30 26.115 15.567 1.991 1.00 15.59 C +ATOM 235 C CYS A 30 25.388 16.723 1.302 1.00 12.37 C +ATOM 236 O CYS A 30 24.894 16.516 0.172 1.00 14.44 O +ATOM 237 CB CYS A 30 25.343 15.046 3.172 1.00 14.99 C +ATOM 238 SG CYS A 30 23.719 14.376 2.695 1.00 17.71 S +ATOM 239 N ALA A 31 25.533 17.913 1.870 1.00 16.06 N +ATOM 240 CA ALA A 31 24.949 19.130 1.305 1.00 15.82 C +ATOM 241 C ALA A 31 25.487 19.354 -0.115 1.00 15.34 C +ATOM 242 O ALA A 31 24.675 19.686 -0.998 1.00 16.00 O +ATOM 243 CB ALA A 31 25.167 20.335 2.200 1.00 14.90 C +ATOM 244 N ALA A 32 26.807 19.354 -0.286 1.00 11.93 N +ATOM 245 CA ALA A 32 27.461 19.536 -1.579 1.00 13.08 C +ATOM 246 C ALA A 32 26.943 18.538 -2.620 1.00 12.38 C +ATOM 247 O ALA A 32 26.767 18.857 -3.789 1.00 13.89 O +ATOM 248 CB ALA A 32 28.982 19.476 -1.398 1.00 14.17 C +ATOM 249 N LYS A 33 26.731 17.303 -2.193 1.00 15.16 N +ATOM 250 CA LYS A 33 26.261 16.216 -3.037 1.00 16.16 C +ATOM 251 C LYS A 33 24.903 16.555 -3.658 1.00 15.04 C +ATOM 252 O LYS A 33 24.806 16.511 -4.890 1.00 15.00 O +ATOM 253 CB LYS A 33 26.221 14.860 -2.351 1.00 16.71 C +ATOM 254 CG LYS A 33 25.697 13.696 -3.185 1.00 19.51 C +ATOM 255 CD LYS A 33 26.498 13.400 -4.446 1.00 17.12 C +ATOM 256 CE LYS A 33 25.686 12.464 -5.331 1.00 24.06 C +ATOM 257 NZ LYS A 33 26.423 11.979 -6.525 1.00 26.78 N +ATOM 258 N PHE A 34 23.972 16.946 -2.817 1.00 16.81 N +ATOM 259 CA PHE A 34 22.569 17.125 -3.247 1.00 17.51 C +ATOM 260 C PHE A 34 22.346 18.506 -3.836 1.00 18.19 C +ATOM 261 O PHE A 34 21.504 18.692 -4.759 1.00 20.21 O +ATOM 262 CB PHE A 34 21.626 16.673 -2.130 1.00 18.58 C +ATOM 263 CG PHE A 34 21.644 15.172 -1.965 1.00 22.22 C +ATOM 264 CD1 PHE A 34 21.209 14.353 -3.007 1.00 20.24 C +ATOM 265 CD2 PHE A 34 22.272 14.627 -0.851 1.00 20.00 C +ATOM 266 CE1 PHE A 34 21.372 12.961 -2.910 1.00 22.03 C +ATOM 267 CE2 PHE A 34 22.443 13.245 -0.743 1.00 21.96 C +ATOM 268 CZ PHE A 34 21.923 12.406 -1.737 1.00 20.77 C +ATOM 269 N GLU A 35 23.251 19.415 -3.451 1.00 15.27 N +ATOM 270 CA GLU A 35 23.178 20.789 -3.996 1.00 15.45 C +ATOM 271 C GLU A 35 23.661 20.944 -5.423 1.00 17.45 C +ATOM 272 O GLU A 35 23.014 21.514 -6.310 1.00 17.91 O +ATOM 273 CB GLU A 35 23.698 21.892 -3.107 1.00 14.42 C +ATOM 274 CG GLU A 35 22.994 22.212 -1.809 1.00 11.08 C +ATOM 275 CD GLU A 35 21.631 22.846 -1.864 1.00 13.55 C +ATOM 276 OE1 GLU A 35 21.408 23.360 -2.981 1.00 20.77 O +ATOM 277 OE2 GLU A 35 20.947 23.032 -0.874 1.00 22.72 O +ATOM 278 N SER A 36 24.867 20.483 -5.674 1.00 15.66 N +ATOM 279 CA SER A 36 25.626 20.615 -6.903 1.00 17.79 C +ATOM 280 C SER A 36 26.139 19.341 -7.569 1.00 16.97 C +ATOM 281 O SER A 36 26.750 19.464 -8.642 1.00 21.78 O +ATOM 282 CB SER A 36 26.830 21.528 -6.654 1.00 18.12 C +ATOM 283 OG SER A 36 27.747 20.951 -5.748 1.00 15.16 O +ATOM 284 N ASN A 37 25.957 18.222 -6.927 1.00 20.15 N +ATOM 285 CA ASN A 37 26.628 16.968 -7.297 1.00 20.85 C +ATOM 286 C ASN A 37 28.149 17.091 -7.302 1.00 19.72 C +ATOM 287 O ASN A 37 28.813 16.627 -8.254 1.00 20.79 O +ATOM 288 CB ASN A 37 26.028 16.490 -8.617 1.00 20.82 C +ATOM 289 CG ASN A 37 26.156 14.980 -8.782 1.00 23.63 C +ATOM 290 OD1 ASN A 37 26.640 14.266 -7.885 1.00 28.05 O +ATOM 291 ND2 ASN A 37 25.867 14.506 -9.990 1.00 29.61 N +ATOM 292 N PHE A 38 28.691 17.882 -6.383 1.00 16.12 N +ATOM 293 CA PHE A 38 30.129 18.115 -6.279 1.00 14.75 C +ATOM 294 C PHE A 38 30.717 18.903 -7.448 1.00 13.86 C +ATOM 295 O PHE A 38 31.923 18.794 -7.702 1.00 16.66 O +ATOM 296 CB PHE A 38 30.914 16.823 -6.047 1.00 17.09 C +ATOM 297 CG PHE A 38 30.487 16.006 -4.863 1.00 15.96 C +ATOM 298 CD1 PHE A 38 30.100 16.572 -3.655 1.00 15.43 C +ATOM 299 CD2 PHE A 38 30.507 14.603 -4.993 1.00 17.66 C +ATOM 300 CE1 PHE A 38 29.766 15.808 -2.558 1.00 16.83 C +ATOM 301 CE2 PHE A 38 30.136 13.814 -3.891 1.00 15.86 C +ATOM 302 CZ PHE A 38 29.835 14.410 -2.646 1.00 18.90 C +ATOM 303 N ASN A 39 29.936 19.792 -8.033 1.00 17.63 N +ATOM 304 CA ASN A 39 30.341 20.573 -9.199 1.00 16.77 C +ATOM 305 C ASN A 39 30.543 22.034 -8.823 1.00 17.13 C +ATOM 306 O ASN A 39 29.544 22.649 -8.423 1.00 17.24 O +ATOM 307 CB ASN A 39 29.406 20.300 -10.366 1.00 17.40 C +ATOM 308 CG ASN A 39 29.876 20.771 -11.716 1.00 16.96 C +ATOM 309 OD1 ASN A 39 30.579 21.750 -11.956 1.00 23.22 O +ATOM 310 ND2 ASN A 39 29.578 19.864 -12.653 1.00 26.35 N +ATOM 311 N THR A 40 31.766 22.492 -8.928 1.00 14.88 N +ATOM 312 CA THR A 40 32.139 23.869 -8.657 1.00 16.08 C +ATOM 313 C THR A 40 31.504 24.890 -9.589 1.00 16.31 C +ATOM 314 O THR A 40 31.316 26.054 -9.213 1.00 17.50 O +ATOM 315 CB THR A 40 33.684 24.103 -8.422 1.00 17.07 C +ATOM 316 OG1 THR A 40 34.270 24.156 -9.775 1.00 23.76 O +ATOM 317 CG2 THR A 40 34.414 23.119 -7.491 1.00 16.46 C +ATOM 318 N GLN A 41 31.001 24.430 -10.706 1.00 16.39 N +ATOM 319 CA GLN A 41 30.524 25.291 -11.812 1.00 16.67 C +ATOM 320 C GLN A 41 28.993 25.381 -11.874 1.00 15.44 C +ATOM 321 O GLN A 41 28.504 26.019 -12.837 1.00 18.55 O +ATOM 322 CB GLN A 41 31.047 24.817 -13.168 1.00 19.65 C +ATOM 323 CG GLN A 41 32.549 25.004 -13.279 1.00 21.26 C +ATOM 324 CD GLN A 41 32.763 26.236 -14.129 1.00 26.23 C +ATOM 325 OE1 GLN A 41 32.356 26.308 -15.291 1.00 24.68 O +ATOM 326 NE2 GLN A 41 33.276 27.231 -13.420 1.00 25.96 N +ATOM 327 N ALA A 42 28.329 24.640 -11.012 1.00 15.95 N +ATOM 328 CA ALA A 42 26.859 24.579 -11.061 1.00 17.42 C +ATOM 329 C ALA A 42 26.257 25.969 -10.807 1.00 18.93 C +ATOM 330 O ALA A 42 26.645 26.686 -9.884 1.00 17.00 O +ATOM 331 CB ALA A 42 26.355 23.604 -9.998 1.00 22.79 C +ATOM 332 N THR A 43 25.276 26.293 -11.643 1.00 18.30 N +ATOM 333 CA THR A 43 24.441 27.490 -11.476 1.00 17.73 C +ATOM 334 C THR A 43 22.976 27.112 -11.714 1.00 19.61 C +ATOM 335 O THR A 43 22.715 26.271 -12.594 1.00 22.06 O +ATOM 336 CB THR A 43 24.814 28.728 -12.375 1.00 17.58 C +ATOM 337 OG1 THR A 43 24.555 28.321 -13.756 1.00 20.94 O +ATOM 338 CG2 THR A 43 26.247 29.213 -12.184 1.00 18.26 C +ATOM 339 N ASN A 44 22.088 27.742 -10.971 1.00 19.77 N +ATOM 340 CA ASN A 44 20.640 27.497 -11.108 1.00 19.51 C +ATOM 341 C ASN A 44 19.903 28.842 -10.963 1.00 14.85 C +ATOM 342 O ASN A 44 20.169 29.600 -10.033 1.00 19.43 O +ATOM 343 CB ASN A 44 20.155 26.480 -10.080 1.00 19.93 C +ATOM 344 CG ASN A 44 18.646 26.315 -10.115 1.00 22.01 C +ATOM 345 OD1 ASN A 44 18.128 25.720 -11.078 1.00 29.53 O +ATOM 346 ND2 ASN A 44 17.906 26.927 -9.188 1.00 22.94 N +ATOM 347 N ARG A 45 19.058 29.117 -11.924 1.00 16.90 N +ATOM 348 CA ARG A 45 18.303 30.363 -12.015 1.00 18.37 C +ATOM 349 C ARG A 45 16.955 30.163 -11.326 1.00 18.76 C +ATOM 350 O ARG A 45 16.396 29.062 -11.425 1.00 20.87 O +ATOM 351 CB ARG A 45 18.143 30.836 -13.462 1.00 19.30 C +ATOM 352 CG ARG A 45 17.012 31.859 -13.557 1.00 23.98 C +ATOM 353 CD ARG A 45 17.502 33.134 -12.930 1.00 23.36 C +ATOM 354 NE ARG A 45 18.311 33.758 -13.981 1.00 29.56 N +ATOM 355 CZ ARG A 45 17.620 34.271 -15.020 1.00 27.18 C +ATOM 356 NH1 ARG A 45 16.287 34.331 -15.098 1.00 31.99 N +ATOM 357 NH2 ARG A 45 18.374 34.698 -16.030 1.00 32.43 N +ATOM 358 N ASN A 46 16.553 31.171 -10.554 1.00 18.13 N +ATOM 359 CA ASN A 46 15.304 31.071 -9.782 1.00 20.10 C +ATOM 360 C ASN A 46 14.261 32.063 -10.313 1.00 17.35 C +ATOM 361 O ASN A 46 14.617 33.104 -10.880 1.00 19.15 O +ATOM 362 CB ASN A 46 15.576 31.229 -8.295 1.00 20.05 C +ATOM 363 CG ASN A 46 16.543 30.240 -7.679 1.00 20.12 C +ATOM 364 OD1 ASN A 46 17.659 30.661 -7.346 1.00 21.21 O +ATOM 365 ND2 ASN A 46 16.125 28.975 -7.600 1.00 19.44 N +ATOM 366 N THR A 47 13.027 31.834 -9.887 1.00 19.96 N +ATOM 367 CA THR A 47 11.871 32.654 -10.246 1.00 19.12 C +ATOM 368 C THR A 47 12.001 34.107 -9.810 1.00 19.44 C +ATOM 369 O THR A 47 11.600 34.969 -10.606 1.00 23.16 O +ATOM 370 CB THR A 47 10.499 32.017 -9.789 1.00 17.70 C +ATOM 371 OG1 THR A 47 10.507 32.195 -8.342 1.00 23.76 O +ATOM 372 CG2 THR A 47 10.331 30.554 -10.188 1.00 22.66 C +ATOM 373 N ASP A 48 12.625 34.377 -8.683 1.00 19.25 N +ATOM 374 CA ASP A 48 12.885 35.716 -8.168 1.00 17.33 C +ATOM 375 C ASP A 48 14.010 36.505 -8.823 1.00 17.71 C +ATOM 376 O ASP A 48 14.246 37.621 -8.309 1.00 23.04 O +ATOM 377 CB ASP A 48 13.023 35.735 -6.640 1.00 18.02 C +ATOM 378 CG ASP A 48 14.367 35.174 -6.168 1.00 17.88 C +ATOM 379 OD1 ASP A 48 15.104 34.602 -6.991 1.00 18.55 O +ATOM 380 OD2 ASP A 48 14.750 35.442 -5.013 1.00 22.86 O +ATOM 381 N GLY A 49 14.650 36.018 -9.862 1.00 17.62 N +ATOM 382 CA GLY A 49 15.744 36.702 -10.546 1.00 17.27 C +ATOM 383 C GLY A 49 17.147 36.315 -10.096 1.00 16.80 C +ATOM 384 O GLY A 49 18.168 36.688 -10.694 1.00 20.27 O +ATOM 385 N SER A 50 17.173 35.661 -8.930 1.00 19.61 N +ATOM 386 CA SER A 50 18.435 35.225 -8.279 1.00 14.28 C +ATOM 387 C SER A 50 18.977 33.963 -8.941 1.00 18.09 C +ATOM 388 O SER A 50 18.273 33.255 -9.697 1.00 16.76 O +ATOM 389 CB SER A 50 18.272 35.089 -6.781 1.00 17.64 C +ATOM 390 OG SER A 50 17.530 33.930 -6.463 1.00 17.54 O +ATOM 391 N THR A 51 20.271 33.766 -8.734 1.00 16.00 N +ATOM 392 CA THR A 51 20.970 32.557 -9.202 1.00 13.82 C +ATOM 393 C THR A 51 21.718 31.969 -8.000 1.00 14.58 C +ATOM 394 O THR A 51 22.160 32.712 -7.119 1.00 13.28 O +ATOM 395 CB THR A 51 21.904 32.908 -10.419 1.00 12.66 C +ATOM 396 OG1 THR A 51 21.099 33.576 -11.407 1.00 17.65 O +ATOM 397 CG2 THR A 51 22.686 31.699 -10.952 1.00 14.39 C +ATOM 398 N ASP A 52 21.708 30.650 -7.927 1.00 14.66 N +ATOM 399 CA ASP A 52 22.528 29.900 -6.959 1.00 13.43 C +ATOM 400 C ASP A 52 23.843 29.488 -7.635 1.00 12.35 C +ATOM 401 O ASP A 52 23.847 29.066 -8.805 1.00 15.18 O +ATOM 402 CB ASP A 52 21.765 28.649 -6.554 1.00 14.12 C +ATOM 403 CG ASP A 52 20.396 28.991 -6.002 1.00 20.03 C +ATOM 404 OD1 ASP A 52 20.220 29.928 -5.237 1.00 21.30 O +ATOM 405 OD2 ASP A 52 19.517 28.144 -6.222 1.00 20.92 O +ATOM 406 N TYR A 53 24.924 29.734 -6.905 1.00 14.56 N +ATOM 407 CA TYR A 53 26.278 29.604 -7.450 1.00 13.61 C +ATOM 408 C TYR A 53 27.161 28.595 -6.708 1.00 12.70 C +ATOM 409 O TYR A 53 27.289 28.606 -5.486 1.00 13.36 O +ATOM 410 CB TYR A 53 26.993 30.972 -7.489 1.00 12.10 C +ATOM 411 CG TYR A 53 26.437 31.959 -8.487 1.00 11.48 C +ATOM 412 CD1 TYR A 53 26.843 32.003 -9.821 1.00 17.21 C +ATOM 413 CD2 TYR A 53 25.510 32.907 -8.050 1.00 14.42 C +ATOM 414 CE1 TYR A 53 26.291 32.922 -10.717 1.00 17.40 C +ATOM 415 CE2 TYR A 53 24.907 33.803 -8.932 1.00 12.97 C +ATOM 416 CZ TYR A 53 25.357 33.847 -10.252 1.00 15.91 C +ATOM 417 OH TYR A 53 24.864 34.804 -11.094 1.00 19.31 O +ATOM 418 N GLY A 54 27.751 27.721 -7.493 1.00 16.54 N +ATOM 419 CA GLY A 54 28.845 26.832 -7.121 1.00 15.67 C +ATOM 420 C GLY A 54 28.499 25.601 -6.290 1.00 10.78 C +ATOM 421 O GLY A 54 27.339 25.155 -6.255 1.00 13.16 O +ATOM 422 N ILE A 55 29.560 25.088 -5.684 1.00 15.43 N +ATOM 423 CA ILE A 55 29.452 23.795 -4.994 1.00 14.01 C +ATOM 424 C ILE A 55 28.424 23.748 -3.872 1.00 12.26 C +ATOM 425 O ILE A 55 27.770 22.697 -3.693 1.00 16.92 O +ATOM 426 CB ILE A 55 30.891 23.340 -4.563 1.00 16.64 C +ATOM 427 CG1 ILE A 55 30.785 21.812 -4.319 1.00 17.00 C +ATOM 428 CG2 ILE A 55 31.396 24.210 -3.390 1.00 18.87 C +ATOM 429 CD1 ILE A 55 32.101 21.018 -4.339 1.00 20.60 C +ATOM 430 N LEU A 56 28.216 24.881 -3.236 1.00 12.85 N +ATOM 431 CA LEU A 56 27.173 24.998 -2.203 1.00 14.96 C +ATOM 432 C LEU A 56 25.981 25.838 -2.659 1.00 11.08 C +ATOM 433 O LEU A 56 25.161 26.111 -1.774 1.00 16.40 O +ATOM 434 CB LEU A 56 27.816 25.424 -0.877 1.00 14.44 C +ATOM 435 CG LEU A 56 28.692 24.348 -0.204 1.00 14.92 C +ATOM 436 CD1 LEU A 56 29.331 24.997 1.008 1.00 18.78 C +ATOM 437 CD2 LEU A 56 27.808 23.177 0.192 1.00 19.47 C +ATOM 438 N GLN A 57 25.865 26.104 -3.946 1.00 14.17 N +ATOM 439 CA GLN A 57 24.668 26.785 -4.465 1.00 11.55 C +ATOM 440 C GLN A 57 24.277 27.940 -3.558 1.00 15.09 C +ATOM 441 O GLN A 57 23.116 28.031 -3.094 1.00 15.28 O +ATOM 442 CB GLN A 57 23.521 25.765 -4.549 1.00 13.56 C +ATOM 443 CG GLN A 57 23.733 24.790 -5.699 1.00 12.45 C +ATOM 444 CD GLN A 57 23.684 25.440 -7.069 1.00 14.21 C +ATOM 445 OE1 GLN A 57 22.574 25.602 -7.591 1.00 18.18 O +ATOM 446 NE2 GLN A 57 24.813 25.805 -7.651 1.00 14.86 N +ATOM 447 N ILE A 58 25.164 28.910 -3.428 1.00 14.04 N +ATOM 448 CA ILE A 58 24.930 30.118 -2.649 1.00 16.09 C +ATOM 449 C ILE A 58 24.204 31.163 -3.504 1.00 11.19 C +ATOM 450 O ILE A 58 24.555 31.405 -4.667 1.00 14.34 O +ATOM 451 CB ILE A 58 26.301 30.665 -2.134 1.00 14.90 C +ATOM 452 CG1 ILE A 58 26.751 29.724 -0.985 1.00 13.85 C +ATOM 453 CG2 ILE A 58 26.178 32.135 -1.693 1.00 15.47 C +ATOM 454 CD1 ILE A 58 28.246 29.954 -0.641 1.00 16.12 C +ATOM 455 N ASN A 59 23.145 31.671 -2.905 1.00 14.23 N +ATOM 456 CA ASN A 59 22.146 32.510 -3.590 1.00 10.60 C +ATOM 457 C ASN A 59 22.550 33.974 -3.730 1.00 13.03 C +ATOM 458 O ASN A 59 22.917 34.607 -2.740 1.00 18.49 O +ATOM 459 CB ASN A 59 20.805 32.306 -2.884 1.00 15.76 C +ATOM 460 CG ASN A 59 19.650 32.986 -3.588 1.00 15.71 C +ATOM 461 OD1 ASN A 59 19.464 34.171 -3.244 1.00 18.79 O +ATOM 462 ND2 ASN A 59 19.155 32.320 -4.612 1.00 16.44 N +ATOM 463 N SER A 60 22.268 34.485 -4.941 1.00 11.71 N +ATOM 464 CA SER A 60 22.570 35.910 -5.255 1.00 13.81 C +ATOM 465 C SER A 60 21.687 36.993 -4.642 1.00 15.28 C +ATOM 466 O SER A 60 22.054 38.177 -4.774 1.00 17.67 O +ATOM 467 CB SER A 60 22.643 36.139 -6.750 1.00 14.62 C +ATOM 468 OG SER A 60 21.432 36.007 -7.444 1.00 14.30 O +ATOM 469 N ARG A 61 20.526 36.660 -4.138 1.00 15.88 N +ATOM 470 CA ARG A 61 19.691 37.653 -3.434 1.00 18.54 C +ATOM 471 C ARG A 61 20.277 38.108 -2.106 1.00 19.97 C +ATOM 472 O ARG A 61 20.282 39.333 -1.876 1.00 26.30 O +ATOM 473 CB ARG A 61 18.267 37.195 -3.250 1.00 18.00 C +ATOM 474 CG ARG A 61 17.315 38.350 -2.959 1.00 20.10 C +ATOM 475 CD ARG A 61 16.063 37.657 -2.503 1.00 26.00 C +ATOM 476 NE ARG A 61 15.101 38.653 -2.063 1.00 29.28 N +ATOM 477 CZ ARG A 61 13.794 38.351 -2.111 1.00 29.36 C +ATOM 478 NH1 ARG A 61 13.439 37.257 -2.784 1.00 26.50 N +ATOM 479 NH2 ARG A 61 12.925 39.249 -1.646 1.00 32.93 N +ATOM 480 N TRP A 62 20.773 37.202 -1.273 1.00 16.51 N +ATOM 481 CA TRP A 62 21.321 37.563 0.032 1.00 16.06 C +ATOM 482 C TRP A 62 22.848 37.643 0.101 1.00 15.55 C +ATOM 483 O TRP A 62 23.323 38.396 0.968 1.00 18.96 O +ATOM 484 CB TRP A 62 20.833 36.611 1.134 1.00 17.91 C +ATOM 485 CG TRP A 62 19.360 36.361 1.096 1.00 18.99 C +ATOM 486 CD1 TRP A 62 18.719 35.247 0.643 1.00 20.47 C +ATOM 487 CD2 TRP A 62 18.326 37.305 1.427 1.00 20.79 C +ATOM 488 NE1 TRP A 62 17.360 35.457 0.609 1.00 21.70 N +ATOM 489 CE2 TRP A 62 17.090 36.696 1.096 1.00 21.11 C +ATOM 490 CE3 TRP A 62 18.333 38.584 1.965 1.00 19.84 C +ATOM 491 CZ2 TRP A 62 15.875 37.327 1.307 1.00 22.57 C +ATOM 492 CZ3 TRP A 62 17.115 39.208 2.186 1.00 23.93 C +ATOM 493 CH2 TRP A 62 15.906 38.611 1.814 1.00 19.55 C +ATOM 494 N TRP A 63 23.537 36.731 -0.584 1.00 16.01 N +ATOM 495 CA TRP A 63 24.906 36.398 -0.276 1.00 15.21 C +ATOM 496 C TRP A 63 26.089 36.924 -1.052 1.00 15.84 C +ATOM 497 O TRP A 63 27.142 37.177 -0.432 1.00 19.13 O +ATOM 498 CB TRP A 63 25.068 34.919 0.112 1.00 15.47 C +ATOM 499 CG TRP A 63 24.036 34.428 1.068 1.00 12.46 C +ATOM 500 CD1 TRP A 63 22.959 33.620 0.777 1.00 16.95 C +ATOM 501 CD2 TRP A 63 23.919 34.728 2.450 1.00 13.27 C +ATOM 502 NE1 TRP A 63 22.243 33.344 1.899 1.00 17.64 N +ATOM 503 CE2 TRP A 63 22.761 34.067 2.931 1.00 17.28 C +ATOM 504 CE3 TRP A 63 24.694 35.480 3.323 1.00 15.25 C +ATOM 505 CZ2 TRP A 63 22.393 34.133 4.278 1.00 18.56 C +ATOM 506 CZ3 TRP A 63 24.302 35.586 4.648 1.00 18.76 C +ATOM 507 CH2 TRP A 63 23.179 34.910 5.117 1.00 19.36 C +ATOM 508 N CYS A 64 25.962 36.914 -2.353 1.00 17.00 N +ATOM 509 CA CYS A 64 26.985 37.433 -3.271 1.00 15.76 C +ATOM 510 C CYS A 64 26.324 38.355 -4.286 1.00 15.97 C +ATOM 511 O CYS A 64 25.102 38.314 -4.475 1.00 13.75 O +ATOM 512 CB CYS A 64 27.638 36.265 -3.988 1.00 16.64 C +ATOM 513 SG CYS A 64 26.562 35.233 -5.007 1.00 17.83 S +ATOM 514 N ASN A 65 27.157 39.165 -4.908 1.00 17.73 N +ATOM 515 CA ASN A 65 26.700 40.134 -5.920 1.00 16.46 C +ATOM 516 C ASN A 65 26.985 39.646 -7.342 1.00 13.16 C +ATOM 517 O ASN A 65 28.130 39.316 -7.647 1.00 15.95 O +ATOM 518 CB ASN A 65 27.381 41.492 -5.712 1.00 19.19 C +ATOM 519 CG ASN A 65 26.910 42.423 -6.824 1.00 19.59 C +ATOM 520 OD1 ASN A 65 25.736 42.559 -7.141 1.00 23.26 O +ATOM 521 ND2 ASN A 65 27.914 42.938 -7.527 1.00 25.56 N +ATOM 522 N ASP A 66 25.920 39.484 -8.116 1.00 15.60 N +ATOM 523 CA ASP A 66 26.102 39.180 -9.545 1.00 15.28 C +ATOM 524 C ASP A 66 25.664 40.317 -10.460 1.00 15.23 C +ATOM 525 O ASP A 66 25.719 40.143 -11.673 1.00 17.91 O +ATOM 526 CB ASP A 66 25.462 37.858 -9.894 1.00 14.84 C +ATOM 527 CG ASP A 66 23.951 37.903 -9.833 1.00 12.12 C +ATOM 528 OD1 ASP A 66 23.288 38.898 -9.542 1.00 16.56 O +ATOM 529 OD2 ASP A 66 23.455 36.769 -10.048 1.00 16.91 O +ATOM 530 N GLY A 67 25.234 41.408 -9.860 1.00 18.13 N +ATOM 531 CA GLY A 67 24.817 42.607 -10.577 1.00 19.40 C +ATOM 532 C GLY A 67 23.544 42.553 -11.401 1.00 20.37 C +ATOM 533 O GLY A 67 23.191 43.542 -12.055 1.00 18.23 O +ATOM 534 N ARG A 68 22.822 41.441 -11.348 1.00 18.79 N +ATOM 535 CA ARG A 68 21.560 41.308 -12.092 1.00 19.77 C +ATOM 536 C ARG A 68 20.424 40.765 -11.243 1.00 18.48 C +ATOM 537 O ARG A 68 19.385 40.383 -11.795 1.00 21.54 O +ATOM 538 CB ARG A 68 21.746 40.454 -13.339 1.00 18.97 C +ATOM 539 CG ARG A 68 22.197 39.048 -12.946 1.00 18.77 C +ATOM 540 CD ARG A 68 22.477 38.187 -14.122 1.00 23.25 C +ATOM 541 NE ARG A 68 21.439 37.201 -14.281 1.00 29.75 N +ATOM 542 CZ ARG A 68 20.242 37.255 -14.855 1.00 28.71 C +ATOM 543 NH1 ARG A 68 19.503 38.311 -15.145 1.00 32.34 N +ATOM 544 NH2 ARG A 68 19.897 36.127 -15.497 1.00 33.10 N +ATOM 545 N THR A 69 20.590 40.896 -9.952 1.00 18.68 N +ATOM 546 CA THR A 69 19.607 40.408 -8.973 1.00 20.02 C +ATOM 547 C THR A 69 18.994 41.597 -8.224 1.00 16.46 C +ATOM 548 O THR A 69 19.683 42.241 -7.425 1.00 23.13 O +ATOM 549 CB THR A 69 20.208 39.384 -7.910 1.00 19.66 C +ATOM 550 OG1 THR A 69 20.851 38.334 -8.715 1.00 19.19 O +ATOM 551 CG2 THR A 69 19.123 38.863 -6.955 1.00 18.58 C +ATOM 552 N PRO A 70 17.687 41.741 -8.418 1.00 20.50 N +ATOM 553 CA PRO A 70 16.953 42.824 -7.733 1.00 21.73 C +ATOM 554 C PRO A 70 16.955 42.520 -6.242 1.00 22.11 C +ATOM 555 O PRO A 70 16.739 41.356 -5.886 1.00 27.13 O +ATOM 556 CB PRO A 70 15.557 42.749 -8.333 1.00 23.50 C +ATOM 557 CG PRO A 70 15.759 42.092 -9.671 1.00 24.66 C +ATOM 558 CD PRO A 70 16.887 41.095 -9.463 1.00 21.80 C +ATOM 559 N GLY A 71 17.163 43.493 -5.401 1.00 21.67 N +ATOM 560 CA GLY A 71 17.135 43.383 -3.947 1.00 24.03 C +ATOM 561 C GLY A 71 18.328 42.710 -3.287 1.00 26.98 C +ATOM 562 O GLY A 71 18.257 42.257 -2.126 1.00 32.77 O +ATOM 563 N SER A 72 19.418 42.627 -4.018 1.00 26.40 N +ATOM 564 CA SER A 72 20.665 41.976 -3.588 1.00 26.94 C +ATOM 565 C SER A 72 21.139 42.582 -2.276 1.00 24.66 C +ATOM 566 O SER A 72 21.055 43.819 -2.125 1.00 29.91 O +ATOM 567 CB SER A 72 21.659 42.002 -4.737 1.00 25.16 C +ATOM 568 OG SER A 72 23.015 41.835 -4.343 1.00 32.21 O +ATOM 569 N ARG A 73 21.646 41.775 -1.369 1.00 22.51 N +ATOM 570 CA ARG A 73 22.254 42.196 -0.113 1.00 22.60 C +ATOM 571 C ARG A 73 23.774 42.058 0.029 1.00 22.33 C +ATOM 572 O ARG A 73 24.425 42.749 0.849 1.00 27.92 O +ATOM 573 CB ARG A 73 21.615 41.555 1.127 1.00 20.14 C +ATOM 574 CG ARG A 73 20.187 41.983 1.439 1.00 22.29 C +ATOM 575 CD ARG A 73 20.209 43.299 2.123 1.00 26.95 C +ATOM 576 NE ARG A 73 18.928 43.771 2.617 1.00 33.74 N +ATOM 577 CZ ARG A 73 17.980 44.302 1.823 1.00 33.76 C +ATOM 578 NH1 ARG A 73 17.841 43.934 0.544 1.00 35.78 N +ATOM 579 NH2 ARG A 73 17.571 45.545 2.146 1.00 33.83 N +ATOM 580 N ASN A 74 24.346 41.143 -0.705 1.00 17.74 N +ATOM 581 CA ASN A 74 25.780 40.833 -0.695 1.00 18.87 C +ATOM 582 C ASN A 74 26.315 40.718 0.731 1.00 16.22 C +ATOM 583 O ASN A 74 27.255 41.471 1.060 1.00 20.87 O +ATOM 584 CB ASN A 74 26.565 41.786 -1.589 1.00 19.51 C +ATOM 585 CG ASN A 74 27.982 41.328 -1.909 1.00 16.31 C +ATOM 586 OD1 ASN A 74 28.318 40.169 -1.652 1.00 18.61 O +ATOM 587 ND2 ASN A 74 28.838 42.192 -2.436 1.00 19.22 N +ATOM 588 N LEU A 75 25.723 39.860 1.544 1.00 15.25 N +ATOM 589 CA LEU A 75 26.153 39.690 2.930 1.00 14.82 C +ATOM 590 C LEU A 75 27.518 39.011 3.085 1.00 16.78 C +ATOM 591 O LEU A 75 28.167 39.197 4.141 1.00 22.00 O +ATOM 592 CB LEU A 75 25.009 39.055 3.733 1.00 16.64 C +ATOM 593 CG LEU A 75 23.815 39.998 3.979 1.00 17.08 C +ATOM 594 CD1 LEU A 75 22.574 39.193 4.336 1.00 25.82 C +ATOM 595 CD2 LEU A 75 24.156 40.969 5.110 1.00 20.95 C +ATOM 596 N CYS A 76 27.973 38.312 2.061 1.00 17.66 N +ATOM 597 CA CYS A 76 29.299 37.680 2.111 1.00 16.46 C +ATOM 598 C CYS A 76 30.390 38.598 1.589 1.00 15.66 C +ATOM 599 O CYS A 76 31.573 38.229 1.568 1.00 17.59 O +ATOM 600 CB CYS A 76 29.396 36.303 1.477 1.00 17.61 C +ATOM 601 SG CYS A 76 28.595 34.961 2.361 1.00 18.07 S +ATOM 602 N ASN A 77 29.964 39.681 0.971 1.00 18.55 N +ATOM 603 CA ASN A 77 30.827 40.725 0.395 1.00 19.18 C +ATOM 604 C ASN A 77 31.711 40.163 -0.702 1.00 16.58 C +ATOM 605 O ASN A 77 32.947 40.331 -0.689 1.00 21.61 O +ATOM 606 CB ASN A 77 31.589 41.488 1.483 1.00 17.72 C +ATOM 607 CG ASN A 77 32.126 42.812 0.957 1.00 20.20 C +ATOM 608 OD1 ASN A 77 31.351 43.589 0.396 1.00 28.77 O +ATOM 609 ND2 ASN A 77 33.430 43.012 1.047 1.00 27.05 N +ATOM 610 N ILE A 78 31.149 39.408 -1.616 1.00 18.88 N +ATOM 611 CA ILE A 78 31.904 38.780 -2.713 1.00 20.14 C +ATOM 612 C ILE A 78 31.099 38.850 -4.013 1.00 17.08 C +ATOM 613 O ILE A 78 29.864 38.688 -3.972 1.00 16.28 O +ATOM 614 CB ILE A 78 32.183 37.255 -2.384 1.00 19.93 C +ATOM 615 CG1 ILE A 78 30.882 36.639 -1.851 1.00 21.17 C +ATOM 616 CG2 ILE A 78 33.437 37.003 -1.524 1.00 24.25 C +ATOM 617 CD1 ILE A 78 30.936 35.120 -1.546 1.00 25.54 C +ATOM 618 N PRO A 79 31.828 38.795 -5.108 1.00 16.64 N +ATOM 619 CA PRO A 79 31.195 38.634 -6.421 1.00 19.12 C +ATOM 620 C PRO A 79 30.792 37.146 -6.446 1.00 14.71 C +ATOM 621 O PRO A 79 31.576 36.273 -6.005 1.00 17.48 O +ATOM 622 CB PRO A 79 32.261 38.967 -7.445 1.00 18.74 C +ATOM 623 CG PRO A 79 33.555 39.029 -6.710 1.00 18.97 C +ATOM 624 CD PRO A 79 33.276 39.023 -5.215 1.00 16.79 C +ATOM 625 N CYS A 80 29.629 36.908 -7.033 1.00 13.55 N +ATOM 626 CA CYS A 80 29.167 35.522 -7.236 1.00 14.33 C +ATOM 627 C CYS A 80 30.150 34.716 -8.073 1.00 13.92 C +ATOM 628 O CYS A 80 30.214 33.484 -7.880 1.00 16.74 O +ATOM 629 CB CYS A 80 27.749 35.338 -7.747 1.00 16.10 C +ATOM 630 SG CYS A 80 26.471 36.160 -6.762 1.00 16.97 S +ATOM 631 N SER A 81 30.769 35.294 -9.083 1.00 15.04 N +ATOM 632 CA SER A 81 31.775 34.671 -9.933 1.00 15.64 C +ATOM 633 C SER A 81 32.907 34.027 -9.109 1.00 14.90 C +ATOM 634 O SER A 81 33.338 32.939 -9.561 1.00 21.08 O +ATOM 635 CB SER A 81 32.381 35.643 -10.953 1.00 18.65 C +ATOM 636 OG SER A 81 33.035 36.681 -10.235 1.00 20.86 O +ATOM 637 N ALA A 82 33.226 34.572 -7.950 1.00 15.59 N +ATOM 638 CA ALA A 82 34.272 33.963 -7.107 1.00 18.01 C +ATOM 639 C ALA A 82 33.869 32.604 -6.540 1.00 18.75 C +ATOM 640 O ALA A 82 34.703 31.798 -6.081 1.00 19.60 O +ATOM 641 CB ALA A 82 34.722 34.930 -6.020 1.00 20.54 C +ATOM 642 N LEU A 83 32.571 32.338 -6.519 1.00 15.36 N +ATOM 643 CA LEU A 83 31.973 31.093 -6.042 1.00 18.66 C +ATOM 644 C LEU A 83 32.060 29.962 -7.049 1.00 17.84 C +ATOM 645 O LEU A 83 31.671 28.815 -6.739 1.00 21.50 O +ATOM 646 CB LEU A 83 30.618 31.424 -5.431 1.00 17.11 C +ATOM 647 CG LEU A 83 30.511 32.364 -4.244 1.00 16.65 C +ATOM 648 CD1 LEU A 83 29.040 32.573 -3.857 1.00 18.78 C +ATOM 649 CD2 LEU A 83 31.277 31.872 -3.020 1.00 20.62 C +ATOM 650 N LEU A 84 32.473 30.271 -8.267 1.00 17.31 N +ATOM 651 CA LEU A 84 32.610 29.295 -9.347 1.00 16.38 C +ATOM 652 C LEU A 84 34.047 28.841 -9.570 1.00 19.37 C +ATOM 653 O LEU A 84 34.334 28.243 -10.622 1.00 23.48 O +ATOM 654 CB LEU A 84 31.914 29.793 -10.614 1.00 20.87 C +ATOM 655 CG LEU A 84 30.446 30.183 -10.573 1.00 14.26 C +ATOM 656 CD1 LEU A 84 30.014 30.771 -11.916 1.00 21.15 C +ATOM 657 CD2 LEU A 84 29.597 28.942 -10.329 1.00 18.96 C +ATOM 658 N SER A 85 34.942 29.197 -8.676 1.00 21.00 N +ATOM 659 CA SER A 85 36.340 28.754 -8.727 1.00 20.86 C +ATOM 660 C SER A 85 36.474 27.245 -8.497 1.00 19.65 C +ATOM 661 O SER A 85 35.765 26.640 -7.681 1.00 20.62 O +ATOM 662 CB SER A 85 37.109 29.482 -7.633 1.00 20.91 C +ATOM 663 OG SER A 85 38.484 29.212 -7.834 1.00 26.88 O +ATOM 664 N SER A 86 37.619 26.742 -8.943 1.00 22.57 N +ATOM 665 CA SER A 86 38.008 25.343 -8.700 1.00 20.44 C +ATOM 666 C SER A 86 38.388 25.153 -7.233 1.00 19.98 C +ATOM 667 O SER A 86 38.314 24.055 -6.671 1.00 23.62 O +ATOM 668 CB SER A 86 39.107 24.868 -9.650 1.00 23.76 C +ATOM 669 OG SER A 86 38.401 24.215 -10.691 1.00 30.29 O +ATOM 670 N ASP A 87 38.846 26.244 -6.668 1.00 19.74 N +ATOM 671 CA ASP A 87 39.282 26.393 -5.271 1.00 18.72 C +ATOM 672 C ASP A 87 37.999 26.657 -4.471 1.00 17.93 C +ATOM 673 O ASP A 87 37.490 27.762 -4.712 1.00 20.06 O +ATOM 674 CB ASP A 87 40.221 27.607 -5.212 1.00 21.65 C +ATOM 675 CG