USER MOD reduce.3.24.130724 H: found=0, std=0, add=1803, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1801 hydrogens (0 hets) HEADER MEMBRANE PROTEIN, PROTEIN BINDING 22-DEC-06 2ODG TITLE COMPLEX OF BARRIER-TO-AUTOINTEGRATION FACTOR AND LEM-DOMAIN TITLE 2 OF EMERIN COMPND MOL_ID: 1; COMPND 2 MOLECULE: BARRIER-TO-AUTOINTEGRATION FACTOR; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: RESIDUES 1-89; COMPND 5 SYNONYM: BREAKPOINT CLUSTER REGION PROTEIN 1; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: EMERIN; COMPND 9 CHAIN: C; COMPND 0 FRAGMENT: RESIDUES 2-47; COMPND 1 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 CELLULAR_LOCATION: NUCLEUS; SOURCE 6 GENE: BANF1, BAF, BCRG1; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 9 MOL_ID: 2; SOURCE 0 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 1 ORGANISM_COMMON: HUMAN; SOURCE 2 ORGANISM_TAXID: 9606; SOURCE 3 CELLULAR_LOCATION: NUCLEUS; SOURCE 4 GENE: EMD, EDMD, STA; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS INNER NUCLEAR MEMBRANE PROTEIN, LEM-DOMAIN BAF KEYWDS 2 MULTIDIMENSIONAL NMR DIPOLAR COUPLINGS, MEMBRANE PROTEIN, KEYWDS 3 PROTEIN BINDING EXPDTA SOLUTION NMR AUTHOR G.M.CLORE,M.CAI REVDAT 3 24-FEB-09 2ODG 1 VERSN REVDAT 2 22-MAY-07 2ODG 1 JRNL REVDAT 1 13-MAR-07 2ODG 0 JRNL AUTH M.CAI,Y.HUANG,J.Y.SUH,J.M.LOUIS,R.GHIRLANDO, JRNL AUTH 2 R.CRAIGIE,G.M.CLORE JRNL TITL SOLUTION NMR STRUCTURE OF THE JRNL TITL 2 BARRIER-TO-AUTOINTEGRATION FACTOR-EMERIN COMPLEX. JRNL REF J.BIOL.CHEM. V. 282 14525 2007 JRNL REFN ISSN 0021-9258 JRNL PMID 17355960 JRNL DOI 10.1074/JBC.M700576200 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR NIH REMARK 3 AUTHORS : SCHWIETERS, KUSZEWSKI, CLORE REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: THE STRUCTURES WERE CALCULATED BY REMARK 3 CONJOINED RIGID BODY/TORSION ANGLE DYNAMICS (SCHWIETERS & REMARK 3 CLORE (2001) J.MAGN.RESON 152, 288-302). THE TARGET FUNCTIONS REMARK 3 COMPRISES TERMS FOR NOE RESTRAINTS, SIDECHAIN TORSION ANGLE REMARK 3 RESTRAINTS, RESIDUAL DIPOLAR COUPLING RESTRAINTS (CLORE ET AL. REMARK 3 J.MAGN.RESON. 131, 159-162 (1998); J.MAGN.RESON.133, 216- REMARK 3 221(1998)), A RADIUS OF GYRATION TERM (KUSZEWSKI ET AL. REMARK 3 J.AM.CHEM.SOC. 121, 2337-2338 (1999)), A QUARTIC VAN DER WAALS REMARK 3 REPULSION TERM (NILGES ET AL. (1988) FEBS LETT. 229, 129-136), REMARK 3 AND A TORSION ANGLE CONFORMATIONAL DATABASE POTENTIAL OF MEAN REMARK 3 FORCE (CLORE AND KUSZEWSKI 2002) J.AM.CHEM.SOC 124, 2866-2867) REMARK 3 . THE STARTING COORDINATE COME FROM THE NMR STRUCTURE OF THE REMARK 3 BAF DIMER (1QCK; KUSZEWSKI ET AL. J.AM.CHEM.SOC.121, 2337- REMARK 3 2338(1999)) AND THE LEM-DOMAIN OF EMERIN (PDB ID 2ODC; CAI ET REMARK 3 AL) THE BACKBONE COORDINATES AND NON-INTERFACIAL SIDECHAINS REMARK 3 ARE TREATED AS RIGID BODIES THROUGHOUT WITH THE BAF DIMER HELD REMARK 3 FIXED, THE MOLECULES ALLOWED TO ROTATE AND TRANSLATE, AND THE REMARK 3 AXIS OF THE SINGLE DIPOLAR COUPLING ALIGNMENT TENSOR FREE TO REMARK 3 ROTATE. THE INTERFACIAL SIDECHAINS ARE GIVEN FULL TORSIONAL REMARK 3 DEGREES OF FREEDOM. REMARK 4 REMARK 4 2ODG COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 7 REMARK 7 IN THIS ENTRY THE LAST COLUMN REPRESENTS THE AVERAGE RMS REMARK 7 DIFFERENCE BETWEEN THE INDIVIDUAL SIMULATED ANNEALING REMARK 7 STRUCTURES AND THE MEAN COORDINATE POSITIONS. IT IS REMARK 7 IMPORTANT TO NOTE THAT THE VALUES GIVEN FOR THE BACKBONE REMARK 7 ATOMS AND NON-INTERFACIAL SIDECHAINS PROVIDE ONLY A REMARK 7 MEASURE OF THE PRECISION WITH WHICH THE RELATIVE REMARK 7 ORIENTATION OF THE TWO PROTEINS HAVE BEEN DETERMINED AND REMARK 7 DOES NOT TAKE INTO ACCOUNT THE ERRORS IN THE NMR REMARK 7 COORDINATES OF THE FREE BAF DIMER AND THE LEM-DOMAIN REMARK 7 OF EMERIN. REMARK 7 REMARK 7 REMARK 7 STRUCTURAL STATISTICS: REMARK 7 --------------------------------------------------------- REMARK 7 RMS DEVIATIONS FROM EXPT RESTRAINTS REMARK 7 NOES (122) 0.016 A REMARK 7 SIDE-CHAIN TORSION ANGLES (46) 0.025 DEG REMARK 7 REMARK 7 1DNH DIPOLAR COUPLING R-FACTORS (CLORE AND GARRETT (1999) REMARK 7 J. AM. CHEM. SOC. 121, 9008-9012): REMARK 7 BAF (54X2) 15.2% LEM-DOMAIN: 14.8% REMARK 7 -------------------------------------------------------- REMARK 7 COORDINATE PRECISION REMARK 7 BACKBONE: 0.13(+/-0.06) A REMARK 7 INTERFACIAL SIDE-CHAIN HEAVY ATOMS: 1.02(+/-0.02) A REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 28-DEC-06. REMARK 100 THE RCSB ID CODE IS RCSB040996. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303.00 REMARK 210 PH : 6.50 REMARK 210 IONIC STRENGTH : 50 MM POTASSIUM PHOSPHATE 200 REMARK 210 MM NACL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : DOUBLE AND TRIPLE RESONANCE REMARK 210 FOR ASSIGNMENT OF PROTEIN, REMARK 210 QUANTITATIVE J CORRELATION FOR REMARK 210 COUPLING CONSTANTS, 3D REMARK 210 HETREONUCLEAR-SEPARATED NOE REMARK 210 EXPERIMENTS, 2D HETERONUCLEAR REMARK 210 FOR DIPOLAR COUPLING REMARK 210 MEASUREMENTS IN LIQUID REMARK 210 CRYSTALLINE MEDIUM OF PHAGE PF1 REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ, 750 MHZ REMARK 210 SPECTROMETER MODEL : DMX, DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XPLOR-NIH REMARK 210 METHOD USED : CONJOINED RIGID BODY/TORSION REMARK 210 ANGLE SIMULATED ANNEALING REMARK 210 DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 180 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : RESTRAINED REGULARIZED MEAN REMARK 210 STRUCTURE REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 PHE B 88 CB PHE B 88 CG 0.162 REMARK 500 PHE B 88 CG PHE B 88 CD1 0.118 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 THR A 2 61.78 -56.32 REMARK 500 PRO A 14 159.98 -39.99 REMARK 500 PHE A 39 74.29 -106.39 REMARK 500 LYS A 54 19.43 56.87 REMARK 500 THR B 2 61.68 -55.98 REMARK 500 PRO B 14 160.04 -39.99 REMARK 500 PHE B 39 74.16 -107.20 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2ODC RELATED DB: PDB REMARK 900 LEM-DOMAIN OF THE NUCLEAR ENVELOPE PROTEIN EMERIN DBREF 2ODG A 1 89 UNP O75531 BAF_HUMAN 1 89 DBREF 2ODG B 1 89 UNP O75531 BAF_HUMAN 1 89 DBREF 2ODG C 2 47 UNP P50402 EMD_HUMAN 2 47 SEQADV 2ODG HIS C 1 UNP P50402 CLONING ARTIFACT SEQRES 1 A 89 MET THR THR SER GLN LYS HIS ARG ASP PHE VAL ALA GLU SEQRES 2 A 89 PRO MET GLY GLU LYS PRO VAL GLY SER LEU ALA GLY ILE SEQRES 3 A 89 GLY GLU VAL LEU GLY LYS LYS LEU GLU GLU ARG GLY PHE SEQRES 4 A 89 ASP LYS ALA TYR VAL VAL LEU GLY GLN PHE LEU VAL LEU SEQRES 5 A 89 LYS LYS ASP GLU ASP LEU PHE ARG GLU TRP LEU LYS ASP SEQRES 6 A 89 THR CYS GLY ALA ASN ALA LYS GLN SER ARG ASP CYS PHE SEQRES 7 A 89 GLY CYS LEU ARG GLU TRP CYS ASP ALA PHE LEU SEQRES 1 B 89 MET THR THR SER GLN