ASP A 87 40.762 28.041 -3.869 1.00 23.98 C +ATOM 676 OD1 ASP A 87 40.335 27.702 -2.742 1.00 26.26 O +ATOM 677 OD2 ASP A 87 41.785 28.802 -3.933 1.00 32.04 O +ATOM 678 N ILE A 88 37.732 25.850 -3.461 1.00 15.96 N +ATOM 679 CA ILE A 88 36.515 26.089 -2.658 1.00 16.22 C +ATOM 680 C ILE A 88 36.582 27.142 -1.563 1.00 14.43 C +ATOM 681 O ILE A 88 35.600 27.315 -0.801 1.00 16.28 O +ATOM 682 CB ILE A 88 35.993 24.736 -2.046 1.00 16.45 C +ATOM 683 CG1 ILE A 88 36.920 24.200 -0.934 1.00 15.71 C +ATOM 684 CG2 ILE A 88 35.587 23.743 -3.163 1.00 19.87 C +ATOM 685 CD1 ILE A 88 36.363 23.226 0.137 1.00 17.47 C +ATOM 686 N THR A 89 37.742 27.786 -1.369 1.00 14.21 N +ATOM 687 CA THR A 89 37.913 28.772 -0.306 1.00 16.87 C +ATOM 688 C THR A 89 36.736 29.761 -0.161 1.00 11.06 C +ATOM 689 O THR A 89 36.341 29.983 1.000 1.00 13.83 O +ATOM 690 CB THR A 89 39.267 29.591 -0.423 1.00 18.61 C +ATOM 691 OG1 THR A 89 40.339 28.592 -0.514 1.00 20.24 O +ATOM 692 CG2 THR A 89 39.419 30.553 0.766 1.00 17.79 C +ATOM 693 N ALA A 90 36.507 30.482 -1.242 1.00 17.37 N +ATOM 694 CA ALA A 90 35.479 31.555 -1.244 1.00 16.63 C +ATOM 695 C ALA A 90 34.125 31.066 -0.735 1.00 14.09 C +ATOM 696 O ALA A 90 33.366 31.671 0.065 1.00 15.68 O +ATOM 697 CB ALA A 90 35.366 32.212 -2.617 1.00 17.13 C +ATOM 698 N SER A 91 33.746 29.919 -1.296 1.00 13.62 N +ATOM 699 CA SER A 91 32.494 29.220 -1.024 1.00 11.35 C +ATOM 700 C SER A 91 32.429 28.817 0.467 1.00 11.70 C +ATOM 701 O SER A 91 31.407 29.057 1.110 1.00 14.31 O +ATOM 702 CB SER A 91 32.282 28.035 -1.917 1.00 13.48 C +ATOM 703 OG SER A 91 32.020 28.335 -3.260 1.00 14.66 O +ATOM 704 N VAL A 92 33.502 28.211 0.953 1.00 13.17 N +ATOM 705 CA VAL A 92 33.595 27.846 2.381 1.00 13.44 C +ATOM 706 C VAL A 92 33.477 29.105 3.261 1.00 12.00 C +ATOM 707 O VAL A 92 32.716 29.020 4.244 1.00 13.83 O +ATOM 708 CB VAL A 92 34.890 27.038 2.650 1.00 11.69 C +ATOM 709 CG1 VAL A 92 35.125 26.987 4.151 1.00 16.05 C +ATOM 710 CG2 VAL A 92 34.776 25.672 2.013 1.00 15.64 C +ATOM 711 N ASN A 93 34.199 30.163 2.912 1.00 15.12 N +ATOM 712 CA ASN A 93 34.160 31.413 3.685 1.00 15.10 C +ATOM 713 C ASN A 93 32.747 32.034 3.803 1.00 9.80 C +ATOM 714 O ASN A 93 32.361 32.393 4.908 1.00 16.51 O +ATOM 715 CB ASN A 93 35.168 32.472 3.247 1.00 16.33 C +ATOM 716 CG ASN A 93 36.582 32.083 3.642 1.00 19.02 C +ATOM 717 OD1 ASN A 93 37.546 32.671 3.120 1.00 29.57 O +ATOM 718 ND2 ASN A 93 36.710 31.188 4.631 1.00 24.29 N +ATOM 719 N CYS A 94 32.096 31.996 2.670 1.00 15.72 N +ATOM 720 CA CYS A 94 30.695 32.449 2.633 1.00 13.58 C +ATOM 721 C CYS A 94 29.778 31.527 3.424 1.00 13.05 C +ATOM 722 O CYS A 94 28.973 32.025 4.236 1.00 16.42 O +ATOM 723 CB CYS A 94 30.291 32.704 1.185 1.00 12.05 C +ATOM 724 SG CYS A 94 28.644 33.431 1.046 1.00 15.81 S +ATOM 725 N ALA A 95 29.945 30.225 3.263 1.00 13.56 N +ATOM 726 CA ALA A 95 29.134 29.227 3.969 1.00 15.63 C +ATOM 727 C ALA A 95 29.236 29.330 5.491 1.00 10.80 C +ATOM 728 O ALA A 95 28.222 29.180 6.179 1.00 12.93 O +ATOM 729 CB ALA A 95 29.495 27.794 3.612 1.00 14.09 C +ATOM 730 N LYS A 96 30.424 29.628 5.987 1.00 11.19 N +ATOM 731 CA LYS A 96 30.627 29.912 7.419 1.00 13.27 C +ATOM 732 C LYS A 96 29.802 31.115 7.906 1.00 13.38 C +ATOM 733 O LYS A 96 29.296 31.011 9.027 1.00 15.75 O +ATOM 734 CB LYS A 96 32.100 30.112 7.775 1.00 12.67 C +ATOM 735 CG LYS A 96 32.874 28.792 7.697 1.00 11.93 C +ATOM 736 CD LYS A 96 34.358 29.071 7.879 1.00 15.55 C +ATOM 737 CE LYS A 96 35.205 27.816 7.938 1.00 18.03 C +ATOM 738 NZ LYS A 96 36.610 28.242 8.169 1.00 20.72 N +ATOM 739 N LYS A 97 29.660 32.101 7.049 1.00 12.90 N +ATOM 740 CA LYS A 97 28.811 33.263 7.379 1.00 16.43 C +ATOM 741 C LYS A 97 27.333 32.905 7.386 1.00 18.88 C +ATOM 742 O LYS A 97 26.570 33.318 8.272 1.00 19.20 O +ATOM 743 CB LYS A 97 29.087 34.456 6.470 1.00 18.97 C +ATOM 744 CG LYS A 97 30.537 34.927 6.563 1.00 19.81 C +ATOM 745 CD LYS A 97 30.841 36.073 5.610 1.00 22.00 C +ATOM 746 CE LYS A 97 32.340 36.293 5.510 1.00 23.71 C +ATOM 747 NZ LYS A 97 32.569 37.524 4.708 1.00 29.75 N +ATOM 748 N ILE A 98 26.897 32.127 6.416 1.00 15.72 N +ATOM 749 CA ILE A 98 25.520 31.693 6.266 1.00 16.36 C +ATOM 750 C ILE A 98 25.030 30.871 7.453 1.00 16.70 C +ATOM 751 O ILE A 98 24.059 31.254 8.126 1.00 18.80 O +ATOM 752 CB ILE A 98 25.307 30.997 4.896 1.00 15.14 C +ATOM 753 CG1 ILE A 98 25.643 31.910 3.702 1.00 13.63 C +ATOM 754 CG2 ILE A 98 23.887 30.386 4.817 1.00 15.62 C +ATOM 755 CD1 ILE A 98 25.620 31.204 2.321 1.00 17.82 C +ATOM 756 N VAL A 99 25.875 29.966 7.915 1.00 16.73 N +ATOM 757 CA VAL A 99 25.488 29.009 8.955 1.00 18.71 C +ATOM 758 C VAL A 99 25.431 29.697 10.316 1.00 20.36 C +ATOM 759 O VAL A 99 24.737 29.212 11.233 1.00 25.30 O +ATOM 760 CB VAL A 99 26.398 27.774 8.859 1.00 16.94 C +ATOM 761 CG1 VAL A 99 27.811 28.138 9.279 1.00 19.19 C +ATOM 762 CG2 VAL A 99 25.834 26.594 9.632 1.00 18.97 C +ATOM 763 N SER A 100 26.205 30.752 10.409 1.00 17.04 N +ATOM 764 CA SER A 100 26.297 31.529 11.650 1.00 23.81 C +ATOM 765 C SER A 100 25.124 32.495 11.765 1.00 24.03 C +ATOM 766 O SER A 100 24.995 33.131 12.820 1.00 28.66 O +ATOM 767 CB SER A 100 27.647 32.194 11.723 1.00 19.71 C +ATOM 768 OG SER A 100 28.714 31.264 11.818 1.00 25.04 O +ATOM 769 N ASP A 101 24.307 32.599 10.750 1.00 25.78 N +ATOM 770 CA ASP A 101 23.162 33.495 10.650 1.00 26.98 C +ATOM 771 C ASP A 101 21.924 33.183 11.481 1.00 28.34 C +ATOM 772 O ASP A 101 21.132 34.143 11.678 1.00 31.88 O +ATOM 773 CB ASP A 101 22.806 33.854 9.207 1.00 27.75 C +ATOM 774 CG ASP A 101 22.426 35.320 9.009 1.00 30.86 C +ATOM 775 OD1 ASP A 101 23.248 36.223 9.266 1.00 34.67 O +ATOM 776 OD2 ASP A 101 21.276 35.519 8.551 1.00 32.70 O +ATOM 777 N GLY A 102 21.723 31.942 11.887 1.00 28.87 N +ATOM 778 CA GLY A 102 20.622 31.656 12.823 1.00 30.67 C +ATOM 779 C GLY A 102 19.812 30.413 12.505 1.00 27.92 C +ATOM 780 O GLY A 102 19.195 29.898 13.458 1.00 30.42 O +ATOM 781 N ASN A 103 19.805 30.005 11.244 1.00 29.26 N +ATOM 782 CA ASN A 103 19.076 28.799 10.848 1.00 25.22 C +ATOM 783 C ASN A 103 19.990 27.600 10.597 1.00 22.06 C +ATOM 784 O ASN A 103 19.472 26.579 10.117 1.00 24.23 O +ATOM 785 CB ASN A 103 17.976 29.046 9.824 1.00 24.87 C +ATOM 786 CG ASN A 103 16.708 28.245 10.063 1.00 27.08 C +ATOM 787 OD1 ASN A 103 16.513 27.577 11.098 1.00 30.30 O +ATOM 788 ND2 ASN A 103 15.672 28.428 9.240 1.00 30.15 N +ATOM 789 N GLY A 104 21.240 27.711 10.997 1.00 23.20 N +ATOM 790 CA GLY A 104 22.177 26.567 10.860 1.00 19.51 C +ATOM 791 C GLY A 104 22.173 26.142 9.388 1.00 15.58 C +ATOM 792 O GLY A 104 22.151 27.040 8.541 1.00 22.50 O +ATOM 793 N MET A 105 22.185 24.847 9.115 1.00 17.51 N +ATOM 794 CA MET A 105 22.278 24.370 7.724 1.00 16.07 C +ATOM 795 C MET A 105 20.915 24.309 7.063 1.00 13.35 C +ATOM 796 O MET A 105 20.902 23.921 5.871 1.00 15.50 O +ATOM 797 CB MET A 105 23.036 23.048 7.632 1.00 19.32 C +ATOM 798 CG MET A 105 24.519 23.221 7.871 1.00 17.10 C +ATOM 799 SD MET A 105 25.379 21.660 7.491 1.00 20.27 S +ATOM 800 CE MET A 105 25.369 21.706 5.703 1.00 20.03 C +ATOM 801 N ASN A 106 19.896 24.839 7.735 1.00 14.64 N +ATOM 802 CA ASN A 106 18.557 24.898 7.103 1.00 18.58 C +ATOM 803 C ASN A 106 18.566 25.831 5.892 1.00 18.20 C +ATOM 804 O ASN A 106 17.678 25.748 5.021 1.00 22.14 O +ATOM 805 CB ASN A 106 17.420 25.150 8.084 1.00 19.18 C +ATOM 806 CG ASN A 106 17.207 23.938 8.967 1.00 19.21 C +ATOM 807 OD1 ASN A 106 16.836 22.867 8.443 1.00 24.65 O +ATOM 808 ND2 ASN A 106 17.542 24.047 10.255 1.00 25.28 N +ATOM 809 N ALA A 107 19.617 26.647 5.800 1.00 18.54 N +ATOM 810 CA ALA A 107 19.824 27.514 4.634 1.00 18.74 C +ATOM 811 C ALA A 107 20.007 26.744 3.329 1.00 16.80 C +ATOM 812 O ALA A 107 19.734 27.292 2.260 1.00 20.63 O +ATOM 813 CB ALA A 107 21.060 28.374 4.877 1.00 19.47 C +ATOM 814 N TRP A 108 20.371 25.465 3.434 1.00 16.46 N +ATOM 815 CA TRP A 108 20.532 24.624 2.241 1.00 14.68 C +ATOM 816 C TRP A 108 19.317 23.688 2.110 1.00 17.55 C +ATOM 817 O TRP A 108 19.240 22.816 2.993 1.00 20.05 O +ATOM 818 CB TRP A 108 21.840 23.826 2.338 1.00 16.18 C +ATOM 819 CG TRP A 108 23.000 24.736 2.026 1.00 15.50 C +ATOM 820 CD1 TRP A 108 23.360 25.234 0.803 1.00 15.45 C +ATOM 821 CD2 TRP A 108 23.798 25.437 2.991 1.00 15.57 C +ATOM 822 NE1 TRP A 108 24.414 26.102 0.952 1.00 17.40 N +ATOM 823 CE2 TRP A 108 24.711 26.237 2.272 1.00 15.78 C +ATOM 824 CE3 TRP A 108 23.833 25.426 4.379 1.00 12.79 C +ATOM 825 CZ2 TRP A 108 25.682 26.985 2.917 1.00 15.77 C +ATOM 826 CZ3 TRP A 108 24.773 26.200 5.033 1.00 16.28 C +ATOM 827 CH2 TRP A 108 25.691 26.960 4.298 1.00 16.65 C +ATOM 828 N VAL A 109 18.487 23.925 1.101 1.00 15.35 N +ATOM 829 CA VAL A 109 17.265 23.096 1.025 1.00 19.96 C +ATOM 830 C VAL A 109 17.573 21.611 0.884 1.00 17.16 C +ATOM 831 O VAL A 109 16.923 20.811 1.587 1.00 20.77 O +ATOM 832 CB VAL A 109 16.146 23.660 0.145 1.00 21.94 C +ATOM 833 CG1 VAL A 109 16.607 23.905 -1.285 1.00 27.84 C +ATOM 834 CG2 VAL A 109 14.901 22.783 0.136 1.00 21.22 C +ATOM 835 N ALA A 110 18.562 21.308 0.075 1.00 20.97 N +ATOM 836 CA ALA A 110 18.972 19.935 -0.237 1.00 18.78 C +ATOM 837 C ALA A 110 19.502 19.244 1.006 1.00 18.30 C +ATOM 838 O ALA A 110 19.197 18.046 1.174 1.00 18.47 O +ATOM 839 CB ALA A 110 19.857 19.777 -1.455 1.00 20.83 C +ATOM 840 N TRP A 111 20.121 19.983 1.892 1.00 16.62 N +ATOM 841 CA TRP A 111 20.551 19.500 3.202 1.00 15.74 C +ATOM 842 C TRP A 111 19.343 19.085 4.046 1.00 19.12 C +ATOM 843 O TRP A 111 19.284 17.986 4.643 1.00 16.20 O +ATOM 844 CB TRP A 111 21.486 20.451 3.925 1.00 14.63 C +ATOM 845 CG TRP A 111 21.858 19.904 5.252 1.00 14.87 C +ATOM 846 CD1 TRP A 111 22.856 18.975 5.486 1.00 18.11 C +ATOM 847 CD2 TRP A 111 21.199 20.093 6.504 1.00 16.63 C +ATOM 848 NE1 TRP A 111 22.848 18.592 6.808 1.00 17.16 N +ATOM 849 CE2 TRP A 111 21.798 19.221 7.435 1.00 16.77 C +ATOM 850 CE3 TRP A 111 20.182 20.959 6.908 1.00 15.16 C +ATOM 851 CZ2 TRP A 111 21.492 19.284 8.784 1.00 17.69 C +ATOM 852 CZ3 TRP A 111 19.818 20.954 8.240 1.00 16.88 C +ATOM 853 CH2 TRP A 111 20.443 20.110 9.162 1.00 19.73 C +ATOM 854 N ARG A 112 18.438 20.038 4.228 1.00 17.47 N +ATOM 855 CA ARG A 112 17.185 19.830 4.955 1.00 19.60 C +ATOM 856 C ARG A 112 16.472 18.593 4.391 1.00 17.68 C +ATOM 857 O ARG A 112 16.000 17.792 5.220 1.00 22.77 O +ATOM 858 CB ARG A 112 16.214 20.990 4.944 1.00 17.57 C +ATOM 859 CG ARG A 112 16.592 22.438 5.091 1.00 25.27 C +ATOM 860 CD ARG A 112 15.368 23.296 5.135 1.00 21.23 C +ATOM 861 NE ARG A 112 14.776 23.555 3.836 1.00 28.06 N +ATOM 862 CZ ARG A 112 14.785 24.695 3.143 1.00 27.89 C +ATOM 863 NH1 ARG A 112 15.596 25.721 3.383 1.00 30.12 N +ATOM 864 NH2 ARG A 112 13.717 25.008 2.398 1.00 30.39 N +ATOM 865 N ASN A 113 16.307 18.521 3.074 1.00 19.43 N +ATOM 866 CA ASN A 113 15.464 17.463 2.491 1.00 20.16 C +ATOM 867 C ASN A 113 16.111 16.083 2.586 1.00 21.26 C +ATOM 868 O ASN A 113 15.454 15.054 2.808 1.00 24.90 O +ATOM 869 CB ASN A 113 14.966 17.779 1.085 1.00 20.43 C +ATOM 870 CG ASN A 113 14.003 18.961 1.018 1.00 16.63 C +ATOM 871 OD1 ASN A 113 13.454 19.344 2.059 1.00 25.68 O +ATOM 872 ND2 ASN A 113 13.840 19.555 -0.159 1.00 22.00 N +ATOM 873 N ARG A 114 17.401 16.041 2.355 1.00 19.72 N +ATOM 874 CA ARG A 114 18.156 14.836 2.042 1.00 21.43 C +ATOM 875 C ARG A 114 19.258 14.440 2.991 1.00 22.71 C +ATOM 876 O ARG A 114 19.505 13.217 3.097 1.00 24.85 O +ATOM 877 CB ARG A 114 18.622 14.910 0.576 1.00 21.05 C +ATOM 878 CG ARG A 114 17.395 14.614 -0.300 1.00 26.59 C +ATOM 879 CD ARG A 114 17.729 14.399 -1.731 1.00 26.92 C +ATOM 880 NE ARG A 114 18.153 15.677 -2.301 1.00 33.46 N +ATOM 881 CZ ARG A 114 17.826 16.080 -3.535 1.00 32.00 C +ATOM 882 NH1 ARG A 114 17.378 15.225 -4.456 1.00 36.02 N +ATOM 883 NH2 ARG A 114 17.735 17.388 -3.796 1.00 36.05 N +ATOM 884 N CYS A 115 19.743 15.372 3.773 1.00 17.56 N +ATOM 885 CA CYS A 115 20.843 15.041 4.708 1.00 15.08 C +ATOM 886 C CYS A 115 20.448 14.933 6.159 1.00 16.64 C +ATOM 887 O CYS A 115 20.972 14.116 6.940 1.00 21.71 O +ATOM 888 CB CYS A 115 21.991 16.018 4.426 1.00 15.21 C +ATOM 889 SG CYS A 115 22.563 16.009 2.739 1.00 19.35 S +ATOM 890 N LYS A 116 19.714 15.918 6.619 1.00 18.76 N +ATOM 891 CA LYS A 116 19.332 16.085 8.025 1.00 19.14 C +ATOM 892 C LYS A 116 18.634 14.821 8.518 1.00 21.91 C +ATOM 893 O LYS A 116 17.819 14.234 7.785 1.00 24.78 O +ATOM 894 CB LYS A 116 18.492 17.363 8.126 1.00 21.01 C +ATOM 895 CG LYS A 116 17.930 17.512 9.547 1.00 21.28 C +ATOM 896 CD LYS A 116 16.745 18.481 9.554 1.00 25.86 C +ATOM 897 CE LYS A 116 16.658 19.147 10.918 1.00 25.58 C +ATOM 898 NZ LYS A 116 15.454 20.010 11.047 1.00 34.69 N +ATOM 899 N GLY A 117 19.152 14.318 9.635 1.00 26.39 N +ATOM 900 CA GLY A 117 18.558 13.126 10.267 1.00 29.06 C +ATOM 901 C GLY A 117 19.018 11.781 9.733 1.00 28.29 C +ATOM 902 O GLY A 117 18.499 10.733 10.164 1.00 31.90 O +ATOM 903 N THR A 118 19.892 11.802 8.740 1.00 26.88 N +ATOM 904 CA THR A 118 20.473 10.578 8.171 1.00 22.31 C +ATOM 905 C THR A 118 21.868 10.375 8.761 1.00 21.43 C +ATOM 906 O THR A 118 22.321 11.119 9.650 1.00 22.31 O +ATOM 907 CB THR A 118 20.440 10.571 6.598 1.00 18.59 C +ATOM 908 OG1 THR A 118 21.560 11.404 6.161 1.00 22.71 O +ATOM 909 CG2 THR A 118 19.095 11.104 6.074 1.00 21.13 C +ATOM 910 N ASP A 119 22.392 9.213 8.431 1.00 21.20 N +ATOM 911 CA ASP A 119 23.768 8.830 8.756 1.00 22.61 C +ATOM 912 C ASP A 119 24.713 9.543 7.779 1.00 20.13 C +ATOM 913 O ASP A 119 25.178 8.950 6.780 1.00 20.57 O +ATOM 914 CB ASP A 119 23.934 7.313 8.738 1.00 21.00 C +ATOM 915 CG ASP A 119 25.347 6.900 9.121 1.00 25.32 C +ATOM 916 OD1 ASP A 119 26.051 7.633 9.830 1.00 27.93 O +ATOM 917 OD2 ASP A 119 25.715 5.746 8.804 1.00 27.31 O +ATOM 918 N VAL A 120 24.988 10.793 8.094 1.00 23.41 N +ATOM 919 CA VAL A 120 25.886 11.637 7.306 1.00 20.10 C +ATOM 920 C VAL A 120 27.342 11.199 7.304 1.00 18.51 C +ATOM 921 O VAL A 120 28.099 11.604 6.406 1.00 19.95 O +ATOM 922 CB VAL A 120 25.721 13.134 7.630 1.00 19.91 C +ATOM 923 CG1 VAL A 120 24.356 13.655 7.183 1.00 23.59 C +ATOM 924 CG2 VAL A 120 26.088 13.478 9.055 1.00 20.79 C +ATOM 925 N GLN A 121 27.701 10.430 8.306 1.00 21.83 N +ATOM 926 CA GLN A 121 29.021 9.783 8.389 1.00 21.12 C +ATOM 927 C GLN A 121 29.317 8.861 7.207 1.00 20.78 C +ATOM 928 O GLN A 121 30.480 8.669 6.820 1.00 19.66 O +ATOM 929 CB GLN A 121 29.088 9.048 9.728 1.00 24.21 C +ATOM 930 CG GLN A 121 30.530 8.965 10.167 1.00 26.13 C +ATOM 931 CD GLN A 121 30.615 8.877 11.674 1.00 26.94 C +ATOM 932 OE1 GLN A 121 31.368 9.632 12.283 1.00 31.43 O +ATOM 933 NE2 GLN A 121 29.884 7.871 12.151 1.00 28.26 N +ATOM 934 N ALA A 122 28.300 8.271 6.576 1.00 17.62 N +ATOM 935 CA ALA A 122 28.390 7.548 5.311 1.00 19.46 C +ATOM 936 C ALA A 122 29.186 8.290 4.227 1.00 17.98 C +ATOM 937 O ALA A 122 30.031 7.710 3.523 1.00 21.35 O +ATOM 938 CB ALA A 122 26.999 7.244 4.783 1.00 18.29 C +ATOM 939 N TRP A 123 29.021 9.616 4.240 1.00 18.07 N +ATOM 940 CA TRP A 123 29.703 10.502 3.283 1.00 16.76 C +ATOM 941 C TRP A 123 31.218 10.581 3.392 1.00 16.76 C +ATOM 942 O TRP A 123 31.905 10.942 2.412 1.00 20.08 O +ATOM 943 CB TRP A 123 29.027 11.872 3.347 1.00 19.49 C +ATOM 944 CG TRP A 123 27.621 11.735 2.850 1.00 17.43 C +ATOM 945 CD1 TRP A 123 26.485 11.608 3.588 1.00 19.42 C +ATOM 946 CD2 TRP A 123 27.241 11.547 1.481 1.00 17.47 C +ATOM 947 NE1 TRP A 123 25.405 11.458 2.774 1.00 18.86 N +ATOM 948 CE2 TRP A 123 25.827 11.391 1.479 1.00 17.28 C +ATOM 949 CE3 TRP A 123 27.947 11.468 0.283 1.00 20.03 C +ATOM 950 CZ2 TRP A 123 25.111 11.184 0.311 1.00 18.33 C +ATOM 951 CZ3 TRP A 123 27.222 11.329 -0.886 1.00 20.85 C +ATOM 952 CH2 TRP A 123 25.835 11.127 -0.869 1.00 20.45 C +ATOM 953 N ILE A 124 31.741 10.269 4.554 1.00 14.19 N +ATOM 954 CA ILE A 124 33.186 10.292 4.801 1.00 16.82 C +ATOM 955 C ILE A 124 33.863 8.955 5.024 1.00 18.45 C +ATOM 956 O ILE A 124 35.100 8.892 5.134 1.00 21.02 O +ATOM 957 CB ILE A 124 33.504 11.403 5.863 1.00 17.69 C +ATOM 958 CG1 ILE A 124 32.956 10.984 7.234 1.00 18.86 C +ATOM 959 CG2 ILE A 124 33.024 12.804 5.387 1.00 21.01 C +ATOM 960 CD1 ILE A 124 33.729 11.437 8.488 1.00 22.81 C +ATOM 961 N ARG A 125 33.080 7.898 5.131 1.00 21.05 N +ATOM 962 CA ARG A 125 33.594 6.534 5.320 1.00 19.12 C +ATOM 963 C ARG A 125 34.311 6.113 4.036 1.00 17.52 C +ATOM 964 O ARG A 125 33.843 6.337 2.906 1.00 23.44 O +ATOM 965 CB ARG A 125 32.476 5.551 5.650 1.00 19.54 C +ATOM 966 CG ARG A 125 32.117 5.596 7.145 1.00 22.40 C +ATOM 967 CD ARG A 125 31.277 4.392 7.482 1.00 24.05 C +ATOM 968 NE ARG A 125 30.282 4.754 8.466 1.00 28.08 N +ATOM 969 CZ ARG A 125 28.984 4.993 8.331 1.00 23.40 C +ATOM 970 NH1 ARG A 125 28.334 4.690 7.207 1.00 23.69 N +ATOM 971 NH2 ARG A 125 28.392 5.549 9.392 1.00 23.77 N +ATOM 972 N GLY A 126 35.497 5.568 4.243 1.00 18.80 N +ATOM 973 CA GLY A 126 36.291 5.058 3.102 1.00 21.28 C +ATOM 974 C GLY A 126 37.334 6.066 2.658 1.00 22.50 C +ATOM 975 O GLY A 126 38.220 5.729 1.855 1.00 23.59 O +ATOM 976 N CYS A 127 37.335 7.221 3.297 1.00 19.05 N +ATOM 977 CA CYS A 127 38.234 8.333 2.961 1.00 19.13 C +ATOM 978 C CYS A 127 39.422 8.382 3.925 1.00 22.50 C +ATOM 979 O CYS A 127 39.206 8.267 5.138 1.00 21.64 O +ATOM 980 CB CYS A 127 37.453 9.628 2.990 1.00 18.75 C +ATOM 981 SG CYS A 127 36.010 9.816 1.936 1.00 19.93 S +ATOM 982 N ARG A 128 40.586 8.695 3.393 1.00 23.60 N +ATOM 983 CA ARG A 128 41.774 8.960 4.217 1.00 28.29 C +ATOM 984 C ARG A 128 41.820 10.438 4.578 1.00 25.64 C +ATOM 985 O ARG A 128 41.976 11.291 3.694 1.00 30.98 O +ATOM 986 CB ARG A 128 43.047 8.304 3.707 1.00 30.82 C +ATOM 987 CG ARG A 128 43.231 6.886 4.280 1.00 34.25 C +ATOM 988 CD ARG A 128 43.833 6.911 5.651 1.00 33.59 C +ATOM 989 NE ARG A 128 45.246 7.263 5.636 1.00 37.63 N +ATOM 990 CZ ARG A 128 45.862 8.258 6.281 1.00 38.37 C +ATOM 991 NH1 ARG A 128 45.241 9.069 7.151 1.00 38.97 N +ATOM 992 NH2 ARG A 128 47.134 8.554 5.973 1.00 40.22 N +ATOM 993 N LEU A 129 41.289 10.715 5.771 1.00 26.05 N +ATOM 994 CA LEU A 129 41.094 12.084 6.273 1.00 26.89 C +ATOM 995 C LEU A 129 42.119 12.382 7.370 1.00 29.58 C +ATOM 996 O LEU A 129 41.730 12.276 8.559 1.00 33.54 O +ATOM 997 CB LEU A 129 39.635 12.335 6.646 1.00 26.31 C +ATOM 998 CG LEU A 129 38.689 12.917 5.620 1.00 23.49 C +ATOM 999 CD1 LEU A 129 39.112 12.657 4.191 1.00 26.43 C +ATOM 1000 CD2 LEU A 129 37.310 12.325 5.886 1.00 25.15 C +ATOM 1001 OXT LEU A 129 43.232 12.675 6.905 1.00 34.20 O +TER 1002 LEU A 129 +HETATM 1003 O HOH A 130 23.434 40.063 -6.661 1.00 19.48 O +HETATM 1004 O HOH A 131 31.994 26.416 -6.047 0.90 22.43 O +HETATM 1005 O HOH A 132 30.250 13.337 9.787 0.98 20.93 O +HETATM 1006 O HOH A 133 22.384 42.331 -8.165 0.90 21.85 O +HETATM 1007 O HOH A 134 29.239 27.621 -3.670 1.00 17.47 O +HETATM 1008 O HOH A 135 29.464 37.761 -10.492 0.98 20.05 O +HETATM 1009 O HOH A 136 20.807 36.305 -11.082 1.00 18.47 O +HETATM 1010 O HOH A 137 41.318 17.849 -1.378 0.98 20.99 O +HETATM 1011 O HOH A 138 34.697 29.056 -4.039 0.89 22.31 O +HETATM 1012 O HOH A 139 26.871 17.298 13.496 1.00 20.31 O +HETATM 1013 O HOH A 140 32.131 11.050 -5.817 0.97 21.39 O +HETATM 1014 O HOH A 141 23.468 40.040 -2.372 0.91 23.40 O +HETATM 1015 O HOH A 142 21.390 45.524 -11.035 0.96 20.63 O +HETATM 1016 O HOH A 143 34.490 26.578 -5.741 0.75 22.11 O +HETATM 1017 O HOH A 144 16.422 34.139 -3.527 0.91 20.71 O +HETATM 1018 O HOH A 145 21.374 29.926 8.946 0.83 24.21 O +HETATM 1019 O HOH A 146 41.048 12.539 -0.011 0.70 22.71 O +HETATM 1020 O HOH A 147 32.794 35.686 2.558 0.78 20.71 O +HETATM 1021 O HOH A 148 49.648 8.964 6.343 0.83 21.93 O +HETATM 1022 O HOH A 149 14.452 34.901 -13.339 0.69 23.89 O +HETATM 1023 O HOH A 150 22.930 10.839 4.044 0.92 22.02 O +HETATM 1024 O HOH A 151 16.012 18.490 -2.200 0.85 24.37 O +HETATM 1025 O HOH A 152 12.130 21.587 3.044 0.78 24.35 O +HETATM 1026 O HOH A 153 15.684 38.922 -5.813 0.76 24.50 O +HETATM 1027 O HOH A 154 10.652 24.228 3.428 0.80 21.12 O +HETATM 1028 O HOH A 155 44.070 17.975 2.852 0.80 21.64 O +HETATM 1029 O HOH A 156 32.029 13.080 -8.110 0.85 20.63 O +HETATM 1030 O HOH A 157 36.425 19.613 15.174 0.56 23.44 O +HETATM 1031 O HOH A 158 37.941 30.505 -3.686 0.79 21.54 O +HETATM 1032 O HOH A 159 30.710 42.741 -6.289 0.72 22.79 O +HETATM 1033 O HOH A 160 23.922 44.367 -7.653 0.62 22.78 O +HETATM 1034 O HOH A 161 33.829 34.252 0.626 0.73 20.81 O +HETATM 1035 O HOH A 162 29.613 40.730 -9.602 0.78 22.12 O +HETATM 1036 O HOH A 163 23.563 7.995 4.406 0.58 22.93 O +HETATM 1037 O HOH A 164 31.511 42.362 -4.183 0.73 22.01 O +HETATM 1038 O HOH A 165 21.882 29.536 -15.013 0.81 22.04 O +HETATM 1039 O HOH A 166 37.763 20.913 9.782 0.86 21.57 O +HETATM 1040 O HOH A 167 42.338 17.481 5.165 0.65 22.17 O +HETATM 1041 O HOH A 168 23.344 39.739 -4.358 0.72 21.56 O +HETATM 1042 O HOH A 169 22.984 29.224 13.124 0.75 22.56 O +HETATM 1043 O HOH A 170 30.778 7.794 -3.514 0.65 21.58 O +HETATM 1044 O HOH A 171 42.965 14.657 4.991 0.63 23.91 O +HETATM 1045 O HOH A 172 36.927 17.948 -13.093 0.62 23.36 O +HETATM 1046 O HOH A 173 35.412 25.852 -11.575 0.58 23.42 O +HETATM 1047 O HOH A 174 37.428 32.540 -5.787 0.62 21.98 O +HETATM 1048 O HOH A 175 37.317 8.592 7.456 0.64 22.92 O +HETATM 1049 O HOH A 176 9.314 36.705 -11.546 0.69 23.77 O +HETATM 1050 O HOH A 177 39.972 23.760 -2.655 0.86 18.96 O +HETATM 1051 O HOH A 178 22.128 30.274 -0.543 0.76 18.78 O +HETATM 1052 O HOH A 179 22.244 15.813 10.000 0.68 19.66 O +HETATM 1053 O HOH A 180 40.729 9.223 0.292 0.64 20.15 O +HETATM 1054 O HOH A 181 12.500 15.267 4.097 0.56 20.12 O +HETATM 1055 O HOH A 182 20.372 28.618 -2.353 0.64 20.17 O +HETATM 1056 O HOH A 183 22.793 15.462 -6.673 0.63 20.60 O +HETATM 1057 O HOH A 184 23.138 31.809 15.121 0.55 20.90 O +HETATM 1058 O HOH A 185 22.671 38.691 8.245 0.48 21.16 O +HETATM 1059 O HOH A 186 33.966 33.112 6.837 0.59 19.45 O +HETATM 1060 O HOH A 187 19.572 25.423 -1.420 0.53 19.94 O +HETATM 1061 O HOH A 188 14.790 15.672 7.259 0.52 21.22 O +HETATM 1062 O HOH A 189 19.112 28.022 -14.647 0.49 19.83 O +HETATM 1063 O HOH A 190 17.302 39.059 -12.453 0.52 20.14 O +HETATM 1064 O HOH A 191 16.198 14.502 5.577 0.46 20.78 O +HETATM 1065 O HOH A 192 17.345 46.346 -7.080 0.50 18.13 O +HETATM 1066 O HOH A 193 14.992 31.300 -4.242 0.46 17.90 O +HETATM 1067 O HOH A 194 28.196 44.775 -3.148 0.44 18.15 O +HETATM 1068 O HOH A 195 29.479 13.863 -9.107 0.44 18.30 O +HETATM 1069 O HOH A 196 23.613 44.811 2.608 0.45 17.66 O +HETATM 1070 O HOH A 197 40.572 22.184 -6.358 0.42 18.06 O +HETATM 1071 O HOH A 198 12.475 31.860 -6.226 0.47 17.85 O +HETATM 1072 O HOH A 199 16.684 13.594 -5.832 0.31 18.51 O +HETATM 1073 O HOH A 200 27.534 38.059 -12.862 0.48 18.19 O +HETATM 1074 O HOH A 201 25.892 35.973 11.563 0.46 18.15 O +HETATM 1075 O HOH A 202 24.790 25.182 16.063 0.46 17.64 O +HETATM 1076 O HOH A 203 12.580 21.214 5.006 0.51 17.97 O +HETATM 1077 O HOH A 204 19.687 23.750 -4.851 0.37 18.08 O +HETATM 1078 O HOH A 205 27.098 35.956 -12.358 0.39 18.71 O +HETATM 1079 O HOH A 206 37.255 9.634 10.002 0.46 18.39 O +HETATM 1080 O HOH A 207 43.755 23.843 8.038 0.38 17.96 O +CONECT 48 981 +CONECT 238 889 +CONECT 513 630 +CONECT 601 724 +CONECT 630 513 +CONECT 724 601 +CONECT 889 238 +CONECT 981 48 +MASTER 290 0 0 8 2 0 0 6 1079 1 8 10 +END diff --git a/tools/colabfold/test-data/test_2.pdb b/tools/colabfold/test-data/test_2.pdb new file mode 100644 index 00000000000..5228267a3ff --- /dev/null +++ b/tools/colabfold/test-data/test_2.pdb @@ -0,0 +1,1436 @@ +HEADER HYDROLASE 19-MAY-97 1AKI +TITLE THE STRUCTURE OF THE ORTHORHOMBIC FORM OF HEN EGG-WHITE +TITLE 2 LYSOZYME AT 1.5 ANGSTROMS RESOLUTION +COMPND MOL_ID: 1; +COMPND 2 MOLECULE: LYSOZYME; +COMPND 3 CHAIN: A; +COMPND 4 EC: 3.2.1.17 +SOURCE MOL_ID: 1; +SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; +SOURCE 3 ORGANISM_COMMON: CHICKEN; +SOURCE 4 ORGANISM_TAXID: 9031; +SOURCE 5 CELL: EGG +KEYWDS HYDROLASE, GLYCOSIDASE +EXPDTA X-RAY DIFFRACTION +AUTHOR D.CARTER,J.HE,J.R.RUBLE,B.WRIGHT +REVDAT 2 24-FEB-09 1AKI 1 VERSN +REVDAT 1 19-NOV-97 1AKI 0 +JRNL AUTH P.J.ARTYMIUK,C.C.F.BLAKE,D.W.RICE,K.S.WILSON +JRNL TITL THE STRUCTURES OF THE MONOCLINIC AND ORTHORHOMBIC +JRNL TITL 2 FORMS OF HEN EGG-WHITE LYSOZYME AT 6 ANGSTROMS +JRNL TITL 3 RESOLUTION +JRNL REF ACTA CRYSTALLOGR.,SECT.B V. 38 778 1982 +JRNL REFN ISSN 0108-7681 +REMARK 1 +REMARK 2 +REMARK 2 RESOLUTION. 1.50 ANGSTROMS. +REMARK 3 +REMARK 3 REFINEMENT. +REMARK 3 PROGRAM : GPRLSA, X-PLOR +REMARK 3 AUTHORS : FUREY +REMARK 3 +REMARK 3 DATA USED IN REFINEMENT. +REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.50 +REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 10.00 +REMARK 3 DATA CUTOFF (SIGMA(F)) : 1.000 +REMARK 3 COMPLETENESS FOR RANGE (%) : 91.1 +REMARK 3 NUMBER OF REFLECTIONS : 16327 +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 + TEST SET) : NULL +REMARK 3 R VALUE (WORKING SET) : 0.212 +REMARK 3 FREE R VALUE : NULL +REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL +REMARK 3 FREE R VALUE TEST SET COUNT : NULL +REMARK 3 +REMARK 3 FIT/AGREEMENT OF MODEL WITH ALL DATA. +REMARK 3 R VALUE (WORKING + TEST SET, NO CUTOFF) : NULL +REMARK 3 R VALUE (WORKING SET, NO CUTOFF) : NULL +REMARK 3 FREE R VALUE (NO CUTOFF) : NULL +REMARK 3 FREE R VALUE TEST SET SIZE (%, NO CUTOFF) : NULL +REMARK 3 FREE R VALUE TEST SET COUNT (NO CUTOFF) : NULL +REMARK 3 TOTAL NUMBER OF REFLECTIONS (NO CUTOFF) : NULL +REMARK 3 +REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. +REMARK 3 PROTEIN ATOMS : 1001 +REMARK 3 NUCLEIC ACID ATOMS : 0 +REMARK 3 HETEROGEN ATOMS : 0 +REMARK 3 SOLVENT ATOMS : 78 +REMARK 3 +REMARK 3 B VALUES. +REMARK 3 FROM WILSON PLOT (A**2) : NULL +REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL +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) : 10.00 +REMARK 3 +REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. +REMARK 3 DISTANCE RESTRAINTS. RMS SIGMA +REMARK 3 BOND LENGTH (A) : 0.009 ; 0.010 +REMARK 3 ANGLE DISTANCE (A) : 0.003 ; 0.025 +REMARK 3 INTRAPLANAR 1-4 DISTANCE (A) : 0.024 ; 0.020 +REMARK 3 H-BOND OR METAL COORDINATION (A) : NULL ; NULL +REMARK 3 +REMARK 3 PLANE RESTRAINT (A) : 0.033 ; 0.030 +REMARK 3 CHIRAL-CENTER RESTRAINT (A**3) : 0.212 ; 0.200 +REMARK 3 +REMARK 3 NON-BONDED CONTACT RESTRAINTS. +REMARK 3 SINGLE TORSION (A) : 0.183 ; 0.300 +REMARK 3 MULTIPLE TORSION (A) : 0.159 ; 0.300 +REMARK 3 H-BOND (X...Y) (A) : 0.299 ; 0.300 +REMARK 3 H-BOND (X-H...Y) (A) : NULL ; NULL +REMARK 3 +REMARK 3 CONFORMATIONAL TORSION ANGLE RESTRAINTS. +REMARK 3 SPECIFIED (DEGREES) : NULL ; NULL +REMARK 3 PLANAR (DEGREES) : 7.900 ; 5.000 +REMARK 3 STAGGERED (DEGREES) : 17.800; 15.000 +REMARK 3 TRANSVERSE (DEGREES) : 18.900; 15.000 +REMARK 3 +REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA +REMARK 3 MAIN-CHAIN BOND (A**2) : 2.500 ; 3.000 +REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.900 ; 4.000 +REMARK 3 SIDE-CHAIN BOND (A**2) : 3.200 ; 4.000 +REMARK 3 SIDE-CHAIN ANGLE (A**2) : 3.600 ; 3.000 +REMARK 3 +REMARK 3 OTHER REFINEMENT REMARKS: NULL +REMARK 4 +REMARK 4 1AKI 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 : NOV-95 +REMARK 200 TEMPERATURE (KELVIN) : 298 +REMARK 200 PH : 4.48 +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 : GRAPHITE(002) +REMARK 200 OPTICS : NULL +REMARK 200 +REMARK 200 DETECTOR TYPE : IMAGE PLATE +REMARK 200 DETECTOR MANUFACTURER : RIGAKU RAXIS IIC +REMARK 200 INTENSITY-INTEGRATION SOFTWARE : RIGAKU +REMARK 200 DATA SCALING SOFTWARE : BIOTEX +REMARK 200 +REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 20571 +REMARK 200 RESOLUTION RANGE HIGH (A) : 1.500 +REMARK 200 RESOLUTION RANGE LOW (A) : 15.000 +REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 1.000 +REMARK 200 +REMARK 200 OVERALL. +REMARK 200 COMPLETENESS FOR RANGE (%) : 91.1 +REMARK 200 DATA REDUNDANCY : 3.100 +REMARK 200 R MERGE (I) : 0.04400 +REMARK 200 R SYM (I) : NULL +REMARK 200 FOR THE DATA SET : 11.7000 +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: MOLECULAR REPLACEMENT +REMARK 200 SOFTWARE USED: X-PLOR +REMARK 200 STARTING MODEL: PDB ENTRY 2LZH +REMARK 200 +REMARK 200 REMARK: NULL +REMARK 280 +REMARK 280 CRYSTAL +REMARK 280 SOLVENT CONTENT, VS (%): 42.84 +REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.15 +REMARK 280 +REMARK 280 CRYSTALLIZATION CONDITIONS: PH 4.48 +REMARK 290 +REMARK 290 CRYSTALLOGRAPHIC SYMMETRY +REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 +REMARK 290 +REMARK 290 SYMOP SYMMETRY +REMARK 290 NNNMMM OPERATOR +REMARK 290 1555 X,Y,Z +REMARK 290 2555 -X+1/2,-Y,Z+1/2 +REMARK 290 3555 -X,Y+1/2,-Z+1/2 +REMARK 290 4555 X+1/2,-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 29.53100 +REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 +REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 15.25850 +REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 +REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 34.22550 +REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 15.25850 +REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 29.53100 +REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 34.22550 +REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 +REMARK 290 +REMARK 290 REMARK: NULL +REMARK 300 +REMARK 300 BIOMOLECULE: 1 +REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM +REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN +REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON +REMARK 300 BURIED SURFACE AREA. +REMARK 350 +REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN +REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE +REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS +REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND +REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. +REMARK 350 +REMARK 350 BIOMOLECULE: 1 +REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: 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 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT +REMARK 500 +REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. +REMARK 500 +REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE +REMARK 500 NH2 ARG A 45 NH2 ARG A 68 2.16 +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: CLOSE CONTACTS +REMARK 500 +REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC +REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 +REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A +REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 +REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE +REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. +REMARK 500 +REMARK 500 DISTANCE CUTOFF: +REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS +REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS +REMARK 500 +REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE +REMARK 500 OD1 ASN A 19 ND2 ASN A 39 1556 2.09 +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: COVALENT BOND ANGLES +REMARK 500 +REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES +REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE +REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN +REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). +REMARK 500 +REMARK 500 STANDARD TABLE: +REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) +REMARK 500 +REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 +REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 +REMARK 500 +REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 +REMARK 500 ARG A 14 NE - CZ - NH1 ANGL. DEV. = -4.2 DEGREES +REMARK 500 ASP A 18 CB - CG - OD1 ANGL. DEV. = 6.1 DEGREES +REMARK 500 ARG A 21 CD - NE - CZ ANGL. DEV. = 13.6 DEGREES +REMARK 500 ARG A 21 NE - CZ - NH2 ANGL. DEV. = 5.1 DEGREES +REMARK 500 ARG A 45 NE - CZ - NH1 ANGL. DEV. = 4.6 DEGREES +REMARK 500 ARG A 45 NE - CZ - NH2 ANGL. DEV. = -5.7 DEGREES +REMARK 500 ASP A 66 CB - CG - OD1 ANGL. DEV. = 6.6 DEGREES +REMARK 500 ASP A 66 CB - CG - OD2 ANGL. DEV. = -7.2 DEGREES +REMARK 500 ARG A 68 NE - CZ - NH1 ANGL. DEV. = 8.8 DEGREES +REMARK 500 ARG A 68 NE - CZ - NH2 ANGL. DEV. = -6.5 DEGREES +REMARK 500 ARG A 73 NE - CZ - NH2 ANGL. DEV. = -4.4 DEGREES +REMARK 500 ASP A 87 CB - CG - OD1 ANGL. DEV. = 8.6 DEGREES +REMARK 500 ARG A 112 NE - CZ - NH1 ANGL. DEV. = 4.4 DEGREES +REMARK 500 ARG A 125 NE - CZ - NH2 ANGL. DEV. = -5.0 DEGREES +REMARK 500 ARG A 128 NE - CZ - NH1 ANGL. DEV. = 3.0 DEGREES +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: PLANAR GROUPS +REMARK 500 +REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL +REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE +REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN +REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS +REMARK 500 AN RMSD GREATER THAN THIS VALUE +REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; +REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). +REMARK 500 +REMARK 500 M RES CSSEQI RMS TYPE +REMARK 500 ARG A 14 0.12 SIDE_CHAIN +REMARK 500 ARG A 21 0.21 SIDE_CHAIN +REMARK 500 ARG A 68 0.15 SIDE_CHAIN +REMARK 500 ARG A 73 0.25 SIDE_CHAIN +REMARK 500 ARG A 112 0.15 SIDE_CHAIN +REMARK 500 ARG A 114 0.13 SIDE_CHAIN +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 ARG A 128 10.17 +REMARK 500 +REMARK 500 REMARK: NULL +DBREF 1AKI A 1 129 UNP P00698 LYSC_CHICK 19 147 +SEQRES 1 A 129 LYS VAL PHE GLY ARG CYS GLU LEU ALA ALA ALA MET LYS +SEQRES 2 A 129 ARG HIS GLY LEU ASP ASN TYR ARG GLY TYR SER LEU GLY +SEQRES 3 A 129 ASN TRP VAL CYS ALA ALA LYS PHE GLU SER ASN PHE ASN +SEQRES 4 A 129 THR GLN ALA THR ASN ARG ASN THR ASP GLY SER THR ASP +SEQRES 5 A 129 TYR GLY ILE LEU GLN ILE ASN SER ARG TRP TRP CYS ASN +SEQRES 6 A 129 ASP GLY ARG THR PRO GLY SER ARG ASN LEU CYS ASN ILE +SEQRES 7 A 129 PRO CYS SER ALA LEU LEU SER SER ASP ILE THR ALA SER +SEQRES 8 A 129 VAL ASN CYS ALA LYS LYS ILE VAL SER ASP GLY ASN GLY +SEQRES 9 A 129 MET ASN ALA TRP VAL ALA TRP ARG ASN ARG CYS LYS GLY +SEQRES 10 A 129 THR ASP VAL GLN ALA TRP ILE ARG GLY CYS ARG LEU +FORMUL 2 HOH *78(H2 O) +HELIX 1 1 ARG A 5 ARG A 14 1 10 +HELIX 2 2 TYR A 20 GLY A 22 5 3 +HELIX 3 3 LEU A 25 SER A 36 1 12 +HELIX 4 4 CYS A 80 LEU A 84 5 5 +HELIX 5 5 THR A 89 ASP A 101 1 13 +HELIX 6 6 GLY A 104 ALA A 107 5 4 +HELIX 7 7 VAL A 109 ARG A 114 1 6 +HELIX 8 8 VAL A 120 TRP A 123 5 4 +SHEET 1 A 2 THR A 43 ARG A 45 0 +SHEET 2 A 2 THR A 51 TYR A 53 -1 N ASP A 52 O ASN A 44 +SSBOND 1 CYS A 6 CYS A 127 1555 1555 1.97 +SSBOND 2 CYS A 30 CYS A 115 1555 1555 2.00 +SSBOND 3 CYS A 64 CYS A 80 1555 1555 1.99 +SSBOND 4 CYS A 76 CYS A 94 1555 1555 2.02 +CRYST1 59.062 68.451 30.517 90.00 90.00 90.00 P 21 21 21 4 +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 0.016931 0.000000 0.000000 0.00000 +SCALE2 0.000000 0.014609 0.000000 0.00000 +SCALE3 0.000000 0.000000 0.032769 0.00000 +ATOM 1 N LYS A 1 35.365 22.342 -11.980 1.00 22.28 N +ATOM 2 CA LYS A 1 35.892 21.073 -11.427 1.00 21.12 C +ATOM 3 C LYS A 1 34.741 20.264 -10.844 1.00 16.85 C +ATOM 4 O LYS A 1 33.945 20.813 -10.081 1.00 18.94 O +ATOM 5 CB LYS A 1 36.872 21.435 -10.306 1.00 20.78 C +ATOM 6 CG LYS A 1 37.453 20.248 -9.565 1.00 18.47 C +ATOM 7 CD LYS A 1 38.688 20.649 -8.775 1.00 20.32 C +ATOM 8 CE LYS A 1 39.057 19.508 -7.837 1.00 24.76 C +ATOM 9 NZ LYS A 1 40.423 19.771 -7.299 1.00 28.27 N +ATOM 10 N VAL A 2 34.739 18.961 -11.042 1.00 19.96 N +ATOM 11 CA VAL A 2 33.903 17.998 -10.333 1.00 18.10 C +ATOM 12 C VAL A 2 34.800 17.312 -9.294 1.00 19.39 C +ATOM 13 O VAL A 2 35.759 16.605 -9.665 1.00 22.14 O +ATOM 14 CB VAL A 2 33.140 17.034 -11.232 1.00 16.81 C +ATOM 15 CG1 VAL A 2 32.251 16.084 -10.434 1.00 21.92 C +ATOM 16 CG2 VAL A 2 32.294 17.714 -12.290 1.00 19.46 C +ATOM 17 N PHE A 3 34.491 17.546 -8.038 1.00 19.89 N +ATOM 18 CA PHE A 3 35.185 16.903 -6.918 1.00 17.43 C +ATOM 19 C PHE A 3 34.742 15.441 -6.771 1.00 15.70 C +ATOM 20 O PHE A 3 33.525 15.162 -6.862 1.00 18.52 O +ATOM 21 CB PHE A 3 34.967 17.632 -5.594 1.00 17.94 C +ATOM 22 CG PHE A 3 35.944 18.737 -5.375 1.00 16.78 C +ATOM 23 CD1 PHE A 3 35.666 20.050 -5.798 1.00 15.97 C +ATOM 24 CD2 PHE A 3 37.000 18.557 -4.473 1.00 19.95 C +ATOM 25 CE1 PHE A 3 36.577 21.076 -5.568 1.00 17.32 C +ATOM 26 CE2 PHE A 3 37.869 19.589 -4.157 1.00 17.65 C +ATOM 27 CZ PHE A 3 37.636 20.873 -4.666 1.00 17.91 C +ATOM 28 N GLY A 4 35.724 14.639 -6.331 1.00 16.79 N +ATOM 29 CA GLY A 4 35.366 13.280 -5.870 1.00 16.34 C +ATOM 30 C GLY A 4 34.924 13.420 -4.415 1.00 11.91 C +ATOM 31 O GLY A 4 35.303 14.403 -3.781 1.00 16.23 O +ATOM 32 N ARG A 5 34.053 12.538 -3.973 1.00 14.65 N +ATOM 33 CA ARG A 5 33.565 12.538 -2.588 1.00 15.91 C +ATOM 34 C ARG A 5 34.665 12.734 -1.556 1.00 15.38 C +ATOM 35 O ARG A 5 34.669 13.651 -0.704 1.00 13.15 O +ATOM 36 CB ARG A 5 32.765 11.262 -2.331 1.00 17.38 C +ATOM 37 CG ARG A 5 32.213 11.203 -0.920 1.00 13.79 C +ATOM 38 CD ARG A 5 31.375 10.001 -0.722 1.00 15.84 C +ATOM 39 NE ARG A 5 32.059 8.749 -0.958 1.00 18.74 N +ATOM 40 CZ ARG A 5 32.733 8.011 -0.097 1.00 15.19 C +ATOM 41 NH1 ARG A 5 32.836 8.332 1.187 1.00 17.50 N +ATOM 42 NH2 ARG A 5 33.245 6.836 -0.526 1.00 23.44 N +ATOM 43 N CYS A 6 35.674 11.853 -1.612 1.00 14.07 N +ATOM 44 CA CYS A 6 36.781 11.870 -0.654 1.00 14.62 C +ATOM 45 C CYS A 6 37.747 13.050 -0.777 1.00 10.99 C +ATOM 46 O CYS A 6 38.148 13.609 0.264 1.00 16.34 O +ATOM 47 CB CYS A 6 37.491 10.532 -0.621 1.00 16.90 C +ATOM 48 SG CYS A 6 36.540 9.205 0.140 1.00 18.61 S +ATOM 49 N GLU A 7 37.861 13.481 -2.019 1.00 14.24 N +ATOM 50 CA GLU A 7 38.685 14.686 -2.311 1.00 13.83 C +ATOM 51 C GLU A 7 38.049 15.926 -1.658 1.00 14.86 C +ATOM 52 O GLU A 7 38.744 16.729 -1.011 1.00 15.01 O +ATOM 53 CB GLU A 7 38.784 14.846 -3.818 1.00 14.85 C +ATOM 54 CG GLU A 7 39.540 16.051 -4.379 1.00 18.50 C +ATOM 55 CD GLU A 7 39.576 16.242 -5.870 1.00 20.16 C +ATOM 56 OE1 GLU A 7 38.672 15.644 -6.491 1.00 26.20 O +ATOM 57 OE2 GLU A 7 40.415 16.953 -6.381 1.00 25.49 O +ATOM 58 N LEU A 8 36.743 16.049 -1.819 1.00 15.18 N +ATOM 59 CA LEU A 8 35.964 17.158 -1.255 1.00 12.72 C +ATOM 60 C LEU A 8 36.051 17.132 0.266 1.00 9.45 C +ATOM 61 O LEU A 8 36.159 18.166 0.920 1.00 13.45 O +ATOM 62 CB LEU A 8 34.528 17.172 -1.811 1.00 14.31 C +ATOM 63 CG LEU A 8 33.718 18.354 -1.305 1.00 15.95 C +ATOM 64 CD1 LEU A 8 34.297 19.656 -1.841 1.00 16.56 C +ATOM 65 CD2 LEU A 8 32.246 18.143 -1.596 1.00 15.88 C +ATOM 66 N ALA A 9 35.754 15.980 0.828 1.00 14.24 N +ATOM 67 CA ALA A 9 35.838 15.757 2.284 1.00 13.25 C +ATOM 68 C ALA A 9 37.144 16.314 2.840 1.00 12.89 C +ATOM 69 O ALA A 9 37.151 16.978 3.897 1.00 14.78 O +ATOM 70 CB ALA A 9 35.656 14.287 2.623 1.00 13.89 C +ATOM 71 N ALA A 10 38.272 15.983 2.204 1.00 12.54 N +ATOM 72 CA ALA A 10 39.610 16.431 2.616 1.00 16.58 C +ATOM 73 C ALA A 10 39.736 17.944 2.459 1.00 15.35 C +ATOM 74 O ALA A 10 40.193 18.499 3.469 1.00 17.40 O +ATOM 75 CB ALA A 10 40.708 15.706 1.842 1.00 15.49 C +ATOM 76 N ALA A 11 39.227 18.519 1.385 1.00 13.54 N +ATOM 77 CA ALA A 11 39.264 19.982 1.223 1.00 15.23 C +ATOM 78 C ALA A 11 38.491 20.702 2.321 1.00 15.68 C +ATOM 79 O ALA A 11 38.946 21.658 2.953 1.00 16.87 O +ATOM 80 CB ALA A 11 38.869 20.421 -0.175 1.00 14.12 C +ATOM 81 N MET A 12 37.288 20.214 2.590 1.00 15.47 N +ATOM 82 CA MET A 12 36.398 20.781 3.612 1.00 13.69 C +ATOM 83 C MET A 12 36.990 20.715 5.007 1.00 12.55 C +ATOM 84 O MET A 12 36.906 21.637 5.840 1.00 17.69 O +ATOM 85 CB MET A 12 34.993 20.213 3.515 1.00 11.18 C +ATOM 86 CG MET A 12 34.320 20.724 2.265 1.00 15.06 C +ATOM 87 SD MET A 12 32.634 19.986 2.235 1.00 17.81 S +ATOM 88 CE MET A 12 31.788 21.135 1.138 1.00 18.08 C +ATOM 89 N LYS A 13 37.688 19.628 5.314 1.00 12.42 N +ATOM 90 CA LYS A 13 38.387 19.385 6.579 1.00 14.58 C +ATOM 91 C LYS A 13 39.460 20.467 6.731 1.00 14.55 C +ATOM 92 O LYS A 13 39.507 21.137 7.776 1.00 16.49 O +ATOM 93 CB LYS A 13 38.934 17.952 6.572 1.00 15.36 C +ATOM 94 CG LYS A 13 39.742 17.555 7.798 1.00 20.46 C +ATOM 95 CD LYS A 13 38.973 16.777 8.834 1.00 23.53 C +ATOM 96 CE LYS A 13 39.293 15.305 8.751 1.00 26.37 C +ATOM 97 NZ LYS A 13 38.077 14.461 8.946 1.00 30.88 N +ATOM 98 N ARG A 14 40.267 20.629 5.688 1.00 18.91 N +ATOM 99 CA ARG A 14 41.387 21.577 5.713 1.00 17.66 C +ATOM 100 C ARG A 14 40.927 23.017 5.881 1.00 16.78 C +ATOM 101 O ARG A 14 41.557 23.834 6.584 1.00 20.06 O +ATOM 102 CB ARG A 14 42.388 21.351 4.601 1.00 20.89 C +ATOM 103 CG ARG A 14 42.173 22.079 3.289 1.00 25.07 C +ATOM 104 CD ARG A 14 43.444 22.075 2.490 1.00 23.98 C +ATOM 105 NE ARG A 14 43.687 20.710 2.012 1.00 31.92 N +ATOM 106 CZ ARG A 14 43.098 20.255 0.892 1.00 26.04 C +ATOM 107 NH1 ARG A 14 42.695 21.186 0.018 1.00 33.46 N +ATOM 108 NH2 ARG A 14 42.949 18.957 0.689 1.00 25.91 N +ATOM 109 N HIS A 15 39.681 23.247 5.463 1.00 17.84 N +ATOM 110 CA HIS A 15 39.075 24.591 5.526 1.00 15.99 C +ATOM 111 C HIS A 15 38.310 24.861 6.814 1.00 17.70 C +ATOM 112 O HIS A 15 37.608 25.875 6.952 1.00 22.68 O +ATOM 113 CB HIS A 15 38.223 24.918 4.285 1.00 19.19 C +ATOM 114 CG HIS A 15 39.085 25.388 3.171 1.00 20.14 C +ATOM 115 ND1 HIS A 15 39.457 24.635 2.091 1.00 24.53 N +ATOM 116 CD2 HIS A 15 39.739 26.570 2.993 1.00 24.44 C +ATOM 117 CE1 HIS A 15 40.211 25.312 1.258 1.00 20.68 C +ATOM 118 NE2 HIS A 15 40.524 26.419 1.889 1.00 27.34 N +ATOM 119 N GLY A 16 38.296 23.927 7.720 1.00 17.50 N +ATOM 120 CA GLY A 16 37.765 24.025 9.072 1.00 18.71 C +ATOM 121 C GLY A 16 36.264 23.799 9.210 1.00 18.40 C +ATOM 122 O GLY A 16 35.646 24.400 10.127 1.00 21.57 O +ATOM 123 N LEU A 17 35.665 23.073 8.274 1.00 17.56 N +ATOM 124 CA LEU A 17 34.238 22.795 8.298 1.00 15.38 C +ATOM 125 C LEU A 17 33.845 21.682 9.266 1.00 18.28 C +ATOM 126 O LEU A 17 32.643 21.594 9.552 1.00 18.24 O +ATOM 127 CB LEU A 17 33.648 22.647 6.901 1.00 15.02 C +ATOM 128 CG LEU A 17 33.451 23.889 6.060 1.00 16.08 C +ATOM 129 CD1 LEU A 17 32.933 23.420 4.705 1.00 13.83 C +ATOM 130 CD2 LEU A 17 32.556 24.946 6.679 1.00 18.60 C +ATOM 131 N ASP A 18 34.785 20.814 9.605 1.00 16.36 N +ATOM 132 CA ASP A 18 34.492 19.722 10.526 1.00 16.25 C +ATOM 133 C ASP A 18 34.015 20.222 11.901 1.00 17.32 C +ATOM 134 O ASP A 18 34.826 20.778 12.658 1.00 20.27 O +ATOM 135 CB ASP A 18 35.557 18.633 10.598 1.00 19.37 C +ATOM 136 CG ASP A 18 35.017 17.408 11.311 1.00 20.25 C +ATOM 137 OD1 ASP A 18 33.805 17.154 11.455 1.00 21.00 O +ATOM 138 OD2 ASP A 18 35.925 16.603 11.662 1.00 27.06 O +ATOM 139 N ASN A 19 32.746 19.990 12.205 1.00 18.55 N +ATOM 140 CA ASN A 19 32.123 20.431 13.448 1.00 17.19 C +ATOM 141 C ASN A 19 31.854 21.941 13.497 1.00 16.61 C +ATOM 142 O ASN A 19 31.426 22.398 14.573 1.00 18.56 O +ATOM 143 CB ASN A 19 32.767 20.004 14.770 1.00 18.92 C +ATOM 144 CG ASN A 19 32.162 20.512 16.064 1.00 24.64 C +ATOM 145 OD1 ASN A 19 30.967 20.273 16.355 1.00 32.53 O +ATOM 146 ND2 ASN A 19 32.847 21.361 16.852 1.00 24.14 N +ATOM 147 N TYR A 20 31.969 22.650 12.406 1.00 16.84 N +ATOM 148 CA TYR A 20 31.707 24.099 12.411 1.00 15.54 C +ATOM 149 C TYR A 20 30.231 24.343 12.759 1.00 15.81 C +ATOM 150 O TYR A 20 29.288 23.874 12.118 1.00 16.89 O +ATOM 151 CB TYR A 20 32.070 24.736 11.066 1.00 18.16 C +ATOM 152 CG TYR A 20 32.061 26.250 11.144 1.00 20.28 C +ATOM 153 CD1 TYR A 20 33.141 26.886 11.760 1.00 21.42 C +ATOM 154 CD2 TYR A 20 30.979 27.004 10.691 1.00 20.44 C +ATOM 155 CE1 TYR A 20 33.206 28.277 11.794 1.00 22.24 C +ATOM 156 CE2 TYR A 20 31.018 28.399 10.779 1.00 21.36 C +ATOM 157 CZ TYR A 20 32.102 29.017 11.383 1.00 19.38 C +ATOM 158 OH TYR A 20 32.136 30.371 11.525 1.00 26.77 O +ATOM 159 N ARG A 21 30.088 25.142 13.803 1.00 18.43 N +ATOM 160 CA ARG A 21 28.774 25.553 14.319 1.00 15.68 C +ATOM 161 C ARG A 21 27.964 24.312 14.623 1.00 15.17 C +ATOM 162 O ARG A 21 26.733 24.333 14.606 1.00 18.36 O +ATOM 163 CB ARG A 21 28.014 26.565 13.453 1.00 19.21 C +ATOM 164 CG ARG A 21 28.507 27.995 13.535 1.00 21.50 C +ATOM 165 CD ARG A 21 28.110 28.755 14.765 1.00 25.00 C +ATOM 166 NE ARG A 21 29.319 29.321 15.324 1.00 30.37 N +ATOM 167 CZ ARG A 21 30.215 30.234 14.978 1.00 29.02 C +ATOM 168 NH1 ARG A 21 31.501 29.856 14.846 1.00 29.04 N +ATOM 169 NH2 ARG A 21 29.938 31.437 14.495 1.00 31.89 N +ATOM 170 N GLY A 22 28.689 23.250 14.998 1.00 17.81 N +ATOM 171 CA GLY A 22 28.103 22.021 15.519 1.00 17.72 C +ATOM 172 C GLY A 22 27.748 21.018 14.436 1.00 18.89 C +ATOM 173 O GLY A 22 27.085 20.022 14.784 1.00 23.26 O +ATOM 174 N TYR A 23 28.209 21.230 13.216 1.00 18.20 N +ATOM 175 CA TYR A 23 27.887 20.318 12.111 1.00 15.42 C +ATOM 176 C TYR A 23 29.124 19.533 11.628 1.00 16.30 C +ATOM 177 O TYR A 23 30.045 20.191 11.139 1.00 16.66 O +ATOM 178 CB TYR A 23 27.351 21.107 10.913 1.00 15.82 C +ATOM 179 CG TYR A 23 26.001 21.745 11.127 1.00 15.96 C +ATOM 180 CD1 TYR A 23 24.846 20.962 11.139 1.00 14.81 C +ATOM 181 CD2 TYR A 23 25.897 23.096 11.458 1.00 16.60 C +ATOM 182 CE1 TYR A 23 23.600 21.518 11.422 1.00 17.08 C +ATOM 183 CE2 TYR A 23 24.647 23.673 11.726 1.00 19.34 C +ATOM 184 CZ TYR A 23 23.518 22.881 11.701 1.00 19.21 C +ATOM 185 OH TYR A 23 22.289 23.438 11.912 1.00 25.61 O +ATOM 186 N SER A 24 29.029 18.223 11.810 1.00 15.35 N +ATOM 187 CA SER A 24 30.143 17.347 11.414 1.00 16.89 C +ATOM 188 C SER A 24 30.359 17.379 9.895 1.00 15.61 C +ATOM 189 O SER A 24 29.442 17.687 9.139 1.00 13.88 O +ATOM 190 CB SER A 24 29.922 15.934 11.907 1.00 17.54 C +ATOM 191 OG SER A 24 28.799 15.336 11.308 1.00 19.85 O +ATOM 192 N LEU A 25 31.593 17.028 9.540 1.00 16.08 N +ATOM 193 CA LEU A 25 32.035 17.092 8.138 1.00 13.16 C +ATOM 194 C LEU A 25 31.030 16.437 7.183 1.00 13.39 C +ATOM 195 O LEU A 25 30.874 16.924 6.056 1.00 15.34 O +ATOM 196 CB LEU A 25 33.410 16.409 8.084 1.00 13.47 C +ATOM 197 CG LEU A 25 34.015 16.477 6.689 1.00 12.91 C +ATOM 198 CD1 LEU A 25 34.174 17.929 6.289 1.00 13.04 C +ATOM 199 CD2 LEU A 25 35.398 15.810 6.752 1.00 14.54 C +ATOM 200 N GLY A 26 30.501 15.280 7.576 1.00 13.10 N +ATOM 201 CA GLY A 26 29.539 14.561 6.756 1.00 13.88 C +ATOM 202 C GLY A 26 28.338 15.378 6.277 1.00 12.12 C +ATOM 203 O GLY A 26 27.886 15.250 5.120 1.00 13.13 O +ATOM 204 N ASN A 27 27.905 16.281 7.161 1.00 12.16 N +ATOM 205 CA ASN A 27 26.827 17.227 6.857 1.00 14.74 C +ATOM 206 C ASN A 27 27.164 18.015 5.597 1.00 15.43 C +ATOM 207 O ASN A 27 26.317 18.208 4.720 1.00 15.27 O +ATOM 208 CB ASN A 27 26.484 18.126 8.054 1.00 12.34 C +ATOM 209 CG ASN A 27 25.681 17.267 9.048 1.00 12.22 C +ATOM 210 OD1 ASN A 27 24.511 16.933 8.820 1.00 17.40 O +ATOM 211 ND2 ASN A 27 26.348 17.052 10.169 1.00 18.27 N +ATOM 212 N TRP A 28 28.344 18.591 5.583 1.00 16.78 N +ATOM 213 CA TRP A 28 28.831 19.475 4.513 1.00 16.49 C +ATOM 214 C TRP A 28 28.940 18.741 3.183 1.00 12.99 C +ATOM 215 O TRP A 28 28.742 19.321 2.090 1.00 13.97 O +ATOM 216 CB TRP A 28 30.104 20.145 5.023 1.00 14.55 C +ATOM 217 CG TRP A 28 29.941 20.978 6.251 1.00 11.93 C +ATOM 218 CD1 TRP A 28 30.176 20.624 7.546 1.00 14.42 C +ATOM 219 CD2 TRP A 28 29.319 22.284 6.287 1.00 13.11 C +ATOM 220 NE1 TRP A 28 29.924 21.690 8.365 1.00 16.94 N +ATOM 221 CE2 TRP A 28 29.337 22.679 7.641 1.00 14.07 C +ATOM 222 CE3 TRP A 28 28.894 23.168 5.295 1.00 15.97 C +ATOM 223 CZ2 TRP A 28 28.913 23.943 8.038 1.00 18.07 C +ATOM 224 CZ3 TRP A 28 28.398 24.404 5.682 1.00 18.26 C +ATOM 225 CH2 TRP A 28 28.431 24.766 7.025 1.00 17.18 C +ATOM 226 N VAL A 29 29.572 17.543 3.261 1.00 13.00 N +ATOM 227 CA VAL A 29 29.729 16.711 2.047 1.00 14.15 C +ATOM 228 C VAL A 29 28.379 16.340 1.429 1.00 10.43 C +ATOM 229 O VAL A 29 28.166 16.496 0.228 1.00 13.40 O +ATOM 230 CB VAL A 29 30.649 15.492 2.359 1.00 12.76 C +ATOM 231 CG1 VAL A 29 30.782 14.596 1.136 1.00 15.37 C +ATOM 232 CG2 VAL A 29 32.010 16.050 2.772 1.00 14.18 C +ATOM 233 N CYS A 30 27.501 15.906 2.299 1.00 15.32 N +ATOM 234 CA CYS A 30 26.115 15.567 1.991 1.00 15.59 C +ATOM 235 C CYS A 30 25.388 16.723 1.302 1.00 12.37 C +ATOM 236 O CYS A 30 24.894 16.516 0.172 1.00 14.44 O +ATOM 237 CB CYS A 30 25.343 15.046 3.172 1.00 14.99 C +ATOM 238 SG CYS A 30 23.719 14.376 2.695 1.00 17.71 S +ATOM 239 N ALA A 31 25.533 17.913 1.870 1.00 16.06 N +ATOM 240 CA ALA A 31 24.949 19.130 1.305 1.00 15.82 C +ATOM 241 C ALA A 31 25.487 19.354 -0.115 1.00 15.34 C +ATOM 242 O ALA A 31 24.675 19.686 -0.998 1.00 16.00 O +ATOM 243 CB ALA A 31 25.167 20.335 2.200 1.00 14.90 C +ATOM 244 N ALA A 32 26.807 19.354 -0.286 1.00 11.93 N +ATOM 245 CA ALA A 32 27.461 19.536 -1.579 1.00 13.08 C +ATOM 246 C ALA A 32 26.943 18.538 -2.620 1.00 12.38 C +ATOM 247 O ALA A 32 26.767 18.857 -3.789 1.00 13.89 O +ATOM 248 CB ALA A 32 28.982 19.476 -1.398 1.00 14.17 C +ATOM 249 N LYS A 33 26.731 17.303 -2.193 1.00 15.16 N +ATOM 250 CA LYS A 33 26.261 16.216 -3.037 1.00 16.16 C +ATOM 251 C LYS A 33 24.903 16.555 -3.658 1.00 15.04 C +ATOM 252 O LYS A 33 24.806 16.511 -4.890 1.00 15.00 O +ATOM 253 CB LYS A 33 26.221 14.860 -2.351 1.00 16.71 C +ATOM 254 CG LYS A 33 25.697 13.696 -3.185 1.00 19.51 C +ATOM 255 CD LYS A 33 26.498 13.400 -4.446 1.00 17.12 C +ATOM 256 CE LYS A 33 25.686 12.464 -5.331 1.00 24.06 C +ATOM 257 NZ LYS A 33 26.423 11.979 -6.525 1.00 26.78 N +ATOM 258 N PHE A 34 23.972 16.946 -2.817 1.00 16.81 N +ATOM 259 CA PHE A 34 22.569 17.125 -3.247 1.00 17.51 C +ATOM 260 C PHE A 34 22.346 18.506 -3.836 1.00 18.19 C +ATOM 261 O PHE A 34 21.504 18.692 -4.759 1.00 20.21 O +ATOM 262 CB PHE A 34 21.626 16.673 -2.130 1.00 18.58 C +ATOM 263 CG PHE A 34 21.644 15.172 -1.965 1.00 22.22 C +ATOM 264 CD1 PHE A 34 21.209 14.353 -3.007 1.00 20.24 C +ATOM 265 CD2 PHE A 34 22.272 14.627 -0.851 1.00 20.00 C +ATOM 266 CE1 PHE A 34 21.372 12.961 -2.910 1.00 22.03 C +ATOM 267 CE2 PHE A 34 22.443 13.245 -0.743 1.00 21.96 C +ATOM 268 CZ PHE A 34 21.923 12.406 -1.737 1.00 20.77 C +ATOM 269 N GLU A 35 23.251 19.415 -3.451 1.00 15.27 N +ATOM 270 CA GLU A 35 23.178 20.789 -3.996 1.00 15.45 C +ATOM 271 C GLU A 35 23.661 20.944 -5.423 1.00 17.45 C +ATOM 272 O GLU A 35 23.014 