LYS HIS ARG ASP PHE VAL ALA GLU SEQRES 2 B 89 PRO MET GLY GLU LYS PRO VAL GLY SER LEU ALA GLY ILE SEQRES 3 B 89 GLY GLU VAL LEU GLY LYS LYS LEU GLU GLU ARG GLY PHE SEQRES 4 B 89 ASP LYS ALA TYR VAL VAL LEU GLY GLN PHE LEU VAL LEU SEQRES 5 B 89 LYS LYS ASP GLU ASP LEU PHE ARG GLU TRP LEU LYS ASP SEQRES 6 B 89 THR CYS GLY ALA ASN ALA LYS GLN SER ARG ASP CYS PHE SEQRES 7 B 89 GLY CYS LEU ARG GLU TRP CYS ASP ALA PHE LEU SEQRES 1 C 47 HIS ASP ASN TYR ALA ASP LEU SER ASP THR GLU LEU THR SEQRES 2 C 47 THR LEU LEU ARG ARG TYR ASN ILE PRO HIS GLY PRO VAL SEQRES 3 C 47 VAL GLY SER THR ARG ARG LEU TYR GLU LYS LYS ILE PHE SEQRES 4 C 47 GLU TYR GLU THR GLN ARG ARG ARG HELIX 1 1 SER A 4 VAL A 11 1 8 HELIX 2 2 PRO A 19 LEU A 23 5 5 HELIX 3 3 GLY A 27 ARG A 37 1 11 HELIX 4 4 LYS A 41 LEU A 52 1 12 HELIX 5 5 ASP A 55 GLY A 68 1 14 HELIX 6 6 ASN A 70 LEU A 89 1 20 HELIX 7 7 SER B 4 VAL B 11 1 8 HELIX 8 8 PRO B 19 LEU B 23 5 5 HELIX 9 9 GLY B 27 ARG B 37 1 11 HELIX 10 10 LYS B 41 LEU B 52 1 12 HELIX 11 11 ASP B 55 GLY B 68 1 14 HELIX 12 12 ASN B 70 LEU B 89 1 20 HELIX 13 13 ASP C 2 LEU C 7 5 6 HELIX 14 14 SER C 8 TYR C 19 1 12 HELIX 15 15 VAL C 27 ARG C 47 1 21 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 29 SER OG : rot 180:sc= 0 USER MOD Set 1.2: C 30 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: B 3 THR OG1 : rot -170:sc=-0.000135 USER MOD Set 2.2: B 7 HIS : no HD1:sc= -0.924 X(o=-0.92,f=-0.76) USER MOD Set 3.1: A 3 THR OG1 : rot -170:sc= 0 USER MOD Set 3.2: A 7 HIS : no HD1:sc= -0.834 X(o=-0.83,f=-0.77) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= -0.874 (180deg=-1.93!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0.0421 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 GLN : amide:sc= -0.0392 K(o=-0.039,f=-1.2!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 MET CE :methyl 165:sc= -0.144 (180deg=-0.925) USER MOD Single : A 18 LYS NZ :NH3+ -142:sc= 0.244 (180deg=0.01) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 128:sc= -0.116 (180deg=-1.05) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.129 K(o=-0.13,f=-1.5!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 71:sc= 0.77 USER MOD Single : A 67 CYS SG : rot -40:sc= 0.191 USER MOD Single : A 70 ASN : amide:sc= -0.255 K(o=-0.26,f=-3.1!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -3.92! C(o=-3.9!,f=-6.4!) USER MOD Single : A 74 SER OG : rot -38:sc= 0.377 USER MOD Single : A 77 CYS SG : rot -26:sc= -2.21! USER MOD Single : A 80 CYS SG : rot -130:sc= -0.746 USER MOD Single : A 85 CYS SG : rot 83:sc= -1.16 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -167:sc= -0.804 (180deg=-2.11!) USER MOD Single : B 2 THR OG1 : rot 180:sc= 0.0377 USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 GLN : amide:sc= -0.0165 K(o=-0.017,f=-1.2!) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 MET CE :methyl 164:sc= -0.154 (180deg=-0.952) USER MOD Single : B 18 LYS NZ :NH3+ -140:sc= 0.237 (180deg=0.0132) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ 148:sc= -0.138 (180deg=-1) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 161:sc=-0.00337 (180deg=-0.485) USER MOD Single : B 43 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN :FLIP amide:sc= -2.54! C(o=-3.5!,f=-2.5!) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 THR OG1 : rot 112:sc= 0.803 USER MOD Single : B 67 CYS SG : rot -44:sc= -0.18 USER MOD Single : B 70 ASN : amide:sc= -0.249 K(o=-0.25,f=-3.2!) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 GLN : amide:sc= -3.88! C(o=-3.9!,f=-6.1!) USER MOD Single : B 74 SER OG : rot -46:sc= 0.406 USER MOD Single : B 77 CYS SG : rot -31:sc= -2.42! USER MOD Single : B 80 CYS SG : rot -130:sc= -0.629 USER MOD Single : B 85 CYS SG : rot 180:sc= -1.15 USER MOD Single : C 1 HIS : no HD1:sc= -1.85! C(o=-1.8!,f=-8!) USER MOD Single : C 1 HIS N :NH3+ -170:sc= -0.788! (180deg=-1.25!) USER MOD Single : C 3 ASN : amide:sc= -0.327 K(o=-0.33,f=-2.9!) USER MOD Single : C 4 TYR OH : rot 180:sc= 0 USER MOD Single : C 8 SER OG : rot 180:sc= -0.0634 USER MOD Single : C 10 THR OG1 : rot 180:sc= 0 USER MOD Single : C 13 THR OG1 : rot 80:sc= 1.1 USER MOD Single : C 14 THR OG1 : rot 180:sc= 0 USER MOD Single : C 19 TYR OH : rot -39:sc= 0.0803 USER MOD Single : C 20 ASN :FLIP amide:sc= -0.101 F(o=-0.98,f=-0.1) USER MOD Single : C 23 HIS : no HE2:sc= 0.889 K(o=0.89,f=-6!) USER MOD Single : C 34 TYR OH : rot 180:sc= 1.04 USER MOD Single : C 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 37 LYS NZ :NH3+ -161:sc= -2.31! (180deg=-2.72!) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 43 THR OG1 : rot 99:sc= 0.666 USER MOD Single : C 44 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 120.171 -8.526 13.128 1.00 0.16 N ATOM 2 CA MET A 1 120.504 -7.863 11.839 1.00 0.15 C ATOM 3 C MET A 1 120.385 -8.929 10.749 1.00 0.14 C ATOM 4 O MET A 1 121.360 -9.478 10.279 1.00 0.14 O ATOM 5 CB MET A 1 121.933 -7.237 11.888 1.00 0.15 C ATOM 6 CG MET A 1 122.482 -7.216 13.332 1.00 0.16 C ATOM 7 SD MET A 1 123.603 -5.808 13.539 1.00 0.15 S ATOM 8 CE MET A 1 125.136 -6.649 13.085 1.00 0.15 C ATOM 0 H1 MET A 1 119.940 -7.804 13.840 1.00 0.16 H new ATOM 0 H2 MET A 1 119.353 -9.154 12.994 1.00 0.16 H new ATOM 0 H3 MET A 1 120.987 -9.084 13.452 1.00 0.16 H new ATOM 0 HA MET A 1 119.822 -7.038 11.633 1.00 0.15 H new ATOM 0 HB2 MET A 1 122.606 -7.808 11.248 1.00 0.15 H new ATOM 0 HB3 MET A 1 121.902 -6.222 11.493 1.00 0.15 H new ATOM 0 HG2 MET A 1 121.659 -7.145 14.043 1.00 0.16 H new ATOM 0 HG3 MET A 1 123.008 -8.147 13.545 1.00 0.16 H new ATOM 0 HE1 MET A 1 125.968 -5.948 13.147 1.00 0.15 H new ATOM 0 HE2 MET A 1 125.311 -7.481 13.768 1.00 0.15 H new ATOM 0 HE3 MET A 1 125.056 -7.027 12.066 1.00 0.15 H new ATOM 20 N THR A 2 119.167 -9.239 10.393 1.00 0.14 N ATOM 21 CA THR A 2 118.883 -10.289 9.373 1.00 0.14 C ATOM 22 C THR A 2 119.595 -9.988 8.049 1.00 0.13 C ATOM 23 O THR A 2 118.970 -9.825 7.020 1.00 0.12 O ATOM 24 CB THR A 2 117.362 -10.326 9.150 1.00 0.14 C ATOM 25 OG1 THR A 2 116.871 -8.991 9.159 1.00 0.14 O ATOM 26 CG2 THR A 2 116.664 -11.123 10.273 1.00 0.15 C ATOM 0 H THR A 2 118.334 -8.795 10.779 1.00 0.14 H new ATOM 0 HA THR A 2 119.250 -11.251 9.729 1.00 0.14 H new ATOM 0 HB THR A 2 117.154 -10.811 8.196 1.00 0.14 H new ATOM 0 HG1 THR A 2 115.902 -8.998 9.016 1.00 0.14 H new ATOM 0 HG21 THR A 2 115.589 -11.136 10.095 1.00 0.15 H new ATOM 0 HG22 THR A 2 117.043 -12.145 10.283 1.00 0.15 H new ATOM 0 HG23 THR A 2 116.867 -10.651 11.234 1.00 0.15 H new ATOM 34 N THR A 3 120.896 -9.942 8.063 1.00 0.13 N ATOM 35 CA THR A 3 121.642 -9.682 6.808 1.00 0.12 C ATOM 36 C THR A 3 121.557 -10.932 5.932 1.00 0.11 C ATOM 37 O