21.514 -6.310 1.00 17.91 O +ATOM 273 CB GLU A 35 23.698 21.892 -3.107 1.00 14.42 C +ATOM 274 CG GLU A 35 22.994 22.212 -1.809 1.00 11.08 C +ATOM 275 CD GLU A 35 21.631 22.846 -1.864 1.00 13.55 C +ATOM 276 OE1 GLU A 35 21.408 23.360 -2.981 1.00 20.77 O +ATOM 277 OE2 GLU A 35 20.947 23.032 -0.874 1.00 22.72 O +ATOM 278 N SER A 36 24.867 20.483 -5.674 1.00 15.66 N +ATOM 279 CA SER A 36 25.626 20.615 -6.903 1.00 17.79 C +ATOM 280 C SER A 36 26.139 19.341 -7.569 1.00 16.97 C +ATOM 281 O SER A 36 26.750 19.464 -8.642 1.00 21.78 O +ATOM 282 CB SER A 36 26.830 21.528 -6.654 1.00 18.12 C +ATOM 283 OG SER A 36 27.747 20.951 -5.748 1.00 15.16 O +ATOM 284 N ASN A 37 25.957 18.222 -6.927 1.00 20.15 N +ATOM 285 CA ASN A 37 26.628 16.968 -7.297 1.00 20.85 C +ATOM 286 C ASN A 37 28.149 17.091 -7.302 1.00 19.72 C +ATOM 287 O ASN A 37 28.813 16.627 -8.254 1.00 20.79 O +ATOM 288 CB ASN A 37 26.028 16.490 -8.617 1.00 20.82 C +ATOM 289 CG ASN A 37 26.156 14.980 -8.782 1.00 23.63 C +ATOM 290 OD1 ASN A 37 26.640 14.266 -7.885 1.00 28.05 O +ATOM 291 ND2 ASN A 37 25.867 14.506 -9.990 1.00 29.61 N +ATOM 292 N PHE A 38 28.691 17.882 -6.383 1.00 16.12 N +ATOM 293 CA PHE A 38 30.129 18.115 -6.279 1.00 14.75 C +ATOM 294 C PHE A 38 30.717 18.903 -7.448 1.00 13.86 C +ATOM 295 O PHE A 38 31.923 18.794 -7.702 1.00 16.66 O +ATOM 296 CB PHE A 38 30.914 16.823 -6.047 1.00 17.09 C +ATOM 297 CG PHE A 38 30.487 16.006 -4.863 1.00 15.96 C +ATOM 298 CD1 PHE A 38 30.100 16.572 -3.655 1.00 15.43 C +ATOM 299 CD2 PHE A 38 30.507 14.603 -4.993 1.00 17.66 C +ATOM 300 CE1 PHE A 38 29.766 15.808 -2.558 1.00 16.83 C +ATOM 301 CE2 PHE A 38 30.136 13.814 -3.891 1.00 15.86 C +ATOM 302 CZ PHE A 38 29.835 14.410 -2.646 1.00 18.90 C +ATOM 303 N ASN A 39 29.936 19.792 -8.033 1.00 17.63 N +ATOM 304 CA ASN A 39 30.341 20.573 -9.199 1.00 16.77 C +ATOM 305 C ASN A 39 30.543 22.034 -8.823 1.00 17.13 C +ATOM 306 O ASN A 39 29.544 22.649 -8.423 1.00 17.24 O +ATOM 307 CB ASN A 39 29.406 20.300 -10.366 1.00 17.40 C +ATOM 308 CG ASN A 39 29.876 20.771 -11.716 1.00 16.96 C +ATOM 309 OD1 ASN A 39 30.579 21.750 -11.956 1.00 23.22 O +ATOM 310 ND2 ASN A 39 29.578 19.864 -12.653 1.00 26.35 N +ATOM 311 N THR A 40 31.766 22.492 -8.928 1.00 14.88 N +ATOM 312 CA THR A 40 32.139 23.869 -8.657 1.00 16.08 C +ATOM 313 C THR A 40 31.504 24.890 -9.589 1.00 16.31 C +ATOM 314 O THR A 40 31.316 26.054 -9.213 1.00 17.50 O +ATOM 315 CB THR A 40 33.684 24.103 -8.422 1.00 17.07 C +ATOM 316 OG1 THR A 40 34.270 24.156 -9.775 1.00 23.76 O +ATOM 317 CG2 THR A 40 34.414 23.119 -7.491 1.00 16.46 C +ATOM 318 N GLN A 41 31.001 24.430 -10.706 1.00 16.39 N +ATOM 319 CA GLN A 41 30.524 25.291 -11.812 1.00 16.67 C +ATOM 320 C GLN A 41 28.993 25.381 -11.874 1.00 15.44 C +ATOM 321 O GLN A 41 28.504 26.019 -12.837 1.00 18.55 O +ATOM 322 CB GLN A 41 31.047 24.817 -13.168 1.00 19.65 C +ATOM 323 CG GLN A 41 32.549 25.004 -13.279 1.00 21.26 C +ATOM 324 CD GLN A 41 32.763 26.236 -14.129 1.00 26.23 C +ATOM 325 OE1 GLN A 41 32.356 26.308 -15.291 1.00 24.68 O +ATOM 326 NE2 GLN A 41 33.276 27.231 -13.420 1.00 25.96 N +ATOM 327 N ALA A 42 28.329 24.640 -11.012 1.00 15.95 N +ATOM 328 CA ALA A 42 26.859 24.579 -11.061 1.00 17.42 C +ATOM 329 C ALA A 42 26.257 25.969 -10.807 1.00 18.93 C +ATOM 330 O ALA A 42 26.645 26.686 -9.884 1.00 17.00 O +ATOM 331 CB ALA A 42 26.355 23.604 -9.998 1.00 22.79 C +ATOM 332 N THR A 43 25.276 26.293 -11.643 1.00 18.30 N +ATOM 333 CA THR A 43 24.441 27.490 -11.476 1.00 17.73 C +ATOM 334 C THR A 43 22.976 27.112 -11.714 1.00 19.61 C +ATOM 335 O THR A 43 22.715 26.271 -12.594 1.00 22.06 O +ATOM 336 CB THR A 43 24.814 28.728 -12.375 1.00 17.58 C +ATOM 337 OG1 THR A 43 24.555 28.321 -13.756 1.00 20.94 O +ATOM 338 CG2 THR A 43 26.247 29.213 -12.184 1.00 18.26 C +ATOM 339 N ASN A 44 22.088 27.742 -10.971 1.00 19.77 N +ATOM 340 CA ASN A 44 20.640 27.497 -11.108 1.00 19.51 C +ATOM 341 C ASN A 44 19.903 28.842 -10.963 1.00 14.85 C +ATOM 342 O ASN A 44 20.169 29.600 -10.033 1.00 19.43 O +ATOM 343 CB ASN A 44 20.155 26.480 -10.080 1.00 19.93 C +ATOM 344 CG ASN A 44 18.646 26.315 -10.115 1.00 22.01 C +ATOM 345 OD1 ASN A 44 18.128 25.720 -11.078 1.00 29.53 O +ATOM 346 ND2 ASN A 44 17.906 26.927 -9.188 1.00 22.94 N +ATOM 347 N ARG A 45 19.058 29.117 -11.924 1.00 16.90 N +ATOM 348 CA ARG A 45 18.303 30.363 -12.015 1.00 18.37 C +ATOM 349 C ARG A 45 16.955 30.163 -11.326 1.00 18.76 C +ATOM 350 O ARG A 45 16.396 29.062 -11.425 1.00 20.87 O +ATOM 351 CB ARG A 45 18.143 30.836 -13.462 1.00 19.30 C +ATOM 352 CG ARG A 45 17.012 31.859 -13.557 1.00 23.98 C +ATOM 353 CD ARG A 45 17.502 33.134 -12.930 1.00 23.36 C +ATOM 354 NE ARG A 45 18.311 33.758 -13.981 1.00 29.56 N +ATOM 355 CZ ARG A 45 17.620 34.271 -15.020 1.00 27.18 C +ATOM 356 NH1 ARG A 45 16.287 34.331 -15.098 1.00 31.99 N +ATOM 357 NH2 ARG A 45 18.374 34.698 -16.030 1.00 32.43 N +ATOM 358 N ASN A 46 16.553 31.171 -10.554 1.00 18.13 N +ATOM 359 CA ASN A 46 15.304 31.071 -9.782 1.00 20.10 C +ATOM 360 C ASN A 46 14.261 32.063 -10.313 1.00 17.35 C +ATOM 361 O ASN A 46 14.617 33.104 -10.880 1.00 19.15 O +ATOM 362 CB ASN A 46 15.576 31.229 -8.295 1.00 20.05 C +ATOM 363 CG ASN A 46 16.543 30.240 -7.679 1.00 20.12 C +ATOM 364 OD1 ASN A 46 17.659 30.661 -7.346 1.00 21.21 O +ATOM 365 ND2 ASN A 46 16.125 28.975 -7.600 1.00 19.44 N +ATOM 366 N THR A 47 13.027 31.834 -9.887 1.00 19.96 N +ATOM 367 CA THR A 47 11.871 32.654 -10.246 1.00 19.12 C +ATOM 368 C THR A 47 12.001 34.107 -9.810 1.00 19.44 C +ATOM 369 O THR A 47 11.600 34.969 -10.606 1.00 23.16 O +ATOM 370 CB THR A 47 10.499 32.017 -9.789 1.00 17.70 C +ATOM 371 OG1 THR A 47 10.507 32.195 -8.342 1.00 23.76 O +ATOM 372 CG2 THR A 47 10.331 30.554 -10.188 1.00 22.66 C +ATOM 373 N ASP A 48 12.625 34.377 -8.683 1.00 19.25 N +ATOM 374 CA ASP A 48 12.885 35.716 -8.168 1.00 17.33 C +ATOM 375 C ASP A 48 14.010 36.505 -8.823 1.00 17.71 C +ATOM 376 O ASP A 48 14.246 37.621 -8.309 1.00 23.04 O +ATOM 377 CB ASP A 48 13.023 35.735 -6.640 1.00 18.02 C +ATOM 378 CG ASP A 48 14.367 35.174 -6.168 1.00 17.88 C +ATOM 379 OD1 ASP A 48 15.104 34.602 -6.991 1.00 18.55 O +ATOM 380 OD2 ASP A 48 14.750 35.442 -5.013 1.00 22.86 O +ATOM 381 N GLY A 49 14.650 36.018 -9.862 1.00 17.62 N +ATOM 382 CA GLY A 49 15.744 36.702 -10.546 1.00 17.27 C +ATOM 383 C GLY A 49 17.147 36.315 -10.096 1.00 16.80 C +ATOM 384 O GLY A 49 18.168 36.688 -10.694 1.00 20.27 O +ATOM 385 N SER A 50 17.173 35.661 -8.930 1.00 19.61 N +ATOM 386 CA SER A 50 18.435 35.225 -8.279 1.00 14.28 C +ATOM 387 C SER A 50 18.977 33.963 -8.941 1.00 18.09 C +ATOM 388 O SER A 50 18.273 33.255 -9.697 1.00 16.76 O +ATOM 389 CB SER A 50 18.272 35.089 -6.781 1.00 17.64 C +ATOM 390 OG SER A 50 17.530 33.930 -6.463 1.00 17.54 O +ATOM 391 N THR A 51 20.271 33.766 -8.734 1.00 16.00 N +ATOM 392 CA THR A 51 20.970 32.557 -9.202 1.00 13.82 C +ATOM 393 C THR A 51 21.718 31.969 -8.000 1.00 14.58 C +ATOM 394 O THR A 51 22.160 32.712 -7.119 1.00 13.28 O +ATOM 395 CB THR A 51 21.904 32.908 -10.419 1.00 12.66 C +ATOM 396 OG1 THR A 51 21.099 33.576 -11.407 1.00 17.65 O +ATOM 397 CG2 THR A 51 22.686 31.699 -10.952 1.00 14.39 C +ATOM 398 N ASP A 52 21.708 30.650 -7.927 1.00 14.66 N +ATOM 399 CA ASP A 52 22.528 29.900 -6.959 1.00 13.43 C +ATOM 400 C ASP A 52 23.843 29.488 -7.635 1.00 12.35 C +ATOM 401 O ASP A 52 23.847 29.066 -8.805 1.00 15.18 O +ATOM 402 CB ASP A 52 21.765 28.649 -6.554 1.00 14.12 C +ATOM 403 CG ASP A 52 20.396 28.991 -6.002 1.00 20.03 C +ATOM 404 OD1 ASP A 52 20.220 29.928 -5.237 1.00 21.30 O +ATOM 405 OD2 ASP A 52 19.517 28.144 -6.222 1.00 20.92 O +ATOM 406 N TYR A 53 24.924 29.734 -6.905 1.00 14.56 N +ATOM 407 CA TYR A 53 26.278 29.604 -7.450 1.00 13.61 C +ATOM 408 C TYR A 53 27.161 28.595 -6.708 1.00 12.70 C +ATOM 409 O TYR A 53 27.289 28.606 -5.486 1.00 13.36 O +ATOM 410 CB TYR A 53 26.993 30.972 -7.489 1.00 12.10 C +ATOM 411 CG TYR A 53 26.437 31.959 -8.487 1.00 11.48 C +ATOM 412 CD1 TYR A 53 26.843 32.003 -9.821 1.00 17.21 C +ATOM 413 CD2 TYR A 53 25.510 32.907 -8.050 1.00 14.42 C +ATOM 414 CE1 TYR A 53 26.291 32.922 -10.717 1.00 17.40 C +ATOM 415 CE2 TYR A 53 24.907 33.803 -8.932 1.00 12.97 C +ATOM 416 CZ TYR A 53 25.357 33.847 -10.252 1.00 15.91 C +ATOM 417 OH TYR A 53 24.864 34.804 -11.094 1.00 19.31 O +ATOM 418 N GLY A 54 27.751 27.721 -7.493 1.00 16.54 N +ATOM 419 CA GLY A 54 28.845 26.832 -7.121 1.00 15.67 C +ATOM 420 C GLY A 54 28.499 25.601 -6.290 1.00 10.78 C +ATOM 421 O GLY A 54 27.339 25.155 -6.255 1.00 13.16 O +ATOM 422 N ILE A 55 29.560 25.088 -5.684 1.00 15.43 N +ATOM 423 CA ILE A 55 29.452 23.795 -4.994 1.00 14.01 C +ATOM 424 C ILE A 55 28.424 23.748 -3.872 1.00 12.26 C +ATOM 425 O ILE A 55 27.770 22.697 -3.693 1.00 16.92 O +ATOM 426 CB ILE A 55 30.891 23.340 -4.563 1.00 16.64 C +ATOM 427 CG1 ILE A 55 30.785 21.812 -4.319 1.00 17.00 C +ATOM 428 CG2 ILE A 55 31.396 24.210 -3.390 1.00 18.87 C +ATOM 429 CD1 ILE A 55 32.101 21.018 -4.339 1.00 20.60 C +ATOM 430 N LEU A 56 28.216 24.881 -3.236 1.00 12.85 N +ATOM 431 CA LEU A 56 27.173 24.998 -2.203 1.00 14.96 C +ATOM 432 C LEU A 56 25.981 25.838 -2.659 1.00 11.08 C +ATOM 433 O LEU A 56 25.161 26.111 -1.774 1.00 16.40 O +ATOM 434 CB LEU A 56 27.816 25.424 -0.877 1.00 14.44 C +ATOM 435 CG LEU A 56 28.692 24.348 -0.204 1.00 14.92 C +ATOM 436 CD1 LEU A 56 29.331 24.997 1.008 1.00 18.78 C +ATOM 437 CD2 LEU A 56 27.808 23.177 0.192 1.00 19.47 C +ATOM 438 N GLN A 57 25.865 26.104 -3.946 1.00 14.17 N +ATOM 439 CA GLN A 57 24.668 26.785 -4.465 1.00 11.55 C +ATOM 440 C GLN A 57 24.277 27.940 -3.558 1.00 15.09 C +ATOM 441 O GLN A 57 23.116 28.031 -3.094 1.00 15.28 O +ATOM 442 CB GLN A 57 23.521 25.765 -4.549 1.00 13.56 C +ATOM 443 CG GLN A 57 23.733 24.790 -5.699 1.00 12.45 C +ATOM 444 CD GLN A 57 23.684 25.440 -7.069 1.00 14.21 C +ATOM 445 OE1 GLN A 57 22.574 25.602 -7.591 1.00 18.18 O +ATOM 446 NE2 GLN A 57 24.813 25.805 -7.651 1.00 14.86 N +ATOM 447 N ILE A 58 25.164 28.910 -3.428 1.00 14.04 N +ATOM 448 CA ILE A 58 24.930 30.118 -2.649 1.00 16.09 C +ATOM 449 C ILE A 58 24.204 31.163 -3.504 1.00 11.19 C +ATOM 450 O ILE A 58 24.555 31.405 -4.667 1.00 14.34 O +ATOM 451 CB ILE A 58 26.301 30.665 -2.134 1.00 14.90 C +ATOM 452 CG1 ILE A 58 26.751 29.724 -0.985 1.00 13.85 C +ATOM 453 CG2 ILE A 58 26.178 32.135 -1.693 1.00 15.47 C +ATOM 454 CD1 ILE A 58 28.246 29.954 -0.641 1.00 16.12 C +ATOM 455 N ASN A 59 23.145 31.671 -2.905 1.00 14.23 N +ATOM 456 CA ASN A 59 22.146 32.510 -3.590 1.00 10.60 C +ATOM 457 C ASN A 59 22.550 33.974 -3.730 1.00 13.03 C +ATOM 458 O ASN A 59 22.917 34.607 -2.740 1.00 18.49 O +ATOM 459 CB ASN A 59 20.805 32.306 -2.884 1.00 15.76 C +ATOM 460 CG ASN A 59 19.650 32.986 -3.588 1.00 15.71 C +ATOM 461 OD1 ASN A 59 19.464 34.171 -3.244 1.00 18.79 O +ATOM 462 ND2 ASN A 59 19.155 32.320 -4.612 1.00 16.44 N +ATOM 463 N SER A 60 22.268 34.485 -4.941 1.00 11.71 N +ATOM 464 CA SER A 60 22.570 35.910 -5.255 1.00 13.81 C +ATOM 465 C SER A 60 21.687 36.993 -4.642 1.00 15.28 C +ATOM 466 O SER A 60 22.054 38.177 -4.774 1.00 17.67 O +ATOM 467 CB SER A 60 22.643 36.139 -6.750 1.00 14.62 C +ATOM 468 OG SER A 60 21.432 36.007 -7.444 1.00 14.30 O +ATOM 469 N ARG A 61 20.526 36.660 -4.138 1.00 15.88 N +ATOM 470 CA ARG A 61 19.691 37.653 -3.434 1.00 18.54 C +ATOM 471 C ARG A 61 20.277 38.108 -2.106 1.00 19.97 C +ATOM 472 O ARG A 61 20.282 39.333 -1.876 1.00 26.30 O +ATOM 473 CB ARG A 61 18.267 37.195 -3.250 1.00 18.00 C +ATOM 474 CG ARG A 61 17.315 38.350 -2.959 1.00 20.10 C +ATOM 475 CD ARG A 61 16.063 37.657 -2.503 1.00 26.00 C +ATOM 476 NE ARG A 61 15.101 38.653 -2.063 1.00 29.28 N +ATOM 477 CZ ARG A 61 13.794 38.351 -2.111 1.00 29.36 C +ATOM 478 NH1 ARG A 61 13.439 37.257 -2.784 1.00 26.50 N +ATOM 479 NH2 ARG A 61 12.925 39.249 -1.646 1.00 32.93 N +ATOM 480 N TRP A 62 20.773 37.202 -1.273 1.00 16.51 N +ATOM 481 CA TRP A 62 21.321 37.563 0.032 1.00 16.06 C +ATOM 482 C TRP A 62 22.848 37.643 0.101 1.00 15.55 C +ATOM 483 O TRP A 62 23.323 38.396 0.968 1.00 18.96 O +ATOM 484 CB TRP A 62 20.833 36.611 1.134 1.00 17.91 C +ATOM 485 CG TRP A 62 19.360 36.361 1.096 1.00 18.99 C +ATOM 486 CD1 TRP A 62 18.719 35.247 0.643 1.00 20.47 C +ATOM 487 CD2 TRP A 62 18.326 37.305 1.427 1.00 20.79 C +ATOM 488 NE1 TRP A 62 17.360 35.457 0.609 1.00 21.70 N +ATOM 489 CE2 TRP A 62 17.090 36.696 1.096 1.00 21.11 C +ATOM 490 CE3 TRP A 62 18.333 38.584 1.965 1.00 19.84 C +ATOM 491 CZ2 TRP A 62 15.875 37.327 1.307 1.00 22.57 C +ATOM 492 CZ3 TRP A 62 17.115 39.208 2.186 1.00 23.93 C +ATOM 493 CH2 TRP A 62 15.906 38.611 1.814 1.00 19.55 C +ATOM 494 N TRP A 63 23.537 36.731 -0.584 1.00 16.01 N +ATOM 495 CA TRP A 63 24.906 36.398 -0.276 1.00 15.21 C +ATOM 496 C TRP A 63 26.089 36.924 -1.052 1.00 15.84 C +ATOM 497 O TRP A 63 27.142 37.177 -0.432 1.00 19.13 O +ATOM 498 CB TRP A 63 25.068 34.919 0.112 1.00 15.47 C +ATOM 499 CG TRP A 63 24.036 34.428 1.068 1.00 12.46 C +ATOM 500 CD1 TRP A 63 22.959 33.620 0.777 1.00 16.95 C +ATOM 501 CD2 TRP A 63 23.919 34.728 2.450 1.00 13.27 C +ATOM 502 NE1 TRP A 63 22.243 33.344 1.899 1.00 17.64 N +ATOM 503 CE2 TRP A 63 22.761 34.067 2.931 1.00 17.28 C +ATOM 504 CE3 TRP A 63 24.694 35.480 3.323 1.00 15.25 C +ATOM 505 CZ2 TRP A 63 22.393 34.133 4.278 1.00 18.56 C +ATOM 506 CZ3 TRP A 63 24.302 35.586 4.648 1.00 18.76 C +ATOM 507 CH2 TRP A 63 23.179 34.910 5.117 1.00 19.36 C +ATOM 508 N CYS A 64 25.962 36.914 -2.353 1.00 17.00 N +ATOM 509 CA CYS A 64 26.985 37.433 -3.271 1.00 15.76 C +ATOM 510 C CYS A 64 26.324 38.355 -4.286 1.00 15.97 C +ATOM 511 O CYS A 64 25.102 38.314 -4.475 1.00 13.75 O +ATOM 512 CB CYS A 64 27.638 36.265 -3.988 1.00 16.64 C +ATOM 513 SG CYS A 64 26.562 35.233 -5.007 1.00 17.83 S +ATOM 514 N ASN A 65 27.157 39.165 -4.908 1.00 17.73 N +ATOM 515 CA ASN A 65 26.700 40.134 -5.920 1.00 16.46 C +ATOM 516 C ASN A 65 26.985 39.646 -7.342 1.00 13.16 C +ATOM 517 O ASN A 65 28.130 39.316 -7.647 1.00 15.95 O +ATOM 518 CB ASN A 65 27.381 41.492 -5.712 1.00 19.19 C +ATOM 519 CG ASN A 65 26.910 42.423 -6.824 1.00 19.59 C +ATOM 520 OD1 ASN A 65 25.736 42.559 -7.141 1.00 23.26 O +ATOM 521 ND2 ASN A 65 27.914 42.938 -7.527 1.00 25.56 N +ATOM 522 N ASP A 66 25.920 39.484 -8.116 1.00 15.60 N +ATOM 523 CA ASP A 66 26.102 39.180 -9.545 1.00 15.28 C +ATOM 524 C ASP A 66 25.664 40.317 -10.460 1.00 15.23 C +ATOM 525 O ASP A 66 25.719 40.143 -11.673 1.00 17.91 O +ATOM 526 CB ASP A 66 25.462 37.858 -9.894 1.00 14.84 C +ATOM 527 CG ASP A 66 23.951 37.903 -9.833 1.00 12.12 C +ATOM 528 OD1 ASP A 66 23.288 38.898 -9.542 1.00 16.56 O +ATOM 529 OD2 ASP A 66 23.455 36.769 -10.048 1.00 16.91 O +ATOM 530 N GLY A 67 25.234 41.408 -9.860 1.00 18.13 N +ATOM 531 CA GLY A 67 24.817 42.607 -10.577 1.00 19.40 C +ATOM 532 C GLY A 67 23.544 42.553 -11.401 1.00 20.37 C +ATOM 533 O GLY A 67 23.191 43.542 -12.055 1.00 18.23 O +ATOM 534 N ARG A 68 22.822 41.441 -11.348 1.00 18.79 N +ATOM 535 CA ARG A 68 21.560 41.308 -12.092 1.00 19.77 C +ATOM 536 C ARG A 68 20.424 40.765 -11.243 1.00 18.48 C +ATOM 537 O ARG A 68 19.385 40.383 -11.795 1.00 21.54 O +ATOM 538 CB ARG A 68 21.746 40.454 -13.339 1.00 18.97 C +ATOM 539 CG ARG A 68 22.197 39.048 -12.946 1.00 18.77 C +ATOM 540 CD ARG A 68 22.477 38.187 -14.122 1.00 23.25 C +ATOM 541 NE ARG A 68 21.439 37.201 -14.281 1.00 29.75 N +ATOM 542 CZ ARG A 68 20.242 37.255 -14.855 1.00 28.71 C +ATOM 543 NH1 ARG A 68 19.503 38.311 -15.145 1.00 32.34 N +ATOM 544 NH2 ARG A 68 19.897 36.127 -15.497 1.00 33.10 N +ATOM 545 N THR A 69 20.590 40.896 -9.952 1.00 18.68 N +ATOM 546 CA THR A 69 19.607 40.408 -8.973 1.00 20.02 C +ATOM 547 C THR A 69 18.994 41.597 -8.224 1.00 16.46 C +ATOM 548 O THR A 69 19.683 42.241 -7.425 1.00 23.13 O +ATOM 549 CB THR A 69 20.208 39.384 -7.910 1.00 19.66 C +ATOM 550 OG1 THR A 69 20.851 38.334 -8.715 1.00 19.19 O +ATOM 551 CG2 THR A 69 19.123 38.863 -6.955 1.00 18.58 C +ATOM 552 N PRO A 70 17.687 41.741 -8.418 1.00 20.50 N +ATOM 553 CA PRO A 70 16.953 42.824 -7.733 1.00 21.73 C +ATOM 554 C PRO A 70 16.955 42.520 -6.242 1.00 22.11 C +ATOM 555 O PRO A 70 16.739 41.356 -5.886 1.00 27.13 O +ATOM 556 CB PRO A 70 15.557 42.749 -8.333 1.00 23.50 C +ATOM 557 CG PRO A 70 15.759 42.092 -9.671 1.00 24.66 C +ATOM 558 CD PRO A 70 16.887 41.095 -9.463 1.00 21.80 C +ATOM 559 N GLY A 71 17.163 43.493 -5.401 1.00 21.67 N +ATOM 560 CA GLY A 71 17.135 43.383 -3.947 1.00 24.03 C +ATOM 561 C GLY A 71 18.328 42.710 -3.287 1.00 26.98 C +ATOM 562 O GLY A 71 18.257 42.257 -2.126 1.00 32.77 O +ATOM 563 N SER A 72 19.418 42.627 -4.018 1.00 26.40 N +ATOM 564 CA SER A 72 20.665 41.976 -3.588 1.00 26.94 C +ATOM 565 C SER A 72 21.139 42.582 -2.276 1.00 24.66 C +ATOM 566 O SER A 72 21.055 43.819 -2.125 1.00 29.91 O +ATOM 567 CB SER A 72 21.659 42.002 -4.737 1.00 25.16 C +ATOM 568 OG SER A 72 23.015 41.835 -4.343 1.00 32.21 O +ATOM 569 N ARG A 73 21.646 41.775 -1.369 1.00 22.51 N +ATOM 570 CA ARG A 73 22.254 42.196 -0.113 1.00 22.60 C +ATOM 571 C ARG A 73 23.774 42.058 0.029 1.00 22.33 C +ATOM 572 O ARG A 73 24.425 42.749 0.849 1.00 27.92 O +ATOM 573 CB ARG A 73 21.615 41.555 1.127 1.00 20.14 C +ATOM 574 CG ARG A 73 20.187 41.983 1.439 1.00 22.29 C +ATOM 575 CD ARG A 73 20.209 43.299 2.123 1.00 26.95 C +ATOM 576 NE ARG A 73 18.928 43.771 2.617 1.00 33.74 N +ATOM 577 CZ ARG A 73 17.980 44.302 1.823 1.00 33.76 C +ATOM 578 NH1 ARG A 73 17.841 43.934 0.544 1.00 35.78 N +ATOM 579 NH2 ARG A 73 17.571 45.545 2.146 1.00 33.83 N +ATOM 580 N ASN A 74 24.346 41.143 -0.705 1.00 17.74 N +ATOM 581 CA ASN A 74 25.780 40.833 -0.695 1.00 18.87 C +ATOM 582 C ASN A 74 26.315 40.718 0.731 1.00 16.22 C +ATOM 583 O ASN A 74 27.255 41.471 1.060 1.00 20.87 O +ATOM 584 CB ASN A 74 26.565 41.786 -1.589 1.00 19.51 C +ATOM 585 CG ASN A 74 27.982 41.328 -1.909 1.00 16.31 C +ATOM 586 OD1 ASN A 74 28.318 40.169 -1.652 1.00 18.61 O +ATOM 587 ND2 ASN A 74 28.838 42.192 -2.436 1.00 19.22 N +ATOM 588 N LEU A 75 25.723 39.860 1.544 1.00 15.25 N +ATOM 589 CA LEU A 75 26.153 39.690 2.930 1.00 14.82 C +ATOM 590 C LEU A 75 27.518 39.011 3.085 1.00 16.78 C +ATOM 591 O LEU A 75 28.167 39.197 4.141 1.00 22.00 O +ATOM 592 CB LEU A 75 25.009 39.055 3.733 1.00 16.64 C +ATOM 593 CG LEU A 75 23.815 39.998 3.979 1.00 17.08 C +ATOM 594 CD1 LEU A 75 22.574 39.193 4.336 1.00 25.82 C +ATOM 595 CD2 LEU A 75 24.156 40.969 5.110 1.00 20.95 C +ATOM 596 N CYS A 76 27.973 38.312 2.061 1.00 17.66 N +ATOM 597 CA CYS A 76 29.299 37.680 2.111 1.00 16.46 C +ATOM 598 C CYS A 76 30.390 38.598 1.589 1.00 15.66 C +ATOM 599 O CYS A 76 31.573 38.229 1.568 1.00 17.59 O +ATOM 600 CB CYS A 76 29.396 36.303 1.477 1.00 17.61 C +ATOM 601 SG CYS A 76 28.595 34.961 2.361 1.00 18.07 S +ATOM 602 N ASN A 77 29.964 39.681 0.971 1.00 18.55 N +ATOM 603 CA ASN A 77 30.827 40.725 0.395 1.00 19.18 C +ATOM 604 C ASN A 77 31.711 40.163 -0.702 1.00 16.58 C +ATOM 605 O ASN A 77 32.947 40.331 -0.689 1.00 21.61 O +ATOM 606 CB ASN A 77 31.589 41.488 1.483 1.00 17.72 C +ATOM 607 CG ASN A 77 32.126 42.812 0.957 1.00 20.20 C +ATOM 608 OD1 ASN A 77 31.351 43.589 0.396 1.00 28.77 O +ATOM 609 ND2 ASN A 77 33.430 43.012 1.047 1.00 27.05 N +ATOM 610 N ILE A 78 31.149 39.408 -1.616 1.00 18.88 N +ATOM 611 CA ILE A 78 31.904 38.780 -2.713 1.00 20.14 C +ATOM 612 C ILE A 78 31.099 38.850 -4.013 1.00 17.08 C +ATOM 613 O ILE A 78 29.864 38.688 -3.972 1.00 16.28 O +ATOM 614 CB ILE A 78 32.183 37.255 -2.384 1.00 19.93 C +ATOM 615 CG1 ILE A 78 30.882 36.639 -1.851 1.00 21.17 C +ATOM 616 CG2 ILE A 78 33.437 37.003 -1.524 1.00 24.25 C +ATOM 617 CD1 ILE A 78 30.936 35.120 -1.546 1.00 25.54 C +ATOM 618 N PRO A 79 31.828 38.795 -5.108 1.00 16.64 N +ATOM 619 CA PRO A 79 31.195 38.634 -6.421 1.00 19.12 C +ATOM 620 C PRO A 79 30.792 37.146 -6.446 1.00 14.71 C +ATOM 621 O PRO A 79 31.576 36.273 -6.005 1.00 17.48 O +ATOM 622 CB PRO A 79 32.261 38.967 -7.445 1.00 18.74 C +ATOM 623 CG PRO A 79 33.555 39.029 -6.710 1.00 18.97 C +ATOM 624 CD PRO A 79 33.276 39.023 -5.215 1.00 16.79 C +ATOM 625 N CYS A 80 29.629 36.908 -7.033 1.00 13.55 N +ATOM 626 CA CYS A 80 29.167 35.522 -7.236 1.00 14.33 C +ATOM 627 C CYS A 80 30.150 34.716 -8.073 1.00 13.92 C +ATOM 628 O CYS A 80 30.214 33.484 -7.880 1.00 16.74 O +ATOM 629 CB CYS A 80 27.749 35.338 -7.747 1.00 16.10 C +ATOM 630 SG CYS A 80 26.471 36.160 -6.762 1.00 16.97 S +ATOM 631 N SER A 81 30.769 35.294 -9.083 1.00 15.04 N +ATOM 632 CA SER A 81 31.775 34.671 -9.933 1.00 15.64 C +ATOM 633 C SER A 81 32.907 34.027 -9.109 1.00 14.90 C +ATOM 634 O SER A 81 33.338 32.939 -9.561 1.00 21.08 O +ATOM 635 CB SER A 81 32.381 35.643 -10.953 1.00 18.65 C +ATOM 636 OG SER A 81 33.035 36.681 -10.235 1.00 20.86 O +ATOM 637 N ALA A 82 33.226 34.572 -7.950 1.00 15.59 N +ATOM 638 CA ALA A 82 34.272 33.963 -7.107 1.00 18.01 C +ATOM 639 C ALA A 82 33.869 32.604 -6.540 1.00 18.75 C +ATOM 640 O ALA A 82 34.703 31.798 -6.081 1.00 19.60 O +ATOM 641 CB ALA A 82 34.722 34.930 -6.020 1.00 20.54 C +ATOM 642 N LEU A 83 32.571 32.338 -6.519 1.00 15.36 N +ATOM 643 CA LEU A 83 31.973 31.093 -6.042 1.00 18.66 C +ATOM 644 C LEU A 83 32.060 29.962 -7.049 1.00 17.84 C +ATOM 645 O LEU A 83 31.671 28.815 -6.739 1.00 21.50 O +ATOM 646 CB LEU A 83 30.618 31.424 -5.431 1.00 17.11 C +ATOM 647 CG LEU A 83 30.511 32.364 -4.244 1.00 16.65 C +ATOM 648 CD1 LEU A 83 29.040 32.573 -3.857 1.00 18.78 C +ATOM 649 CD2 LEU A 83 31.277 31.872 -3.020 1.00 20.62 C +ATOM 650 N LEU A 84 32.473 30.271 -8.267 1.00 17.31 N +ATOM 651 CA LEU A 84 32.610 29.295 -9.347 1.00 16.38 C +ATOM 652 C LEU A 84 34.047 28.841 -9.570 1.00 19.37 C +ATOM 653 O LEU A 84 34.334 28.243 -10.622 1.00 23.48 O +ATOM 654 CB LEU A 84 31.914 29.793 -10.614 1.00 20.87 C +ATOM 655 CG LEU A 84 30.446 30.183 -10.573 1.00 14.26 C +ATOM 656 CD1 LEU A 84 30.014 30.771 -11.916 1.00 21.15 C +ATOM 657 CD2 LEU A 84 29.597 28.942 -10.329 1.00 18.96 C +ATOM 658 N SER A 85 34.942 29.197 -8.676 1.00 21.00 N +ATOM 659 CA SER A 85 36.340 28.754 -8.727 1.00 20.86 C +ATOM 660 C SER A 85 36.474 27.245 -8.497 1.00 19.65 C +ATOM 661 O SER A 85 35.765 26.640 -7.681 1.00 20.62 O +ATOM 662 CB SER A 85 37.109 29.482 -7.633 1.00 20.91 C +ATOM 663 OG SER A 85 38.484 29.212 -7.834 1.00 26.88 O +ATOM 664 N SER A 86 37.619 26.742 -8.943 1.00 22.57 N +ATOM 665 CA SER A 86 38.008 25.343 -8.700 1.00 20.44 C +ATOM 666 C SER A 86 38.388 25.153 -7.233 1.00 19.98 C +ATOM 667 O SER A 86 38.314 24.055 -6.671 1.00 23.62 O +ATOM 668 CB SER A 86 39.107 24.868 -9.650 1.00 23.76 C +ATOM 669 OG SER A 86 38.401 24.215 -10.691 1.00 30.29 O +ATOM 670 N ASP A 87 38.846 26.244 -6.668 1.00 19.74 N +ATOM 671 CA ASP A 87 39.282 26.393 -5.271 1.00 18.72 C +ATOM 672 C ASP A 87 37.999 26.657 -4.471 1.00 17.93 C +ATOM 673 O ASP A 87 37.490 27.762 -4.712 1.00 20.06 O +ATOM 674 CB ASP A 87 40.221 27.607 -5.212 1.00 21.65 C +ATOM 675 CG ASP A 87 40.762 28.041 -3.869 1.00 23.98 C +ATOM 676 OD1 ASP A 87 40.335 27.702 -2.742 1.00 26.26 O +ATOM 677 OD2 ASP A 87 41.785 28.802 -3.933 1.00 32.04 O +ATOM 678 N ILE A 88 37.732 25.850 -3.461 1.00 15.96 N +ATOM 679 CA ILE A 88 36.515 26.089 -2.658 1.00 16.22 C +ATOM 680 C ILE A 88 36.582 27.142 -1.563 1.00 14.43 C +ATOM 681 O ILE A 88 35.600 27.315 -0.801 1.00 16.28 O +ATOM 682 CB ILE A 88 35.993 24.736 -2.046 1.00 16.45 C +ATOM 683 CG1 ILE A 88 36.920 24.200 -0.934 1.00 15.71 C +ATOM 684 CG2 ILE A 88 35.587 23.743 -3.163 1.00 19.87 C +ATOM 685 CD1 ILE A 88 36.363 23.226 0.137 1.00 17.47 C +ATOM 686 N THR A 89 37.742 27.786 -1.369 1.00 14.21 N +ATOM 687 CA THR A 89 37.913 28.772 -0.306 1.00 16.87 C +ATOM 688 C THR A 89 36.736 29.761 -0.161 1.00 11.06 C +ATOM 689 O THR A 89 36.341 29.983 1.000 1.00 13.83 O +ATOM 690 CB THR A 89 39.267 29.591 -0.423 1.00 18.61 C +ATOM 691 OG1 THR A 89 40.339 28.592 -0.514 1.00 20.24 O +ATOM 692 CG2 THR A 89 39.419 30.553 0.766 1.00 17.79 C +ATOM 693 N ALA A 90 36.507 30.482 -1.242 1.00 17.37 N +ATOM 694 CA ALA A 90 35.479 31.555 -1.244 1.00 16.63 C +ATOM 695 C ALA A 90 34.125 31.066 -0.735 1.00 14.09 C +ATOM 696 O ALA A 90 33.366 31.671 0.065 1.00 15.68 O +ATOM 697 CB ALA A 90 35.366 32.212 -2.617 1.00 17.13 C +ATOM 698 N SER A 91 33.746 29.919 -1.296 1.00 13.62 N +ATOM 699 CA SER A 91 32.494 29.220 -1.024 1.00 11.35 C +ATOM 700 C SER A 91 32.429 28.817 0.467 1.00 11.70 C +ATOM 701 O SER A 91 31.407 29.057 1.110 1.00 14.31 O +ATOM 702 CB SER A 91 32.282 28.035 -1.917 1.00 13.48 C +ATOM 703 OG SER A 91 32.020 28.335 -3.260 1.00 14.66 O +ATOM 704 N VAL A 92 33.502 28.211 0.953 1.00 13.17 N +ATOM 705 CA VAL A 92 33.595 27.846 2.381 1.00 13.44 C +ATOM 706 C VAL A 92 33.477 29.105 3.261 1.00 12.00 C +ATOM 707 O VAL A 92 32.716 29.020 4.244 1.00 13.83 O +ATOM 708 CB VAL A 92 34.890 27.038 2.650 1.00 11.69 C +ATOM 709 CG1 VAL A 92 35.125 26.987 4.151 1.00 16.05 C +ATOM 710 CG2 VAL A 92 34.776 25.672 2.013 1.00 15.64 C +ATOM 711 N ASN A 93 34.199 30.163 2.912 1.00 15.12 N +ATOM 712 CA ASN A 93 34.160 31.413 3.685 1.00 15.10 C +ATOM 713 C ASN A 93 32.747 32.034 3.803 1.00 9.80 C +ATOM 714 O ASN A 93 32.361 32.393 4.908 1.00 16.51 O +ATOM 715 CB ASN A 93 35.168 32.472 3.247 1.00 16.33 C +ATOM 716 CG ASN A 93 36.582 32.083 3.642 1.00 19.02 C +ATOM 717 OD1 ASN A 93 37.546 32.671 3.120 1.00 29.57 O +ATOM 718 ND2 ASN A 93 36.710 31.188 4.631 1.00 24.29 N +ATOM 719 N CYS A 94 32.096 31.996 2.670 1.00 15.72 N +ATOM 720 CA CYS A 94 30.695 32.449 2.633 1.00 13.58 C +ATOM 721 C CYS A 94 29.778 31.527 3.424 1.00 13.05 C +ATOM 722 O CYS A 94 28.973 32.025 4.236 1.00 16.42 O +ATOM 723 CB CYS A 94 30.291 32.704 1.185 1.00 12.05 C +ATOM 724 SG CYS A 94 28.644 33.431 1.046 1.00 15.81 S +ATOM 725 N ALA A 95 29.945 30.225 3.263 1.00 13.56 N +ATOM 726 CA ALA A 95 29.134 29.227 3.969 1.00 15.63 C +ATOM 727 C ALA A 95 29.236 29.330 5.491 1.00 10.80 C +ATOM 728 O ALA A 95 28.222 29.180 6.179 1.00 12.93 O +ATOM 729 CB ALA A 95 29.495 27.794 3.612 1.00 14.09 C +ATOM 730 N LYS A 96 30.424 29.628 5.987 1.00 11.19 N +ATOM 731 CA LYS A 96 30.627 29.912 7.419 1.00 13.27 C +ATOM 732 C LYS A 96 29.802 31.115 7.906 1.00 13.38 C +ATOM 733 O LYS A 96 29.296 31.011 9.027 1.00 15.75 O +ATOM 734 CB LYS A 96 32.100 30.112 7.775 1.00 12.67 C +ATOM 735 CG LYS A 96 32.874 28.792 7.697 1.00 11.93 C +ATOM 736 CD LYS A 96 34.358 29.071 7.879 1.00 15.55 C +ATOM 737 CE LYS A 96 35.205 27.816 7.938 1.00 18.03 C +ATOM 738 NZ LYS A 96 36.610 28.242 8.169 1.00 20.72 N +ATOM 739 N LYS A 97 29.660 32.101 7.049 1.00 12.90 N +ATOM 740 CA LYS A 97 28.811 33.263 7.379 1.00 16.43 C +ATOM 741 C LYS A 97 27.333 32.905 7.386 1.00 18.88 C +ATOM 742 O LYS A 97 26.570 33.318 8.272 1.00 19.20 O +ATOM 743 CB LYS A 97 29.087 34.456 6.470 1.00 18.97 C +ATOM 744 CG LYS A 97 30.537 34.927 6.563 1.00 19.81 C +ATOM 745 CD LYS A 97 30.841 36.073 5.610 1.00 22.00 C +ATOM 746 CE LYS A 97 32.340 36.293 5.510 1.00 23.71 C +ATOM 747 NZ LYS A 97 32.569 37.524 4.708 1.00 29.75 N +ATOM 748 N ILE A 98 26.897 32.127 6.416 1.00 15.72 N +ATOM 749 CA ILE A 98 25.520 31.693 6.266 1.00 16.36 C +ATOM 750 C ILE A 98 25.030 30.871 7.453 1.00 16.70 C +ATOM 751 O ILE A 98 24.059 31.254 8.126 1.00 18.80 O +ATOM 752 CB ILE A 98 25.307 30.997 4.896 1.00 15.14 C +ATOM 753 CG1 ILE A 98 25.643 31.910 3.702 1.00 13.63 C +ATOM 754 CG2 ILE A 98 23.887 30.386 4.817 1.00 15.62 C +ATOM 755 CD1 ILE A 98 25.620 31.204 2.321 1.00 17.82 C +ATOM 756 N VAL A 99 25.875 29.966 7.915 1.00 16.73 N +ATOM 757 CA VAL A 99 25.488 29.009 8.955 1.00 18.71 C +ATOM 758 C VAL A 99 25.431 29.697 10.316 1.00 20.36 C +ATOM 759 O VAL A 99 24.737 29.212 11.233 1.00 25.30 O +ATOM 760 CB VAL A 99 26.398 27.774 8.859 1.00 16.94 C +ATOM 761 CG1 VAL A 99 27.811 28.138 9.279 1.00 19.19 C +ATOM 762 CG2 VAL A 99 25.834 26.594 9.632 1.00 18.97 C +ATOM 763 N SER A 100 26.205 30.752 10.409 1.00 17.04 N +ATOM 764 CA SER A 100 26.297 31.529 11.650 1.00 23.81 C +ATOM 765 C SER A 100 25.124 32.495 11.765 1.00 24.03 C +ATOM 766 O SER A 100 24.995 33.131 12.820 1.00 28.66 O +ATOM 767 CB SER A 100 27.647 32.194 11.723 1.00 19.71 C +ATOM 768 OG SER A 100 28.714 31.264 11.818 1.00 25.04 O +ATOM 769 N ASP A 101 24.307 32.599 10.750 1.00 25.78 N +ATOM 770 CA ASP A 101 23.162 33.495 10.650 1.00 26.98 C +ATOM 771 C ASP A 101 21.924 33.183 11.481 1.00 28.34 C +ATOM 772 O ASP A 101 21.132 34.143 11.678 1.00 31.88 O +ATOM 773 CB ASP A 101 22.806 33.854 9.207 1.00 27.75 C +ATOM 774 CG ASP A 101 22.426 35.320 9.009 1.00 30.86 C +ATOM 775 OD1 ASP A 101 23.248 36.223 9.266 1.00 34.67 O +ATOM 776 OD2 ASP A 101 21.276 35.519 8.551 1.00 32.70 O +ATOM 777 N GLY A 102 21.723 31.942 11.887 1.00 28.87 N +ATOM 778 CA GLY A 102 20.622 31.656 12.823 1.00 30.67 C +ATOM 779 C GLY A 102 19.812 30.413 12.505 1.00 27.92 C +ATOM 780 O GLY A 102 19.195 29.898 13.458 1.00 30.42 O +ATOM 781 N ASN A 103 19.805 30.005 11.244 1.00 29.26 N +ATOM 782 CA ASN A 103 19.076 28.799 10.848 1.00 25.22 C +ATOM 783 C ASN A 103 19.990 27.600 10.597 1.00 22.06 C +ATOM 784 O ASN A 103 19.472 26.579 10.117 1.00 24.23 O +ATOM 785 CB ASN A 103 17.976 29.046 9.824 1.00 24.87 C +ATOM 786 CG ASN A 103 16.708 28.245 10.063 1.00 27.08 C +ATOM 787 OD1 ASN A 103 16.513 27.577 11.098 1.00 30.30 O +ATOM 788 ND2 ASN A 103 15.672 28.428 9.240 1.00 30.15 N +ATOM 789 N GLY A 104 21.240 27.711 10.997 1.00 23.20 N +ATOM 790 CA GLY A 104 22.177 26.567 10.860 1.00 19.51 C +ATOM 791 C GLY A 104 22.173 26.142 9.388 1.00 15.58 C +ATOM 792 O GLY A 104 22.151 27.040 8.541 1.00 22.50 O +ATOM 793 N MET A 105 22.185 24.847 9.115 1.00 17.51 N +ATOM 794 CA MET A 105 22.278 24.370 7.724 1.00 16.07 C +ATOM 795 C MET A 105 20.915 24.309 7.063 1.00 13.35 C +ATOM 796 O MET A 105 20.902 23.921 5.871 1.00 15.50 O +ATOM 797 CB MET A 105 23.036 23.048 7.632 1.00 19.32 C +ATOM 798 CG MET A 105 24.519 23.221 7.871 1.00 17.10 C +ATOM 799 SD MET A 105 25.379 21.660 7.491 1.00 20.27 S +ATOM 800 CE MET A 105 25.369 21.706 5.703 1.00 20.03 C +ATOM 801 N ASN A 106 19.896 24.839 7.735 1.00 14.64 N +ATOM 802 CA ASN A 106 18.557 24.898 7.103 1.00 18.58 C +ATOM 803 C ASN A 106 18.566 25.831 5.892 1.00 18.20 C +ATOM 804 O ASN A 106 17.678 25.748 5.021 1.00 22.14 O +ATOM 805 CB ASN A 106 17.420 25.150 8.084 1.00 19.18 C +ATOM 806 CG ASN A 106 17.207 23.938 8.967 1.00 19.21 C +ATOM 807 OD1 ASN A 106 16.836 22.867 8.443 1.00 24.65 O +ATOM 808 ND2 ASN A 106 17.542 24.047 10.255 1.00 25.28 N +ATOM 809 N ALA A 107 19.617 26.647 5.800 1.00 18.54 N +ATOM 810 CA ALA A 107 19.824 27.514 4.634 1.00 18.74 C +ATOM 811 C ALA A 107 20.007 26.744 3.329 1.00 16.80 C +ATOM 812 O ALA A 107 19.734 27.292 2.260 1.00 20.63 O +ATOM 813 CB ALA A 107 21.060 28.374 4.877 1.00 19.47 C +ATOM 814 N TRP A 108 20.371 25.465 3.434 1.00 16.46 N +ATOM 815 CA TRP A 108 20.532 24.624 2.241 1.00 14.68 C +ATOM 816 C TRP A 108 19.317 23.688 2.110 1.00 17.55 C +ATOM 817 O TRP A 108 19.240 22.816 2.993 1.00 20.05 O +ATOM 818 CB TRP A 108 21.840 23.826 2.338 1.00 16.18 C +ATOM 819 CG TRP A 108 23.000 24.736 2.026 1.00 15.50 C +ATOM 820 CD1 TRP A 108 23.360 25.234 0.803 1.00 15.45 C +ATOM 821 CD2 TRP A 108 23.798 25.437 2.991 1.00 15.57 C +ATOM 822 NE1 TRP A 108 24.414 26.102 0.952 1.00 17.40 N +ATOM 823 CE2 TRP A 108 24.711 26.237 2.272 1.00 15.78 C +ATOM 824 CE3 TRP A 108 23.833 25.426 4.379 1.00 12.79 C +ATOM 825 CZ2 TRP A 108 25.682 26.985 2.917 1.00 15.77 C +ATOM 826 CZ3 TRP A 108 24.773 26.200 5.033 1.00 16.28 C +ATOM 827 CH2 TRP A 108 25.691 26.960 4.298 1.00 16.65 C +ATOM 828 N VAL A 109 18.487 23.925 1.101 1.00 15.35 N +ATOM 829 CA VAL A 109 17.265 23.096 1.025 1.00 19.96 C +ATOM 830 C VAL A 109 17.573 21.611 0.884 1.00 17.16 C +ATOM 831 O VAL A 109 16.923 20.811 1.587 1.00 20.77 O +ATOM 832 CB VAL A 109 16.146 23.660 0.145 1.00 21.94 C +ATOM 833 CG1 VAL A 109 16.607 23.905 -1.285 1.00 27.84 C +ATOM 834 CG2 VAL A 109 14.901 22.783 0.136 1.00 21.22 C +ATOM 835 N ALA A 110 18.562 21.308 0.075 1.00 20.97 N +ATOM 836 CA ALA A 110 18.972 19.935 -0.237 1.00 18.78 C +ATOM 837 C ALA A 110 19.502 19.244 1.006 1.00 18.30 C +ATOM 838 O ALA A 110 19.197 18.046 1.174 1.00 18.47 O +ATOM 839 CB ALA A 110 19.857 19.777 -1.455 1.00 20.83 C +ATOM 840 N TRP A 111 20.121 19.983 1.892 1.00 16.62 N +ATOM 841 CA TRP A 111 20.551 19.500 3.202 1.00 15.74 C +ATOM 842 C TRP A 111 19.343 19.085 4.046 1.00 19.12 C +ATOM 843 O TRP A 111 19.284 17.986 4.643 1.00 16.20 O +ATOM 844 CB TRP A 111 21.486 20.451 3.925 1.00 14.63 C +ATOM 845 CG TRP A 111 21.858 19.904 5.252 1.00 14.87 C +ATOM 846 CD1 TRP A 111 22.856 18.975 5.486 1.00 18.11 C +ATOM 847 CD2 TRP A 111 21.199 20.093 6.504 1.00 16.63 C +ATOM 848 NE1 TRP A 111 22.848 18.592 6.808 1.00 17.16 N +ATOM 849 CE2 TRP A 111 21.798 19.221 7.435 1.00 16.77 C +ATOM 850 CE3 TRP A 111 20.182 20.959 6.908 1.00 15.16 C +ATOM 851 CZ2 TRP A 111 21.492 19.284 8.784 1.00 17.69 C +ATOM 852 CZ3 TRP A 111 19.818 20.954 8.240 1.00 16.88 C +ATOM 853 CH2 TRP A 111 20.443 20.110 9.162 1.00 19.73 C +ATOM 854 N ARG A 112 18.438 20.038 4.228 1.00 17.47 N +ATOM 855 CA ARG A 112 17.185 19.830 4.955 1.00 19.60 C +ATOM 856 C ARG A 112 16.472 18.593 4.391 1.00 17.68 C +ATOM 857 O ARG A 112 16.000 17.792 5.220 1.00 22.77 O +ATOM 858 CB ARG A 112 16.214 20.990 4.944 1.00 17.57 C +ATOM 859 CG ARG A 112 16.592 22.438 5.091 1.00 25.27 C +ATOM 860 CD ARG A 112 15.368 23.296 5.135 1.00 21.23 C +ATOM 861 NE ARG A 112 14.776 23.555 3.836 1.00 28.06 N +ATOM 862 CZ ARG A 112 14.785 24.695 3.143 1.00 27.89 C +ATOM 863 NH1 ARG A 112 15.596 25.721 3.383 1.00 30.12 N +ATOM 864 NH2 ARG A 112 13.717 25.008 2.398 1.00 30.39 N +ATOM 865 N ASN A 113 16.307 18.521 3.074 1.00 19.43 N +ATOM 866 CA ASN A 113 15.464 17.463 2.491 1.00 20.16 C +ATOM 867 C ASN A 113 16.111 16.083 2.586 1.00 21.26 C +ATOM 868 O ASN A 113 15.454 15.054 2.808 1.00 24.90 O +ATOM 869 CB ASN A 113 14.966 17.779 1.085 1.00 20.43 C +ATOM 870 CG ASN A 113 14.003 18.961 1.018 1.00 16.63 C +ATOM 871 OD1 ASN A 113 13.454 19.344 2.059 1.00 25.68 O +ATOM 872 ND2 ASN A 113 13.840 19.555 -0.159 1.00 22.00 N +ATOM 873 N ARG A 114 17.401 16.041 2.355 1.00 19.72 N +ATOM 874 CA ARG A 114 18.156 14.836 2.042 1.00 21.43 C +ATOM 875 C ARG A 114 19.258 14.440 2.991 1.00 22.71 C +ATOM 876 O ARG A 114 19.505 13.217 3.097 1.00 24.85 O +ATOM 877 CB ARG A 114 18.622 14.910 0.576 1.00 21.05 C +ATOM 878 CG ARG A 114 17.395 14.614 -0.300 1.00 26.59 C +ATOM 879 CD ARG A 114 17.729 14.399 -1.731 1.00 26.92 C +ATOM 880 NE ARG A 114 18.153 15.677 -2.301 1.00 33.46 N +ATOM 881 CZ ARG A 114 17.826 16.080 -3.535 1.00 32.00 C +ATOM 882 NH1 ARG A 114 17.378 15.225 -4.456 1.00 36.02 N +ATOM 883 NH2 ARG A 114 17.735 17.388 -3.796 1.00 36.05 N +ATOM 884 N CYS A 115 19.743 15.372 3.773 1.00 17.56 N +ATOM 885 CA CYS A 115 20.843 15.041 4.708 1.00 15.08 C +ATOM 886 C CYS A 115 20.448 14.933 6.159 1.00 16.64 C +ATOM 887 O CYS A 115 20.972 14.116 6.940 1.00 21.71 O +ATOM 888 CB CYS A 115 21.991 16.018 4.426 1.00 15.21 C +ATOM 889 SG CYS A 115 22.563 16.009 2.739 1.00 19.35 S +ATOM 890 N LYS A 116 19.714 15.918 6.619 1.00 18.76 N +ATOM 891 CA LYS A 116 19.332 16.085 8.025 1.00 19.14 C +ATOM 892 C LYS A 116 18.634 14.821 8.518 1.00 21.91 C +ATOM 893 O LYS A 116 17.819 14.234 7.785 1.00 24.78 O +ATOM 894 CB LYS A 116 18.492 17.363 8.126 1.00 21.01 C +ATOM 895 CG LYS A 116 17.930 17.512 9.547 1.00 21.28 C +ATOM 896 CD LYS A 116 16.745 18.481 9.554 1.00 25.86 C +ATOM 897 CE LYS A 116 16.658 19.147 10.918 1.00 25.58 C +ATOM 898 NZ LYS A 116 15.454 20.010 11.047 1.00 34.69 N +ATOM 899 N GLY A 117 19.152 14.318 9.635 1.00 26.39 N +ATOM 900 CA GLY A 117 18.558 13.126 10.267 1.00 29.06 C +ATOM 901 C GLY A 117 19.018 11.781 9.733 1.00 28.29 C +ATOM 902 O GLY A 117 18.499 10.733 10.164 1.00 31.90 O +ATOM 903 N THR A 118 19.892 11.802 8.740 1.00 26.88 N +ATOM 904 CA THR A 118 20.473 10.578 8.171 1.00 22.31 C +ATOM 905 C THR A 118 21.868 10.375 8.761 1.00 21.43 C +ATOM 906 O THR A 118 22.321 11.119 9.650 1.00 22.31 O +ATOM 907 CB THR A 118 20.440 10.571 6.598 1.00 18.59 C +ATOM 908 OG1 THR A 118 21.560 11.404 6.161 1.00 22.71 O +ATOM 909 CG2 THR A 118 19.095 11.104 6.074 1.00 21.13 C +ATOM 910 N ASP A 119 22.392 9.213 8.431 1.00 21.20 N +ATOM 911 CA ASP A 119 23.768 8.830 8.756 1.00 22.61 C +ATOM 912 C ASP A 119 24.713 9.543 7.779 1.00 20.13 C +ATOM 913 O ASP A 119 25.178 8.950 6.780 1.00 20.57 O +ATOM 914 CB ASP A 119 23.934 7.313 8.738 1.00 21.00 C +ATOM 915 CG ASP A 119 25.347 6.900 9.121 1.00 25.32 C +ATOM 916 OD1 ASP A 119 26.051 7.633 9.830 1.00 27.93 O +ATOM 917 OD2 ASP A 119 25.715 5.746 8.804 1.00 27.31 O +ATOM 918 N VAL A 120 24.988 10.793 8.094 1.00 23.41 N +ATOM 919 CA VAL A 120 25.886 11.637 7.306 1.00 20.10 C +ATOM 920 C VAL A 120 27.342 11.199 7.304 1.00 18.51 C +ATOM 921 O VAL A 120 28.099 11.604 6.406 1.00 19.95 O +ATOM 922 CB VAL A 120 25.721 13.134 7.630 1.00 19.91 C +ATOM 923 CG1 VAL A 120 24.356 13.655 7.183 1.00 23.59 C +ATOM 924 CG2 VAL A 120 26.088 13.478 9.055 1.00 20.79 C +ATOM 925 N GLN A 121 27.701 10.430 8.306 1.00 21.83 N +ATOM 926 CA GLN A 121 29.021 9.783 8.389 1.00 21.12 C +ATOM 927 C GLN A 121 29.317 8.861 7.207 1.00 20.78 C +ATOM 928 O GLN A 121 30.480 8.669 6.820 1.00 19.66 O +ATOM 929 CB GLN A 121 29.088 9.048 9.728 1.00 24.21 C +ATOM 930 CG GLN A 121 30.530 8.965 10.167 1.00 26.13 C +ATOM 931 CD GLN A 121 30.615 8.877 11.674 1.00 26.94 C +ATOM 932 OE1 GLN A 121 31.368 9.632 12.283 1.00 31.43 O +ATOM 933 NE2 GLN A 121 29.884 7.871 12.151 1.00 28.26 N +ATOM 934 N ALA A 122 28.300 8.271 6.576 1.00 17.62 N +ATOM 935 CA ALA A 122 28.390 7.548 5.311 1.00 19.46 C +ATOM 936 C ALA A 122 29.186 8.290 4.227 1.00 17.98 C +ATOM 937 O ALA A 122 30.031 7.710 3.523 1.00 21.35 O +ATOM 938 CB ALA A 122 26.999 7.244 4.783 1.00 18.29 C +ATOM 939 N TRP A 123 29.021 9.616 4.240 1.00 18.07 N +ATOM 940 CA TRP A 123 29.703 10.502 3.283 1.00 16.76 C +ATOM 941 C TRP A 123 31.218 10.581 3.392 1.00 16.76 C +ATOM 942 O TRP A 123 31.905 10.942 2.412 1.00 20.08 O +ATOM 943 CB TRP A 123 29.027 11.872 3.347 1.00 19.49 C +ATOM 944 CG TRP A 123 27.621 11.735 2.850 1.00 17.43 C +ATOM 945 CD1 TRP A 123 26.485 11.608 3.588 1.00 19.42 C +ATOM 946 CD2 TRP A 123 27.241 11.547 1.481 1.00 17.47 C +ATOM 947 NE1 TRP A 123 25.405 11.458 2.774 1.00 18.86 N +ATOM 948 CE2 TRP A 123 25.827 11.391 1.479 1.00 17.28 C +ATOM 949 CE3 TRP A 123 27.947 11.468 0.283 1.00 20.03 C +ATOM 950 CZ2 TRP A 123 25.111 11.184 0.311 1.00 18.33 C +ATOM 951 CZ3 TRP A 123 27.222 11.329 -0.886 1.00 20.85 C +ATOM 952 CH2 TRP A 123 25.835 11.127 -0.869 1.00 20.45 C +ATOM 953 N ILE A 124 31.741 10.269 4.554 1.00 14.19 N +ATOM 954 CA ILE A 124 33.186 10.292 4.801 1.00 16.82 C +ATOM 955 C ILE A 124 33.863 8.955 5.024 1.00 18.45 C +ATOM 956 O ILE A 124 35.100 8.892 5.134 1.00 21.02 O +ATOM 957 CB ILE A 124 33.504 11.403 5.863 1.00 17.69 C +ATOM 958 CG1 ILE A 124 32.956 10.984 7.234 1.00 18.86 C +ATOM 959 CG2 ILE A 124 33.024 12.804 5.387 1.00 21.01 C +ATOM 960 CD1 ILE A 124 33.729 11.437 8.488 1.00 22.81 C +ATOM 961 N ARG A 125 33.080 7.898 5.131 1.00 21.05 N +ATOM 962 CA ARG A 125 33.594 6.534 5.320 1.00 19.12 C +ATOM 963 C ARG A 125 34.311 6.113 4.036 1.00 17.52 C +ATOM 964 O ARG A 125 33.843 6.337 2.906 1.00 23.44 O +ATOM 965 CB ARG A 125 32.476 5.551 5.650 1.00 19.54 C +ATOM 966 CG ARG A 125 32.117 5.596 7.145 1.00 22.40 C +ATOM 967 CD ARG A 125 31.277 4.392 7.482 1.00 24.05 C +ATOM 968 NE ARG A 125 30.282 4.754 8.466 1.00 28.08 N +ATOM 969 CZ ARG A 125 28.984 4.993 8.331 1.00 23.40 C +ATOM 970 NH1 ARG A 125 28.334 4.690 7.207 1.00 23.69 N +ATOM 971 NH2 ARG A 125 28.392 5.549 9.392 1.00 23.77 N +ATOM 972 N GLY A 126 35.497 5.568 4.243 1.00 18.80 N +ATOM 973 CA GLY A 126 36.291 5.058 3.102 1.00 21.28 C +ATOM 974 C GLY A 126 37.334 6.066 2.658 1.00 22.50 C +ATOM 975 O GLY A 126 38.220 5.729 1.855 1.00 23.59 O +ATOM 976 N CYS A 127 37.335 7.221 3.297 1.00 19.05 N +ATOM 977 CA CYS A 127 38.234 8.333 2.961 1.00 19.13 C +ATOM 978 C CYS A 127 39.422 8.382 3.925 1.00 22.50 C +ATOM 979 O CYS A 127 39.206 8.267 5.138 1.00 21.64 O +ATOM 980 CB CYS A 127 37.453 9.628 2.990 1.00 18.75 C +ATOM 981 SG CYS A 127 36.010 9.816 1.936 1.00 19.93 S +ATOM 982 N ARG A 128 40.586 8.695 3.393 1.00 23.60 N +ATOM 983 CA ARG A 128 41.774 8.960 4.217 1.00 28.29 C +ATOM 984 C ARG A 128 41.820 10.438 4.578 1.00 25.64 C +ATOM 985 O ARG A 128 41.976 11.291 3.694 1.00 30.98 O +ATOM 986 CB ARG A 128 43.047 8.304 3.707 1.00 30.82 C +ATOM 987 CG ARG A 128 43.231 6.886 4.280 1.00 34.25 C +ATOM 988 CD ARG A 128 43.833 6.911 5.651 1.00 33.59 C +ATOM 989 NE ARG A 128 45.246 7.263 5.636 1.00 37.63 N +ATOM 990 CZ ARG A 128 45.862 8.258 6.281 1.00 38.37 C +ATOM 991 NH1 ARG A 128 45.241 9.069 7.151 1.00 38.97 N +ATOM 992 NH2 ARG A 128 47.134 8.554 5.973 1.00 40.22 N +ATOM 993 N LEU A 129 41.289 10.715 5.771 1.00 26.05 N +ATOM 994 CA LEU A 129 41.094 12.084 6.273 1.00 26.89 C +ATOM 995 C LEU A 129 42.119 12.382 7.370 1.00 29.58 C +ATOM 996 O LEU A 129 41.730 12.276 8.559 1.00 33.54 O +ATOM 997 CB LEU A 129 39.635 12.335 6.646 1.00 26.31 C +ATOM 998 CG LEU A 129 38.689 12.917 5.620 1.00 23.49 C +ATOM 999 CD1 LEU A 129 39.112 12.657 4.191 1.00 26.43 C +ATOM 1000 CD2 LEU A 129 37.310 12.325 5.886 1.00 25.15 C +ATOM 1001 OXT LEU A 129 43.232 12.675 6.905 1.00 34.20 O +TER 1002 LEU A 129 +HETATM 1003 O HOH A 130 23.434 40.063 -6.661 1.00 19.48 O +HETATM 1004 O HOH A 131 31.994 26.416 -6.047 0.90 22.43 O +HETATM 1005 O HOH A 132 30.250 13.337 9.787 0.98 20.93 O +HETATM 1006 O HOH A 133 22.384 42.331 -8.165 0.90 21.85 O +HETATM 1007 O HOH A 134 29.239 27.621 -3.670 1.00 17.47 O +HETATM 1008 O HOH A 135 29.464 37.761 -10.492 0.98 20.05 O +HETATM 1009 O HOH A 136 20.807 36.305 -11.082 1.00 18.47 O +HETATM 1010 O HOH A 137 41.318 17.849 -1.378 0.98 20.99 O +HETATM 1011 O HOH A 138 34.697 29.056 -4.039 0.89 22.31 O +HETATM 1012 O HOH A 139 26.871 17.298 13.496 1.00 20.31 O +HETATM 1013 O HOH A 140 32.131 11.050 -5.817 0.97 21.39 O +HETATM 1014 O HOH A 141 23.468 40.040 -2.372 0.91 23.40 O +HETATM 1015 O HOH A 142 21.390 45.524 -11.035 0.96 20.63 O +HETATM 1016 O HOH A 143 34.490 26.578 -5.741 0.75 22.11 O +HETATM 1017 O HOH A 144 16.422 34.139 -3.527 0.91 20.71 O +HETATM 1018 O HOH A 145 21.374 29.926 8.946 0.83 24.21 O +HETATM 1019 O HOH A 146 41.048 12.539 -0.011 0.70 22.71 O +HETATM 1020 O HOH A 147 32.794 35.686 2.558 0.78 20.71 O +HETATM 1021 O HOH A 148 49.648 8.964 6.343 0.83 21.93 O +HETATM 1022 O HOH A 149 14.452 34.901 -13.339 0.69 23.89 O +HETATM 1023 O HOH A 150 22.930 10.839 4.044 0.92 22.02 O +HETATM 1024 O HOH A 151 16.012 18.490 -2.200 0.85 24.37 O +HETATM 1025 O HOH A 152 12.130 21.587 3.044 0.78 24.35 O +HETATM 1026 O HOH A 153 15.684 38.922 -5.813 0.76 24.50 O +HETATM 1027 O HOH A 154 10.652 24.228 3.428 0.80 21.12 O +HETATM 1028 O HOH A 155 44.070 17.975 2.852 0.80 21.64 O +HETATM 1029 O HOH A 156 32.029 13.080 -8.110 0.85 20.63 O +HETATM 1030 O HOH A 157 36.425 19.613 15.174 0.56 23.44 O +HETATM 1031 O HOH A 158 37.941 30.505 -3.686 0.79 21.54 O +HETATM 1032 O HOH A 159 30.710 42.741 -6.289 0.72 22.79 O +HETATM 1033 O HOH A 160 23.922 44.367 -7.653 0.62 22.78 O +HETATM 1034 O HOH A 161 33.829 34.252 0.626 0.73 20.81 O +HETATM 1035 O HOH A 162 29.613 40.730 -9.602 0.78 22.12 O +HETATM 1036 O HOH A 163 23.563 7.995 4.406 0.58 22.93 O +HETATM 1037 O HOH A 164 31.511 42.362 -4.183 0.73 22.01 O +HETATM 1038 O HOH A 165 21.882 29.536 -15.013 0.81 22.04 O +HETATM 1039 O HOH A 166 37.763 20.913 9.782 0.86 21.57 O +HETATM 1040 O HOH A 167 42.338 17.481 5.165 0.65 22.17 O +HETATM 1041 O HOH A 168 23.344 39.739 -4.358 0.72 21.56 O +HETATM 1042 O HOH A 169 22.984 29.224 13.124 0.75 22.56 O +HETATM 1043 O HOH A 170 30.778 7.794 -3.514 0.65 21.58 O +HETATM 1044 O HOH A 171 42.965 14.657 4.991 0.63 23.91 O +HETATM 1045 O HOH A 172 36.927 17.948 -13.093 0.62 23.36 O +HETATM 1046 O HOH A 173 35.412 25.852 -11.575 0.58 23.42 O +HETATM 1047 O HOH A 174 37.428 32.540 -5.787 0.62 21.98 O +HETATM 1048 O HOH A 175 37.317 8.592 7.456 0.64 22.92 O +HETATM 1049 O HOH A 176 9.314 36.705 -11.546 0.69 23.77 O +HETATM 1050 O HOH A 177 39.972 23.760 -2.655 0.86 18.96 O +HETATM 1051 O HOH A 178 22.128 30.274 -0.543 0.76 18.78 O +HETATM 1052 O HOH A 179 22.244 15.813 10.000 0.68 19.66 O +HETATM 1053 O HOH A 180 40.729 9.223 0.292 0.64 20.15 O +HETATM 1054 O HOH A 181 12.500 15.267 4.097 0.56 20.12 O +HETATM 1055 O HOH A 182 20.372 28.618 -2.353 0.64 20.17 O +HETATM 1056 O HOH A 183 22.793 15.462 -6.673 0.63 20.60 O +HETATM 1057 O HOH A 184 23.138 31.809 15.121 0.55 20.90 O +HETATM 1058 O HOH A 185 22.671 38.691 8.245 0.48 21.16 O +HETATM 1059 O HOH A 186 33.966 33.112 6.837 0.59 19.45 O +HETATM 1060 O HOH A 187 19.572 25.423 -1.420 0.53 19.94 O +HETATM 1061 O HOH A 188 14.790 15.672 7.259 0.52 21.22 O +HETATM 1062 O HOH A 189 19.112 28.022 -14.647 0.49 19.83 O +HETATM 1063 O HOH A 190 17.302 39.059 -12.453 0.52 20.14 O +HETATM 1064 O HOH A 191 16.198 14.502 5.577 0.46 20.78 O +HETATM 1065 O HOH A 192 17.345 46.346 -7.080 0.50 18.13 O +HETATM 1066 O HOH A 193 14.992 31.300 -4.242 0.46 17.90 O +HETATM 1067 O HOH A 194 28.196 44.775 -3.148 0.44 18.15 O +HETATM 1068 O HOH A 195 29.479 13.863 -9.107 0.44 18.30 O +HETATM 1069 O HOH A 196 23.613 44.811 2.608 0.45 17.66 O +HETATM 1070 O HOH A 197 40.572 22.184 -6.358 0.42 18.06 O +HETATM 1071 O HOH A 198 12.475 31.860 -6.226 0.47 17.85 O +HETATM 1072 O HOH A 199 16.684 13.594 -5.832 0.31 18.51 O +HETATM 1073 O HOH A 200 27.534 38.059 -12.862 0.48 18.19 O +HETATM 1074 O HOH A 201 25.892 35.973 11.563 0.46 18.15 O +HETATM 1075 O HOH A 202 24.790 25.182 16.063 0.46 17.64 O +HETATM 1076 O HOH A 203 12.580 21.214 5.006 0.51 17.97 O +HETATM 1077 O HOH A 204 19.687 23.750 -4.851 0.37 18.08 O +HETATM 1078 O HOH A 205 27.098 35.956 -12.358 0.39 18.71 O +HETATM 1079 O HOH A 206 37.255 9.634 10.002 0.46 18.39 O +HETATM 1080 O HOH A 207 43.755 23.843 8.038 0.38 17.96 O +CONECT 48 981 +CONECT 238 889 +CONECT 513 630 +CONECT 601 724 +CONECT 630 513 +CONECT 724 601 +CONECT 889 238 +CONECT 981 48 +MASTER 290 0 0 8 2 0 0 6 1079 1 8 10 +END From 060543d24aad8807210848860b9119c251010a6b Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 20 Feb 2024 10:28:42 -0800 Subject: [PATCH 02/33] missed shed in git add --- tools/colabfold/.shed.yml | 13 +++++++++++++ 1 file changed, 13 insertions(+) create mode 100644 tools/colabfold/.shed.yml diff --git a/tools/colabfold/.shed.yml b/tools/colabfold/.shed.yml new file mode 100644 index 00000000000..868e4fd3d35 --- /dev/null +++ b/tools/colabfold/.shed.yml @@ -0,0 +1,13 @@ +categories: +- Proteomics +- Graphics +description: Protein prediction based on AlphaFold2 +homepage_url: https://github.com/sokrypton/ColabFold +long_description: | + ColabFold offers accelerated (40-60x faster) prediction of protein structures + and complexes by combining the fast homology search of MMseqs2 + |with AlphaFold2 or RoseTTAFold. +name: suite_colabfold +owner: iuc +remote_repository_url: https://github.com/sokrypton/ColabFold +type: repository_suite_definition \ No newline at end of file From a2a3b2931c534c39a6e0929b1165c5a244c2ca71 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 20 Feb 2024 10:47:40 -0800 Subject: [PATCH 03/33] tar file --- tools/colabfold/test-data/input.tar | Bin 0 -> 146944 bytes 1 file changed, 0 insertions(+), 0 deletions(-) create mode 100644 tools/colabfold/test-data/input.tar diff --git a/tools/colabfold/test-data/input.tar b/tools/colabfold/test-data/input.tar new file mode 100644 index 0000000000000000000000000000000000000000..917fc3395c568da25b12ff09e0a22f82f26e9c75 GIT binary patch literal 146944 zcmeFZ2UwHY);1i+Heee^Y}imiI)*elh>8dSgwUid3UwAxTj!YK9q2H95-*^Iv_cvVPy@X^*WC~GEmMBZ22;pVPWD)@Z@!o zPZr$+rbc&W_|jeN7#?n(EDtwtPba^xcg*~T+wASXzx3T-U)F&Z2`{1VKKnoT54Rcp zvlyN%rmKUDJJZ(5nelI)FW^BT&FK5@`j;gU$rRG}`X}H?1Tszt|8JhhKZ^UmT>qhS zqL`0ofDyA|?`@ff!>P*RW%+fr^tGroLqi(PluD&)(sbdssTq|@)1lFHs5A{4m8MQJ zs(vkLRNh`0z3caSQ8GTicw>M<&Anas&b&Nk)N$hXFwLmjUp6L^7W|9?93`OY0umow zC&~Xg!VEkHyb%mQwl0;bK}FzD4QbMU8GxWcqG{qud}JaTfIK2dD`$B%=IR;k?-c zJTT78KFMsf0s|7615d*fIhMxIXoWJOOaLhI)4HJ2hT?UW8#_5jCxIwdUt=PUYI`sk6zz_ zPchNf2Tj zn7iy3#eOG$MzOq|L81IrvDCjPR{iga1=CcJB^zpz2ww&O<;uzs@W?blHnJHWIDabl zPw@Xqxh6(`Q!ZH+zkMeOP(TY%0Pw$)&jX(*%SVAVkp7Ag@(eT{LOja^&+vEj@#>HO z=;DoF^WzahFkM+03K>}^nGfLSEdX{jS&okarf;GJNYnIb)Nfpm&WsAc^%(4?QDKnp z)JxiBWXBi{sa0HV-wA< z;1GCz`A^y466E;+AqpSqZ*CdQ-S8XR|1$aSfCsm%LE3F@0CPu9O%C)cCqv-vEg~N{ zW>|nc9|4>;D3|AWkdW^+YXX`DqX*4WAt=Dde;I(Vo1$%|0fHzn0Ga1C2}F{HBytfm z4($s_Jn*HdyCG;H%K^W?100VL&uN0i&}iVF(eV6ix}Fs~e9Qk{h-1^O*wk6@BZw^) zzJ|qcad)P(7&dfgXB#@p&Beyu&6CMuy19C?!lVGDP#JiKgK>@)1}xx5?M;qzVXW^Osdrs58>cg)(y4r9~UV$@mif9e*h2z54# zy?;UYTsxMZI|F_52YY$;(cfoonjJn%nXRX%r#%fX-VZ8{#ol*x`-_ABnCV~_F$6FK zFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6J zFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6J zFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6J zFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6J zFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa$6JFa-X`BEV*` z_l2)yFgLK|)5Dki@hP3o@^feW7fr+~pov%@{0An9ef0O4=Hl7=SLx~L zX-~t8_k)Uq-sGd(e_DjY&H4|4i^-h<7Q+F<;oB{S*#l+|m_2-p0A>&0qJjAb%pNd% z_!a@o9==5b^AG=7d*GE}f`1fRwr;NWOgmJF*?8Kzc`*Kq2RD!K9^1tKp_~D=nOS1L z{}m2AyqEuhx1E~{o#|@hN_PRMzbSqHyu*Xx%%FQRZ0z8n+Hddp`41VMUM@E79&Y>o zQCIN9E!4*L|Ef0LF$YZ?P0owXV#~~|;{S}FZeA>RFV_PhZDm8`=|1EiC&&8x(7^+ z?#%F|yV@~4+&ozxZr+|we&62s|3hAziSm51{Hn5eS$@YDT5fbZ9gkDouk%rK!^l`BjZwnKXvIEFN#8M=_zv;AoGhQLj4YX`A&pnyBk~dD_>gEhKC&zynZPeCE&bmMr~Os9I$oVjBx!4#lljPG z7(k9d;3LT>knk`7$o?__o{vc8lgA_Zy1dD&!{lk2RNmxi@K%>bgNbVxP@Q1_qi<&q z1IQbZcN^$Y_{by}fI^bvQ;;E&$zKPc@K!+LgX<*uKS!8>$ACA20m#;+QZ=Xu9I7Er z`Y!_zG)Oc}Jc*A?L<3ML0Fj&=0R{lsXyyPBk-|rj=aZBDGJvKb4K2YyQ_le54@;l| z{xqt(AsRyZy8&pj8YE5p7vTUkL54(>|0VVnVCH8t8UG7Xog6(0m#*&X~5)l zXjCorzfGQ~AZMy$O8g>Uj`A<$|6x03@Qx=R!B71nU+3@g2~?uC0u9hd_9KVKgL)~l z3SZ|>K;Yo{2w+S+^O;ev2~zLw@6-$P2jJ1`JMbwc+PXaJ!