THR A 3 121.419 -12.034 6.424 1.00 0.12 O ATOM 38 CB THR A 3 123.111 -9.383 7.135 1.00 0.11 C ATOM 39 OG1 THR A 3 123.698 -10.533 7.730 1.00 0.12 O ATOM 40 CG2 THR A 3 123.222 -8.195 8.110 1.00 0.12 C ATOM 0 H THR A 3 121.474 -10.074 8.893 1.00 0.13 H new ATOM 0 HA THR A 3 121.214 -8.826 6.286 1.00 0.12 H new ATOM 0 HB THR A 3 123.631 -9.127 6.212 1.00 0.11 H new ATOM 0 HG1 THR A 3 124.582 -10.303 8.084 1.00 0.12 H new ATOM 0 HG21 THR A 3 124.272 -8.000 8.328 1.00 0.12 H new ATOM 0 HG22 THR A 3 122.775 -7.310 7.657 1.00 0.12 H new ATOM 0 HG23 THR A 3 122.697 -8.433 9.035 1.00 0.12 H new ATOM 48 N SER A 4 121.631 -10.777 4.642 1.00 0.11 N ATOM 49 CA SER A 4 121.546 -11.964 3.746 1.00 0.10 C ATOM 50 C SER A 4 122.827 -12.797 3.865 1.00 0.10 C ATOM 51 O SER A 4 123.834 -12.348 4.379 1.00 0.10 O ATOM 52 CB SER A 4 121.363 -11.493 2.301 1.00 0.10 C ATOM 53 OG SER A 4 120.803 -12.549 1.531 1.00 0.10 O ATOM 0 H SER A 4 121.747 -9.881 4.168 1.00 0.11 H new ATOM 0 HA SER A 4 120.696 -12.581 4.037 1.00 0.10 H new ATOM 0 HB2 SER A 4 120.711 -10.620 2.271 1.00 0.10 H new ATOM 0 HB3 SER A 4 122.322 -11.190 1.881 1.00 0.10 H new ATOM 0 HG SER A 4 120.683 -12.251 0.605 1.00 0.10 H new ATOM 59 N GLN A 5 122.783 -14.016 3.392 1.00 0.11 N ATOM 60 CA GLN A 5 123.976 -14.913 3.463 1.00 0.11 C ATOM 61 C GLN A 5 125.196 -14.195 2.879 1.00 0.10 C ATOM 62 O GLN A 5 126.325 -14.562 3.137 1.00 0.10 O ATOM 63 CB GLN A 5 123.695 -16.185 2.630 1.00 0.11 C ATOM 64 CG GLN A 5 123.187 -17.323 3.519 1.00 0.12 C ATOM 65 CD GLN A 5 122.776 -18.496 2.627 1.00 0.12 C ATOM 66 OE1 GLN A 5 122.268 -18.298 1.542 1.00 0.12 O ATOM 67 NE2 GLN A 5 122.982 -19.718 3.035 1.00 0.13 N ATOM 0 H GLN A 5 121.961 -14.433 2.954 1.00 0.11 H new ATOM 0 HA GLN A 5 124.173 -15.178 4.502 1.00 0.11 H new ATOM 0 HB2 GLN A 5 122.956 -15.963 1.860 1.00 0.11 H new ATOM 0 HB3 GLN A 5 124.605 -16.497 2.118 1.00 0.11 H new ATOM 0 HG2 GLN A 5 123.965 -17.633 4.217 1.00 0.12 H new ATOM 0 HG3 GLN A 5 122.339 -16.987 4.116 1.00 0.12 H new ATOM 0 HE21 GLN A 5 123.409 -19.886 3.946 1.00 0.13 H new ATOM 0 HE22 GLN A 5 122.716 -20.505 2.443 1.00 0.13 H new ATOM 76 N LYS A 6 124.977 -13.198 2.077 1.00 0.09 N ATOM 77 CA LYS A 6 126.116 -12.480 1.452 1.00 0.09 C ATOM 78 C LYS A 6 126.988 -11.847 2.534 1.00 0.09 C ATOM 79 O LYS A 6 128.196 -11.812 2.421 1.00 0.08 O ATOM 80 CB LYS A 6 125.563 -11.417 0.510 1.00 0.08 C ATOM 81 CG LYS A 6 124.843 -12.134 -0.631 1.00 0.08 C ATOM 82 CD LYS A 6 124.265 -11.120 -1.613 1.00 0.07 C ATOM 83 CE LYS A 6 123.554 -11.873 -2.739 1.00 0.07 C ATOM 84 NZ LYS A 6 123.219 -10.928 -3.838 1.00 0.07 N ATOM 0 H LYS A 6 124.053 -12.847 1.825 1.00 0.09 H new ATOM 0 HA LYS A 6 126.735 -13.176 0.886 1.00 0.09 H new ATOM 0 HB2 LYS A 6 124.877 -10.757 1.040 1.00 0.08 H new ATOM 0 HB3 LYS A 6 126.369 -10.794 0.122 1.00 0.08 H new ATOM 0 HG2 LYS A 6 125.537 -12.797 -1.148 1.00 0.08 H new ATOM 0 HG3 LYS A 6 124.044 -12.759 -0.231 1.00 0.08 H new ATOM 0 HD2 LYS A 6 123.566 -10.457 -1.103 1.00 0.07 H new ATOM 0 HD3 LYS A 6 125.059 -10.494 -2.020 1.00 0.07 H new ATOM 0 HE2 LYS A 6 124.192 -12.672 -3.115 1.00 0.07 H new ATOM 0 HE3 LYS A 6 122.646 -12.342 -2.360 1.00 0.07 H new ATOM 0 HZ1 LYS A 6 122.736 -11.442 -4.602 1.00 0.07 H new ATOM 0 HZ2 LYS A 6 122.594 -10.180 -3.475 1.00 0.07 H new ATOM 0 HZ3 LYS A 6 124.092 -10.500 -4.207 1.00 0.07 H new ATOM 98 N HIS A 7 126.400 -11.347 3.579 1.00 0.09 N ATOM 99 CA HIS A 7 127.217 -10.720 4.652 1.00 0.09 C ATOM 100 C HIS A 7 128.194 -11.747 5.236 1.00 0.10 C ATOM 101 O HIS A 7 129.376 -11.493 5.343 1.00 0.10 O ATOM 102 CB HIS A 7 126.282 -10.187 5.740 1.00 0.10 C ATOM 103 CG HIS A 7 127.063 -9.775 6.961 1.00 0.11 C ATOM 104 ND1 HIS A 7 127.409 -8.454 7.211 1.00 0.10 N ATOM 105 CD2 HIS A 7 127.547 -10.497 8.024 1.00 0.11 C ATOM 106 CE1 HIS A 7 128.069 -8.423 8.386 1.00 0.11 C ATOM 107 NE2 HIS A 7 128.178 -9.640 8.918 1.00 0.12 N ATOM 0 H HIS A 7 125.393 -11.344 3.738 1.00 0.09 H new ATOM 0 HA HIS A 7 127.798 -9.895 4.241 1.00 0.09 H new ATOM 0 HB2 HIS A 7 125.720 -9.335 5.358 1.00 0.10 H new ATOM 0 HB3 HIS A 7 125.555 -10.954 6.009 1.00 0.10 H new ATOM 0 HD2 HIS A 7 127.452 -11.566 8.146 1.00 0.11 H new ATOM 0 HE1 HIS A 7 128.460 -7.524 8.839 1.00 0.11 H new ATOM 0 HE2 HIS A 7 128.630 -9.890 9.797 1.00 0.12 H new ATOM 115 N ARG A 8 127.716 -12.916 5.607 1.00 0.11 N ATOM 116 CA ARG A 8 128.614 -13.964 6.176 1.00 0.11 C ATOM 117 C ARG A 8 129.536 -14.515 5.089 1.00 0.11 C ATOM 118 O ARG A 8 130.682 -14.831 5.332 1.00 0.11 O ATOM 119 CB ARG A 8 127.780 -15.132 6.704 1.00 0.12 C ATOM 120 CG ARG A 8 127.001 -14.731 7.958 1.00 0.13 C ATOM 121 CD ARG A 8 126.337 -15.982 8.532 1.00 0.14 C ATOM 122 NE ARG A 8 125.213 -15.579 9.440 1.00 0.14 N ATOM 123 CZ ARG A 8 125.419 -15.120 10.636 1.00 0.15 C ATOM 124 NH1 ARG A 8 126.628 -15.082 11.127 1.00 0.15 N ATOM 125 NH2 ARG A 8 124.408 -14.726 11.359 1.00 0.15 N ATOM 0 H ARG A 8 126.735 -13.185 5.537 1.00 0.11 H new ATOM 0 HA ARG A 8 129.197 -13.511 6.978 1.00 0.11 H new ATOM 0 HB2 ARG A 8 127.086 -15.465 5.932 1.00 0.12 H new ATOM 0 HB3 ARG A 8 128.432 -15.975 6.932 1.00 0.12 H new ATOM 0 HG2 ARG A 8 127.670 -14.285 8.694 1.00 0.13 H new ATOM 0 HG3 ARG A 8 126.249 -13.980 7.714 1.00 0.13 H new ATOM 0 HD2 ARG A 8 125.959 -16.609 7.725 1.00 0.14 H new ATOM 0 HD3 ARG A 8 127.068 -16.575 9.082 1.00 0.14 H new ATOM 0 HE ARG A 8 124.254 -15.669 9.106 1.00 0.14 H new ATOM 0 HH11 ARG A 8 127.415 -15.414 10.570 1.00 0.15 H new ATOM 0 HH12 ARG A 8 126.785 -14.720 12.068 1.00 0.15 H new ATOM 0 HH21 ARG A 8 123.461 -14.780 10.984 1.00 0.15 H new ATOM 0 HH22 ARG A 8 124.564 -14.364 12.300 1.00 0.15 H new ATOM 139 N ASP A 9 129.034 -14.644 3.896 1.00 0.10 N ATOM 140 CA ASP A 9 129.874 -15.191 2.798 1.00 0.10 C ATOM 141 C ASP A 9 130.965 -14.184 2.466 1.00 0.09 C ATOM 142 O ASP A 9 132.086 -14.535 2.164 1.00 0.09 O ATOM 143 CB ASP A 9 129.017 -15.437 1.557 1.00 0.10 C ATOM 144 CG ASP A 9 128.074 -16.614 1.812 1.00 0.10 C ATOM 145 OD1 ASP A 9 128.356 -17.390 2.709 1.00 0.11 O ATOM 146 OD2 ASP A 9 127.085 -16.716 1.105 1.00 0.10 O ATOM 0 H ASP A 9 128.080 -14.395 3.633 1.00 0.10 H new ATOM 0 HA ASP A 9 130.318 -16.135 3.115 1.00 0.10 H new ATOM 0 HB2 ASP A 9 128.442 -14.543 1.316 1.00 0.10 H new ATOM 0 HB3 ASP A 9 129.654 -15.647 0.698 1.00 0.10 H new ATOM 151 N PHE A 10 130.637 -12.930 2.514 1.00 0.09 N ATOM 152 CA PHE A 10 131.636 -11.883 2.196 1.00 0.08 C ATOM 153 C PHE A 10 132.770 -11.900 3.235 1.00 0.08 C ATOM 154 O PHE A 10 133.935 -11.913 2.892 1.00 0.08 O ATOM 155 CB PHE A 10 130.920 -10.538 2.213 1.00 0.07 C ATOM 156 CG PHE A 10 131.812 -9.464 1.664 1.00 0.07 C ATOM 157 CD1 PHE A 10 131.897 -9.274 0.273 1.00 0.06 C ATOM 158 CD2 PHE A 10 132.535 -8.632 2.537 1.00 0.07 C ATOM 159 CE1 PHE A 10 132.705 -8.251 -0.245 1.00 0.05 C ATOM 160 CE2 PHE A 10 133.346 -7.610 2.016 1.00 0.06 C ATOM 161 CZ PHE A 10 133.428 -7.420 0.629 1.00 0.05 C ATOM 0 H PHE A 10 129.711 -12.582 2.762 1.00 0.09 H new ATOM 0 HA PHE A 10 132.078 -12.062 1.216 1.00 0.08 H new ATOM 0 HB2 PHE A 10 130.006 -10.598 1.622 1.00 0.07 H new ATOM 0 HB3 PHE A 10 130.625 -10.289 3.232 1.00 0.07 H new ATOM 0 HD1 PHE A 10 131.341 -9.915 -0.395 1.00 0.06 H new ATOM 0 HD2 PHE A 10 132.467 -8.778 3.605 1.00 0.07 H new ATOM 0 HE1 PHE A 10 132.772 -8.102 -1.313 1.00 0.05 H new ATOM 0 HE2 PHE A 10 133.906 -6.971 2.683 1.00 0.06 H new ATOM 0 HZ PHE A 10 134.049 -6.632 0.230 1.00 0.05 H new ATOM 171 N VAL A 11 132.438 -11.898 4.501 1.00 0.09 N ATOM 172 CA VAL A 11 133.497 -11.908 5.559 1.00 0.09 C ATOM 173 C VAL A 11 133.986 -13.339 5.823 1.00 0.10 C ATOM 174 O VAL A 11 134.736 -13.578 6.748 1.00 0.10 O ATOM 175 CB VAL A 11 132.927 -11.333 6.861 1.00 0.10 C ATOM 176 CG1 VAL A 11 132.399 -9.898 6.632 1.00 0.09 C ATOM 177 CG2 VAL A 11 131.793 -12.240 7.344 1.00 0.11 C ATOM 0 H VAL A 11 131.479 -11.890 4.849 1.00 0.09 H new ATOM 0 HA VAL A 11 134.334 -11.302 5.213 1.00 0.09 H new ATOM 0 HB VAL A 11 133.713 -11.289 7.615 1.00 0.10 H new ATOM 0 HG11 VAL A 11 131.998 -9.505 7.566 1.00 0.09 H new ATOM 0 HG12 VAL A 11 133.214 -9.261 6.290 1.00 0.09 H new ATOM 0 HG13 VAL A 11 131.612 -9.916 5.878 1.00 0.09 H new ATOM 0 HG21 VAL A 11 131.378 -11.842 8.270 1.00 0.11 H new ATOM 0 HG22 VAL A 11 131.012 -12.281 6.585 1.00 0.11 H new ATOM 0 HG23 VAL A 11 132.180 -13.243 7.521 1.00 0.11 H new ATOM 187 N ALA A 12 133.579 -14.288 5.016 1.00 0.10 N ATOM 188 CA ALA A 12 134.034 -15.706 5.215 1.00 0.11 C ATOM 189 C ALA A 12 135.094 -16.071 4.172 1.00 0.11 C ATOM 190 O ALA A 12 135.777 -17.068 4.294 1.00 0.11 O ATOM 191 CB ALA A 12 132.848 -16.654 5.066 1.00 0.11 C ATOM 0 H ALA A 12 132.950 -14.145 4.226 1.00 0.10 H new ATOM 0 HA ALA A 12 134.459 -15.798 6.214 1.00 0.11 H new ATOM 0 HB1 ALA A 12 133.183 -17.681 5.211 1.00 0.11 H new ATOM 0 HB2 ALA A 12 132.091 -16.410 5.812 1.00 0.11 H new ATOM 0 HB3 ALA A 12 132.421 -16.549 4.068 1.00 0.11 H new ATOM 197 N GLU A 13 135.245 -15.270 3.152 1.00 0.10 N ATOM 198 CA GLU A 13 136.270 -15.571 2.107 1.00 0.10 C ATOM 199 C GLU A 13 136.681 -14.260 1.423 1.00 0.09 C ATOM 200 O GLU A 13 135.897 -13.335 1.351 1.00 0.08 O ATOM 201 CB GLU A 13 135.674 -16.533 1.072 1.00 0.10 C ATOM 202 CG GLU A 13 134.306 -16.020 0.625 1.00 0.10 C ATOM 203 CD GLU A 13 133.830 -16.821 -0.588 1.00 0.10 C ATOM 204 OE1 GLU A 13 134.373 -17.889 -0.819 1.00 0.11 O ATOM 205 OE2 GLU A 13 132.929 -16.353 -1.265 1.00 0.09 O ATOM 0 H GLU A 13 134.704 -14.420 2.996 1.00 0.10 H new ATOM 0 HA GLU A 13 137.144 -16.035 2.564 1.00 0.10 H new ATOM 0 HB2 GLU A 13 136.340 -16.618 0.213 1.00 0.10 H new ATOM 0 HB3 GLU A 13 135.577 -17.530 1.501 1.00 0.10 H new ATOM 0 HG2 GLU A 13 133.588 -16.113 1.439 1.00 0.10 H new ATOM 0 HG3 GLU A 13 134.368 -14.961 0.373 1.00 0.10 H new ATOM 212 N PRO A 14 137.886 -14.169 0.910 1.00 0.08 N ATOM 213 CA PRO A 14 138.356 -12.937 0.217 1.00 0.07 C ATOM 214 C PRO A 14 137.260 -12.314 -0.660 1.00 0.07 C ATOM 215 O PRO A 14 136.301 -12.964 -1.025 1.00 0.07 O ATOM 216 CB PRO A 14 139.522 -13.441 -0.640 1.00 0.08 C ATOM 217 CG PRO A 14 140.095 -14.594 0.127 1.00 0.09 C ATOM 218 CD PRO A 14 138.936 -15.211 0.930 1.00 0.09 C ATOM 0 HA PRO A 14 138.638 -12.149 0.915 1.00 0.07 H new ATOM 0 HB2 PRO A 14 139.181 -13.754 -1.627 1.00 0.08 H new ATOM 0 HB3 PRO A 14 140.266 -12.660 -0.793 1.00 0.08 H new ATOM 0 HG2 PRO A 14 140.532 -15.329 -0.549 1.00 0.09 H new ATOM 0 HG3 PRO A 14 140.891 -14.259 0.792 1.00 0.09 H new ATOM 0 HD2 PRO A 14 138.586 -16.138 0.476 1.00 0.09 H new ATOM 0 HD3 PRO A 14 139.240 -15.450 1.949 1.00 0.09 H new ATOM 226 N MET A 15 137.392 -11.056 -0.993 1.00 0.06 N ATOM 227 CA MET A 15 136.356 -10.389 -1.839 1.00 0.06 C ATOM 228 C MET A 15 136.705 -10.565 -3.321 1.00 0.06 C ATOM 229 O MET A 15 135.847 -10.548 -4.180 1.00 0.06 O ATOM 230 CB MET A 15 136.352 -8.879 -1.549 1.00 0.05 C ATOM 231 CG MET A 15 137.803 -8.388 -1.423 1.00 0.05 C ATOM 232 SD MET A 15 137.906 -6.627 -1.845 1.00 0.04 S ATOM 233 CE MET A 15 136.732 -5.981 -0.640 1.00 0.04 C ATOM 0 H MET A 15 138.173 -10.461 -0.716 1.00 0.06 H new ATOM 0 HA MET A 15 135.386 -10.834 -1.615 1.00 0.06 H new ATOM 0 HB2 MET A 15 135.842 -8.344 -2.350 1.00 0.05 H new ATOM 0 HB3 MET A 15 135.804 -8.674 -0.629 1.00 0.05 H new ATOM 0 HG2 MET A 15 138.162 -8.548 -0.406 1.00 0.05 H new ATOM 0 HG3 MET A 15 138.449 -8.966 -2.083 1.00 0.05 H new ATOM 0 HE1 MET A 15 136.851 -4.901 -0.559 1.00 0.04 H new ATOM 0 HE2 MET A 15 135.716 -6.211 -0.962 1.00 0.04 H new ATOM 0 HE3 MET A 15 136.918 -6.440 0.331 1.00 0.04 H new ATOM 243 N GLY A 16 137.967 -10.697 -3.622 1.00 0.06 N ATOM 244 CA GLY A 16 138.385 -10.835 -5.046 1.00 0.06 C ATOM 245 C GLY A 16 137.875 -9.619 -5.830 1.00 0.06 C ATOM 246 O GLY A 16 137.912 -8.502 -5.352 1.00 0.05 O ATOM 0 H GLY A 16 138.728 -10.715 -2.943 1.00 0.06 H new ATOM 0 HA2 GLY A 16 139.471 -10.901 -5.116 1.00 0.06 H new ATOM 0 HA3 GLY A 16 137.982 -11.754 -5.471 1.00 0.06 H new ATOM 250 N GLU A 17 137.423 -9.826 -7.042 1.00 0.06 N ATOM 251 CA GLU A 17 136.930 -8.689 -7.891 1.00 0.06 C ATOM 252 C GLU A 17 135.406 -8.758 -8.015 1.00 0.06 C ATOM 253 O GLU A 17 134.839 -8.423 -9.036 1.00 0.06 O ATOM 254 CB GLU A 17 137.555 -8.806 -9.280 1.00 0.07 C ATOM 255 CG GLU A 17 139.051 -8.504 -9.193 1.00 0.07 C ATOM 256 CD GLU A 17 139.678 -8.621 -10.583 1.00 0.08 C ATOM 257 OE1 GLU A 17 139.000 -9.098 -11.477 1.00 0.08 O ATOM 258 OE2 GLU A 17 140.826 -8.236 -10.727 1.00 0.08 O ATOM 0 H GLU A 17 137.373 -10.742 -7.487 1.00 0.06 H new ATOM 0 HA GLU A 17 137.209 -7.740 -7.432 1.00 0.06 H new ATOM 0 HB2 GLU A 17 137.398 -9.809 -9.678 1.00 0.07 H new ATOM 0 HB3 GLU A 17 137.072 -8.111 -9.967 1.00 0.07 H new ATOM 0 HG2 GLU A 17 139.208 -7.501 -8.795 1.00 0.07 H new ATOM 0 HG3 GLU A 17 139.533 -9.199 -8.505 1.00 0.07 H new ATOM 265 N LYS A 18 134.745 -9.211 -6.989 1.00 0.06 N ATOM 266 CA LYS A 18 133.260 -9.329 -7.047 1.00 0.06 C ATOM 267 C LYS A 18 132.642 -7.942 -7.301 1.00 0.05 C ATOM 268 O LYS A 18 133.199 -6.933 -6.915 1.00 0.05 O ATOM 269 CB LYS A 18 132.758 -9.906 -5.722 1.00 0.05 C ATOM 270 CG LYS A 18 133.172 -11.376 -5.646 1.00 0.06 C ATOM 271 CD LYS A 18 132.628 -12.015 -4.370 1.00 0.06 C ATOM 272 CE LYS A 18 133.033 -13.490 -4.339 1.00 0.07 C ATOM 273 NZ LYS A 18 132.254 -14.202 -3.289 1.00 0.08 N ATOM 0 H LYS A 18 135.169 -9.506 -6.109 1.00 0.06 H new ATOM 0 HA LYS A 18 132.967 -9.992 -7.861 1.00 0.06 H new ATOM 0 HB2 LYS A 18 133.178 -9.350 -4.883 1.00 0.05 H new ATOM 0 HB3 LYS A 18 131.674 -9.814 -5.655 1.00 0.05 H new ATOM 0 HG2 LYS A 18 132.797 -11.912 -6.518 1.00 0.06 H new ATOM 0 HG3 LYS A 18 134.259 -11.456 -5.666 1.00 0.06 H new ATOM 0 HD2 LYS A 18 133.020 -11.499 -3.494 1.00 0.06 H new ATOM 0 HD3 LYS A 18 131.543 -11.922 -4.336 1.00 0.06 H new ATOM 0 HE2 LYS A 18 132.853 -13.947 -5.312 1.00 0.07 H new ATOM 0 HE3 LYS A 18 134.100 -13.580 -4.137 1.00 0.07 H new ATOM 0 HZ1 LYS A 18 132.864 -14.900 -2.818 1.00 0.08 H new ATOM 0 HZ2 LYS A 18 131.908 -13.516 -2.588 1.00 0.08 H new ATOM 0 HZ3 LYS A 18 131.445 -14.688 -3.726 1.00 0.08 H new ATOM 287 N PRO A 19 131.512 -7.888 -7.978 1.00 0.05 N ATOM 288 CA PRO A 19 130.833 -6.596 -8.321 1.00 0.05 C ATOM 289 C PRO A 19 130.386 -5.812 -7.084 1.00 0.05 C ATOM 290 O PRO A 19 130.115 -6.369 -6.039 1.00 0.05 O ATOM 291 CB PRO A 19 129.620 -7.025 -9.173 1.00 0.06 C ATOM 292 CG PRO A 19 129.380 -8.455 -8.814 1.00 0.06 C ATOM 293 CD PRO A 19 130.751 -9.043 -8.493 1.00 0.06 C ATOM 0 HA PRO A 19 131.508 -5.918 -8.844 1.00 0.05 H new ATOM 0 HB2 PRO A 19 128.747 -6.411 -8.953 1.00 0.06 H new ATOM 0 HB3 PRO A 19 129.827 -6.915 -10.237 1.00 0.06 H new ATOM 0 HG2 PRO A 19 128.711 -8.535 -7.958 1.00 0.06 H new ATOM 0 HG3 PRO A 19 128.909 -8.991 -9.638 1.00 0.06 H new ATOM 0 HD2 PRO A 19 130.682 -9.840 -7.753 1.00 0.06 H new ATOM 0 HD3 PRO A 19 131.221 -9.470 -9.379 1.00 0.06 H new ATOM 301 N VAL A 20 130.317 -4.515 -7.208 1.00 0.05 N ATOM 302 CA VAL A 20 129.900 -3.672 -6.058 1.00 0.05 C ATOM 303 C VAL A 20 128.562 -4.159 -5.504 1.00 0.05 C ATOM 304 O VAL A 20 128.364 -4.240 -4.309 1.00 0.05 O ATOM 305 CB VAL A 20 129.775 -2.217 -6.517 1.00 0.06 C ATOM 306 CG1 VAL A 20 128.741 -2.108 -7.648 1.00 0.06 C ATOM 307 CG2 VAL A 20 129.348 -1.353 -5.326 1.00 0.06 C ATOM 0 H VAL A 20 130.533 -4.002 -8.063 1.00 0.05 H new ATOM 0 HA VAL A 20 130.650 -3.743 -5.270 1.00 0.05 H new ATOM 0 HB VAL A 20 130.736 -1.868 -6.894 1.00 0.06 H new ATOM 0 HG11 VAL A 20 128.659 -1.069 -7.968 1.00 0.06 H new ATOM 0 HG12 VAL A 20 129.057 -2.723 -8.491 1.00 0.06 H new ATOM 0 HG13 VAL A 20 127.772 -2.454 -7.289 1.00 0.06 H new ATOM 0 HG21 VAL A 20 129.257 -0.314 -5.644 1.00 0.06 H new ATOM 0 HG22 VAL A 20 128.387 -1.703 -4.949 1.00 0.06 H new ATOM 0 HG23 VAL A 20 130.096 -1.426 -4.537 1.00 0.06 H new ATOM 317 N GLY A 21 127.637 -4.476 -6.374 1.00 0.05 N ATOM 318 CA GLY A 21 126.299 -4.948 -5.925 1.00 0.06 C ATOM 319 C GLY A 21 126.441 -6.187 -5.039 1.00 0.05 C ATOM 320 O GLY A 21 125.468 -6.693 -4.516 1.00 0.06 O ATOM 0 H GLY A 21 127.756 -4.426 -7.386 1.00 0.05 H new ATOM 0 HA2 GLY A 21 125.793 -4.155 -5.374 1.00 0.06 H new ATOM 0 HA3 GLY A 21 125.679 -5.181 -6.791 1.00 0.06 H new ATOM 324 N SER A 22 127.633 -6.690 -4.867 1.00 0.05 N ATOM 325 CA SER A 22 127.815 -7.901 -4.016 1.00 0.05 C ATOM 326 C SER A 22 127.920 -7.498 -2.540 1.00 0.05 C ATOM 327 O SER A 22 127.679 -8.297 -1.657 1.00 0.06 O ATOM 328 CB SER A 22 129.098 -8.619 -4.436 1.00 0.05 C ATOM 329 OG SER A 22 129.261 -9.789 -3.645 1.00 0.06 O ATOM 0 H SER A 22 128.488 -6.316 -5.278 1.00 0.05 H new ATOM 0 HA SER A 22 126.958 -8.562 -4.144 1.00 0.05 H new ATOM 0 HB2 SER A 22 129.051 -8.884 -5.492 1.00 0.05 H new ATOM 0 HB3 SER A 22 129.956 -7.959 -4.310 1.00 0.05 H new ATOM 0 HG SER A 22 130.082 -10.253 -3.912 1.00 0.06 H new ATOM 335 N LEU A 23 128.290 -6.277 -2.260 1.00 0.05 N ATOM 336 CA LEU A 23 128.418 -5.853 -0.834 1.00 0.06 C ATOM 337 C LEU A 23 127.051 -5.906 -0.151 1.00 0.06 C ATOM 338 O LEU A 23 126.044 -5.515 -0.707 1.00 0.06 O ATOM 339 CB LEU A 23 128.962 -4.424 -0.765 1.00 0.06 C ATOM 340 CG LEU A 23 130.388 -4.381 -1.333 1.00 0.05 C ATOM 341 CD1 LEU A 23 130.793 -2.921 -1.548 1.00 0.06 C ATOM 342 CD2 LEU A 23 131.394 -5.073 -0.365 1.00 0.05 C ATOM 0 H LEU A 23 128.508 -5.559 -2.951 1.00 0.05 H new ATOM 0 HA LEU A 23 129.105 -6.529 -0.325 1.00 0.06 H new ATOM 0 HB2 LEU A 23 128.316 -3.752 -1.329 1.00 0.06 H new ATOM 0 HB3 LEU A 23 128.962 -4.075 0.267 1.00 0.06 H new ATOM 0 HG LEU A 23 130.408 -4.918 -2.281 1.00 0.05 H new ATOM 0 HD11 LEU A 23 131.805 -2.880 -1.951 1.00 0.06 H new ATOM 0 HD12 LEU A 23 130.103 -2.452 -2.249 1.00 0.06 H new ATOM 0 HD13 LEU A 23 130.760 -2.390 -0.596 1.00 0.06 H new ATOM 0 HD21 LEU A 23 132.397 -5.029 -0.790 1.00 0.05 H new ATOM 0 HD22 LEU A 23 131.385 -4.560 0.597 1.00 0.05 H new ATOM 0 HD23 LEU A 23 131.105 -6.114 -0.224 1.00 0.05 H new ATOM 354 N ALA A 24 127.021 -6.382 1.057 1.00 0.07 N ATOM 355 CA ALA A 24 125.728 -6.461 1.790 1.00 0.08 C ATOM 356 C ALA A 24 125.185 -5.048 2.033 1.00 0.08 C ATOM 357 O ALA A 24 125.898 -4.150 2.436 1.00 0.08 O ATOM 358 CB ALA A 24 125.939 -7.172 3.130 1.00 0.08 C ATOM 0 H ALA A 24 127.834 -6.721 1.571 1.00 0.07 H new ATOM 0 HA ALA A 24 125.009 -7.023 1.194 1.00 0.08 H new ATOM 0 HB1 ALA A 24 124.991 -7.229 3.665 1.00 0.08 H new ATOM 0 HB2 ALA A 24 126.316 -8.179 2.952 1.00 0.08 H new ATOM 0 HB3 ALA A 24 126.660 -6.615 3.728 1.00 0.08 H new ATOM 364 N GLY A 25 123.919 -4.857 1.781 1.00 0.08 N ATOM 365 CA GLY A 25 123.297 -3.511 1.984 1.00 0.09 C ATOM 366 C GLY A 25 123.238 -2.773 0.645 1.00 0.08 C ATOM 367 O GLY A 25 122.455 -1.861 0.465 1.00 0.09 O ATOM 0 H GLY A 25 123.282 -5.578 1.441 1.00 0.08 H new ATOM 0 HA2 GLY A 25 122.294 -3.620 2.397 1.00 0.09 H new ATOM 0 HA3 GLY A 25 123.877 -2.935 2.705 1.00 0.09 H new ATOM 371 N ILE A 26 124.050 -3.170 -0.303 1.00 0.08 N ATOM 372 CA ILE A 26 124.034 -2.502 -1.641 1.00 0.07 C ATOM 373 C ILE A 26 123.196 -3.358 -2.589 1.00 0.07 C ATOM 374 O ILE A 26 123.573 -4.461 -2.934 1.00 0.07 O ATOM 375 CB ILE A 26 125.466 -2.386 -2.177 1.00 0.07 C ATOM 376 CG1 ILE A 26 126.364 -1.709 -1.121 1.00 0.07 C ATOM 377 CG2 ILE A 26 125.475 -1.576 -3.490 1.00 0.07 C ATOM 378 CD1 ILE A 26 125.776 -0.361 -0.676 1.00 0.08 C ATOM 0 H ILE A 26 124.724 -3.929 -0.208 1.00 0.08 H new ATOM 0 HA ILE A 26 123.609 -1.502 -1.560 1.00 0.07 H new ATOM 0 HB ILE A 26 125.854 -3.383 -2.383 1.00 0.07 H new ATOM 0 HG12 ILE A 26 126.472 -2.365 -0.257 1.00 0.07 H new ATOM 0 HG13 ILE A 26 127.362 -1.556 -1.532 1.00 0.07 H new ATOM 0 HG21 ILE A 26 126.496 -1.499 -3.863 1.00 0.07 H new ATOM 0 HG22 ILE A 26 124.855 -2.079 -4.232 1.00 0.07 H new ATOM 0 HG23 ILE A 26 125.080 -0.577 -3.304 1.00 0.07 H new ATOM 0 HD11 ILE A 26 126.430 0.093 0.068 1.00 0.08 H new ATOM 0 HD12 ILE A 26 125.692 0.301 -1.538 1.00 0.08 H new ATOM 0 HD13 ILE A 26 124.789 -0.520 -0.243 1.00 0.08 H new ATOM 390 N GLY A 27 122.058 -2.875 -3.013 1.00 0.08 N ATOM 391 CA GLY A 27 121.204 -3.679 -3.936 1.00 0.07 C ATOM 392 C GLY A 27 121.576 -3.372 -5.388 