^_Bnh04pwk!8QimPN7w zeZWTHucpaU>~3WDS~QqGO@k-;d)at(IbEVDl>~E_{i4|K}awa9|cU`L<^9n>C>p+xE`Gu6@cq8*iECtAm6E%w9CwZ4Eqv<%flMv0Ue}Xgbp$p zo_b-Nf2H0T<^IKVz%gjc85{0Y_#$6k{vYJaBI5zy@K<#Hv>!l6m-=4}fNWnI44=0E zWc%Pd3CQ+INWI_KJ`eqGY@ha5+t>XE^eM(BnqR>o@ciKGNUZGMc;L zH@5#}^4|duZdrr0+uQ)=j+~kt=vPjLz}s6yK5)#i0C_$FIBifa&+#B3-)q(cGz&%# znx#TefRFz&0AV*p+e`xlQD6Wv&ubEhBn?UAB4!-g7m#@1OH+44&_b32et!oz9wVO9 z1dE~3z(1qm|Az$Q{|~15CI919CJr)=o^G!H{z*Vy^xx%w1U!-SP5wtl`5){EEdTrW zYvS(`1NepDwaFE#95^EMU@|;6DGJF-&0O_@%IIq$gs$7uojn;}K11Jt>WS_P*YRJj z@&1N?lE~MF$zpiWSxh%q^fdw)z;}1B+??TKD1*_5GDL;%K7>NV-rkkr$(smX=KF6V z*xwycorzgS2%a!TDu;29c4*1mB2Ay}Jd+5&Y`|0*> z&UOSFcb3c7d(hI56lXMruj9|G*VfP0nFo=pm$UO9)8<{ZVbDFC{cJp0ZtgbUF7TT> zkqm~bC&Oi*GaCLY%)GH|+&rN8fU6cf?2%T!e2(4{X2wEqzpNF#CH;Ao%=?zrmnk_h z816OHuo;^m1mQ#jrfQzUmL~ce2^%2NyTFJKNc@zAhdi48Xy4vh0^pH=%0` zUzP{`&riO>;!bCJ`~kU_EBcdRXEXEbt4Q=0ngLp_Wo5`RL?JPP0#Sj? zkh5bj2(|=ycuTh@%aa-QlzkLiJB9+0U~h*$Cy0L?oTo85Yle~mkxG9kem2} z{_ZWXEB}8(;7j~>c5{$n`Lg~qtNR!6A5SLZzlr}m{s$5UEdKvzwDG-E0x)sXc!IPn zz^NGtqJxxU+S2rO|ePbaz z28&_KV%SLu`7oWGh4wLoygbp+JM@kJE`y{XB}}46c*|U7;9t@l=o#pQA#&Txv6Z(=f5M|^cO&9u_xVijsgN&Pp!&Y)eP6`O& zbKh;|iNmeGhyI)8`oc>Ubqi|kR5$Xy(9`JSE702X=wpC))sLqRUDTg5r}OvSZZrV{ z^*IZUE&8e2w&nLtHJg8lx%!K`#?rZE>iX&eKWY4QN8&v$Q<`Z|`@|9e8UW_ho~;X+GB zhHGuewvQI3S{0g%bNfv#EiYWqODv7qnr@!sn52Gip5v?Jr~+2!6^cv!la{w`v1rzB zb&oJ(6B;#eIQ`h(*BLvwZ#*MRQq80Kog8b^QiH}n`=yDY`?jqJhqc`~2;aTd*I3y7 z;pv&aTnXdk>$>MD$HK$e_gh{(JtLaq)os%ICf`sdh8oEl8)BZ9K(>UN)&Sf>!>(Ps z){)!b>N%hDD%rTIu)jEEYI3}+lV#r-^67(C(DWpC?A`IL+4TGK++r4>?*&INM{qdb zCvwe!S1nxgH6jIm{`pFC$h6goHFD2ua|(U>O>X-SE1RuHHw!KEK8eHK*|9>#vLm=L z&#gIdJ}2@=ZKUKo^N==tce7a8<6eygUMio$*=&KJsnK>p{4b$0#UuNow%S-T%A$?o zL$dqZZ9(I`c@j^ABMlSvIuEb3)-Q{eUcPkc0uuX-9tUZ4kYW zw_A0jt2*gSZ&0+1RaajXd=jXlbi0JUYP2il-2=W88`P{-0zMn1n&+VT|Ni@rWM<{g zB`QOwYSL}u+f^Q&T-P1k_Bz8>L@OyNX{;x!g7wPSG-=lfLH@;yO^l4#W5eBveuHhT zDY@YY{=|#^+P(EThIV$>e*5h=qclqevh!>Gye9t?)u|ENhYuh6wGOT@q0u5$M?WlE zv3PxukM=i$s!IlMmuufzI{WblIho78gh}jRCOBd+_^K_iQC_t zu61S$^X;8q9cyl!yLbQo@>Q#@Yez|RR#LaVn!QB%64|Nd!+2JrMUG=sU-7u>t0Y6s zjT<+D45LK7IMRW4J4J+rcb86aH*P(?a%)Y=)bLiaOTE!@NfRS?_nXP4>1o!t{W}|d znvG!wzdFJ8ycxxZ!zsTj=uRVwoQr%mYxX>W@yQq|vwbxwrWKRn7fymw&%b>6a=8 zLb4U{YVq%b9)+)d-=}8(Y!y*avAze?o5o#7u>1X7bab@C379*{$I|khq&5svFCGAJq0d&S}@KU2T354Q?fk$^oC9bGg2~Ikj&l{keT{ z>0`^5Ei1oy6VLT3nVt&Bos5i(d=@gR7uP1!?x=#p z^R-#q5A&P#EnmOhHNWrU;|&$H6~~1=K>-TEaRiTi%eKuC%8}hcYsijvpkwK>{vEE1 z*UJCm-CZMHp_pQt?m9Kro$glyAikA+{T6;LNwO&^9v?398_Wjn{-FD?qP*57Bvq;J z)(&xT@kp5)N9&7&0+8bL5)GAn`l`ELr9{QXCWB_L?+9CLp642uY@8C^J6V%vm7*Fn z*3na!6)6+`$+ksg06wWQv8Rz zw6(P>ADvi}!zf#EE+J`;>gdj}B^zocMh9EnKd4^bvT>t&t)=IQT<5wgFJ9=QT>$E( z1qK#HOPO7YJ-)7TwoBzCybCn%1%?NmD)1Jr}Fn z%Fj2(6B8?BJ==5|4?JF{O{Ja@R*2K{>U(20++AzBefw|GTW$K*XD9@Xv3eT|O-m*| z9pAovyA(J7{Yj;vXT*vptsb3;@xe4_=Nl5HX&1U3&MNt&J-?u^S!c6=qVPLZ|y=+UEss)4uQi&q^k`faI5 zZvos%-aUI^P1k80?Sgm5B#rVt80(b0b=JtaW)G?O4qVcyV$)YSzP@=`km8IsrZ^t2 zFRFLp1wuN2>#9{5V-uWo>y~`^dAY5%FJDI}fBJok-h~d;B?}f90(?ds?d9MM_EMvz zUV@&y8og>ekF0ThGB~(<<*sIHzt*T@M~|LnwY0y>ER!*;O3+;{D3}aZ(FrDG49Z!& zLG{K(l>o=Pzs>Dxx*bs5w*-g#MKU1E9Ea0R55FoYat^$Xtfgd8t)J#rz?I%U!*pwv!S?u&=ar&l z@~c1yt&M7;dWlt*5CC$yW%8LMA)z~@h4%wLK3thKu~1k<#O(R>c=L2DL_BiD2DOXt z+eaatD2LEf*grkm9^d|&3l^9;VcqCip<)k;;Zz)5Ci*ORa?C7vKD+EmWtKxlEQDom zZedq)$}=z_yUvv>S2|2}+e~|Kj~_cm*b}cBXPXMqxcE1eWi8QOvXQX<2>tA$H55{R zLAT6cZ(cJcWV}}n@Dpj~B51~~x85G2r3Eef`DdxSk7CJAnM0!k_m@cDwQduVyc%A0 z>Grzliwd5P!hiqWeZDaS>9XNqi#%8Ij_uoZwCp+BQJHa>7i6VgP497euC;I96|)o* zX`klRM0>l2{;LtHnR6J2<9_QoT5;Y69F={XqSu@Ft1!*EW2?)>Y=80tY|ewDF3spa z#JB8C(7MH8`3@BqrGgT4&b{lay1XOIGCm06yU#7RRY&sOnv11^f+vSfxswpdn2#Pj z_~2gwPUu17bgWa_)7(9eZj#hW66fal^jmYe1)y|=&rYD+!Xw2&E`&Qkj2RGvKW2v7k*{Zc^~rAY`{dG{W^PoEHy@^ zd^k8{;$zr&?7T&SXCaU9s~KpGv1wB@PlpVxj~nmbm1Nl;6&bm&Ce@-g`sPq-UXw?O z8mr?)VB_G_c)yPg(W&N!RKLSQ>cQWB`?Rq1qVGFCpXt+^HSHTj--|Vh#s>nQZvS{$ zyj+R>v$HM5d+IV7p6fc#o(GFD+a=j%Y-nyCTbIqOvJ6=d81^pa7dZzB+VhXWXSV2i za0|h=WcHrKsY zX?`rktycdMaHMUkqhTMNH%>9}3ahI-TyYNk*%OuR`H&WkP6dKdd5e$jGl3*f6SBBh zrZz#G!wXh+0q_RfwtX%;EGjJAQMR?jD9^Q#b$^juM|F~6-RJR^unlk0-SS&kD8xNi zcIrR|H+*clq*VXI$B&)vA6e8lSlCw}SsO5S&YX_V4Q>^K=PsW5nAPmv;4)gUC9mS5 zS^M+2<*QepbBYh|w(4uh+gdgbd3PxDT9OT*C?=H`(P~qOHfFvZ6v&Yx>*4R+zd)0W=ApetG*ppN3!9neD zKK6cUWU{f^^hDOR1!@g)jV!~oVXc)l?K(CARU}t@n79}x)Qxk&~Qng#H3aTdy0Ak3JtkWvGUuRrJX{=K`1f{~- zzTOv?4?+zP*WP~J`gVaJ*-==l9-ONlY~yw^LVVvrQ5>%55^RaCx~xRK3-Xr%dnV*E zW0TzGVQ_YmGBVFAx$wp`M#d`Jf7lVS?50mm5dNjp2bVoMH(jC-!J^MThq7AXm@<*h zdylq`)`cdcs^jy=L*en0Srw{P7Zf}{6>WhWYEp5~q2dN;+^;DeqE%n*xe~X?Z2NLS zZZ}mXem>o*L_rBz}EF6xc*X|W>pw?_y}z6OiQ<^=_8t}8~xhj#@f!i z30wWRb9yj-+AhBWs*uJt6!7TX(H5>xD;*#T_34&F1SUCFUk?nF03YntSL+uPhmz3r zfCP)%{y7)@yTqk!ir;)HJb(W6>(^2)yv^s;kn1w&6%XsN8`lgC&tU}G2T!j$wfcg0=Fg`B}KXxecaXP`~E~EAix1%*l~Po@e9ojLDwMd(Wofc(Mh+(XEZ z)jxjx*f&_AHeGaw`-GY8S}-s$pxnQ7)vAu*I7kv(C$DNo6xi5+`=5LLdFh&XIk|_! z3WTY^RtJGA!et$gK76o)O&}>H^{lcTGG#;Xr7UoDF3rVOYbef7e%7Aq51IB1J8?UJ z`3s^o;GL9h(KQuHgT_g+6~aYtpPKNKiAPz;ul2EtpI1wFfnD|Uj9 zX;t31@$RG|iA1vDidp13pLP@rzY^@)d5_)w=7Xr%bLyiP$(H#Zhl?ZRRNY*Ub$i-P zjF$FS=(Yvd&HWW#(WkGhPHb?fjcybOe5z#A4q5VtZdFiR6_{=RVr>+1ZVx_JLV4-Q zbxH}KhjS}GuQ|nx6(sFHHC{jTvSqd3JD-NWcwkF#ZbGOm)+D*U*$X+KPrN8Z(u8sC z8oVu}S5xg`dbXnieM$c3dMD|2Sy|cWK`80+Z6IxE)(EzKBz_N)?`O3` z%@a2cpF2?CAG|BFmAp@S)28ir@80bjd^geqj&b}<@vJ@c*OPw7d5|kY8C{%KR}xY( z?xnA$AL~>$zHc*yg5;Uc z?x=N2YHr{)UU(fKI@V=!#)qNM%aWRXI&Mh!TxEKNi{BwsfK4g})!!~_tqfmHeABC- zdpAZVe2eb%IwjAxaK`M-Ze_RD?+54M*}G=t%0#f>*7|nHYCTJ=3%y;69iJ#is$_*v zPnto#{v1lg^l@OA*up5NkDLlu+Dom}SZQUa&|j4pF+Tk6;qk%cgtmmh(NEDQ4iHX0 zDbsUwOitJnf3ZENyE^Ip;(YJk`lxoJzVzZTiHZRGiJlFC1HZ!7{#5j+0Z})QpBGjv z$fD~jqLnRuPPBja#5-?zq66H#Qn+&P#I3f9_;{y~D$+3276lanLmj7`rXk>!P5OWC zsngccsRl3eZt;325cWJysogi|9DyNK;R|`PXV67a&h*Rer2+L5Y;nWP#$Ti$8*4<# zTW?*KXzf&rNopmeH6FcHNrs}_U1pFML$wy+(F@tT{?CY7d%JPj7M&MYG>(62L}3lw zk$1dlib**^QKtZ3k5`!^t7{0nL?Y~>GwI`^kV6+P8-8(lM`L<3IB?6v+LIg9RBfs< z@87#ueUrXJYo)5G_nLug4Yv;17H^M%nA5zjdZ(sl_ucs$o^jJ!GBPqo1z+u5yFQ>t zmfQXD{bQ%mPpyXwBI4q?kJh-c`mN)^e{I}xM8MJZA`mo<{@tm4g9cZ3wHDO01@zxe zgs^K^d3a!;DWJc6cxsU#Nx!=$Rm5u5>Pgrl7Qr=rx89#rmh1EX^i;Gl-Jv{|18IC~ zz1r2ynkPRLx>;Ao2%NgsUpy}JI5=c_GVfx@)TnZQZIPcRcf)p_s%qN^mFV{sdqBZJ z`b4#>96WfCyzjw}+)-kMvf(AQ*K1Y$NzFmvAZPYz*bQL#5TgVz0|W9vsyo6y8>(Kb zfZm*F_hBesv%@J=Ip9XPj}*>RTxj6jJQp#1dh0n5Jj{TV$AHP+>m|`FRSMCfLt2(?$)l@4zo!J+BQS*^!Y~oYL}l^_NTs=Wd>L z=FAzgPoL#*f3sRyfOl|HXejPBgpa=dGN2Kvfn``5f7`8D^~8D=^Z208X3<>4rcC)Y z=6fbWr60v$Uxi)x;OH`G^*1|~s9Xa_)@J7Pi22ztLFXmV2U$T|MIo`t>5&S7%xXX6 zmkKf)4nPeS#BKEHYAz`m``mlJeR5Fp{qA><*9S;7a8|C^YJJ1Cu|Ql^Rkb3no3p?v zJ^_fGevLJTAzUYgmX>AmaZ+D_{&LaM6PaY{ZlC|rN|@WFXJUjD## zn1TV^HUun5yB~5@g{$p@!+=B${UN_Mw}AvK0M!B#l4?-DahjzWge0IA*ofJKs%h^S zU}9qvG#vHA4?kqy<^mk7?$kW7z! z1^TW4^1Vhbap8{MhCEZKRe_$k)>;-*DCg}D+jbbXpmqViTp=;3@W6osh&u?-&Ze(I zSs&zgK+g)N+LSb{E7pxuG~RJ!;Q^cT4bv*CRs6F><`5R{0QrVl_T>UARwO{N*9Dug z{?>u3kPr6ut=zD|tuD?g5>c7!IdV`SDEm-s3Rp=6KK(MC+n+>Nog4&8tqW3Y2HO>p zDL#ESz9&-ho4TjMPx;HNl%x`Vah9uHF(@raz9GKm(PgqafFQx8B|!n`x{WGb)ArFdNSw) zZsHfoWk7d70FJ&Kc1CREry%gsj{>2pe8y(8mHVe3ZwNUH6+^v zk52VKMN2*t8JYRU;n`W)K2_UC;ZFzif%ZAT?T1*J7PRMrJpD85cbj3*#eK>6JUo~Q z-2_Tevh^*Jep&56nijj$Q%)OaQ+DW zgKq_}e6fHXG2XB3Twur~qz3dRk22}}Cb{=ZmoBC2ou^1Q+n^(eLOV4};EV<8z&oWt zATWi5^JONZ43!-y8UAw4qElrA@dRqYBMDvlILlpSAO`n5jKEggtzR3zl<`Sim+$#rQ+0EVRt-0>?Q zm_B&q8)ez+S^;6^|Mu7U)i=ztl;wVX+5xl_DmcmXdvnU;luQG-eO}G5J1_bV+@1gG zn%0@X=BhF^Kiqu8oT8)PgM`C`(x6-hdkCG9(Krz#$a$6?DHTTj*=} z@Yr%PaLsU%p;wi-r?!$qUA}HzDpdMOI_C(>l;1wesl%i)F=QaU+KwI+jY<*#lB_*nTgdcj81{?(~m7k1AO5R08aepJGSYb;y7 zQ$r&OScL*e_`N2FYgcw$TpYFoXv1o_C3%VJ$hNW=pf#^*0$rYl91NUaRjF{_yk9SV zK_=+-n+rxa_8K5>jc8?5l>v&cfT#3=Vo71`VvU_UuLDI^F!8C(3!UkJVnzkU7s3ve zOK6!55uq;6Ej~c{=^OY<%nUKiFc+;zlXUA;P-=rEus)&OjJvR#ac|p!g}>AsJg!@L zc-Y(`dq3S%11^6?^#=|&aTdxG*?orsW~Z%jy`>ILEF)h6t_S?YJI3Txqtmt+Ykw_3 zp!Dm3pa!nVYYvv|yeF6#q4N2x92Fi_8xVIMKu@f(X^=7b!vPr?4lvMxif$~) z0Q@#2f{76E9KjuE>*{)OL%^WSQlOR{A@fd2FR?xIE$fT?vM6p%7kbB`JP;(>hhGdH zV{SEtqrkToykpZ)8W^1cia)_qqYe<%w4f9;1a>>}%o*d1eHvCCPeo9yfNh!pwQao> zJU18GyAWuO!s9SG^qP2?Vf#4SyVo3@c0w*z1&$6?s9Kem)DMzCxSV}B?Wdf9Ht0D z@I-WBhG5{jssV7#=ye_@whM)F$j#tXkPN|k4H|5e7s=|X77v>E_;`KlW79uQxH)@)QiS|RN(&J==p4?aWQ|*q0i8~d zyawkA0ja7ss6gbs*!!R$cr`lME}{h)R(XaE!~^hN{l!~=_LdwTjl>l$*!J`kBpwhx zsgXc&TnWVmvv}VXa|JK12&IQ`63{sOe0&-CoBDU_>b`>L)g!an6e`cr(w!cHIm|?e zCiymUj@4qd#lRO--aEVi9T~wXmjzhjN0y)J;Rg#wGyMkbb6gr~`UpJn18ZPv#sF%M z%zep|YZb0QG^?}Pl`-(}cJ-3=%0PXXo<09@+u^x|QX) z0jt@V4t%q+$(i(hcH*Ca_>kzUy`OE;x}0H4-u5!C+BGOGrInW12xS}Y^_2@(NIE4? zPtkqEafIJZ!xK90J$oKLy@D&sbxbWC)$coXX;skBbn_W-ND>mIK8|JSkY#bZFI~E1 zIX-Xx{6ZViEnEC=Y_ZYUdo1wjt@WCI8sa*|c~kRF*(6xTavG%7lQxFccP>>}exWQ1 z1{5(p_S`XbOF_jlfva=Y87vxoEMRj<_*3oV_EK@}7S&iK@MohRVz2ol&>#&Q96{ zvk9=X&KtT;>AdD$XS4`+NnYnXMfV6Da>Wztlqe0V5o%MngvFr%M(qHVm6cNcj~_ik z2as%Gh#mW1-=wcktuvkb+6tyrFEe>fZTK7~^|Gt}vPNef)}NC&CnZvn6;o{ca$RCm z_0Cc5&cPMlx)51*v+!8REgdcKi-prry=6Pqs)b}9J8{CRq$$TKCPDYSeWw~ErQ1~! zArCD;bqREipcV||0(OP3x(v0P6GTvdIQaK^duNtbrBnLt1juLvx)em#(Zxe)(q??I ziR02PcloQl{P!FQ>>YSDv@iGoQbl#U%f4U}@!4|5(;290=#0J;5eI7x&2Cp&vN zMJnnVI-zxVe&Hoh<(D7>-v2aGB$^9{EO3Ob&nb}gCohV$c1 zkC_uw_wc$^*@Zuj6nAt$TJJ@#eWvN9PfuogYHVw|GJIauWWLt)ghN_xf#a#*(|4P} zoI*EH4UaYH8;f*i7xoI?zUqCB@?g%}AP0d|Ij@%HX5ht)%44TK_V;p)uL?X26Xo5Ubs2UjF*BOBRJ0i(<$L7=nd zADtCSV;;7yl6A?*_IkC~xKd^XOT2BQiN045gQzky>5Cg#{2AI|2aUg=6X|ES&&35+P*S^G5U7fxr9 z@KcUJZ?&>jvXV>M!ca9&1>u;gK8dN8%tD;+^3Bv)Z2knD^4gL&POh9n>kZ=i4CiF< z1b6c0rWAE`I{pDtkLF(fOGdA6OfzGGv$L(z0*o~qd&GYPpK*xiGYW^UMiM7y0h}Rs zNr5<#CbM<55rTB4WTMz`bx1Go&NktRBK-1qh%?vU}{OYmfl)h-#XfB3u0`mI!O@VDka}5V`G;GZ4V>|50 zG_?SJFix>w1-rMDjp~&fc1^pD&B2ALZ3HOy#hDhhbvE2H*M6q0geuzM#XfgJ!0Cvc zUc8@E(-}l(8RbTCpkg(p#eR(9-J> zs_fJBu~p!pKBZ@jSv+6nwS9azMfVk?LrWl$6M3HQZCX{^4o!3Yx3ZBJKT zRy;&=k*+pR(>gOY)Tv)E#qIa-p#v7FQb^OW1`Gmxo-R$k3;&A#AP zn@4EnnR!tJT3rh*wzw8wR&Ta=?)7xl=pC~tCXgHID}t*esmmU#5kzkP&iL+?IQFWN zPM38xic||xl_bZ4YMz7FjwyA#F5!6PeSMc}Lqc6L=Oo2s?w#hds=2doGus;HbLJzH z`Y|zEv!p{UI#=8Ax+Eb7P`R|95FyhDK}iGp`39B%?;3bf+;EUpLW|nZ>`xKr*Z*DD z7@??zUpjPzbPbWcM?T9eqZ5ujU%l?_KLF3nSrMK)a700cEz|> zIrElVh~ioH+_Ah!R%vC8#Rjpx^qE1%7#ELiNO4h2bKz}EE`HI5(2DxB{%m6#i~3mR zCBf@?Gaeu;)-mx@a+>ct?>v_(XXBSy2o@U@3&MVuT$wd6d2GpK$1JgA;fI|?&tF4c zwA(l`_{G8KTtf0Sr=i>#Axm~FCeuPvs{;CRdt*~2QM%4qOBdJYzr{|@FE9=1Fx293 z_gL3x_uhiI@F~oZHEl3Sd-Rs6&Q5eCNi?hOr%0MzIGg#|n0p zdxbSJ;Qo;l^<7s8$&eqUxw$0I3spOy5Y!(!{fnJAe^16iXhQQgHOL(5jPJ?_h*v4J zD4F_nf!&s&`TBXMREoK2amu30oRJ-{%SJAht{LxoJC)Qo=(W7W;O+A1+>A|^hNwC^ zQNfvo{C7fRGX=!%0-@P0z8>z4^w8cR3mnC{>2Qi!@g2b4}5OiH&W>ZL)u zTsX4+w|>y(sC~0zb`@)r_fbyol>%;x!5LHM;iWbV?dBlD_x%T4K&0!7}^~tp$b8|Y+u5fG<aQGYpW=UD#EQdFr=;2A2pRq1*t~kn)uEM7T8rFA z_-&HsUVQunK-*2FR=26$C_Je+yEMt~I2ZaWd6?bVFlU~|b&pq)(k`+(59j09+k@9c zuZLzO$WyA|_}&W|(-Z5xpzdMahMylth;JLbT|?BN zA1E`M?D#3N^pLe3FP9n+1#6IMM-wwQzoPOG^t>@xX;BGO5!NC0Q1RZL(qS(?kQh?i zWaVaFzeyt3w6|c%2Y1jAPQNHwWB65@+IsefNMQ~quIl5}1t}cAm=q=o40sebi z(z`r*CqVKFSj`+})h?(WtKdKeH9!Q~Y=9O^`|{Yi9f}(Z7+(;b`-!e=oPKv1&#&P^Or*Q!P3ABU zjVqJMdZH({8b>*rHkb;8(jK?sTRmdEV_MogM)afyl-maUU%(-FTd>ty!+{nXohnZG znrV@k?!Y4^JIc3?pDKBSa9F`8tv1?uI5#@??ENfoEV$5jntQu8LTwjIbT}!T1cwr+ z!L3L7N0H~h1{tzGJ@BAfH2U8+zPwL~ms8@dJ?WA&e;)BD(9O(d11>Z&{ATqI)I|Y= z2UN~*a!`g3-UiA!8+p;C$4tHnE*@PtN zkj18sU8|`9gJn&ou#L|rgNww;zybNid-r5sogS>`Sx`8m6do99bkqZs znDwRcTF9}VkgxbYSUa^#GvZlJ_NyCSG08@~Ox~UfHMSd`s<}zBKN(Ak*LNm%K{m30 zo-`lzo%M--d`M1a0l$3g_urpXHlt*{w#oaD!a{@{vo|@ri#Xu#bwP8B-S$OCirmto6G%L29_5aEl`di!$N_J zj1flt9Y9h_M+exiWG6`46c@o+mLzl!YDJR#KG}(gimvRKLg(DWd*Qg&pj1=UrGcRR zv^~PCK9&+IDp#&tQ8u6uVJlaBoJrG;8$d*|e||w+E7?3JIW50UFkLmi zrHb^dd^!72iV>%@wx5^Eg$`;JEE9*ZjIxT46N2?3|_78rgUH>*GS0I`zV zlzWx?*a!HhfUqkX>wy+h?)4hz%!S6)`jiUImRpuj>$5+qYRUMVzrXZGo3z>~`an0d z8{?W+tY%o{k*1!lh|?WG(U4H#I#Os2$?W|R#*k=4I4J3L;H6JoFhhFgLXa%dHGx0hVQR0^eIjoA%>XM%P@y7 zlrrkgfZxOoXe^iT(sy?!QyU=Oqr@Rn8rq=j z>z>9vFKc@QNKKLD)7LAZy-gRLSfP#|Uhglo<)dRQI0;C#zHJU|a+P-v&KJ>wCZK9) z7e78cIuJfG;!>Y8xSVRS*LQ)H<+SXKqvC&rzmUA*mFfJ?K_6U?D=1qG3x;Px>WSm8 zaJyeAZkW(fwMVV|^KEFHa|Bu|I=ARv<&gLYv|q#cni*bd#2%mq!k#_uW{8gz}XrUV@4{Y?$O> zI(MFlzILg&Ps8c63dt7z%_!&G)-vLUjl4=si#QAB?3lBd#n7?sHZ0I19~L`UIfe-)bZ<9S7r= zNJ^9MRyIv!YI)2%1kV-#68famuf{E&@42}5@}QO`Y>aJM4vIYu!>Wb%g=gxat%_?^ zc0ew1Gy7Gt%Fd`1)=cqysYAlFS3EJx`N#@G&4@rZ3l%tBT0s|oEAq76HpeT=D{=ho z+udYW#pg3qd)LA`a^3NRS9I>?u=dx6aCD&Y76Qc&O`mJq9&;=CUqjxQr08!~d;)kdefLA0&@j{vIk;hodHoMRY_86J*f0~n1xiBi zd`h;=N&M3{+@lMszNMq5LLz^L+Xdy;C7wDZHe<8Oo0I)R)+rGxf`TVrZ|5Xz5fi#} z;e_!lF(xFvN|37$Tmp~Z3FmBC*~ZClta2Qe%y`5*p2@pDpQcX`w>)mut~`CV-}%Om zV2Qxrzg1tbLJIn_rb%<=mkr-tU~bWUHb?{VbKH7?pBfCrokG0g-BbtIi>LBZ*S6ks zzL9LF(3E?mQRL39moH}}8<+J-;HDowq1`#C7pKTjSkmRoxscOU4?GL7fE|hG7I1z)``$n- z4`z~igmallnZnI=Z-g`Zcv7YMn3p1X@CdPeD$Mml7KaUuS{*U zyQ9Lt-~Sv(`s1LMc4Pjli@$;3`A9G!j01c&+%$2hg_Zn8)r?cqhV{9BQu9Z z(?2VIX!fYde^BY|`e}{!@g|2o>Nwm7X!9Nr0(*npta-KiT?uYacO-qH%2!p3FI`o< zio_ez84Wq}Sl#YlV{%QNlpmCG5$`tbns~Ds?CefV{@Txb3iH-pa|k}{Cihm|EU{%7 zPo&ym(Cpe*$rkm`iw7euGhh<}+Bc9|WOdJ+=D-^6Onb7W6Fv46J2Hvy-?IlEc_Pc* zW`b;5SX5L}TDrV)7w=pnWJPtS_FQh41Cwg~>EQFNR=>as0wX&~L46QaK!L)8*Wup; z+r7GfB~s1Esmut~t(%K}Ps+jbc%DYruVqH4xG_B+ zu76c`bZZ^Tpn1|}wDrW=J$;J5=S5?s_f+B5sG?vFKs+Fl+v^`+HUsf)(5#UDu5Fi4 zF#_Fg5AX}40=menFEgZj0mF?%@t4SQ&;+-5?k&BJo>P3g;rSCm{-6PI>Ul~3lIKCB zCgezXw@~+%w&}qwp&Czg4+^+5ov0S?hMsCS7T3WoBR^Epr?bby!?gU{Oh>$DufO*M zi4*cUa{sc&o@rD5g=2{?TWJ$z5oJ2M8R>XjXfv?8%ED!_9Mr)E4+zd$DW~7@wk0|@ zJ1#{0W5@;+^zXz&0l7ZXOHh^fkmRX2!ol^CS=KwK4f*1361{iUgLC*rG^T1OfA-Wt zu$NOess_xmkS#wsxpdVvkBTCh)sNIpJZ)b-T`G1?CMM|cEZoFmgfkCh+^4NK>stBq zy{>blz23WN#}XUSYNvh&Q9n_9k*@d?dP**y+MFEC>3vhURkC+)IG}vtYmaUZV z`>2du+sHE5UOUkCLjBM|-OXCXmAV*9~j{o@@#DNVrX3 z{^S6^1b5_kG-c4}#`EIIeTz-usxq?QFL(GNf1)3gBJI-N9>V$19E=M5P&K5=Lp=N5 z)&gxHnOChNmzqDXyg1NxhOn%n4#JZgeqDm4UbBME{58);d9y<_4leY{0h5%p7cCX$ z^_H^py*}TsMO#L{{;P)8C?nT7cX?(1;KiUhCGJ#;wvxvaWJVk~9eO*<>>e%b zen9}zZRmE{?WNb>R88k(pKE_EL4Q+4(5-?UC?HxzFJ+CrXn9*AJtcgn?}yMzG0(k@ zY(C>r4<_PKAUY7N8lHN+Pt`uFQq{=L>{_|H%s$1ke~q)$4d3cXrxFyDk~H`A$jlmW z0@GF&^4!}cc3%Lw;!EYfNj6Ee}h5_4q)SYLgSl9rJj7pJD#9=#QX*=<_Dt@~~R zmp-$vlrO)_+WKVa3VWu~$B8VDI9-%pY|{d7>5H2=$L{~}I?Z_bE>$NcRmo#-VpA~M zc>+=Bw1IV2udrkjBEas<&OF4qJfk*c&YKgn1uE07a-^rqD%jZv4)P2^0^J2E08Gs{ zg1#!5)MmVT-ETtBMe%%fYB{BJ+4gaGy3~{7pYqUq5;;?2Q|f+B6jQ zTqoWhA_f1mG^>73rMGIxP=DdMfjg=#OC~I4dC7n`3~pb<*|~wIG%XZ4zaTg+|Jx2D zzn+w63Q^WT^kT@agr~ctaiJHG`QDkCxb?==hNOv5B}ge!V!C^{S!k)j`D-J~=wmPF zh&6bSw`L#|oF*U74BS!%UK@It9M8^(yoMv7JBU4e*aM9=X7w`~e*M@iDN{oA;{}d%?`wm& z3j?vp1_GA@!TgM{=WYz|c~aa>i@IVtiEFkisTTKYtD>@})Y zEutrEfOQqfdPZkLXS1FB2ydeXs*g6z7w@PnlX5v=s8&7N8&YTZQ>c^>oR8&Jt5-#PNUY9Q<8J%OjVtYPFQv|o_#LX(T0wjXo5=C3mV!T z;lV%XvMogIH_(NJ9!PSJ3=jL2JnC${1b?%p$eY9 z?#g()-ViuaAOaKijTwn7L2&az0@Tt*CBNPaQ~3qVxj@4~b^J9-1qxBS^Xz#G^`Q~6 zG)giNbqzyHYb7+LdqHEMcBFUD>&wvPB)M_pW&Mf~Ag6{#-bYBnF*cmJ`VYO-B!^4| zPQoKov8q7@(Do&zRS(YrAhrRXPG8>8E~)iHj|@)CC36AwxWgr7*wmr#em>B=Losh) zKIeZi_T_Ok@87%Id`^XfA|zAMEQypRoUlttvr?TXsi>oYG~<*bW1C9RKtKAuX_jO%G>qp66L#-#6KB8T~Nb*Q`?G z)S^mCHI%ca<;vME2EU0Gz{iInx&OX46kxySS4HidOKc$$If3$dT=Tm0R&dFsIyabk z{7~y}2YclXkhG3&(CKUecxAW7+>iyc?de~CwLs$e7R+md^tlF8saJ4_vz0v}=JDQD zUw7duPeI+GaFyf*2P1-PhO~A~i|m26Fbo=hG3F8l=Qv>zO*zL#lxnp`tR4VMqQb&# z)soF11%L~-ibLE{RxIxA zeTM5eX!ua!oxby;8ZRVR*ldv>vtkQwvBfUm@7L%!P-@X=>a+m}Xe{oj7Dyud9heVdoX2v^ExYt5ww+^7(bqzP6l*Joo9IN;2XR^G;M^8u^rL3q?Zfy@$0Eutu zrn`?yL}mjjP&)qgIt0?OpxCun+a>D*uCU_w<0&X@czmYYuc6kpz+04__jeDqtD4POrVtJ0r5Q*d`k+yh zJfgR?d?$-oaCDYP1P@Lbd2$eg`tp`1x|3`CeBZ6xV#-Q8?(I?hWUp~vDM|OU`QD~Q z&)yp?W|*gfn5U+u##cj*1hvVeDE+!zKtO^CS%5@EH+(OWL6($x?xL|s(l{FYJ8Fv{ zWQtd8P*=#Gt%0AD2tqumz!D4+LxJ1Hg5S4r$cvO0;LiIeKiVCRSG7#Z&EnJ#XsJlK zcPzh(t+9x7?+9I`*igN-P9?2Z_bC4`k}L#e1qVc1CNMWM`St5zt#kQf_}SN$bgkU$ zBW1oRRMXF%$H%ANIOW)4-#`AiZ*EpAiVPx ziihknC{nggGOPAB4m6XcJp6UTi4?ByKn(C()z=hA>*1!hyq2NmtF-=$=mRc!e{R*s zNOU5$D6%08>ZlqFF^&kAZ?rD*0`@Lgi8JE@kpuBH5w3Oey+-xGrkpWzW*g*IZ-EIW zLP}l)o;sx6kcYWGR^Bc8G0Vb+*#({;%3)2GtYzU9fnm18?!cg+7-%&1;%Bk;O z@cp81$|vYqRu;6xQ#H2Uy&PA?wL=gaLT;BTB&wjGP?blq%6iU>x?Q#)8+X_dzgi&8 zUp)Dtj-lB}wvY|cra;L&6|TGFm!Kd9$h9Z(JFr_XjmqR@9eB!h`RyN+|4=M58Ju!L zdPeMYe)D@}uwUxwC9iFV)csNCcs*&lvR`Ytg5u3^!g0%d6(Mq*E#HTW zH)PlaOMr;#0N77zP~U7SM0Yp-8xk=0JPF zTosA3T+kFnn1jZun?3oD4{aO->pHA`-hu_Xoli!2IXk#(hUtFudE==`Rl%uFIj>(1 zyrkD)fcA}3ez<~*ZKmgbsbK7+C*Iyrn^r)eIaO)(=a?^xt);D-!F>*NwpeDp$No^q zoso5dQimY4yEg$yx0F6!rq}U4Z6_oiWn{Pmo+6w?##t8p*-$QV^#Y4_We%D=lvBE1 zTyp!-Vm{|Y?na566xq8H-kzXIFw{dG=hjC>`*vSTKX^7L@x!MX#{JdYn+$x*q!emJ z$9y}?$ty<6H2W~l%n%X=sE<~-;Csugk=}Id`-{9IrcRqC`F+ogO|NoGUR_^*klZPX zhw%_^;jUpB8e`@)XhjVwa!JuChQJ}iYt)UYGu-!0KVFCZY3MrAb(?uTkkFi&IU7Gc zs1ISJ1-El032Bh0i3tmZ=I@YU5KyY}u;xs`k7Y<3N_(|cf0APPz4vm&3eS54AZuD{P3I_-G!RuJANDSLEa zH2|TMty1^P4Mb$0zhJ>eu;kyzSN!qCaVzU!ka|Sk*t=(;Bt@;IkH$@xjZK7J*7= zRH8h5OdB`D|2Ep3q4G{K9S^&;!sMNH0Nvdkq>MORib$xR=P|fV z=`*576*8@j5Q9Kip!obk0+QQM#gnNB+6HmW*PQR}YqNm7E7`r#=9#Z6_o~t06)L*z z<*`1^6uL;c-TSA%znJSsFOhCukI7r|#m%N7(dfs*L78B^zoI_RA?)8=5=udErAJo* z+OM?9vt8_n-HhK%ZA@;@@rH)quzR+XkqW5@NajY}THJ7A26y9d>9ss)4ll>G;sS>C zqR(r^_wnNwB6d*zL9zu34%+>3P&!-^R7z-RX;B=Gx%`XOY#sMT{-8Ax#W8Z&@II`_ z-RBpoSKll5)IwPoG&r79I?PpmJ_D+A6OuQ=HiFB!4pA90xCW2jZ%CO>$^F^2_JTz3 z)N+aH>V@d&1qdN0ZY>O0E#G(k+_^U)8?1$xco?a&4SP3p5>oYu(qdzy*QoF!dsa#G zrht&%I?=L1w{20IAR^uI{MSdtyr1<`XpOVJbr@h25^=7deq+$j)Mi=D(dh4}y93Es z4Z!V3SJC`E($)B)BY+JGw`7G94ukmF&rh;!p#+ofL)sE5^a2`eSX%hHE%g5fT8wPu zw)y>>z^z+28NpM-4=UgyqMDbRTGY^j9Zd41R1P6!Z<+71Z)bTHvySG2%>F`}2Spm% zqE;tWWMp)x2PQ;*HWX&AvPi=MYZbaNBORB5 zYHMRw_Zh>xMz`>*AC!O-UzZF`W0N2|M5=q$1H=GbJZ0sr?XyUfnEf@inCz}#1w;xe z@DbkN>plzW4?*x52c4yFQa=nb-s0HAVPWi092n<&<>HcF-MUR=3(_g3PN0}R@i6#? zTTAma%8?6htB_Fg0pZF$2T;?9X> zzIESV8*vA!5PIoLEDBIa4Z`c6$D`i3Ml6nIR|6VbFe;qiG zxeRn#oWR$P65`J0>7L7d@aSt4pl(QChQdOKSJ*=dA49Byd;>Ar&J<=NkVJq{r<(;+4luvb}z3!^&!~y zR5Mk3J0>3zDSdL9fB)1Nf{`EL8WCitaGQ7m8Jgvhds06`W1#yBJSIf)9} zwH+T>?s{bY*qz>ME__;@IknQ;g7lZMFBJFSR ziWmhGIiSj0No+Hsd;R@;gXJYmQHJ7@pZGFepSl?gwi>$nsP`p~PCnFCc?l&dL>=mr zkdT79L(k9pxV>O__i|!cWi1t16S6Z~w`uqT_w>0#3$jc;ub(VnKtvRBWSTsIv3BQNB}h^p1o8S~@H6@$y;{KNfFC)X6B@ zrhE-H&}$;1KJ~?etO+S7gMtoeDDfWAuwX)o$SNN!`8^F5Mm^)I9* zmO)z~P}0Nz9xVYUZgr|)@9?UeEkIvGZ2=!2 z8=|9K?N!NHIoA~b`?s(ZC=5l>h{Ezbk|VAS$@q~F$1apKZV5Z_;SDr^U!}xN{_~i7 zzNE-PcwCd^kcGBnr{?Hzzu|Ac!KjOz#z^B!DsnP5B;T2knC}-p2xE(p(gBO@4fY9D zgc?hAf1J8~Y_rFA)i*CgH)i#=jw!A)nNTc459u(9P$|Vjt9@5`7<8%>w#cHiJjod z#(76;@9&N9=sK4-(xm~(rw)B7YJ=OT4b+H);5TPk0ujehQu(*O-J7Sc2JF>-K7T}!|ELuN>Osg7Z&bX?6;DMj{|5_iAYcJ_aguLZLxbI z`iz$S_s1cL36*oOpCEQO*281c1)6mcT$GeCA^i|5mql_btkn5v8q(4-KB=!Ye~iE!x-eusVuQ+r6cmhc)5b&o5ra!{ zSGKf&g)|T8T43&WeW?F?@}ozp%rZD^CgM^yrB?-5ByN19StXPZm@4>q{(ZK*p=i=t z?lo|0_$DHAssiNHd82(MBprtlV~|a#%qwmSXK1%%VF56EnSvh3moFT@2?y`L4e|+D z1h~QOj0ho@D|X>y&*1PQubxat8RG#buf{^9LEdqYWfOU#a~bLUK!c;a7)cWoKVNpm z3RS8OQY;Fb!Tv1zSm^$=6hy~1b1-C~I^xXuPcZJpl|W!AMBVnjd3&%BBpm-FE`it-$&bK<-*OnC zH3+M>A{SsOY<6-;)z|0__#qB^SZ$ryEZQf90zpgsZb8EJZi1P>*aDusGxA*W5iD;- zTOrcYar16@0p;{*x%BIO&z@~3(RVi&#wRv!D;-|~-6i^(7%wVMx=9X}k6+uo2g$$brJoc{o9Smkz*x zXJG8c)z|&!KB|W?BiX4UNiu+BoE%l@e2`Kfh72ggoD^lorW7ruSitEqu2_a^$0yJx zv}1MmNv}B$UG}ov*K{UsRz?}^B=SF_!#Lw04kNuJ8?ai1D^cBkm0DTBU7tNcYbV2`l)hjoe7$D9F)WB{p~u zkG#<{`}-fukee6cd*ejz>J5qgPRbggy>#xVm8bARKu(<%litXTi8tbNff7(GEo9sX zchu2;=Kx;`k{TP_HL|eD2c9lr(MlF6@GCIGPpi&$xq~7;*I;#d=RdzJ3b!r_M8Hno zkiluEZWhQp5!pg4LO3khfkzy=oImww}QW4}JdKu`)R6T+L5F>OVUNT}|QoJu0I@1=6yB{-Mxo zY!8JF(_on^WuWEgM|4c(G_}#Jrfnd$3?*lFP4>j;b=R9sSan;2RNd*CCDvJuF06iL1Nhl$)t*#(uD zC~7JI&O;nPC4R<{_hol7W;WK%P_;*_+x?iB0#`af10>nHd(`~aCoN?NWA6=l8Sfh4 zv8GM1wsWfvq1>p|uUPQ2q5&*s53?`l<-#>xa=@Gx@9a{`? zuv2q|=PL2PLOJrMaPM^3&%?s1^FSh|*`Monw)4ZN;SPd|&H z+9~6YAsh zhwJvQuODeqwgwH&TLxLdV!yp{cC!mWXi=a4?_YZ97@l%4S?9Hoi1gi?Xb)z#@a0vH& z9je)9Z;Mt=A-05 zOuZoBv=y+DU?cgodvjY&FzI#C$I93#>|Z#?e54Q(ot~LENvQ`%#$`Rs<#}R0y4Mk< z6~Y0#)-v`GGR@qfBM3-;ui(yK+rI>Lm$zqKyS{OR@u+4d5C4jCSrntP$;!b936m=~ z7;w_krt97Ubp`%|sH+-kR;^ww%mjtDv&{)ysek_3JhvZeTo-=QEo$A+k%>=@d#P4= z^e$JY5=L$mOv)`)CbYadC>ISQ+Ot+`T!z6Ny45y4EpM`6{sx;JE2OOmZv2)TH8^boHpIfjDSVEy{1-G)za&);t^{uYN2a!+yYAgCnRbt_bO z3bb9tsepY*&hHbR1o6N<%seyeFG(aKgAPclPq(>Bz90hw0}|f>ovNekcmw5uEc{GB zPF6!45h?3#AaNW%veEF@_Cx-r4~sm#+(s8Jy)%XJeb;i~(4}xrq^>w3r5hHT44{EG z)!65};^rGG07P>Exf>fWi`~a3zJqyRUWRPwh)l=7Xe*DsOcr^-JzCL23srK@gjvIF z0Nr&UFN+~UC*}54uc~q*&rlel7yTH8aDSD`v_b38HJtbEQT))}rgnKvqdGHSwKNVC zqyB0hcW!bg+gLq;dR7BV%4KP_$gWy2PQ)55Ipp-l|I_{$w+@}beN!CBC;G{IP+Z(Reddgko_^n?Zs)wSCqhRh8Wa16Ytg{W{_$)n zDjx~pl_q3s34`f<(ale?ECuz&CWFvEZ8jHIqKQUxpP+MAm|1=Zbe-{=km4&2Zx)zC zaw62V`e-E}+~;cVGr&{35e7*g%Pa#U;%5zw#hf!ggYQjt$VQ2}6t#@A_ey45d2Mms zkw0%kZ(XphXgthpEl>PB_$4LBr>p~jb4S&jS>_#OeiLAj>Q*bWtZSO#j7KM~d^q_I zph9gjjGgrwheu&2LtQ$3{BmDEzXX7g*)Ubwh|+Fq^0?3KVu2ty2#H!7%s=SPBy61A zOd5uFpbtI-fPMF=@2zuj2VD>&RN_i-*Q=#P^LRxJ9sP48C*qU4`_em8J;%02x__wx`+rcfCxe<3p6aYK3J?@{vgbeS`CJjk_|EOvlx zQ}4jc{o6*ELpBX_L^-2i8o=vgQ+o6&~2Qb9O9~H@J(p(5wU-sB0{=t6Qh;p$CSGFVqDcYdq z1lAt4(aE@YN;v6Kv6rL~%YVHS6SN88TuPd<_ruRFFHa^PxN~d6wV`vkF#?4CCnZg5tj(=hGfU{3Nrm_@y5>l~iQP zDr32Psh#gy8bf9P&G{^OAt* zL~&_6odOD%~fZSsXyZW!hyvi z0+Sn=PjCJHTfI_c59(&s9*wPX*y~!nhEzVnd(gL__>C*kj%qBj!?ha+whKDkF{}*! zzdoJ7MWn)kw8#_AQ1A1y9Glc>BtcmaU~3rjA^ZBG>dnCUdW#JlCR{+60}&~5VKJ)!4>-W=WY$<|JPKVB^MmW>+1TDjRQTez5J3*hC@w3j z2aw5-hL^y7&eXHFvZGg^0Vo~zKEof^!-i$y^7Woxp}1`11!8VaKx&=0aK)pSco>gQ zY`jmOK20R^APAC^ABZbr1=7wvEqiIELyS$4>^hHE&o3^GMcdIm!{9%C6dpmv&Bcey zpQxLkS-BR7%%Orc%O_*F$SUKFSvMm_-6M3g!uI~=D@}~^5`KBdXw+%^jLs+WnunF@7^rA+@U}xax({S67f&@GQ07oIjnY%)SPcU-@W6D0+&Iy z&QSaubHiQ-`x-Z-0IJAc)FZ;}hK@TmOo1!6!-9|qCA|FnhczxzIWqZ?TsyTRpGX~z zD{tSFQ={eZZnqIve$d|;&>7%~buiW=W38`J!X|TaxEbm)oQ-xovhQ0Wnm7EMlWDaze4+CAqlnK32 zLM^b3Qw?kH2jt=QHMU88OT^9X4w24Inb(FMv-5gqbv#(x zGJpTc^GO~})A|P=D9x(;I68w|&meB{8HY?sd)NQg@z7?ue5=;Sxld2e1xt{u?}(N@ zvH-27U7)toM{Dy#tp}yzJ?!5cNi^hfBay@Y#lR^anx#Epn1Hg0i_KI(j zprTeGT8Nj+^8NBlB=9AmipOaVkxeMI?P%}}-AkAPLFpW136LS0pUlwucL8110V90y z9`}SjYkl2uSdmiEJ_P$kBJC+|&)e8rcjbG9jt;pH;qC~6ttzM=G=ixTb!1K6tT_Uu z=%Ym8T2~{A4Y?ix@qKNVLHOR}jIr>FWOJ1|j3Nojgzq=`B2pURy8$I3QwNkX8cXtp z|C%~EMMuxzUf2SA>8nD(+$&M(KtJ=(=WN3H*N@YFT-Nt!+T0ctJoGs;vfx^Y3l)f; z7zXo|jKO-=4Q6n_V$tmRjQbi*GTzB?W_!+GxKM$jNb)FJ3~qSEIA)!SIUs?5Q+*=< z`$!gM++6iAFGr7zNt0=I+7_Y5q`iw1G#^^Pe<2&AKqQW$3!6t^A@EFX>DG`J=xB9$ zzCsf~m`M%+@uF-0voU5CNcZ5%J@hjVng4-<1R=Z6h#l-Bg=|o`4dxvJu`I|gmpX}) zi}t}0q}cYSi_Fv0X@VL2+gaG#;h&{Fj*8{gnFp|vL1aK92FbdML*KO$>AWBgx5=x+g?O1=Fkr2TrQY3B7SPOs`vD4q4pw0clfD zf4%oa;}5eRVDXu{N=e)lj(8h^#u6)*?pA6lQc5e|C#R`PW`rPCQEUV;iE1g=8q~=N z7*SSKmI>UL8XMSp)C#>u(#e9J0qZfy@i+eVh=CSPJm6Y#7=xLj7+uTM@rvfwaOgp{ zw`;ZX=TD!=%wa{cG8~*Hw@ty z02&C(WR_uPfpngY6HZ(nFuiV2S)qg=3*bhg)QJ`kT-5!no`~_0wHn%?0T%p%rq!#_ zZNwh$c{h6gw9SC(O3SP`naRD@itLff5RDqLq|YdpZD=Q*b92E}9LLXIN+67W&0jO; zEP=2XM1x z_7F?z$owq$b&^3Q%>8CaD%E32Vo*68hK&XwAFRvY-}&{)q?D&K29wh~;ggF50fqHI z=SS?+YhEy+^uKiJb*~7`s$;S!(`~QlN9AM%s_7*AkI7PSZi%E9iJlptyDC#dN5N;|t*Ey&=E$Pjf;X3(v-Uw2l)N6B8?G?V2%f{`^l~VG*-~Fv($E z>l2=;C(1inX5gJ2u`Wcw-6!|KHHy4rj=oP-BS8+L6L*gUle)n{o6sRbg0X18jI3Tx zC5v)>nLW*yQv*K==J&e=(va0))(dFiO&aDMW;~4jm+ZZh$lh8d@hC8;XMeCB%<%{2 z$@ovz5~g)%OjBXJQr7Ctn~kD&Tr5Mrp&Pe^>wEyx-pM>^BN~Tq?r>i8ROt zvk8fYhRm{%xog*-pex-4g^W}k)&1zUcPQQlR6D~>>)F`Jix*zK>j!v(|H?*rVEh^! zzg4)gah(w9MBdDr-w$(hc)@rA zmE%C)x5HJ~k%_Sk#t~%qb!aVS9G!<0`AfKqNaG z47rE``r?3u%JJ&@{vt(Br7(;`0JyYEBDCF8}@J!rt*_ULp}FG&^Vso0VnTM z5m&6h|5eT4e1IfDHHi{n%)Y- z$rtw?VuGU~$HkfCjtqS5sIHpo6#f{V9_s<{WMH*A)6dst|!{jqHxhJbU#M_oeNiL50{O$rMQbVQXub+;6#kzUK+|x?L>L zeIlVaXu}FrB1fec+k%YsEh4fo6PC#|Y2kcRTA-|1T?2I$SkVAqOsX-dGXwosq~8GH zOS(Q#EkON4+~obnVX9`F&fB9ZLNjO~dQr3F)Zi4wU<+CfX2~(!(c{$FVEwuRw6J*m z-7bOo8VM9}wz^2?DUvu<>z635gHNpvr+VdX*L`SWZ$vz4c5qI7dWY#C0 zb~*AZJG-_zp|RZyZ2YRAXU|@$_K?og{zIZk100C$g(mL0E~kmLg>e*8+hD>iK+nca zc?TQX4XJwu#v4KgaEo7g?~6wKI)J0P5FWz7`GCzHb8d=;3Ap+2`!@1Vo%+yN>q zcaM{&y{UC|v9v*q6k@834Med$kw{`45Ds5CYPzKu!?N|Vo7#r15(L;Y_N|&b|S!FH>7?gsnoK2`S)U2WSUfnSq7KAiofiaYvDvz_0d zQ6It{N4-m;G;p(fzrHX3_p`b-seF~m(NLX9EqrW56^s?AszYl>k1Fqdn@nc7p%0j*`Lct|LC>{~QEa8{JNje1UnKV!C_}DNt z31~pmH#F=bV1xHE->zYU0AUK6p8eE2L#@$5t4`+xZIEm^=YBP_Fu#bsz$(yBJG=i( z8J6ZSC?kYJVqb)}Pkk?=d6feZougq1pwYiB%ft{1jFBOyp8?{SQSCx-Eya6`e%TGA zD>LWrk@pK>bV#=5O^y#HX|xP=f8gRO#d#};0*E(ijex73L)rtlh5>X#URFs_gm`!; z72n{^#o=7OGrfJ|s6{*?GBj?tNjrC`$k_*5ucBXv%cB()+9v&t5CTJ z(3B)z0fDdfu+gU~5Z+Npi|#*K`C=u?C*DfL6C9P5G)Mx(h`{nzAQ;41q4W*wPB|5Q z>wy#TeIEHB$0XBaJo0OU7a(1Kb~vt7#j)!#P~k2DJI!u>KU2>Kq+crEt~ujMdnwcF zg?wcQBi`)jk+A4m!+;vRU1xjoQX;m)~I)X#vIN2OX&Cb2ufkx2vR zZ|pX*(d*vV1VS7OiRWVwMNo+dRFj5;C(4}K4^9fiiSK;itHe+}w*bb7h_;0v2i7h@f$&kNfouF9BVjeVQt~9Gp-_TUJK$_BD)V1xH521@9pV;)M zx!oQLB1F*k0XrKhr!LV=sUZ_y6}?Vj6z{ z0HDC+Q6-i#9#%vXL#R&n=jWCy4K`lQOkDKSqkN$?YufM(hBUS}-^+92b)qo^Bm%pE zB09}Zglj*xekcYI12Oz|Pk8&oB|$OcXZwIe758s!-CBVFrMP##_HUD~^(qX$pnQ5? z76iH>*tsj7EA3$HNp-LGJU+|69{Hd%x`1M+KhckPi$sbBod9CNHr!2I018vs7_CTr zh|f9E?)c*m;2K)vgC*XII>CkoIt9`~@v7tZlxVPkC`J~p-Z*8(Bz~UWN@FDEEVH$_ zfjg20&d`RA!hvjua8?%=Km|0To*3KZfBAB-O(?ioiONGQtMPIVgC#=$*;I`(kw88@1S zw8?jpprP0|W00x^6-ZuanKk zbUIKK`QF|dH8{4nkn_Dkq`kHfHyDA2ct|PgCuG$fH_4OpDT%|y05B&Ry^7DL#Mq3> zwHs$q=*-95b}GfGrtup1IE$JF9sP2UdcnqzXd9tqq{m_*kwZ5p9=qKg+33#6XHFyA z0}^|o1yg&JLIjOtL3FDDn!{=Xyrl~mpy_vB&st1I*Fza`{#L?Q#EHOY8nFX(c?fb| znt1anT&X7aNBOc7wI4fz^M0;CQb)==*PPw|ei_oac8ppoMRaJl--1c2q(r8Pk+8A$ zwxA?J)%^`OLkzWx#X-ej&Il5EKC!3(@ zOA+_8$CtaG5EN7k{O&!X8+Ju?;h(<*{gv|bs<^nXBCDoPpEd6n{?f&~ws)o)jXS8ALX9V^tl@w$3n_8o;$ zFQq+7d-_{-UGh|Qi`F(*Fn9MH9*!6vTz>Rj%H!MqjOj8Uqu|_Pp^Dp`5NO+#OCm;; z(_~9HTDIS)?x#se0CAg~74*?qCzDwcXe7u+{>phP2?{6-k&E3ymXYoH<92i{A0Z~> z6X22en9C<&tpneK{MX{^il3AzqK8U6mr5&!8K>v>3lBK)NrX6{_H)XjTYIQkWjr45 z%h-@VK{4l>sza>tX{On(w(oq+Ugmytrz>!