1.00 0.07 C ATOM 393 O GLY A 27 122.434 -2.557 -5.663 1.00 0.07 O ATOM 0 H GLY A 27 121.683 -1.960 -2.761 1.00 0.08 H new ATOM 0 HA2 GLY A 27 121.336 -4.742 -3.734 1.00 0.07 H new ATOM 0 HA3 GLY A 27 120.152 -3.450 -3.765 1.00 0.07 H new ATOM 397 N GLU A 28 120.950 -4.041 -6.316 1.00 0.07 N ATOM 398 CA GLU A 28 121.285 -3.805 -7.748 1.00 0.07 C ATOM 399 C GLU A 28 121.055 -2.330 -8.104 1.00 0.08 C ATOM 400 O GLU A 28 121.830 -1.733 -8.825 1.00 0.08 O ATOM 401 CB GLU A 28 120.416 -4.700 -8.638 1.00 0.07 C ATOM 402 CG GLU A 28 120.788 -6.166 -8.398 1.00 0.07 C ATOM 403 CD GLU A 28 120.154 -7.043 -9.480 1.00 0.07 C ATOM 404 OE1 GLU A 28 119.481 -6.497 -10.338 1.00 0.07 O ATOM 405 OE2 GLU A 28 120.358 -8.245 -9.435 1.00 0.07 O ATOM 0 H GLU A 28 120.224 -4.738 -6.146 1.00 0.07 H new ATOM 0 HA GLU A 28 122.334 -4.049 -7.914 1.00 0.07 H new ATOM 0 HB2 GLU A 28 119.361 -4.539 -8.415 1.00 0.07 H new ATOM 0 HB3 GLU A 28 120.563 -4.442 -9.687 1.00 0.07 H new ATOM 0 HG2 GLU A 28 121.872 -6.283 -8.410 1.00 0.07 H new ATOM 0 HG3 GLU A 28 120.445 -6.482 -7.413 1.00 0.07 H new ATOM 412 N VAL A 29 120.006 -1.735 -7.606 1.00 0.08 N ATOM 413 CA VAL A 29 119.744 -0.298 -7.922 1.00 0.09 C ATOM 414 C VAL A 29 120.863 0.554 -7.316 1.00 0.09 C ATOM 415 O VAL A 29 121.402 1.434 -7.957 1.00 0.10 O ATOM 416 CB VAL A 29 118.380 0.104 -7.315 1.00 0.09 C ATOM 417 CG1 VAL A 29 118.116 1.621 -7.473 1.00 0.10 C ATOM 418 CG2 VAL A 29 117.248 -0.704 -7.995 1.00 0.09 C ATOM 0 H VAL A 29 119.320 -2.178 -6.996 1.00 0.08 H new ATOM 0 HA VAL A 29 119.718 -0.141 -9.000 1.00 0.09 H new ATOM 0 HB VAL A 29 118.402 -0.122 -6.249 1.00 0.09 H new ATOM 0 HG11 VAL A 29 117.149 1.870 -7.036 1.00 0.10 H new ATOM 0 HG12 VAL A 29 118.900 2.182 -6.963 1.00 0.10 H new ATOM 0 HG13 VAL A 29 118.113 1.882 -8.531 1.00 0.10 H new ATOM 0 HG21 VAL A 29 116.288 -0.418 -7.565 1.00 0.09 H new ATOM 0 HG22 VAL A 29 117.243 -0.494 -9.065 1.00 0.09 H new ATOM 0 HG23 VAL A 29 117.415 -1.769 -7.835 1.00 0.09 H new ATOM 428 N LEU A 30 121.204 0.308 -6.083 1.00 0.09 N ATOM 429 CA LEU A 30 122.275 1.108 -5.422 1.00 0.09 C ATOM 430 C LEU A 30 123.624 0.806 -6.070 1.00 0.09 C ATOM 431 O LEU A 30 124.435 1.685 -6.276 1.00 0.09 O ATOM 432 CB LEU A 30 122.329 0.754 -3.933 1.00 0.09 C ATOM 433 CG LEU A 30 120.996 1.107 -3.242 1.00 0.10 C ATOM 434 CD1 LEU A 30 120.994 0.556 -1.781 1.00 0.10 C ATOM 435 CD2 LEU A 30 120.796 2.640 -3.248 1.00 0.11 C ATOM 0 H LEU A 30 120.785 -0.417 -5.500 1.00 0.09 H new ATOM 0 HA LEU A 30 122.054 2.169 -5.537 1.00 0.09 H new ATOM 0 HB2 LEU A 30 122.536 -0.310 -3.814 1.00 0.09 H new ATOM 0 HB3 LEU A 30 123.147 1.293 -3.455 1.00 0.09 H new ATOM 0 HG LEU A 30 120.171 0.646 -3.786 1.00 0.10 H new ATOM 0 HD11 LEU A 30 120.050 0.809 -1.298 1.00 0.10 H new ATOM 0 HD12 LEU A 30 121.113 -0.527 -1.801 1.00 0.10 H new ATOM 0 HD13 LEU A 30 121.817 1.002 -1.223 1.00 0.10 H new ATOM 0 HD21 LEU A 30 119.853 2.886 -2.759 1.00 0.11 H new ATOM 0 HD22 LEU A 30 121.617 3.116 -2.713 1.00 0.11 H new ATOM 0 HD23 LEU A 30 120.776 3.000 -4.277 1.00 0.11 H new ATOM 447 N GLY A 31 123.871 -0.429 -6.395 1.00 0.08 N ATOM 448 CA GLY A 31 125.168 -0.775 -7.034 1.00 0.07 C ATOM 449 C GLY A 31 125.304 0.014 -8.336 1.00 0.08 C ATOM 450 O GLY A 31 126.385 0.401 -8.733 1.00 0.08 O ATOM 0 H GLY A 31 123.234 -1.212 -6.247 1.00 0.08 H new ATOM 0 HA2 GLY A 31 125.994 -0.540 -6.363 1.00 0.07 H new ATOM 0 HA3 GLY A 31 125.216 -1.845 -7.235 1.00 0.07 H new ATOM 454 N LYS A 32 124.206 0.246 -9.009 1.00 0.08 N ATOM 455 CA LYS A 32 124.254 1.001 -10.294 1.00 0.09 C ATOM 456 C LYS A 32 124.663 2.460 -10.041 1.00 0.10 C ATOM 457 O LYS A 32 125.404 3.044 -10.806 1.00 0.10 O ATOM 458 CB LYS A 32 122.843 0.966 -10.940 1.00 0.10 C ATOM 459 CG LYS A 32 122.877 0.308 -12.332 1.00 0.10 C ATOM 460 CD LYS A 32 121.618 0.703 -13.119 1.00 0.10 C ATOM 461 CE LYS A 32 121.361 -0.316 -14.228 1.00 0.10 C ATOM 462 NZ LYS A 32 121.045 -1.635 -13.611 1.00 0.09 N ATOM 0 H LYS A 32 123.275 -0.057 -8.721 1.00 0.08 H new ATOM 0 HA LYS A 32 124.988 0.543 -10.957 1.00 0.09 H new ATOM 0 HB2 LYS A 32 122.159 0.417 -10.293 1.00 0.10 H new ATOM 0 HB3 LYS A 32 122.455 1.981 -11.025 1.00 0.10 H new ATOM 0 HG2 LYS A 32 123.770 0.623 -12.872 1.00 0.10 H new ATOM 0 HG3 LYS A 32 122.930 -0.776 -12.232 1.00 0.10 H new ATOM 0 HD2 LYS A 32 120.759 0.750 -12.449 1.00 0.10 H new ATOM 0 HD3 LYS A 32 121.743 1.697 -13.548 1.00 0.10 H new ATOM 0 HE2 LYS A 32 120.534 0.013 -14.857 1.00 0.10 H new ATOM 0 HE3 LYS A 32 122.237 -0.401 -14.871 1.00 0.10 H new ATOM 0 HZ1 LYS A 32 120.157 -2.001 -14.011 1.00 0.09 H new ATOM 0 HZ2 LYS A 32 121.816 -2.304 -13.809 1.00 0.09 H new ATOM 0 HZ3 LYS A 32 120.941 -1.521 -12.583 1.00 0.09 H new ATOM 476 N LYS A 33 124.165 3.062 -8.999 1.00 0.10 N ATOM 477 CA LYS A 33 124.512 4.486 -8.745 1.00 0.11 C ATOM 478 C LYS A 33 125.987 4.580 -8.367 1.00 0.11 C ATOM 479 O LYS A 33 126.711 5.413 -8.873 1.00 0.11 O ATOM 480 CB LYS A 33 123.629 5.017 -7.616 1.00 0.11 C ATOM 481 CG LYS A 33 122.167 4.956 -8.071 1.00 0.12 C ATOM 482 CD LYS A 33 121.246 5.483 -6.964 1.00 0.12 C ATOM 483 CE LYS A 33 119.769 5.423 -7.417 1.00 0.12 C ATOM 484 NZ LYS A 33 119.303 6.795 -7.767 1.00 0.13 N ATOM 0 H LYS A 33 123.538 2.634 -8.318 1.00 0.10 H new ATOM 0 HA LYS A 33 124.341 5.087 -9.638 1.00 0.11 H new ATOM 0 HB2 LYS A 33 123.770 4.422 -6.714 1.00 0.11 H new ATOM 0 HB3 LYS A 33 123.906 6.042 -7.369 1.00 0.11 H new ATOM 0 HG2 LYS A 33 122.035 5.548 -8.977 1.00 0.12 H new ATOM 0 HG3 LYS A 33 121.898 3.929 -8.320 1.00 0.12 H new ATOM 0 HD2 LYS A 33 121.380 4.891 -6.059 1.00 0.12 H new ATOM 0 HD3 LYS A 33 121.515 6.510 -6.716 1.00 0.12 H new ATOM 0 HE2 LYS A 33 119.668 4.762 -8.278 1.00 0.12 H new ATOM 0 HE3 LYS A 33 119.150 5.008 -6.622 1.00 0.12 H new ATOM 0 HZ1 LYS A 33 118.309 6.757 -8.072 1.00 0.13 H new ATOM 0 HZ2 LYS A 33 119.386 7.413 -6.935 1.00 0.13 H new ATOM 0 HZ3 LYS A 33 119.888 7.174 -8.539 1.00 0.13 H new ATOM 498 N LEU A 34 126.457 3.715 -7.515 1.00 0.10 N ATOM 499 CA LEU A 34 127.900 3.752 -7.160 1.00 0.10 C ATOM 500 C LEU A 34 128.711 3.472 -8.435 1.00 0.10 C ATOM 501 O LEU A 34 129.744 4.060 -8.680 1.00 0.10 O ATOM 502 CB LEU A 34 128.205 2.697 -6.085 1.00 0.09 C ATOM 503 CG LEU A 34 127.461 3.037 -4.780 1.00 0.09 C ATOM 504 CD1 LEU A 34 127.372 1.774 -3.905 1.00 0.08 C ATOM 505 CD2 LEU A 34 128.208 4.159 -4.000 1.00 0.10 C ATOM 0 H LEU A 34 125.909 2.989 -7.052 1.00 0.10 H new ATOM 0 HA LEU A 34 128.167 4.729 -6.757 1.00 0.10 H new ATOM 0 HB2 LEU A 34 127.904 1.710 -6.437 1.00 0.09 H new ATOM 0 HB3 LEU A 34 129.278 2.655 -5.900 1.00 0.09 H new ATOM 0 HG LEU A 34 126.460 3.392 -5.026 1.00 0.09 H new ATOM 0 HD11 LEU