>!pENosYNSKv6|GP6mb{oPhVkl6XFWi zxYMG1KQ>w`sD3KJ$WuCADgK(6;G0=RA+nf&gQ5TwG? z7#&5=Vxrczd*m~PX7IT9PDx=yM6$?sgQhNZ!pmJi$@==E*3!Gv&ImY~0jCM?>Zt`t zl8hqp{DUbnk0x*K)0)Kc$BN-azp4ug4^JX92V9Mv!!soqUyuIv=RCph_3q!5@G)T0 ziNmz^T{i+3vUWan>uFvQCT4XGk3LPdXa&7an2FEt9lH52LOXEd$(bI2`ssF-p78E) z>p2W%XF**i#Nw1k(v(x*z*`AF2gLufbYf4yaprxR(uaK1daP&~c|^){KH-zEl9wv7 zV`DXn!j88mKFmXFsh6p#y3f+uT71ivnyAU%V#;;k^+-&Ws;Qp_kxChzhtovdpu8P7 z>0K$dp4V&*6glEdYP(i7H}+yQ)}=kRQ;Tjl+|`-v$#uqI_5?-N%bDZ{K$>GUz9~OV zheY=-1q?(|V^j6`ktIRLTS~Wr=Zof*Sp?EY0W1^F$PgBI3+E)AHU(jRBc`8T&P0N0 z2kdyE{vQd?EUss6`9*PL=w+G8*pJJ`n9hi+iH##^2Si7>F9IbAIo#sofbkE+t4F$W zK5oTmzxQ|+p^vx+9@J3kh&QK+=0kdl48wpjxM3IEjQ&T~T^_0G+K5d?DnBZ3kVa9r zo6HboF&K)}?I?K94{B&o5Bde_2!&Zm(u|;@nuHDP$H?!-A~T(?rMLj!=wX;w;Mx8 z1i2Pcj-sNXGJsP`LwHfBYaC5BM=D=M zrqds_k0LjtdWM)4Z^nRJkoKbr9ls1nYXBzXZTlSQs>W$5|8fDwD)?t?0D#7=t*sq> zh#59WEE6!{+qZH`$`c%&;tKnnUUM~sXvhiqb(0xw`0RE9C$lIA@n2lWFUhPIf zdBy=>8i{`N zd)6qfZyE@P0%YAjIC+R)0Q|lC+i^>#QD`$L?4^8$`z>C)qZ16x8TeDPDxvJb@V<53 z-3yS5M3DtMs{&1H8Yc$T$Q2=!SzAe22gh`ptqP?!laxT{uNx$}5kS*Ep}_`u_T&-Q zO8Bi1aD(cm5)ae!azhE_V3JjvMHX}VD6V9S)QfZs-AB!iO!_|h%Sb})EUbRg^LuqX zQtpTzx5v7}%X2!(w*-a6ol?gUpsd-;rMDnEJE0xA78958&#zv~IaZ15#VqL$*3KaO_qXyl+9lqVAL6QM^OR{^*qqeGMHQ7L;FtPqMrVw6R6WTGW^7;5h(FQH|puWpx;Z%obR zk=s%^|3cA*A1SLw1cMG)TDAa!tl0AXVHBd0yJxrse8eVp z+7Av^5NQddAr-uxeG$okm@u-!!#kWUFTNYjMT=V{Ye30rrz;LT-1#y$*J@&#qP}Xq&^oh+EncS8$*a*r8dX@mI;!^I z$?oAmIfIkW?p@8Z&N4CG7Ld2a>95bDtWu|;7cm)B)f%L=k5?7+x9wRLyWQL4uhB8| zFS3udZb@)=TEu-PL9y7@%-ZE=pF|gw1Eo=NyUQiYd7R2+;W)M9vY_evrocj^Aoz9o z1JK16m2Qm}0lpp3F)Xpa1g07Lhxi?nphCs>eNv{Tm*AjWgpUS+}+P} zYx}CAvF4vCPU)NGn#qa9Y_|)0|FFF7_(*qh0tix(&T2}h(ek--tI-nX z1VxjfW>Y$T=yFQWU#XSZZf&kGQCw)?tJ-iy^z6l;yc&8DfS>#Az($YSITv>gB6HyV z9}i%;h~SUHNy6PS+Pt6)i1WnEQCvx*@^|+%&RwKYBOp3{_f^-(*0n-HWR^}(E)l-9 zZRu<7mlLfshC@ZZ*= zoC6OQVSx2ib&mscs_*dPMs%|vl!tlb^Z^$LU{lUOS2_*nyB&$VzI|0H0?jz1FQRqS1 zgloqFh$=vOU_RKeQx15kWj@f!Z0n#o{L+!7TEBg0LG>eWsa7QcGPy-H4uINNLMXzJ zF9)9#xc2(w$J@_`wGT}|H>&rR^mOxRtP_;KRiF8dRzW1p{Btexv-<_xkT75ZE5Rk* zZTkzPuU)5<)fbCY{QL%vK90ysS{@cc8 zF@?o9TAr*Mt~>gCQL@hNoI8o)Ts~Hgj*bv<%Mcr7GQOiXt)ci_nun$l?}5>VM4;pL zvfF0EH7M~jtV;y@hrw{^ZwIt>-`eI2Q(axm`66)N7L3TNAn7;&_c&O*57pF<#Xu2Z zgM&?s8>Cokm_x8HNmF~~=FT-ovzRRS`6VD{)?odUmLOk> zDHpAJy8H5`aL#nir{hp)szY!tsG4ODtDNgwXll!@f|7K_uU5ALu$f{NYEuCuB() zMRiAPQBD%=5m$?@=)qelr!_j^l9ZY~Ban`+YD3&fQ}N2fys;O~Jg+_aJlF$?$@Bn1 z#}P{bD!xG$5lh%QkRyX&eW788txc;jQ$;krB5xIOYUpx zMP{zI_8+`8;wZ&CN8^3NM95V?#P8SE-+pU!{5xh4{wOhwe_B4*$cXRj1*-x565MyF zpC_0KFr6|8)?MZP%4x=tyQMF63a&)W+%SQHN6O-DJ-Thn7%=%@wiOJS z^!u!`eVfuMnjCHLLkM}lv|J^rr^lJ-#{TEeJN3UPD$>!?xN9F@E<#z-H_korHOGI0cUgT_ z&d!=2!sh#Qd5)Cast^8D^I27mSi!95@zMJ63_Q!=Xo)+x6okD1p$58%x3{`nV(9%` zWLkOvTtRP0M!_-kK_ z^1@xf4sd{}CC7>;CJw~z3TW2d8!dS9g!UK!Y(8;=fjhe+cgeRdQu=WA*ZC9i%_pnP z`Dm=|`i)A}m)4mc-Mf)7LUXaHARt2%M5PB27PdRRJP)-Z2~PU@^#~ERY3w^_DC$bF z2yVpU#NX{0o_cCN?|#4KMK33+hR)C^%5?`p;w!%!W9!c-CQK@a`_}{-rW2qmzin7UsPCF3T6P=0_ePc z*;JBJkzCw~VZuU8n#282c`ZP3*0u2Pj`J)=GGBFrXlk|^=Pdo^ule=vl{k;I!ri)S zgA(uE6=aMZ42>BU8OTd7h`@pVB3x)Ss0KSYbru?7uXNm|<~`*sLEQB#Z66b=hId@f z{2Y;t%i~?3#rvdwwdFI5JH=l%IqJ7`u0_EQJdQ^pfUa}_K7 ztp1CRe~jl{J{NK|YJs_siP1d9$ZLEC3fOf_dY8~@njWYppdOSEeH5NJQMJue4J-~( zOO~Ox|FGU42i(oRzd3&3h2cW|XBtlE{-RK~Y z;bcNk8Vdtx6cjavkO(1-PCywqCc!7dac^OW?L0FUuJL0}Vs+%r?jv7$rk^259#jK5 zjx-5<5*v*wK`9~&P=KIoujF+V_0upqUK4bRQWW9IAm|Y>!J1` zP|`d2XWmZ_e}D7Y^QXzpvcIj)@#=+A?GSlf{J49lVPSx>`!)P~bj$SSB?_2ow=rU0m42L?)d!7#W zKhC7?6pKc@58nBex$vdLs|`5Ev*Dad?vr$-f)@>}6gR|95;$V(-4&ZHqNDXV&S1??^L86Fk@`5`n60YX7NRR9xA79?O92TF+314>nV zW22=~Z-wrdSY>vK>>hB`$hgC0v1 zN48Ft$DJYX`!7BfG4wJ43+|b48hdc2tPEpuwOB-|9=e-!d%$zC@-J~loUzb>Yae>u zm3lCyK<6ZlcR6djRL!!u>*z)lOY_tnd%nypV!@(CYbPu&l8eMZnr>ikvk;wpo7*_& zqp{2KL28<0!c3p!3G|t4CV~d{2N&mCWS9qkgv)X_pMv+3KYk9>`&oMvBqAYRZ=xqSq*&n6U-E}ZYwYm4;+5;tXjwOB$6YR3Ql)cw&L{o z(>JzY$j9{howSX>Li}=(&&A3qtUlv8m2QCvb%P4+{-@ajF~FJ=rH{Xh3sNP+H3DFW zEkUlLDBN~|q2S~_2C@(l?}s4oaKROg+YUH>D<~a3?t(4-Rs&YY$~EO$5vEE(HSPsK zU}QSyw9(^~ioHtvckKF8Z9-w9T3HrpKKF9}+8~dop9g%zz7RhSjV=8wds8dG6hPU3 z|9-Rw9S=LGvdM%8-CB_GgVvcRfkQo}~E7?ZZ;xC#73%v&q(1e4t^SqlT@1pt~+>&^$V$9AHQfbpLWJ_Q&fX+7LSKHq{q zE+R~US%#WfGHLqbyA3n2iCNBwN^kmRFav|Kw_i=A2X0X4xX2&J*Jnf%iTAoPnT^zqgc4Ial5N z<#|VD!FhxBqS%g%6fuU?vG-Pi;{~$|q(`!Y1L}i6HqVIsaGwYd!TBRV z<#hFZz6JUDX1D$)Bz=-+m9W_o13Fbrr`lWbb-@C=;oGA;u1XosA%^Zv(c2Ta*ag zl*W@8%&g@e+Ccbz*g+HPv*_;+Yjbf(w%w>S{>sIYnTlN($AgYIm^UPj;ak4k+;$w$ z-^JxBX7As>ryO;;*a*1f6kGqCj5|AP0!pfkba^B!u1m=uapsRHZmVbc z09{s?NH-rU#}cJ98ml-Q9rI}bbKZkZkMCofmrL_NKbTdP%-zWGRbY%=m0q!Tmdel* zz+2fzi*_qTb-v?o_n)e5kF=E~WOe9}o2Qmp{X?gTh8hqAr4LIdtjNmm^xbakoiXXJ z${2~=n*5sUT%45kkQ$Q(?6xp9Bm2m&-si=qX$w*@0u=!?g5xGQ`9IojLZYp~f@axs zpYcj;pPd)@S2AfP0cHVERf#x=gd+}Z3rKBOHzI0$YKg zk^~_t`XR;06%mCddiFQu_MnAB6ug;p1dI;%i~k?DiF>k&#tg;Dt>Abo9^t03swFa=muYp7jPKtVtbn+3Afy@O{_$SdVy zN+misI`E;Ve?)i8>~LZopn?-ehXh`<6<1bn=bFK0@xqQ59XM)`5tWkqZHOpOBiK^~ zC-+$Xr(x%S)ptXObH&9?p63lzKLLfp5DI5mv;(n8Ma0EvsGu&I+T?LZ!$4^y#96 zmKKtTALyTxm>u>PC{5{z0!?hEYYE^uW)EB@;0=eA&2T)cl#wS((xdzA|)yG^V{_4Y(}!!i_CFK|jt_wuU)1 zD;nLxh>GdgI6f1MyYmE>MrE7UxTY^VBpR3`eLIAFHRUj zw)Qn}tFq1IKs+n#>nik?G)MMTjZp|hBP3Otfk6;qm$>smpW01r01JNfI@42AQ-zvl z#)8%x3TqT(=dC3=Q?gE5h^DF2H$L)SC6ySf5N6!oleMMp=-EYyYa|k%@Z3Nf{$1R{ z970`%fbsv&R&H=K_KGgL=ej_=K;uKca_CSDx|cD~aASLw*L{FLb)tE`8D=cR<`++| zom@iW;Dzr>TU*L3AB;JauVwTF1h4Df|6AZFJbH>Z#%tI_!C`UlEh3?T3x~8js2{PDwyynygt&Dedf6iN7M9otoqj3C! z87XE@zMT{Nep$jyvb>3)TK&K#i&g|ysyzt?MN7yacp5LqZk6#?e4w`MLR4%|dywf{ z-f59VsX`Lej3L4Rxzd4Xp+h`CG`rc+(XKtipo_|a7y#hW)8N|AyEt@U#+JCsHW@YZ zH-AOZ#f=Y&aJ(KP5L3KkR&nQ+mp0^joQp!uK2}%%R|?T2a;?oEcD}!%n8W^-AXItQU8cSnls96 zKn_HpG{pUG3Ofx}w7J*EwQ4CC<3xw#-5Cphb&-@e<#ZeCaQh?>aFJyCAg6*l`0Y-F ze=!x{ox4tbs`_N_v~Tb4qGJv!Un?J&&oS1U?UV2f{|3EDAtvQaLpMRURA-?R_=V!! z801AG$!#eNp#v!tBB^>=Ieody;+#S32$3Ppah^ssR@VSp|}WGK@zBIyfWH+H9Y{zfax3 zDbB5RKU6!<%q?0T_!hG=(*8d}p`R8XR>;SlOD$Ni0rknM`=R3p%r99Nau7d?b5VOj zrt39{2+2sBz*6B*bFngZ0(5bLa2b1;7!zLnIHTKlaM*2(rpnfrtIz38&R=%&;$L!F zH?N2q&N^s$bCvF5zpmz&YXwxqn2lhrQjiNC%k+0@*q5=1Lumk(MQDCeq*!RL=Zzt_ z-j0+tyS5HB;r%GYrepNJLP-aGFaZKc1$%;CAD%!0S~(HZXsl)Xpq6uU!*o+W%#s(~@>Y&T6H(zNPR`xG^gx}i_ddvqX1v~L9XmP|f~29L}wP$zs}KVWivCZ(C| zhF^>)8Rmuu=AC)qcZ1TT(_0zS0P!%T_O88jK9&$v<)sI^$Hs>yJq{N!0qTT8BKf&b ze+O<&09k6H?34tGSLNO8a`Gkw$Y>4l>qp=9aly)?3(K&(bz8gA-V@w8Z?<1p5+pZ3 zsuGs}_>mo?1CuF-j8dld^Y@wL6`m)NVyZe`^Tdf0)P;a-te^teadm*YFMxDeaaIP_ zf220m2L^*fXs{yJYG;}usw_$hc>IQ=H0=Nm8_b{pBSb&j~t_=4SScVE{R~5ObLG_7~9W1pn zMA?LYpl2CKQPg-0?KSj?D~*0k$QP)C2q5X|jI6NU#`|a#6(L5hY7e`fob44wmIuoJwFoj71sQ>IFA46_-pE$%r)3$OIpgcZy;vD57H2od)uTUNbzx7F*X zlns_xj%!^Al}ORxN*(=(U0cU1!p6%hKX;?&0^|-*t9ALERqg9gMP^LoshdwqyRlQ? z1b8Apfs8_vR0L&t*JUo+Z%*5>G*QY;nZaCq5`V0F8jW zcs9S*Bd?#b^6~(MFF>-VO`STQ-Rm4`p_UVS0GhL%t4`>s>fsZr&*TazQ%3*<*E;Cx zaz*^iuD<5SGCs2v?Ck6WfBk~$uPN|7fOq>mSoPnsL5Y$=Q-0kOvLF8(l)Y4K&6gk zG9V5aBX(C%Pyj1SL37V>V#+2?DxB`;*N5(ea zLWknEjyNOp3b`)uHbKYC9=&`Hr1_dxt5$#xE=DGYs>xG+pU>7fpQl96d+{eal~J*C z;>1d*{z;`xjVfpvehBQ_eHYeftVD8SfzUrn;R^~CoiEl3a8PiKY zyaFLhMYS(usCN;G-f_Buc|Qcr4yTNBQ|J|F%M!airrqaK2~5#Spz zjni9#(VS81t~pL~@+JT+&ClJ5R*!NTd{L<$f;VC%l70c8hM=$)N~JUj(a46}EKPcR z#rGiWC&$t&R!xICF#YZ9yckmO%6-TX(fe z9(OQZ7TtNsnJPo0b2dOIRHUmL6?D07zcxV!l8lZPV)N=L1GA$#qZNMM=Y!y~JyAr} zl7$keaotllOz5(qzMvr;uIf_SL)Il7GDD1E6>4!PbQ?PjfsjN6io=HwlX*mGQ*o(7 zsm!rMhp2rGnQ#C^H>Rus8=hEwSOSaWD5+5BKisknnczxrE&(Zm*V&w=U%VT@RFbnY z@(DRA0k9I`B-02g$>kR(;iV??!(G_MDx14@2hW>^g)^`Rtz>4OTFX3>;01Q{fG_Bd zwCiO*Dt`Kubf${{G3F0^cL_9mHh^7BlSS1ks#?8O1KE#ww?w$cT##P8_+^!N&Mz5= z7LYADA)%RtrjNMniE>Oji$p7}j zKhY=fGd!sO0vZmUtr+ylen9uE^a0Ad zsN=`at!lY_;lajj#y4{-zu1jqb@XEHyjrLvxKRGmt}%xYJ?B`PJeuO)Bf`m3Muk0j z^rJ{Q>Pw)GDWCOglw>}B~5On>F-0@FRm4Oe8$1e5FIxtn3*&KA=9@iS+(0WQ=`Yo1vRT% zPye;^@X@2v9g0j%R?tj;V`Jl#0Yybc@syI%Pg-clg7iV0340#>q%nCPAaL4`eLWF( z-bh68Mo=5R;6#K_{MF-1pZ0eO{Wcw_G-mI=NrlTWTf-txbV5uaGCejW5;3AO-3j-o zCP>f95hxS~yvHdN?d{#M`L9%t>oS99?LDnHUd_q8aMyXCao5Z|KE}ZN`gXN^;w!*P zz^Nwh?qGXNe&ppR8f{=M>*=@5mj-%i=`@6ZqzOD}me|CZ3J)%22|g&%7fERr@4;k$ zMWh_80V(j$aV_MzLGzc4%qew*)Hq#SGn$}FL1BUH*&c$iuh1ZhMy+ewo0FN-_L0*J zMW;?qPAO@DLGA5eeq20nO~1UGR1X>Rl{s|paM(=H-rU22kHot6E%NC z3@Qr{8LsDc4h|q1RZFU>ewcf@cWQB40Q8Zn5yeq`LXHrb2}JW*&@R41iU-63RMRd#jTMhai)NfT=fz3V8P z5e`_O6PFHEk{*j#R@w0#r!dMZasWVxF%eJgIv(zR41(Xyk|X=t|2oG;G}PELv|AHG~%3*ayvG54)7Wa>P(Wg=hKGE zTke{Z1te?_#F)?UjrJEt&RJ@{x~a`Tk~9y*MS(%U zTIyYc1xc(t0GHH*!?&mIAW*fs_^tj=z%xT7lDukx6)n6}Zq~R0fNl3$JA@h1dV}IU z9|r%3?%I49yEYlHKnd(~wF<_XVMt2FnN$I%lE|YXy~y*?b?hhFjAl~%t{_CCS{2-` z^)GfnR~Z=@X?X5xz`&u$ARiN#jo6~J<}ykZC+yE$G6_;4g7{d8Bpt!@x*XYrYMv3+ z8TnL^zy{EK8g`EFi~$Ugrof;s>dD6)YGR1%yn#wDH<=*!EzhXdi}a*x*bi3PKO zfl?5R^3nFb059CwQ^aN{FG!}eUmCOOtTvr)fCOc3>L8$80`nBa;raTH`R%zUkttR( z-ecvSj|afTx6xZKA#m^;tI)&DD(noXnTB{qmE`^>>BXueO9h}RDfr*bcbm^--eBb- zZ)CYSc=4ktaoH6=P#4HmjB0|U(?Oc{6@dc>MSg|YCrz!tPC!FLgZd~)@3!Q?ed-Bl z)oX&LBLK&$cO$_^0r4T*J36N>Y&PL&q)YyISpR-YSYC61)WAg9$QE zmle`$eYm@V4O%}_i}Ao;^+H}2u!bWcDRBHu9Mr&4@a*0oJ`rOR7rBfj9)UB;qg4-X zUa@)h+-u#6OGmEWqW%`nd`G1vQH<1`z{#I^K?MmOpf*Y@O6C7&KSb|GE;ZXYMqi4$ zXK)AE8_Pf5w)0va&q3R36Y|f)2SXJd;7PUymi3?=7=K&$FZ}!EcqSk|8xj?A?O}CB z+8m_Ns9}{O=FPa%lA{TvtO6cn4y1;Koq1ARYpKIow@Zv8+;nc=B^zocMs4Gi9LpY@ z4q+q%9|5?_LMe!Ji~$g7Z8^JhMi@xN{$_Dw|9P!IaWBBg7`{3m-bb@oYfNXUw@2r{ z3nikieO}GR@<;iXU^=*%a}ax?JHif~4md3o%|pF3%l9Do{rXDWdbnc6<9GquPaB z0rR98_(2~5rq}I{k-rQGztSLmQ7b)?G_x^RoTL#ElPDg|QpLUUj&|VoZ(~f7z+eNl zFo1#to1-lj!1#lXZ(%MDTF+O?5QtX`wNv*FkyU%sH~uytLZVxSO5VWfr>XQ)4KM3J@ejT~A~d9D;5u5!4$G^cu#g^CH6&#Le{_`D}23 zAk3doJ_}zO{c+?gY@gwO8!_O_fui!->p>)Jv(S|nwKF8b{YDqzhQ%JO*cS>=NY`t%cQ z?&Xn(Ia?EWxliylRzXZ*z5bzM0v7mZgEj>xqr|PtJfw<%ory6Kh5uw~Jp@bf?{_Bh zq&LEN(}jo^S!5I87oZJ4+r;}pF#*&ZX?WyshA3(x82kwWoSEUoN!9-rw*%}tjic>l z@K_-Gd#@P;4{ic5br`M5jiJNGbHN4Y)#0 z@_s)&=#^Tw^qx7G)Dx_PjGqh})PZrpv0|3O_CwSSsk;GoPj{(x4^;$6TZfIG^fG_V zO~V1!mu0-vo975e%ML0YYKoL!^{LoO+MLA~-vFUgfJ^S`K+FnM`utvJ+O`DxoKdGr zI|nVpIq~;9aMsoSLc6yu>JM?4uG?opJno2fcH>A>s#JT7x=`I5V; zd|ln_b-@`CT_s%RE4a%f2~$A>&#v>qR2>NjK&S~QLhl7&C(hn=_3!<_a3X-@$F`@b z%vRTM>exLg029RSM7UZ3Mxt4G3 zzOnGk(7uZv6M=J4kB~_Ct(j)<7~RYK3FHR#3k+R>1>z+1WFk+T{*`jYZTomQ`*lL2 z1W0QR4oy%>Py)MN@Z1vq80eh9Dl?G1mx!~Sl?dONUQbKl#iO~;rBV+eAX+wg-?%zW zB$M12p0f6g)7-~{>R6$?EH8gxz!3+{b|WVCLPn`{S{FkcQm)u{{P@{a)r05VON< zO*!4z63(MFUMh?-?hV9cR(#+HLe_Sri0eX1db2_mW^SlLli4ScGZ0Q}Lb%29=WJHN z=Q#(ndhJ$wNt?@vn_?X2o&FVM`wPZ}O3=DnM;VDBaQl4^n2e^SOSCe=cV5ZfK)y00 zYs}B+vcrDE;OyUqvUpw(U9&%Pj-gCF*?mr!W=UO$Do8SbLm23uteT99?}FF2U*8B7d+q zjXkxg8C9m#w8wP{^{#Im=q%!?+4hgiR8hV)EqK{UGrnou&B90rmzIUPcsIza1wrJ0 zppk#kb_SWhCRtNMoB|2;n}?xa3Ej&I*Nfl|Ke+<0VODzn#G;EBBe2nfvz=}Lm2J&IUNo^@P z7`VfjtU7{!KkA?D^b~XlN*9CD?4xA{5wJbYgYw670)ho*LuS!osgtc_x$^+M(0(xhE6tm=9Zy&R9nua zVIcy2f{=gK+1o9m!QvhlPDh>1MP;x>)-FSYUrwe=01C-3g^WJ|e_la! z8y+YU@bfs;h{&I@RSAsaCtMYG>dmhR%rLd`Un88QTo)Dfr%Qt3FI!Z65`dV`msF4l z-^p>yIrqng{K}^#`l7Jkr%O$Ki>(tA&3jQX0|0)Z=D3xj(a8!yXH4lzXnq+(g z%$puP$*B<%U(ykwoEhe%Z2|j!;W+;LPG)uPluq1md*f`)A0ukWGX&L*ZQ&|kjC7@# zdMg-G6*s&(sHX#vfY*_Lbqs)F^%9=~M{t;)~9R z`=W%OQThhlKUC8KhE#Qcn*P3tykwp;%4b)(R-f0^y$TVzGdBv~&3k}nJLX<||Tl+!o=U&@O<~&9)-&GyzcZav*dP<#P z`a&?!U@oko3EM!8SDXn7CXxv1%v-Y)Gde|Ym8=rj%Z=gZ@Hw|5*-_tW z?^tjfMp9HELo-+38zLxt5;Fk~^wjT!Jlduk&FBHFq_%1K@W5z=-p9T^GMe~|XwoZ} z{dtOJlc>yPF{m~Y2>PGa=d*t8EhIBJ`^$i@s&u{H1~0fOJmO9`CG8|ZF)UN0dC)+ZK9GqTd6@nE&@_kBFZDlK|_PYF`;%}zbMLa1obg`hGd(KvBT- zH^f*W7bTD8*NelS?xg0&Y~}(OM5x7;q3cFN__g=m_Kpm1`1go2aTTXk19DbLJevw2 z8So2}MV;t?z~xr~AK|Fc+azvJux35~uI9X2T)mP7drP1fO{g7LLIZ#FyBAKIMpQM> zaSyd&BKM*c1GW_22*i~EB1R2LSxvD``A#m#R1y?Jw5kby^ZG98EDA7Al1Up?O=Fq{ zkm>pJdJfN{eH9!+rTaz~R_`XH;oW{PgKjsw&loNI<{*oFeDzzliBS%=Jsxv~(moul z2((_26bV9JVq>qw2$4XDSw8>S(vN_R+x%Zhnh9%)kcp zt&MHs5uCbTD=xU`7PJu9bMSq^cMSj;J@Vs#bfA&c_dx3l8zw%BU15MX zix#8aT3!#Q?*s7Y5B~#_AsXW6Ff(exY^wr=^ag4}d{*74{dnX%V}pSQhiWN6RhVt) zpWCxv4_Z17YOR|kI6<>i@%psnOm*+!fR3XvfUa?rSDTHlBNkkj3j;t{Oz*kfdI27HJ0v(qGM1|At%-;zra&M|7WNp+VzR4=yXGajz^ zhcn4RKe7xdU;bTOVTO;AEe`_k@)Kors@;(VKb06k_97oe+44@d zC&^sU3bxj?wYhdTQT_E8w;MI@Qp}o8?|2pq4S;bV!0c<^qJPI>@tMj?t%rZDj}CT- zHrCZ!?HGsPtO>T#o(E%*2}yT!b_D%#MDugU=iQ^k>s2S*lEH>x`0*-Glxu>*!NX5s z8YTgbBgDFu=ba)Rr&_gYuB^SA>ku_P>*!tZ1+Q&CEcUd{m0S`YZfQXJ!E)ZS?JYoevW#Q0%#XsdM@|)5fvCmYD+% z+H~sqv-}hT$20QvH4~0FL_`ClrnNLG=EaK_YlZ?B$c&b<2P{M&xY)NizZN~zJ(r+# zMxiZ;IydgrOx01=YgWR!hWaH=6mll&INkB-R8pYL>H7F9XVrGR2T7XNj=;o;MhIGq zRqQi4Ts6d;aAKvLkTQ1PY|WbQ*GH-pw-qnIY(zUb6KwgOUCm~6*nt^x{HNcBz5gpx zNK8(L{PhX}#O?Kgb0G%0=)TJ1Yi-~cM}X2-2T%y9CKaW#?hz(ee zOs&9Oqt(wjlyC3ZMy=I+A;HvC9tsuO5+Mdt?O>FSp5gHRNw()`d`g5|^NSr9E?lUD z5@w*UX6RK>lr+KQ;Yq)IrpuTnAYss8QQ7Cm{r#Now2Vl9pAS#C(X=9 zz;i-RTU+~TeEjk~Yl8YeiA0?}E6enSu@GM;ikN?~joYbKe7wpB8<;q4;Pg`%d8nxB zpvqq}*tLwQ598QCV0 zs(>PRilFEKA;1@GP0CZq1P}pLq!_hYwCioJLjp+CZIVACbHL&;#mK4e^(%g~V z0=pBLp<*>(eyvKTv>+o&M~3AiEm(;TSX5pmH8?&)IDXX}eu_F~srY(iKjs|{Smr0ilnPnS>E)57fXB zrBjj|;jatW9n#=!K;=PcyI32J0W0Gk8NjE)!Usv{S7%Ko^ADLUR&kWyYZN>7mEwlf zp)sR_jL(YN`Qp!(?xBwOp>#DE=nBr7x_h`e})~z@1D3*|rtPDOsD#kpNbRJXOm+(DaTvssP!6ck$+p_6u7^B7&%6mJfoINS` z)b0Xmg9EF0)UY2IE|;-0=4?JB3jtm!$}wwW z)nz%xASfZ~+^N)zm!S1kFt;Za?_N|hh`HT+YaTKnyPo0g`Za>wMBR5#<)NRF$*=sA zHZixx-?e(3GQDRGavyF5FcZzU5D|AOzcoD~K#Q0AF^o71K45VX+_+CvCTn7hWB$n1 zX#K?i@h028;j!4aiS8D#fQS7xVeXOa7m7vnzSx0nCYV(pB}k%%2d} zX=rMaTca^@Pwt0BAe)CJk)o8Xr0OI~+%D%@8HorRsE<7yG%I+Fv8b!}C7_1KeJl}a zwfg-y;w=n#8Jd_yT)OaQDJRUNd-E$Ac^IoW`7Hy(ceB=`UYL@hTK5u}^)JAY(*qFl zd*%Sg7QH<=dfr#T*x^pZ>X}lFr;;u{9i!G3j>XytUm!ySktCBNU;?gO)FTLjg)QfH z#$&t=)TLXnX5X@dANDvCh^cNZ85t#X_!#N80VC6k~ z_V5V^bW@7wzZ>;FGKfd$wv56il4(#YAwav|K;t?g2EL^Zwcdlk-ug=un%$d2)abT+ z4z*%j0`E<*a7?Ik#!sZHP0)lyh@HiTPxgzzxVD_i&kep`qCe^`0N=toiJu}H=;qa3 zVNuVnOoO$~u13(tH9l>P(J~mJz?w`NconrSg%^A4U^?(*Vx5q4IQd{vm(K&^rWSb& zV8&3#apEsxQhokmMx_L3)G6~Nqf`u=5;jlBN>cR$ckc^3mBj1IVba4k56hnZq+NY_ z;-RH|3;)l(EBtdO1Q9NU>ZzC`^i0BtrT!y})o#`&+$FhR8c9ezYo!wgh^RP|OvZ7T z6ffCewA%DYf{7uAsKvYGKvLT!(2%mNYruG4Pv|*$&5B9N%08QW#rP($dQFz4oXLwo z;*9*{>=2A!lcVp)6C7G0iy{Gh45e>cWB;wrs3IApdAkdv-gT72t|yBB@+;;gcD=jD z`euAis|Q|}v{whNf93V)M7xnm&K-iY%>50k;Elef!SE(BMJ7o-VUOH$VsSG>JFB^b z-Uw?{Pmptgfg!p0$r{(Mc(0Uz&E80!j+GjtFWB`QwBN|j#9AXG?x&6PK_4; z#uo3oP>s8RqIDbR@%nQ1#^8RE5g@z_7llE8lI|fsk*DuMKghLLUUMv80I1pMZPM?^ z+Gz-pHB*1Xh7C!TwH_;}BR27ySwy{Di>gz~ji#~C){Ro(?pA?7brBG^h(DcDD!cy5 z?c28%)K1(G!wKz`{~Qs2R?vqrn;|JkzA=lEeKJgl5bON@&ZJbiV{?+#s!1qs3=g30 zq%+F*ME+(9+JY%qGn?W~;%76%UAT z%gvkCC^YwZ#>iO}seB+!HEHHq9@vE(A+7}nQMS7?^`8T}8Ve1Znn@%7XNi5~cKL+| zo%09wb~h0f?agEGkwExhB|`HLl0@{*bduvEKnKSGhGZ|m8=r@hp8u15`jX-_Hg8~Yo=48lhG4@)hW*8v^9VD;h*Y4<70cC~3 z2W$O;c^GX?sEw$iPa9E$Tg*qH37U0dRIiT1Wc&erWmKJI($H$Pg z4e~X+yg^_Pbn9ZKi67Fvo<9v0n1_x>K3c@@QuaK*^k1 zb%L%r9yLq}q^>~Ss>qK6jg?5>(x{N8Y>%UndnzB%cRhjQvd0|E0420zMmZ#Da|253 zQOn1Bpl8HG)#7PHjIFSg6XKZGFxCV5I8^@g7ynPYk2hYz}e%pn&uz&~mtenW}7CoplDwQF#h+{-2@&m_w=h}bf@_2>jK%yL8} zFlVL{W&LVV7a`x_5O!WNcMLUv^gM$}7koct$ioMb$L}9a5fRD2G3GW&eh_{kOhg3%vhu0LN`#g6FJ zbp;2troBpxlk0EuQ$GzqUaY0@(mb`Ock()M*nJG|`8kfUWr3UYyuY8$$@x|fn}W=o z#MEN;2S(S875w{21ux6#&tF&>pzRr2d8BOBIjhTZV}rvdMbF!D>LS-EtW9IPe>zNH z+5oeRx(v~2Hed4ucXO@40cIU?AI@3~YI_c1U+V7weMoij8HMmsI6 z;jfl{{zt+xZwICm9O3t6gR(McmNtif3N*{!}s-37#MB&&c>O5IFI@X-mAh3?&9dM!lwFfs=v%+iCU3u-6)Xa&25+=Y+R(|2XQd!krEKaA`Lgd8&Z=F>a(hUMMUQB z`&85n0E6}$5X?RKBDlaLOD`OHEmb%o^l>Z#+(R}dMlJ}jZ<6Rx62Mvgu>t3kbcfP+ zL{_xLaIX9XU`d$VEMS%aK!c{DkIyOtMDZNhWLAO){qXT)G!d{M`ZcK;FPmOnL)3Cm zS+cf2ozjW;a&wh40Ig7`@!akhjMow6cGvBCmSPMynl{cy{O{YC0s;W+gFOJo z*MRsD;~HERGV9DozZTs8vqjs8ZI9e0GIG`REE!uzP{lKfuE}zCV#cl~>{TCg3{b?1 zbh!kn6{tl!=l!y$1|l#6gKt4426SNQAfe2G0q7nEU)+>Rr>2em*ex_iT=MwQ8~ zmBVd6|CP<@{=^Iac+_w&yhrL=@;(RafyEB72$$;LvhhO?3sFgH_m7bix%AdlvZ}@dP zlL;X;ByJ7VVOOT%~yP@w`;rm8dY;So+I3F2($hAznGuTaBzgjXr( z-aGvr7RpLMD$yupT3=Zl!j;4_7<{mfV^B9C(mtb#Nb(3OQEJDl%9bx7VJcB$dJ9Dc z6JYKRU-a@uw~<^D9Q(H~Gs@Fr9bW^D!saQ})q!~V8*Ftdu>)F2emduBItwfoP$~d2 zv)7=r936poOv6Mrzpfp(It4_5nKLB|<#8^vf6myej`QA-o4hfCYac22j}jlAg+-2Z z*m0h=WC%9~U|+|2T`nNOP+v{a4)?2qi@#46Yy&s9p1z2wa1KKv1zMZKr+%~>5JuX^ zxi)|-7Cz{N(1{eKu=Nwi#1tV7e(?t?L0=(VyuQ5|lvvG2>{B#^Q=|yavb+c%G_NF9ipH>fB}M zUqL0*D|x+6@qe)y{tQOne3{UC_&y{c_Vl}9g`}`!t!`u)ya{;boI03QjUw)%Gp>_}fT%an&h25Y~AXA7&iG=++(UZuUr%)P7+e-LN z@|dQbb@+W4s{x?3-2txM2)n$t9d|ynG>I_-1_b-}Z`LV%$ITqI>$!K}R8rd=_*9#t zUe&eZ3`%euMF9JC3?O6uyFep@SCXH zuv`2jvkR9n&VhER&K%*J78L)<|30$z35<6@>h9@O7nfN$QyvSLR3FA z=t8zp7rv9#zEYLtHof)i7c$gs0ac_>wM}HG=io-l=f`JpMwVfWxX1s|5-oH~ z{Jk}|<1aSBkDa?PUY{}5;1QIR( zk1##+{djnx@>}ZQR~j@}j`le0Kfx?aB-I}zK?Ptgyqn00sNFhht!DpNRDQXZAG<#f z8`?{(~LrwF2iZ zdr#qv4WmuCxJ^$I+3kw&Z>~SS@Evl6OX!rmi#zb5qS@Oqc4na>h9}LA@F8w%{Rx{h zpBre4ll@|Y4tHG6;$zm}A%i|30XdzQ1uCKJP8Yzy>!ns}cQ&@T?*bL_0zJZXCm%y@oSvC8f4Qjzy;&dV_KP z2x4!Kd39&Mx;Q|+VATLQTNUfOKbe5PtqGsHbnh4)P84e-Zk{9&OY02}tkF`REO3|DfMSBwJH*o)iAZI!Yh z4)+wV;Z_FlFLk7BoIAH!sBNII>&DNsc0H>@Iq)xj&PC|)uZRZ<{`d=jULP(OpJ^;~ zJRD93qub{H7w^hBMXArsU;o9szTX>v%R;41^1paPZ37m%ORUmLlMWUEgvGfg2Df5> zuUK3=T?S*-o;SPR+s5ka^w3YDk?Nw43qAr+-sV*SBdSP5aD$=l^r5g;R20FfyOLrBBflGo=9 zU)ZZFt@M1H&zDnf;d-&q?xg|oVkN=~33KpV*<3#YXrE)$h8C8bFDd}kmv{&6 zGY8Hd=xdB*gc`5{q>b^5C4N(W3ArF(-UaFqikyQ%POZ(uW4SdOTN6=zAvPS^vl( zuUBzg*e*$3Tto5>cbuf5vtLb#he?fwcf7TwZ_zZHS8zc^79}`J<|Nib@>u(P0VcTo4NUn4`iVW zmZCV5?MhzIc&{rMXrx~XxQ|j zcVPYi?~nBSGo(t=ITl9w0D?CXP(b!A8IP9Znvty$SEm@e!x5&(qY@G-aT$ zuuz6YrXu1iWXwLkiW3RK#YC+(Fty+`^VVD$$oReaYi*iO-m_jVk)u^TdF>6*384GinU%eit&ogU0kHdZqdMC z^dH>yG!T!0J{(AVlwq%PJM!z6MHXf;nGHiv*PHFV?2w|&9nST!4LqKL24nX!W?=`cmQ^^scM~9TKc0&L9uXv$!U7zl@I}Iq`aJy$^6zx;g;h z<9)^*G&s1p7$UFQz#iwprfCqfCxLxDeI@rK>sohn`=SF$f*#s`BfhG`1Ld+2jw(MqcFJf>b=bb9Jig6Y(2+?Zv zoNhdsEP&}2DMqwQs{21~fa>PB?F_KS2>Wo0h0+UM5FmaepJ?q%<)1o0oq%CV(22;t z7<+{3g1w%cL$jd!Npy2)=8Y-2xLM**An2+9({%uBhYCb4S?GU6aWKHy6Jlu2vj)Xs z*{T_2w18YolG%%_4t1kN0fWC9hV?pFxJ@`fScwn-t%tb?v%dc$clsJ&`c8K89AUH? zYkdiPryv`&qMJvJ!8%z7TMV_j0kIFeFZuRin8>-Ct^)MIx1ZeMdgBo1vjK^hT=$HJ z%uSonuOKSWYLxKrIV}1^rJ%J(PW_`_aLo@ZMy}8V?&kju`)uCOpdSekoL-&}MXrMK z#03ybs80-tYZjqilhU{}5*VdZ-%5S5Lc?AJ>U$#s_vZ*m6lvFLu?5I=xg3Tur0C-3&UHWRk;S99uUz!5oU5VT-f+{mWxego{1sC{D z*2u}~g~BxqX4dS7#KJqE<|H^vIzcKD`8X7{3GpQUKE^-_i8HZpFnXxH+(1^VU={AS z#wPX8))CzY3cL`{2EZI@76h{hOG%rLYMVLn1u%}(ZIb+&h*WG+^(k=DNvThM1p^HA z0{MMYWUO*3(vjXurabuseWX0$ot~%K&V3wg9xsfI=X#Ezp*l0@=KKwRw)L)*izy}r zx@PVNB-buEmU1-%TXmhIeyE&8Rj8`_80v0)Kdbh)XM?w!+uLymX$D%Tl}yQasPc!a z(W~xYzcsaeKz;7^b{su+Oer7Q{jC{=1EQHmkGg~VMg*%*mP(ib_U8+fdr2OFDj9h( zfnZ<=xiIy*rq;z|VNwCMI58D4D#kGrLr(9B1Ev%GQxLk)(Tif7-WT_w zAK^jNm@-<7+`qA?3{W~InIa7gaVM#0N(DKnn77)+{H0-dymfUPIW~Y^y{M}LrW|h8 zv-8}6`7!mu)FN6pjK>JlM3s+tQe-3n6znSo#soTYJOY#EtlJAmT`B4p{#+L~={CXe zs6YUr)<$MW?Lk4qN5M56HCsb?vFW012#J@0hBrY1CFwD-W$eBTg}kvow?!D4N@?Zh zuTAiDw3zlNsQ*IrG_AKE;k@V2XY!l6p0K88?T7du(2MN!lx#Z(JIa$_$1M&QQFA_h z(eYwpVx-T8I!vjpVPRpXStVF~XJGFo9B+Nw_1-QR%k<@4!=f)5v`YxV^oR(0wFz4O z)+3>%Kfk}LibX&2QzuRsd~U!YrGRv}ZqR)TfV1NRxWk)8y~3_Ky#5aZ#fz3`gj(b>Wf&8-l}i~a0~DVLH7bHQ!9F8?!aR^V+s2FYB(EclgY%v5 zOVRc+zq;xq`m|zm6k~#BYJjs&Sv4GnSkNJ{eJXwNKE*22{V!mkc>T!?5K~8R$`t+2 z4Og#TC7bQO0fJbztF?^VcljEP141y9JWoE5?5Z6t+RXn z7P#4#Hu2c#z?Pw<;az?HqG{r-9k_y>C`jkYO$-)*HFdW2syU%UUM#;gt`gtZu`X9c%W7++JuXi#gQ`^5+s%aZz)JN>76&?AN?FJg{0Ib*W4K*wK5`7&Z={=JB zdCj5Ja?k(k$Pq9&wr@|Av%H;vM5gbWjH%fF24`FomHcOoEZcq8s+Y9~7R)=`w?U8? zSdLgt$xRoHeC*aB&I$n^;9Wz^AXK04_clXnQLA;g%_3>acUjPI zP~J5&|tfU-s}wx&Ra=p>*A5&Z(6_{Wcz&I$sxRZMdJ{6Yt% zdn-|;(?cF~t_xa$Z$v`^H;an+upDZ_7E}RVLgUap+ibezmYGw!kEK$#QkqH=3fp$H zLRQpr`x8IZVutYe)dxj^8da0?EzZBpWb;TPBx7Vr&!hwYCpneA!MRrX<$JgK$2i@} zYB0uHY?RUZ53R*35qqTr^#upjmX^IIU=_}j!P8Lxi2HDbE-%!O-2-!If8Ws)aAjdq zY*p$M;(3HmqXXmwYiexY7vz6Q>&%x+sW!{(vRyvER}^cRZKMYV7vI2qiF|6}3w=d; zVs%3-63Sxhq;nyGJ#}Lz!kZW{C|GS(bR}T83cZQJ#TrGo?t7qeE*1IeOR}OR(;4`= zQJh8%AZYHACk`oU=#*#ArQcUfBTr=Zoi5S&mbYD3v%ECB^g1o~zOh427b8Y>Gm=C; z6uigx`%>>U0t9p)+9o+PW^rc5f2wt5z#;ofoUT$-r(dlsrgtl_zE?={Kf|~V)i!Bx z!Ukq`@2}M>>n^aU7GS&{VJpdp2Ff{D;NncuPF!_CF4`C5)UFmW_g+2QZpnUZacyK! zVOUwq>|e`v)#go(#q~7|wod4t(6{P;S|`&~rZr{|*ShZ(Hin5PT1G_9_8tUUxc8R3 z8n4{L0D;_x1B~Fg7=le0dsgHs1Np!CL;NA(j;Dc39jzBA>8KGpaz9`srkDD0(5f*P z9U%^4xry9T@b78UFZ~p!n-$sZr#roRDvvex(f1hwbC%ZzJ{u6dJ*`_sVmuaV`UcY@ z^Vsd=+=Axa1_Zmcuikpr%Op*q_^Q!_GY1IMljElKy+*HD4jJ^-bVefz^{#!ooJ1F$KjaaqYi$(Umzorj*k4j zSc&;V1Fh6+@=NEh>Zz$=M*=b6D(9SfKA+I3ru6^&@Cda{?;gpxX~XmI>)Wg}$)^)0 zPE>*p`OKPll-$xTiW#teHD4dfzw0M(B{io{elT$i?;nS%=kZ7`ys+Ic^F*@g`9qsB zqcv_sxLuvQpl;r#qvn^EUw&o0a>6EyMW&A9Z%lIaxUq@xvSRg`{YfEDDmSdVa(GFY zrq0AAn|UTa^%=5p+oJC#es7w;s-nY}?HPAp{kpupbbL|pNm*FO79t%sn3D?ZZI>O3GS})j|Wq$eHzXpas2_@{VE(q7{~@*BaFyeXw_IY ziFcI5qD2d3WsiY6z_X75`Lpi-COZ)0` zopL}Agsy{g+s+4#im>aKZ!=Imi)qZ?c@u{F=U*b`X;`$poGt$ko zq&!fmJUFzbrzQgd_zT#STjXrE62(!G+UXF~g`G?maddTAed;(&{MkRRU-7NHc>er6 zxYhQo?9)Ce{|6d${uupSdtzn9C(&igZmk{w(7qODv&+7jsejCJpTHmyT;h66`U z+~(^*GJ)tMyrWDivkjTSimvPS~f(rE*fk{F_k1yZ)pyBJg62%Nz ztJKpH^XKn}|Kbwwq29r7J;?q`Q0#u4>!XNYlC#Qr0X`j4ixNb&XUwn2MO+jf3tk+? z<_O>qpl;Jqu3INR<1=<8RG5wlT08&q+Bs@&%T z_nmm4ZEo)FZ?bj@;he8S)kFyCl%-F76tGkUkXcdTtxOma@>adQT&Z(;o4@F{ty@i{ zm@F~+ufW7Shr#`KueHtZ@6U+V;JjeU-`@*{NfYO#Bf^q6KV^;jKlsA3^_LP7fVw88E)EWHO0A1=oI529A&hL%pzawfRw zveEW*lZN|o3h0}fZrZzdsep1D1IIoj2$zzIogy9{6*{=KCL|;zT5cnLA!i5s7Ds?f z{>P$4i~3O;nu@vCkkfQ!qzzIz|Bf>?iRtO-q0*u1qUsXU=1t=RsQEJSDqM7hg*EXG zz1I|FqQsaySdZV}4cp^cEPG2HU@@F}i)3$A^QZ>~s=}LWSDl79ZpBK1J-D7AILLzK zG9d^jjms??B^q!!G4ugoCHnqstx@YAgl_NhtGx(u;rF5C=B5CB^m!b6&{CXe^>0{} z+xg0(^RK&bHvyKRzGe*%4#N3TQb&MblFL(I+kTNuDN#>64uf!OpJ;`OJ+#c9`FDtn-w z9BYGMy&C>cbQQo$U!e0he42`pW;f1h0Bnp3;0bJwz;-tQ-M~>LjcTe2&V&Yd8>)c6 zf7yKkMj=J+xU5w$9@kLLlP5z%Q7PCE`UA07PME#)&-3TcJM{&@j16hj@u;YWkg$5= z^geXt$V!K5=$+$0&(_2CzS|Fr8%4-n?`|He8EEl><=~{LQ_D-PJKe^yd>B5v~d@T9mH;;9d{(4vg80iUbxblQW*kC%Cupj9ozgi1u@oyvA(!{tJ%v{5% zoS9n!3&Z|EHhc!BD9Qv^J5HzJc1L}< zj_oLA11#=$Ro^}iL39k9H%A7eh8~NaZxP5|LrwhQ8u7j|q)ZBINn5Cn>oj|if?8Z2 zXsatMI3?eazrXA{nxXE?@K3S}w6nOnbu_wT&SVgKA#HS$5g`1BXiK+~0pZlsl9F`K zTmWrwT`4tF;%h^SaPSt8mppTe%5J{oA5#XTV0nncaTRmoH(hR^|q}=7^76(JN*#%L{M{j(C0`0wn$nPikI*Mpp-&0-W6NJCkS6w%BHYh5POOon@}};@{q+=9#Ex zjWwsMc=n8T?G%2nc$5))f3B}zy#2`}1|Y%|EJrk`;p(aQukY{GmY5^dDkr z-Tr>_-6kz9J2;OvS7)ElmGBs0U*>JpF<}%>R#+?pN5BF}$rSVW)0SX_c?NDlB*>7! zcW$bvs>WgY&RyQ2n~pQK4d-+$kxt;3@Jekm?K=A=Xkyg{qYGR_OpH(<+Tg{2nHmd@ zbNiW^{;-U|&a}D!YNFcKmm_y>EGV@W#|EH+H{TM_X@ouP31AB!_<5dGu;T+gMtteg zXsnkw_Z7WDms3CVe&HQbE4|*(Q`2~-+o|&VnCDyeS=1xj6koAo=JM;ayuepVOiXlz zmA>oaxnA;UN2m>gh6^f6OnocPrGeCi66@?h;?O;F8!FB*K727L>3Dp6DI82^F5Wr{ zi(s_qj0x=kXcZy%!s>^j4ZMF;*R5NpyJgFB z1P@iNFLDt$jW<6?=gn^RS#-?MGkbXfneSD1H+Nm{Gy3-8+(^hL=SfQ+MJ?eP%+-hw zf_f}}0oqG@11CR|(*7tVwYzz&OyxzVIHhM-S3n=phBPJ`%#TB4HJl6a+XP|d8Nmo> z6(Oe`-}?)C}Q8<jEXe4mk<8;bzhq^V>5SFB%Lq&-f*YOF&BmcV{&pMkbY zn-DjYu|uJXO#n7NqL@C?29D5KEnYBd1bcF7%hZ`O-_({KI(l^eAAgKk?rs*iZQc6y zp*8V9GxY*WjXTxTbR`}@5AO8d1v}InsLRab7nvhu?g`k2mLzy=g6w^71KI+u!XY=7 zHfNRQS50>{<*riwYLKJhb zHK5h68j3VLEwseC^B00uUHmeL(e$JxrKLyOfI@RDRaR2+Ft#8}*{7v}U5d!!#*N~s zyY#I4>q|1WeYHv(C%$Q>%?Om~aTLqj6fg)?M7j0QpMP$LJ4Q*I$}0cEgNmifYoQ*R zWwdiGJuJxCUm||iH!vWT(YIHZXJgbpH#7hknz`kkA2>%wK#abrXp3iy=&UQWO_zn192K4g9ayWozR-;^YEcG&$tTMRF{f#F1 zTajB<)BgO{-Q6Aipmp~@B17pXB_-PtOVSy9DbDu@{+Ie_c34=ocm z>GT|N&fsvyY@5tGYQ}O`QFzCQ!Y{GVr*f%Z*DeaY0BJlxv2X>BKNz4kC>bLiflK>X zR5R;42E1=@>!E@;YulznMWTxP#*@Bjc>YN*@At2Fe?b;=SBWgZI z!xnt)y2|UgfwEtR5IUTTmRo}_=s)w*LB4dH(|_!HqkoKJk30K&1+<^Df6SnH&;BRR z|5Gol9b$Nj+}iZY;pVc}eW%aAz7bw#Z~w2~`j@ZhPUPh| zH%EW}U-C!Y*3H9l+b%mlEl0QQjvlrOcpNf(ww@k4T-;PdhrcT$s^z%L#X}SWBxjLiL&yGmn>f{yBM!=a`AL?w%tXq)3){Sbh8uHvcuJHcgN2>96ff~(NFx= zy6m#uy1`}F_LX@1osP~9qPlJ_^qHde_$GaAyKS4DySw97{DOyzsO_#@0eAx+J6kvU zeHs>gxy@zwZaZfW`p)k+6m@jow#$?K7Ft^Fc6;0vM70c7i@Mvn?X`0Y;0xgU&qKU; z#qbc*J8?(;U&i=9j|O|_{pR_(1O(7$$%tyW?67rqwxiqp=P<2MT(s5E#nIW`#cj7O z9g zFF-%XpvROdJrM0 z&mj-H`so!}zNzWC3_8!A-`OxzH7S@NMWZxgQk9Vg7q=8H7!7YOTrh)6r&8f>qMVk( zF}XZGpUq{#z?QY)QbAHapyqhuCOUy`~6ox-V=>Rcf5x91M({-1JuOe@IjP4+_(={+m=r zXt}9!XnVddJ$hIdxoq>g?`Zue*3FjnpM%kvbUKUcgqeTG$4d{#*5H5n`tP9rI-`PS zOtVGlAMHVbIh^O}KL!(ujr1QAXEJa$n+5e}FgW-t{r8VR|C1LF9t3hh?+aZ&4Wp{a z5{XP0E%T?iGbrTfSfO+bY%(e2K!HpMTPzAWIFJDwY_!3I4G!ACVS`H{$I66qVMHA4 z@XR|gLP=D(AV!Gn@hRjGQFx3{3frLPCR4~Uf`rJ3ND1hS+1mo-iRw z5D_dF#tFjxLCuf_;iAw8^Dcu<4i<%k_~Sqk~{gE0`6Sgyi|!K#L38(~=kL6{6GBu%HtN;hK4 zY(fl1Mao18m@!SI)ndunsc4WE)GDS(Hsq+l3jC6@mSDjo8N+PD#V`~moyLPRt->U$ zHDuL<3`3R)Gs74#gCUVHe+F456i9=@-e? z%4Dk6piokE2BivPVpIhjOQ#xB3?PO*VS)DJb9`XER{Qbjo={~XYbsTzm_S8(6(i7U zs!xj}wMGkWs5*_Fs?sZvE=B{9JB?b6x#y!AOorV|(1d`$51qz@FBW`p;EU(OprOH; z#uN;Fw|JuxgZV%p3ueuE0R#%Y5ppu80oSO&i50TQ7codlwS;DoC`K4(sjwqQx^$%` z3!`QrA|N6IxnRo-HBcfYON9hYGCECA9*#AQ^vzTz+m5#AOPc{`ILr&{>#|fvD=Q{l z2C&ZEx{@{_=yJ^NiRgUMXkRVFWHkArs%f+;Ib7cC5*?Ex2R1gedTSdHw>-_kHE@tj z9!j>k(u}D>t8a0E(r(I%rcq9?vec9rO1SkYIT)ir5$qV*Tt}kXlWp7+lCi~gb9T@7 zZ+6m*2SkL903?Jd2kr?bwaiFFBt%Da$CqIO^0Z7zbV{K$!IuWu4l~InR5R_sU$)lN z5^>vL*@pJKpyg)Mj$${@FNh1xBzNc|2wpS;?PisEx>;t1?WAq)gG7sM)dn$?OY?mA zr%5)a@`7BO$2nk&c{ZC{(PZeE*72nn^l)Qsf(jY`P7N$>o4q$jnXT7ksnj$b&tVbF zx6@R!T*BZ^H7m~t9vr2rOg?H2+$@@WU;=4XdLNy}2>0D^*O;ovFl4}iO!R=s8$6o9mnmGAgi=SmHqVuOPL_%{sBr>^WFlF z0@opYz%11Q39;yK5Gn0ep{6d4LTG8wO5nE#{r@O)qq_n~_Y$5azErs3FRPi$lh zc^m{sQ^K>Q3>5`TTa-&kq%=qBUfM!~^UN5a1C4#e6v^dgh1|kIi!`-mn!W0g*+oqObS-+bF z1+z6DFsc#b(%6JrBqX6-198}ATRClL`-O?fZ~jR;^2g z!bJsjP#(CO`DcZ}?F*yQ=U9~rlpb!c3vCPUK%3c>0C%XuEN^Y~+8tS^77IoJKeBZDv9tXX!Ai8X8KABxqhTh7l*TY|omXPBc#o*afv+j-n0B>x5lb5 zhWHDk-D)l#{%rYr?Y`V)pWweAzkAB~@%lOKyq(AI%YB^DzH{;W9l{I0sI0Ge{9}iO zGhUxK){tA1IjNoE=I@R9t9~c#II-YX)T1+3&+eek=*H|k?_ZP|bz3)W^4eOu-g{GF z>^N@HprUQ_lLQYY(JHo%SvldP_k*Kf)_vWudW&lx#o95WO7?tG;c@-P>awmRrE~wI8gZY%beRf2a0!)|w9jc2rY8>ArK< z%-)%z)7b--4f#&j(W z2Nqs@XVA|&b>I(uu%AzkPb=yFVZb8x*|&#sZ{ChBSm77h``Bu3*zoLC3;il=?#CU6KJfd=;5PPw?_y*1v4=Yz>@haX%Wimg^T4<{?M$=Y>N#l5;nzxh9(Zq@ z@@e~+8%d2`-Zg^td%NPE+ulEESUHfxuV1L`OD3X=7#Avj+7dI>W$l(Jt0whwc5WBsJw7RmZb&+p=yE=k!+hv*=bbf!dplLS zpFcs>I~{k9dSlIp<>iH@w+&@8`uEIL`LRy*U?raN!%7yv7x2e~%cly|+v@K0N!VUk zdny05zDY@Y_w6l?Nl2$ z1N|Ra_p_n5qVf99FT>^+?kMYidYq!yiF1dT_xJ59Y)HP69XkBU7oR%KJL)0}Enm`W z{^VZE1I|uRWuH6i_npVs^FOSr<0Ysn{J6!D#|knhRHywI>Rvf%{IE?opU#^%=Z*XK z-S1r&R}1zWeYkkVp3q~Ly4FyaRd`Xq>4ZJK)#=gHNs^BKJr5T=T*>*ec2rU6ieIOO z$?kP({9|zMkUq;BAJNLRaUWLIp9*lP)#K-Po|`tLvg}&e@*Q1b)5+ln=KQPkDxa*p zlNI}}2Q4`A&XVp@l`@7m^US?XCu(m89{&ExfWWUyFRng4z+*bjOgJ=W8~446@tyiM z$oECBaB+5aaUOsj%HQ2Ne@T~PPZGLLD_q9BBU9~6r&e89_ZhkGj_T^3Gp4ZKke_o+ z5L6w$cPme)UDcQ%Sh1Vg$mTT0%JM#FoO)p5{rYjoU9UXcJE6mnVXO~zpPemvcZd)9 z^PaO;#vd%EkoV+V-1zPg$s3PyGh=;jSIv|562F$eF79Bl7ui$yS!Mr^VDtTvrj<7{ zzpdtl%Y|=@JlAi)?3jb6s3Ex@pV&5Ps$cz?5x>24b$E2z+p8n|o{Dz&bouT6w#hrM zWJlZ$IqN#Ruwuhc^G}5q&1k6qZb59XLGC**>6)W$4KhmGittegEU{-wyJr*zR^oAS$ct*zNF!BITz=%Fm0G>xz_{i&QyJ zhE)fd43cZJz3aD^i;WM|cV=!IMLJFIX54AoQ#?lf-dk=yiIoddGXvN4p?N1NhwkeC zr2CTfonP<#eeTEDQvKwMOX!ydDjIQz7iCrdE zL>GkTx|6?&3=Cl&-N^0w-n!z3uO$NI!Lj2e;=O+AzI)5y1r4;6%l-a%Qz0;2EV@4G zcF2;=!|2BsnXWAAv}8iV$d5cqP5D=fwMY7S7IPmB3W=&?maH#*FKt9W&jpgWb6?EP zDcg95a^>{16}i%lXD^R6y;HLJRF1dy!j1md2j}QI2R`wio;Yj!jq+~?`IhAsEQQ}w zE}9@&cc9-N_qe;hs=o1b*~0Q+KHp^Ya7m&_)Q3$=%QyF(w|{9*-?BBLyj!km%a`oS zyGC~-lICe9kXy5zoKJu+T@#eq*U+!wS zwRG^c?Y(+G_;r83s~5kj<#N1l_PyhA`KbHK4)V9|EUB4(pi9RdHR`U1_|>&;Jq{k& zbFX8kp&pmJ4EDI}GOpt`r?ro7^r)`#`=Y-4-kGPrcU}BTv`T-CYgO^nR2A$vWpYmIqyjLu^sa-4cT~I#{Xz~hG^)LkJt7NlAYs^y}qQD zaVrT=bh@_%K7&wnZHMd0{ZoGt3QMmf4!cS7P7~yH~0r{!$(Xqh8UmDI~en0(pP-hgWLF`vdGXocen339$tf8 z3aQ;cwcPbm(#+Yb0w1n29US@f$?U25-xl;wobjx7^Sjrlc?|q$+@`Sk&NYF;QA;}N zRfYWqzkyw!)NRD7uFv)t8X~UdroP*)Yr|dl-9O*{><9n1uSR!V_V~z~$0KKSIit8+ zIqM7EBiE2I zl=YcX?c~#@%KE>1(t-YOdSd(1f=2rP`S1UL)HmyY%lkh_|1;n-Qm^#?ODjMdh5&pL zccLOyPAAc6T%1k9StLG*PGXU8E{TEmcr-SfDWo#!BsLEF5;D4kW6V|lwQ z4V`cU7Onl@G&+Ybq|*5$HuBr#Ctdy5FEXWZ{>DW*wLAr)<8V1BZ3e?8ItILf4k*xh zBsRS{I`;VFG&2eu28qcavEdR1*Nhz61zYGE1RI<-X9U;afAtzx4ofc=q#@}3ydzc) zCtDu)7cOdpC9h8Xe?`DS|8Mz8|4T~x1^pk#Sxl?tlt*ylq&zx_!-Ss1 z=Q2pp9@#k2yrJ1a2jrnX2z{K*B*QP0Y1_Ee-nf7+VB@UOqu*we*w9jGTqcvmqVZXD zZ~(R~4xkOQNjy5TFCl^#K=9H~F%i5JHYM;eRtP>?tOW-#*3p9lUJN@dI)X!Dvrx-t zaY=j{ynEc_09F9VfJK7iEMAKTGd$6RhiI@Z5sQUl1ddoHrP?`Q3R%)nItwkD;DEyc zh`7XR0Jc%&-~i{4I6M-UVQ~;DlcE%&LnERQ{*Zzg@Ry1OGUS44<3P#~vOS?r_?O%X`{AwaGsXC5z7)_${Nd6;20#{Q@h9SEB5>#=CZB{8^f8w=4wW~| zro3PufJc99z~{t`mJsZNw@`thJQ|nHXtE8`0+w(B8@@d?iNb~<-ixFVzEntTu0{FCt zgdPKvA8ASsgv+3D*od8Mq$r65U`DgKBo0tNP6S9xqoiW1))Q_n0kodzFsT@v*p!zQ zGA5c0^Ae2nAO{|xgUXB0L6jlN3w~ZyUUPBnr~{2*G&fcj%(vL*@f_G^Kp9{F*B+e~ z{s1}>@pBv??vDoI6A2*hL+@lF?t|n8!nbgrK;Me{QhV-89H7sMjSFo82PCMCZD4z-c=N%rMUAF+woJ0S9cNYcg?`&>OV~b3?O$M1W5fhryzSm;-%3 j2pUfe(KLZEQYrLj Date: Wed, 21 Feb 2024 09:58:50 -0800 Subject: [PATCH 04/33] Update tools/colabfold/.shed.yml Co-authored-by: Wolfgang Maier --- tools/colabfold/.shed.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/.shed.yml b/tools/colabfold/.shed.yml index 868e4fd3d35..c1aeb3918fa 100644 --- a/tools/colabfold/.shed.yml +++ b/tools/colabfold/.shed.yml @@ -6,7 +6,7 @@ homepage_url: https://github.com/sokrypton/ColabFold long_description: | ColabFold offers accelerated (40-60x faster) prediction of protein structures and complexes by combining the fast homology search of MMseqs2 - |with AlphaFold2 or RoseTTAFold. + with AlphaFold2 or RoseTTAFold. name: suite_colabfold owner: iuc remote_repository_url: https://github.com/sokrypton/ColabFold From 75bc21aaf62094a7d312b4ccf589f6746cba2884 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 21 Feb 2024 10:05:00 -0800 Subject: [PATCH 05/33] update with most of the suggestion --- tools/colabfold/colabfold_alphafold.xml | 68 +++++++------------------ tools/colabfold/colabfold_msa.xml | 50 +++++------------- tools/colabfold/macros.xml | 37 ++++++++++++++ 3 files changed, 69 insertions(+), 86 deletions(-) create mode 100644 tools/colabfold/macros.xml diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 50455cbdadc..18b13b819d6 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -1,25 +1,21 @@ - - This tool runs the alphafold step of the collabfold tool in Galaxy + + AlphaFold step of colabfold in Galaxy - 1.5.3 - 12.2.2 - 1 + macros.xml - - ghcr.io/sokrypton/colabfold:@VERSION@-cuda@CUDA_VERSION@ - + + - - - - - - - - - - - - - - - - - - - - - + + + - - - - - - - - + + @@ -109,12 +81,12 @@ - + - + @@ -138,7 +110,7 @@ - output_options['save_all'] == "--save-all" + output_options['save_all'] - - - - + macros.xml - - ghcr.io/sokrypton/colabfold:@VERSION@-cuda@CUDA_VERSION@ - + + - + + + + + + \ No newline at end of file From a7ed2f2021cfb6492d85109be7c787f7f3de3900 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Mon, 11 Mar 2024 11:45:58 -0700 Subject: [PATCH 06/33] add tests for msa, change minor params --- tools/colabfold/colabfold_alphafold.xml | 18 +++++++++--------- tools/colabfold/colabfold_msa.xml | 18 ++++++++++++++---- 2 files changed, 23 insertions(+), 13 deletions(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 18b13b819d6..602b30e6da0 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -56,14 +56,14 @@ && mkdir pickle_out && mv ./*.pickle pickle_out #end if - ## #if $output_options.save_pair_representations or $output_options.save_single_representations: - ## && mkdir npy_out - ## && mv ./*.npy npy_out - ## #end if + #if $output_options.save_pair_representations or $output_options.save_single_representations: + && mkdir npy_out + && mv ./*.npy npy_out + #end if ]]> - + @@ -112,14 +112,14 @@ output_options['save_all'] - + output_options['save_single_representations'] or output_options['save_pair_representations'] + - + diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 4a2644a41e9..08d38e403cd 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -34,8 +34,8 @@ --custom-template-path template_dir #end if "$input_file" - output && - tar -cf output.tar output + output.colab && + tar -cf output.colab.tar output.colab ]]> @@ -65,7 +65,7 @@ - + @@ -81,6 +81,11 @@ + + + + + @@ -93,7 +98,12 @@ - + + + + + + Date: Mon, 11 Mar 2024 12:59:59 -0700 Subject: [PATCH 07/33] fix shed file to make suite --- tools/colabfold/.shed.yml | 18 ++++++++++++++---- 1 file changed, 14 insertions(+), 4 deletions(-) diff --git a/tools/colabfold/.shed.yml b/tools/colabfold/.shed.yml index c1aeb3918fa..b0a9fac331c 100644 --- a/tools/colabfold/.shed.yml +++ b/tools/colabfold/.shed.yml @@ -1,13 +1,23 @@ +name: colabfold +owner: iuc categories: - Proteomics - Graphics -description: Protein prediction based on AlphaFold2 +description: "Protein prediction based on AlphaFold2" homepage_url: https://github.com/sokrypton/ColabFold long_description: | ColabFold offers accelerated (40-60x faster) prediction of protein structures and complexes by combining the fast homology search of MMseqs2 with AlphaFold2 or RoseTTAFold. -name: suite_colabfold -owner: iuc remote_repository_url: https://github.com/sokrypton/ColabFold -type: repository_suite_definition \ No newline at end of file +type: unrestricted +auto_tool_repositories: + name_template: "{{ tool_id }}" + description_template: "Wrapper for the colabfold tool suite: {{ tool_name }}" +suite: + name: "suite_colabfold" + description: "Protein prediction based on AlphaFold2" + long_description: | + ColabFold offers accelerated (40-60x faster) prediction of protein structures + and complexes by combining the fast homology search of MMseqs2 + with AlphaFold2 or RoseTTAFold. \ No newline at end of file From a7a50d209446965aede4f5fa2a5faeebb1290fc3 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Mon, 11 Mar 2024 13:50:52 -0700 Subject: [PATCH 08/33] fix file name problem, add pre-set param for naming files to prevent problems, update docker image version --- tools/colabfold/colabfold_alphafold.xml | 1 + tools/colabfold/colabfold_msa.xml | 5 +++-- tools/colabfold/macros.xml | 2 +- 3 files changed, 5 insertions(+), 3 deletions(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 602b30e6da0..534e366b47e 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -41,6 +41,7 @@ $output_options.save_recycles $output_options.save_single_representations $output_options.save_pair_representations + --jobname-prefix "galaxy" input_data output && cd output diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 08d38e403cd..50c60fe52d6 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -17,7 +17,7 @@ #end for #end if ## For single file runs. Will need to be updated for multiple file calls - #set input_file = re.sub('[^\w\-_\.]', '_', str($query_type.input.element_identifier)) + str($query_type.input.ext) + #set input_file = re.sub('[^\w\-_\.]', '_', str($query_type.input.element_identifier)) + "." str($query_type.input.ext) ln -s $query_type.input '$input_file' && mkdir output && @@ -33,6 +33,7 @@ #if $custom_template: --custom-template-path template_dir #end if + --jobname-prefix "galaxy" "$input_file" output.colab && tar -cf output.colab.tar output.colab @@ -91,7 +92,7 @@ - + diff --git a/tools/colabfold/macros.xml b/tools/colabfold/macros.xml index 25311e249a4..518e62586cb 100644 --- a/tools/colabfold/macros.xml +++ b/tools/colabfold/macros.xml @@ -1,5 +1,5 @@ - 1.5.3 + 1.5.5 12.2.2 0 From e722272f207be73a70ea3ffeb7d8be549353be0a Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 12 Mar 2024 10:15:09 -0700 Subject: [PATCH 09/33] add num_outputs test to alphafold tool --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 534e366b47e..b0b53bf372e 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -120,7 +120,7 @@ - + From 985214229343e22537c9596f8a901bf6b448f158 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 12 Mar 2024 11:28:44 -0700 Subject: [PATCH 10/33] fix test because inputs removed conditionals --- tools/colabfold/colabfold_alphafold.xml | 10 ++-------- 1 file changed, 2 insertions(+), 8 deletions(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index b0b53bf372e..2896eb584df 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -122,14 +122,8 @@ - - - - - - - - + + From f645e67346a6bf371af837f4fafb1cfadab6c366 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 12 Mar 2024 11:30:38 -0700 Subject: [PATCH 11/33] fix missing text modifier --- tools/colabfold/colabfold_msa.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 50c60fe52d6..448692a8b95 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -17,7 +17,7 @@ #end for #end if ## For single file runs. Will need to be updated for multiple file calls - #set input_file = re.sub('[^\w\-_\.]', '_', str($query_type.input.element_identifier)) + "." str($query_type.input.ext) + #set input_file = re.sub('[^\w\-_\.]', '_', str($query_type.input.element_identifier)) + "." + str($query_type.input.ext) ln -s $query_type.input '$input_file' && mkdir output && From 75ba87b9c2af573d9dd509982cf63c3987a4890a Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Fri, 15 Mar 2024 09:57:40 -0700 Subject: [PATCH 12/33] Add hardcoded file names to prevent file headers from breaking dataset history names, modify help text, put params into advanced section --- tools/colabfold/colabfold_alphafold.xml | 110 ++++++++++++------------ tools/colabfold/colabfold_msa.xml | 8 +- 2 files changed, 61 insertions(+), 57 deletions(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 2896eb584df..61e45905d4d 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -11,31 +11,31 @@ tar -xmf '$input' --strip-components 1 -C input_data && mkdir output && colabfold_batch - #if str($num_recycles)!="": - --num-recycle $num_recycles + #if str($advanced.num_recycles)!="": + --num-recycle $advanced.num_recycles #end if - #if str($recycle_early_stop_tolerance)!="": - --recycle-early-stop-tolerance $recycle_early_stop_tolerance - #end if - #if $num_ensemble: - --num-ensemble $num_ensemble + #if str($advanced.recycle_early_stop_tolerance)!="": + --recycle-early-stop-tolerance $advanced.recycle_early_stop_tolerance #end if + #if $advanced.num_ensemble: + --num-ensemble $advanced.num_ensemble + #end iadvanced.f #if $random_seed: - --random-seed $random_seed + --random-seed $advanced.random_seed #end if - #if $num_seeds: - --num-seeds $num_seeds + #if $advanced.num_seeds: + --num-seeds $advanced.num_seeds #end if - #if $num_models: - --num-models $num_models + #if $advanced.num_models: + --num-models $advanced.num_models #end if - $use_dropout - #if $max_msa: - --max-msa $max_msa + $advanced.use_dropout + #if $advanced.max_msa: + --max-msa $advanced.max_msa #end if - #if $amber.use_amber == "yes": + #if $advanced.amber.use_amber == "yes": --amber - --num-relax $amber.num_relaxed + --num-relax $advanced.amber.num_relaxed #end if $output_options.save_all $output_options.save_recycles @@ -65,31 +65,33 @@ ]]> - - - - - - - - - - - - - - - - - - - +
+ + + + + + + + + + + + + - - - - - + + + + + + + + + + + +
@@ -122,18 +124,20 @@ - - - - - - - - - - - - +
+ + + + + + + + + + + + +
diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 448692a8b95..38ec09f14a3 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -49,7 +49,7 @@ - + @@ -63,7 +63,7 @@ --> - + @@ -84,7 +84,7 @@ - + @@ -102,7 +102,7 @@ - + From 522a5e1016f8679199a69fda67a38c8115b882d1 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 19 Mar 2024 08:21:37 -0700 Subject: [PATCH 13/33] fix typo from creating an advanced section --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 61e45905d4d..8da95fb44f2 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -19,7 +19,7 @@ #end if #if $advanced.num_ensemble: --num-ensemble $advanced.num_ensemble - #end iadvanced.f + #end if #if $random_seed: --random-seed $advanced.random_seed #end if From d513720f5f7fbc3c16efe534bd4a99dd35ce9803 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 19 Mar 2024 09:03:26 -0700 Subject: [PATCH 14/33] fix msa filenames --- tools/colabfold/colabfold_msa.xml | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 38ec09f14a3..0bf85675cce 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -84,7 +84,7 @@ - + @@ -102,7 +102,7 @@ - + From fdfee660acf20eca42edb9641993e5612d70c689 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 19 Mar 2024 09:38:02 -0700 Subject: [PATCH 15/33] update archive member paths, assert expect_error --- tools/colabfold/colabfold_alphafold.xml | 2 +- tools/colabfold/colabfold_msa.xml | 4 ++-- 2 files changed, 3 insertions(+), 3 deletions(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 8da95fb44f2..204a92e64a5 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -122,7 +122,7 @@ - +
diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 0bf85675cce..6689ff48415 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -84,7 +84,7 @@ - + @@ -102,7 +102,7 @@ - + From ae36f0f3978f921916f0413f333aa0d901c2a3da Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 19 Mar 2024 10:03:21 -0700 Subject: [PATCH 16/33] test update --- tools/colabfold/colabfold_msa.xml | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 6689ff48415..87116919e76 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -82,7 +82,7 @@ - + @@ -100,7 +100,7 @@ - + From c30fc11dda3b16da9ba964297b425ea23d9e495b Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Tue, 19 Mar 2024 10:16:15 -0700 Subject: [PATCH 17/33] print dir content test --- tools/colabfold/colabfold_msa.xml | 1 + 1 file changed, 1 insertion(+) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 87116919e76..9124e914e80 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -36,6 +36,7 @@ --jobname-prefix "galaxy" "$input_file" output.colab && + ls output.colab && tar -cf output.colab.tar output.colab ]]> From eb62b2f84f441803ce8a97b70627cdfc2442df4d Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 20 Mar 2024 07:56:41 -0700 Subject: [PATCH 18/33] try as just tar --- tools/colabfold/colabfold_msa.xml | 3 +-- 1 file changed, 1 insertion(+), 2 deletions(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 9124e914e80..dd699467ae4 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -36,7 +36,6 @@ --jobname-prefix "galaxy" "$input_file" output.colab && - ls output.colab && tar -cf output.colab.tar output.colab ]]> @@ -67,7 +66,7 @@ - + From 0a84144c89f9905255609174f02789313703236a Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 20 Mar 2024 08:13:08 -0700 Subject: [PATCH 19/33] add back ls --- tools/colabfold/colabfold_msa.xml | 1 + 1 file changed, 1 insertion(+) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index dd699467ae4..991fb92569f 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -36,6 +36,7 @@ --jobname-prefix "galaxy" "$input_file" output.colab && + && ls output.colab tar -cf output.colab.tar output.colab ]]> From e3058005dddefa0a5cb59ee575a2aec8b59e125c Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 20 Mar 2024 08:23:33 -0700 Subject: [PATCH 20/33] wrong place for && --- tools/colabfold/colabfold_msa.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 991fb92569f..86472b7c2ad 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -36,7 +36,7 @@ --jobname-prefix "galaxy" "$input_file" output.colab && - && ls output.colab + ls output.colab && tar -cf output.colab.tar output.colab ]]> From 7a025dfc561341c14a43dc8cd81a46021042e983 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 20 Mar 2024 08:42:20 -0700 Subject: [PATCH 21/33] quotes and another archive test --- tools/colabfold/colabfold_msa.xml | 8 ++++---- 1 file changed, 4 insertions(+), 4 deletions(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 86472b7c2ad..b3874fc5665 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -33,8 +33,8 @@ #if $custom_template: --custom-template-path template_dir #end if - --jobname-prefix "galaxy" - "$input_file" + --jobname-prefix 'galaxy' + '$input_file' output.colab && ls output.colab && tar -cf output.colab.tar output.colab @@ -85,7 +85,7 @@ - + @@ -103,7 +103,7 @@ - + From c5531fc186e941f2fe24059c88dd2a3331e831a5 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 20 Mar 2024 08:53:42 -0700 Subject: [PATCH 22/33] make tests match now that one passed --- tools/colabfold/colabfold_msa.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index b3874fc5665..a6da0bd5c19 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -85,7 +85,7 @@ - + From 031b7119820a0e2f24770e8d2bc2ad4f1b0da45c Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 20 Mar 2024 09:06:34 -0700 Subject: [PATCH 23/33] switch back to colab.tar --- tools/colabfold/colabfold_msa.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index a6da0bd5c19..166d10e0652 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -67,7 +67,7 @@ - + From 7d612ba6520425df5264945af7b087d036f7ab30 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 20 Mar 2024 11:42:17 -0700 Subject: [PATCH 24/33] test fail state of alphafold tool --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 204a92e64a5..02d071456a0 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -147,7 +147,7 @@ - + From b181a948b95dca7a087a281514b13c782601c063 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Wed, 20 Mar 2024 11:53:54 -0700 Subject: [PATCH 25/33] Failed properly, tool ready --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 02d071456a0..204a92e64a5 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -147,7 +147,7 @@ - + From a75d4bb654f7b99a60b8b633b77982cf95152a60 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Thu, 21 Mar 2024 08:41:04 -0700 Subject: [PATCH 26/33] Try expect code --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 204a92e64a5..6b4edf35c06 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -122,7 +122,7 @@ - +
From 783c58db03350054a2198a72d73f01dd83cecabb Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Thu, 21 Mar 2024 10:02:05 -0700 Subject: [PATCH 27/33] Expect both failure and exit code --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 6b4edf35c06..29e4c597a40 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -122,7 +122,7 @@ - +
From e94b467988b361358a58e7ad94193201b803b494 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Thu, 21 Mar 2024 10:21:01 -0700 Subject: [PATCH 28/33] Expect fail, exit code, and num outputs --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 29e4c597a40..fa298a23ba1 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -122,7 +122,7 @@ - +
From 5f9df6d10becc2cc1ae59242ba9d0ca19b35f7a4 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Thu, 21 Mar 2024 10:34:55 -0700 Subject: [PATCH 29/33] remove num_outputs to fix lint --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index fa298a23ba1..29e4c597a40 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -122,7 +122,7 @@ - +
From dfebe1e14afcc8d8a09f1f73964e725204f9f66d Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Fri, 22 Mar 2024 05:32:28 -0700 Subject: [PATCH 30/33] matthias final pass --- tools/colabfold/colabfold_alphafold.xml | 12 +++++------- tools/colabfold/colabfold_msa.xml | 7 +++---- tools/colabfold/macros.xml | 6 +++--- 3 files changed, 11 insertions(+), 14 deletions(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 29e4c597a40..b47061385b8 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -1,5 +1,5 @@ - - AlphaFold step of colabfold in Galaxy + + AlphaFold step of Colabfold macros.xml @@ -20,19 +20,17 @@ #if $advanced.num_ensemble: --num-ensemble $advanced.num_ensemble #end if - #if $random_seed: + #if str($advanced.random_seed)!="": --random-seed $advanced.random_seed #end if - #if $advanced.num_seeds: + #if str($advanced.num_seeds)!="": --num-seeds $advanced.num_seeds #end if #if $advanced.num_models: --num-models $advanced.num_models #end if $advanced.use_dropout - #if $advanced.max_msa: - --max-msa $advanced.max_msa - #end if + --max-msa $advanced.max_msa #if $advanced.amber.use_amber == "yes": --amber --num-relax $advanced.amber.num_relaxed diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 166d10e0652..153b3e77431 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -1,5 +1,5 @@ - - Generate MSAs for the alphafold step of Colabfold + + Generate MSAs for the Alphafold step of Colabfold macros.xml @@ -13,7 +13,7 @@ mkdir template_dir && #for $file in $custom_template: #set input_file = re.sub('[^\w\-_\.]', '_', str($file.element_identifier)) + '.pdb' - ln -s $file "template_dir/${file.element_identifier}.pdb" && + ln -s $file 'template_dir/${file.element_identifier}.pdb' && #end for #end if ## For single file runs. Will need to be updated for multiple file calls @@ -36,7 +36,6 @@ --jobname-prefix 'galaxy' '$input_file' output.colab && - ls output.colab && tar -cf output.colab.tar output.colab ]]> diff --git a/tools/colabfold/macros.xml b/tools/colabfold/macros.xml index 518e62586cb..104c5729878 100644 --- a/tools/colabfold/macros.xml +++ b/tools/colabfold/macros.xml @@ -1,7 +1,7 @@ - 1.5.5 - 12.2.2 - 0 + 1.5.5 + 12.2.2 + 0 ghcr.io/sokrypton/colabfold:@VERSION@-cuda@CUDA_VERSION@ From eb670e9c95afe56ba4e80734bceda27fc12a7df4 Mon Sep 17 00:00:00 2001 From: Alexander OSTROVSKY Date: Fri, 22 Mar 2024 05:34:58 -0700 Subject: [PATCH 31/33] better descrption for alphafold --- tools/colabfold/colabfold_alphafold.xml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index b47061385b8..051cbb049c4 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -1,5 +1,5 @@ - AlphaFold step of Colabfold + Predict protein structures with Colabfold macros.xml From 0295aae32b695ec8849956276e683e977b97948f Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bj=C3=B6rn=20Gr=C3=BCning?= Date: Sun, 24 Mar 2024 21:45:50 +0100 Subject: [PATCH 32/33] small changes --- tools/colabfold/colabfold_alphafold.xml | 12 ++++++------ 1 file changed, 6 insertions(+), 6 deletions(-) diff --git a/tools/colabfold/colabfold_alphafold.xml b/tools/colabfold/colabfold_alphafold.xml index 051cbb049c4..a2dce563be8 100644 --- a/tools/colabfold/colabfold_alphafold.xml +++ b/tools/colabfold/colabfold_alphafold.xml @@ -62,7 +62,7 @@ ]]> - +
@@ -70,7 +70,7 @@ - + @@ -78,7 +78,7 @@ - + @@ -86,7 +86,7 @@ - +
@@ -150,7 +150,7 @@ - \ No newline at end of file + From bedeb9f7fb99947fbb6c6e77dc5b10d6fa05dbce Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bj=C3=B6rn=20Gr=C3=BCning?= Date: Sun, 24 Mar 2024 21:47:24 +0100 Subject: [PATCH 33/33] another round --- tools/colabfold/colabfold_msa.xml | 6 +++--- 1 file changed, 3 insertions(+), 3 deletions(-) diff --git a/tools/colabfold/colabfold_msa.xml b/tools/colabfold/colabfold_msa.xml index 153b3e77431..c7babc4664a 100644 --- a/tools/colabfold/colabfold_msa.xml +++ b/tools/colabfold/colabfold_msa.xml @@ -62,8 +62,8 @@ --> - - + + @@ -111,4 +111,4 @@ Generate MSAs for the alphafold step of Colabfold ]]> - \ No newline at end of file +