A 34 126.846 2.009 -2.980 1.00 0.08 H new ATOM 0 HD12 LEU A 34 126.830 0.996 -4.443 1.00 0.08 H new ATOM 0 HD13 LEU A 34 128.377 1.421 -3.672 1.00 0.08 H new ATOM 0 HD21 LEU A 34 127.667 4.385 -3.081 1.00 0.10 H new ATOM 0 HD22 LEU A 34 129.215 3.823 -3.755 1.00 0.10 H new ATOM 0 HD23 LEU A 34 128.265 5.055 -4.618 1.00 0.10 H new ATOM 517 N GLU A 35 128.236 2.565 -9.240 1.00 0.09 N ATOM 518 CA GLU A 35 128.959 2.226 -10.503 1.00 0.09 C ATOM 519 C GLU A 35 129.063 3.479 -11.378 1.00 0.10 C ATOM 520 O GLU A 35 130.093 3.761 -11.958 1.00 0.11 O ATOM 521 CB GLU A 35 128.181 1.129 -11.240 1.00 0.09 C ATOM 522 CG GLU A 35 128.906 0.742 -12.530 1.00 0.09 C ATOM 523 CD GLU A 35 128.170 -0.425 -13.191 1.00 0.09 C ATOM 524 OE1 GLU A 35 126.950 -0.395 -13.211 1.00 0.09 O ATOM 525 OE2 GLU A 35 128.837 -1.337 -13.652 1.00 0.09 O ATOM 0 H GLU A 35 127.376 2.040 -9.080 1.00 0.09 H new ATOM 0 HA GLU A 35 129.964 1.867 -10.278 1.00 0.09 H new ATOM 0 HB2 GLU A 35 128.075 0.255 -10.598 1.00 0.09 H new ATOM 0 HB3 GLU A 35 127.175 1.479 -11.471 1.00 0.09 H new ATOM 0 HG2 GLU A 35 128.945 1.594 -13.209 1.00 0.09 H new ATOM 0 HG3 GLU A 35 129.936 0.461 -12.312 1.00 0.09 H new ATOM 532 N GLU A 36 128.007 4.240 -11.462 1.00 0.11 N ATOM 533 CA GLU A 36 128.038 5.487 -12.279 1.00 0.12 C ATOM 534 C GLU A 36 128.981 6.487 -11.598 1.00 0.12 C ATOM 535 O GLU A 36 129.433 7.446 -12.192 1.00 0.13 O ATOM 536 CB GLU A 36 126.631 6.096 -12.392 1.00 0.13 C ATOM 537 CG GLU A 36 125.854 5.461 -13.568 1.00 1.13 C ATOM 538 CD GLU A 36 124.999 6.526 -14.262 1.00 1.68 C ATOM 539 OE1 GLU A 36 124.626 7.481 -13.602 1.00 2.09 O ATOM 540 OE2 GLU A 36 124.745 6.375 -15.446 1.00 2.46 O ATOM 0 H GLU A 36 127.119 4.051 -10.997 1.00 0.11 H new ATOM 0 HA GLU A 36 128.390 5.255 -13.284 1.00 0.12 H new ATOM 0 HB2 GLU A 36 126.085 5.938 -11.462 1.00 0.13 H new ATOM 0 HB3 GLU A 36 126.706 7.173 -12.539 1.00 0.13 H new ATOM 0 HG2 GLU A 36 126.551 5.021 -14.281 1.00 1.13 H new ATOM 0 HG3 GLU A 36 125.219 4.654 -13.203 1.00 1.13 H new ATOM 547 N ARG A 37 129.253 6.268 -10.344 1.00 0.12 N ATOM 548 CA ARG A 37 130.139 7.203 -9.592 1.00 0.12 C ATOM 549 C ARG A 37 131.601 6.750 -9.720 1.00 0.12 C ATOM 550 O ARG A 37 132.493 7.358 -9.161 1.00 0.12 O ATOM 551 CB ARG A 37 129.754 7.199 -8.113 1.00 0.12 C ATOM 552 CG ARG A 37 128.393 7.866 -7.918 1.00 0.16 C ATOM 553 CD ARG A 37 128.483 9.359 -8.247 1.00 0.33 C ATOM 554 NE ARG A 37 127.652 10.122 -7.275 1.00 1.29 N ATOM 555 CZ ARG A 37 127.784 11.415 -7.189 1.00 1.80 C ATOM 556 NH1 ARG A 37 128.540 12.048 -8.043 1.00 1.87 N ATOM 557 NH2 ARG A 37 127.148 12.077 -6.262 1.00 2.85 N ATOM 0 H ARG A 37 128.899 5.479 -9.803 1.00 0.12 H new ATOM 0 HA ARG A 37 130.024 8.205 -10.004 1.00 0.12 H new ATOM 0 HB2 ARG A 37 129.721 6.175 -7.741 1.00 0.12 H new ATOM 0 HB3 ARG A 37 130.511 7.725 -7.532 1.00 0.12 H new ATOM 0 HG2 ARG A 37 127.651 7.389 -8.559 1.00 0.16 H new ATOM 0 HG3 ARG A 37 128.059 7.732 -6.889 1.00 0.16 H new ATOM 0 HD2 ARG A 37 129.519 9.693 -8.199 1.00 0.33 H new ATOM 0 HD3 ARG A 37 128.136 9.542 -9.264 1.00 0.33 H new ATOM 0 HE ARG A 37 126.983 9.634 -6.679 1.00 1.29 H new ATOM 0 HH11 ARG A 37 129.026 11.530 -8.776 1.00 1.87 H new ATOM 0 HH12 ARG A 37 128.645 13.060 -7.978 1.00 1.87 H new ATOM 0 HH21 ARG A 37 126.547 11.582 -5.603 1.00 2.85 H new ATOM 0 HH22 ARG A 37 127.252 13.089 -6.196 1.00 2.85 H new ATOM 571 N GLY A 38 131.863 5.709 -10.480 1.00 0.11 N ATOM 572 CA GLY A 38 133.280 5.249 -10.673 1.00 0.11 C ATOM 573 C GLY A 38 133.596 4.035 -9.796 1.00 0.10 C ATOM 574 O GLY A 38 134.731 3.606 -9.720 1.00 0.10 O ATOM 0 H GLY A 38 131.159 5.160 -10.974 1.00 0.11 H new ATOM 0 HA2 GLY A 38 133.443 4.995 -11.721 1.00 0.11 H new ATOM 0 HA3 GLY A 38 133.964 6.062 -10.432 1.00 0.11 H new ATOM 578 N PHE A 39 132.619 3.469 -9.137 1.00 0.09 N ATOM 579 CA PHE A 39 132.873 2.272 -8.273 1.00 0.08 C ATOM 580 C PHE A 39 132.315 1.027 -8.967 1.00 0.08 C ATOM 581 O PHE A 39 131.279 0.510 -8.600 1.00 0.08 O ATOM 582 CB PHE A 39 132.152 2.460 -6.940 1.00 0.08 C ATOM 583 CG PHE A 39 132.774 3.602 -6.172 1.00 0.09 C ATOM 584 CD1 PHE A 39 132.360 4.914 -6.419 1.00 0.12 C ATOM 585 CD2 PHE A 39 133.756 3.349 -5.206 1.00 0.10 C ATOM 586 CE1 PHE A 39 132.926 5.976 -5.703 1.00 0.13 C ATOM 587 CE2 PHE A 39 134.324 4.410 -4.490 1.00 0.12 C ATOM 588 CZ PHE A 39 133.908 5.723 -4.739 1.00 0.13 C ATOM 0 H PHE A 39 131.649 3.785 -9.159 1.00 0.09 H new ATOM 0 HA PHE A 39 133.944 2.156 -8.106 1.00 0.08 H new ATOM 0 HB2 PHE A 39 131.095 2.661 -7.114 1.00 0.08 H new ATOM 0 HB3 PHE A 39 132.209 1.543 -6.354 1.00 0.08 H new ATOM 0 HD1 PHE A 39 131.602 5.109 -7.163 1.00 0.12 H new ATOM 0 HD2 PHE A 39 134.075 2.335 -5.013 1.00 0.10 H new ATOM 0 HE1 PHE A 39 132.605 6.989 -5.895 1.00 0.13 H new ATOM 0 HE2 PHE A 39 135.082 4.215 -3.746 1.00 0.12 H new ATOM 0 HZ PHE A 39 134.345 6.542 -4.187 1.00 0.13 H new ATOM 598 N ASP A 40 132.982 0.559 -9.986 1.00 0.08 N ATOM 599 CA ASP A 40 132.474 -0.634 -10.724 1.00 0.08 C ATOM 600 C ASP A 40 132.828 -1.922 -9.976 1.00 0.07 C ATOM 601 O ASP A 40 132.361 -2.990 -10.322 1.00 0.07 O ATOM 602 CB ASP A 40 133.110 -0.669 -12.115 1.00 0.09 C ATOM 603 CG ASP A 40 134.624 -0.838 -11.975 1.00 0.08 C ATOM 604 OD1 ASP A 40 135.137 -0.549 -10.906 1.00 0.08 O ATOM 605 OD2 ASP A 40 135.246 -1.253 -12.940 1.00 0.09 O ATOM 0 H ASP A 40 133.855 0.950 -10.340 1.00 0.08 H new ATOM 0 HA ASP A 40 131.389 -0.563 -10.805 1.00 0.08 H new ATOM 0 HB2 ASP A 40 132.693 -1.491 -12.697 1.00 0.09 H new ATOM 0 HB3 ASP A 40 132.884 0.251 -12.654 1.00 0.09 H new ATOM 610 N LYS A 41 133.658 -1.840 -8.964 1.00 0.07 N ATOM 611 CA LYS A 41 134.056 -3.068 -8.196 1.00 0.06 C ATOM 612 C LYS A 41 133.855 -2.812 -6.695 1.00 0.05 C ATOM 613 O LYS A 41 133.915 -1.690 -6.233 1.00 0.06 O ATOM 614 CB LYS A 41 135.537 -3.374 -8.468 1.00 0.06 C ATOM 615 CG LYS A 41 135.770 -3.661 -9.967 1.00 0.07 C ATOM 616 CD LYS A 41 135.087 -4.977 -10.379 1.00 0.07 C ATOM 617 CE LYS A 41 135.627 -5.464 -11.744 1.00 0.07 C ATOM 618 NZ LYS A 41 134.903 -6.701 -12.149 1.00 0.08 N ATOM 0 H LYS A 41 134.080 -0.972 -8.633 1.00 0.07 H new ATOM 0 HA LYS A 41 133.444 -3.914 -8.507 1.00 0.06 H new ATOM 0 HB2 LYS A 41 136.151 -2.530 -8.155 1.00 0.06 H new ATOM 0 HB3 LYS A 41 135.850 -4.233 -7.875 1.00 0.06 H new ATOM 0 HG2 LYS A 41 135.378 -2.839 -10.565 1.00 0.07 H new ATOM 0 HG3 LYS A 41 136.839 -3.721 -10.169 1.00 0.07 H new ATOM 0 HD2 LYS A 41 135.263 -5.738 -9.619 1.00 0.07 H new ATOM 0 HD3 LYS A 41 134.009 -4.830 -10.439 1.00 0.07 H new ATOM 0 HE2 LYS A 41 135.494 -4.688 -12.498 1.00 0.07 H new ATOM 0 HE3 LYS A 41 136.697 -5.661 -11.675 1.00 0.07 H new ATOM 0 HZ1 LYS A 41 135.265 -7.030 -13.067 1.00 0.08 H new ATOM 0 HZ2 LYS A 41 135.052 -7.440 -11.433 1.00 0.08 H new ATOM 0 HZ3 LYS A 41 133.886 -6.497 -12.230 1.00 0.08 H new ATOM 632 N ALA A 42 133.607 -3.846 -5.936 1.00 0.05 N ATOM 633 CA ALA A 42 133.390 -3.680 -4.465 1.00 0.05 C ATOM 634 C ALA A 42 134.666 -3.172 -3.780 1.00 0.05 C ATOM 635 O ALA A 42 134.611 -2.361 -2.878 1.00 0.05 O ATOM 636 CB ALA A 42 132.993 -5.032 -3.860 1.00 0.04 C ATOM 0 H ALA A 42 133.545 -4.807 -6.273 1.00 0.05 H new ATOM 0 HA ALA A 42 132.597 -2.949 -4.308 1.00 0.05 H new ATOM 0 HB1 ALA A 42 132.833 -4.918 -2.788 1.00 0.04 H new ATOM 0 HB2 ALA A 42 132.074 -5.384 -4.328 1.00 0.04 H new ATOM 0 HB3 ALA A 42 133.789 -5.756 -4.033 1.00 0.04 H new ATOM 642 N TYR A 43 135.805 -3.659 -4.172 1.00 0.04 N ATOM 643 CA TYR A 43 137.060 -3.220 -3.503 1.00 0.04 C ATOM 644 C TYR A 43 137.266 -1.700 -3.659 1.00 0.05 C ATOM 645 O TYR A 43 138.008 -1.097 -2.909 1.00 0.05 O ATOM 646 CB TYR A 43 138.255 -4.007 -4.054 1.00 0.04 C ATOM 647 CG TYR A 43 138.670 -3.483 -5.401 1.00 0.05 C ATOM 648 CD1 TYR A 43 139.416 -2.301 -5.477 1.00 0.05 C ATOM 649 CD2 TYR A 43 138.321 -4.177 -6.576 1.00 0.05 C ATOM 650 CE1 TYR A 43 139.815 -1.804 -6.720 1.00 0.06 C ATOM 651 CE2 TYR A 43 138.722 -3.679 -7.829 1.00 0.06 C ATOM 652 CZ TYR A 43 139.470 -2.489 -7.900 1.00 0.06 C ATOM 653 OH TYR A 43 139.865 -1.994 -9.127 1.00 0.07 O ATOM 0 H TYR A 43 135.924 -4.339 -4.923 1.00 0.04 H new ATOM 0 HA TYR A 43 136.978 -3.428 -2.436 1.00 0.04 H new ATOM 0 HB2 TYR A 43 139.092 -3.938 -3.359 1.00 0.04 H new ATOM 0 HB3 TYR A 43 137.994 -5.062 -4.135 1.00 0.04 H new ATOM 0 HD1 TYR A 43 139.683 -1.773 -4.574 1.00 0.05 H new ATOM 0 HD2 TYR A 43 137.747 -5.090 -6.515 1.00 0.05 H new ATOM 0 HE1 TYR A 43 140.390 -0.891 -6.776 1.00 0.06 H new ATOM 0 HE2 TYR A 43 138.457 -4.208 -8.733 1.00 0.06 H new ATOM 0 HH TYR A 43 139.545 -2.588 -9.838 1.00 0.07 H new ATOM 663 N VAL A 44 136.598 -1.066 -4.589 1.00 0.05 N ATOM 664 CA VAL A 44 136.757 0.420 -4.724 1.00 0.06 C ATOM 665 C VAL A 44 135.900 1.070 -3.635 1.00 0.06 C ATOM 666 O VAL A 44 136.217 2.111 -3.090 1.00 0.07 O ATOM 667 CB VAL A 44 136.262 0.908 -6.101 1.00 0.07 C ATOM 668 CG1 VAL A 44 136.522 2.430 -6.258 1.00 0.08 C ATOM 669 CG2 VAL A 44 136.964 0.128 -7.226 1.00 0.07 C ATOM 0 H VAL A 44 135.958 -1.502 -5.253 1.00 0.05 H new ATOM 0 HA VAL A 44 137.810 0.686 -4.627 1.00 0.06 H new ATOM 0 HB VAL A 44 135.189 0.729 -6.169 1.00 0.07 H new ATOM 0 HG11 VAL A 44 136.168 2.761 -7.234 1.00 0.08 H new ATOM 0 HG12 VAL A 44 135.990 2.972 -5.476 1.00 0.08 H new ATOM 0 HG13 VAL A 44 137.591 2.627 -6.174 1.00 0.08 H new ATOM 0 HG21 VAL A 44 136.606 0.482 -8.193 1.00 0.07 H new ATOM 0 HG22 VAL A 44 138.041 0.283 -7.159 1.00 0.07 H new ATOM 0 HG23 VAL A 44 136.744 -0.935 -7.124 1.00 0.07 H new ATOM 679 N VAL A 45 134.809 0.428 -3.325 1.00 0.06 N ATOM 680 CA VAL A 45 133.888 0.954 -2.281 1.00 0.07 C ATOM 681 C VAL A 45 134.502 0.684 -0.911 1.00 0.07 C ATOM 682 O VAL A 45 134.459 1.520 -0.031 1.00 0.07 O ATOM 683 CB VAL A 45 132.522 0.267 -2.379 1.00 0.07 C ATOM 684 CG1 VAL A 45 131.641 0.658 -1.158 1.00 0.07 C ATOM 685 CG2 VAL A 45 131.854 0.686 -3.699 1.00 0.07 C ATOM 0 H VAL A 45 134.513 -0.448 -3.755 1.00 0.06 H new ATOM 0 HA VAL A 45 133.746 2.025 -2.426 1.00 0.07 H new ATOM 0 HB VAL A 45 132.644 -0.816 -2.368 1.00 0.07 H new ATOM 0 HG11 VAL A 45 130.672 0.165 -1.236 1.00 0.07 H new ATOM 0 HG12 VAL A 45 132.135 0.345 -0.238 1.00 0.07 H new ATOM 0 HG13 VAL A 45 131.498 1.739 -1.143 1.00 0.07 H new ATOM 0 HG21 VAL A 45 130.880 0.204 -3.783 1.00 0.07 H new ATOM 0 HG22 VAL A 45 131.726 1.768 -3.715 1.00 0.07 H new ATOM 0 HG23 VAL A 45 132.482 0.383 -4.537 1.00 0.07 H new ATOM 695 N LEU A 46 135.101 -0.458 -0.722 1.00 0.06 N ATOM 696 CA LEU A 46 135.732 -0.725 0.593 1.00 0.06 C ATOM 697 C LEU A 46 136.792 0.353 0.808 1.00 0.06 C ATOM 698 O LEU A 46 137.022 0.805 1.909 1.00 0.07 O ATOM 699 CB LEU A 46 136.368 -2.135 0.612 1.00 0.05 C ATOM 700 CG LEU A 46 137.253 -2.351 1.866 1.00 0.05 C ATOM 701 CD1 LEU A 46 136.411 -2.399 3.148 1.00 0.06 C ATOM 702 CD2 LEU A 46 138.002 -3.678 1.739 1.00 0.05 C ATOM 0 H LEU A 46 135.179 -1.206 -1.411 1.00 0.06 H new ATOM 0 HA LEU A 46 134.991 -0.697 1.392 1.00 0.06 H new ATOM 0 HB2 LEU A 46 135.581 -2.889 0.588 1.00 0.05 H new ATOM 0 HB3 LEU A 46 136.970 -2.274 -0.286 1.00 0.05 H new ATOM 0 HG LEU A 46 137.948 -1.513 1.928 1.00 0.05 H new ATOM 0 HD11 LEU A 46 137.064 -2.552 4.007 1.00 0.06 H new ATOM 0 HD12 LEU A 46 135.872 -1.459 3.265 1.00 0.06 H new ATOM 0 HD13 LEU A 46 135.698 -3.221 3.084 1.00 0.06 H new ATOM 0 HD21 LEU A 46 138.625 -3.830 2.621 1.00 0.05 H new ATOM 0 HD22 LEU A 46 137.284 -4.494 1.656 1.00 0.05 H new ATOM 0 HD23 LEU A 46 138.632 -3.657 0.850 1.00 0.05 H new ATOM 714 N GLY A 47 137.437 0.765 -0.248 1.00 0.06 N ATOM 715 CA GLY A 47 138.484 1.812 -0.128 1.00 0.07 C ATOM 716 C GLY A 47 137.877 3.076 0.463 1.00 0.08 C ATOM 717 O GLY A 47 138.472 3.732 1.289 1.00 0.08 O ATOM 0 H GLY A 47 137.281 0.418 -1.194 1.00 0.06 H new ATOM 0 HA2 GLY A 47 139.297 1.457 0.505 1.00 0.07 H new ATOM 0 HA3 GLY A 47 138.913 2.026 -1.107 1.00 0.07 H new ATOM 721 N GLN A 48 136.694 3.424 0.049 1.00 0.08 N ATOM 722 CA GLN A 48 136.057 4.650 0.593 1.00 0.09 C ATOM 723 C GLN A 48 135.909 4.493 2.110 1.00 0.09 C ATOM 724 O GLN A 48 136.172 5.399 2.869 1.00 0.10 O ATOM 725 CB GLN A 48 134.672 4.808 -0.045 1.00 0.09 C ATOM 726 CG GLN A 48 133.998 6.090 0.450 1.00 0.15 C ATOM 727 CD GLN A 48 134.722 7.311 -0.122 1.00 1.15 C ATOM 728 OE1 GLN A 48 135.283 7.250 -1.198 1.00 1.90 O ATOM 729 NE2 GLN A 48 134.712 8.432 0.547 1.00 1.83 N ATOM 0 H GLN A 48 136.142 2.914 -0.641 1.00 0.08 H new ATOM 0 HA GLN A 48 136.664 5.528 0.372 1.00 0.09 H new ATOM 0 HB2 GLN A 48 134.766 4.835 -1.131 1.00 0.09 H new ATOM 0 HB3 GLN A 48 134.052 3.946 0.200 1.00 0.09 H new ATOM 0 HG2 GLN A 48 132.951 6.102 0.147 1.00 0.15 H new ATOM 0 HG3 GLN A 48 134.015 6.123 1.539 1.00 0.15 H new ATOM 0 HE21 GLN A 48 134.241 8.483 1.450 1.00 1.83 H new ATOM 0 HE22 GLN A 48 135.175 9.257 0.166 1.00 1.83 H new ATOM 738 N PHE A 49 135.504 3.334 2.549 1.00 0.09 N ATOM 739 CA PHE A 49 135.347 3.082 4.012 1.00 0.09 C ATOM 740 C PHE A 49 136.698 3.277 4.715 1.00 0.09 C ATOM 741 O PHE A 49 136.777 3.813 5.802 1.00 0.10 O ATOM 742 CB PHE A 49 134.860 1.643 4.197 1.00 0.09 C ATOM 743 CG PHE A 49 134.683 1.329 5.663 1.00 0.09 C ATOM 744 CD1 PHE A 49 133.584 1.853 6.370 1.00 0.10 C ATOM 745 CD2 PHE A 49 135.607 0.492 6.318 1.00 0.09 C ATOM 746 CE1 PHE A 49 133.408 1.540 7.731 1.00 0.11 C ATOM 747 CE2 PHE A 49 135.434 0.181 7.680 1.00 0.10 C ATOM 748 CZ PHE A 49 134.334 0.704 8.387 1.00 0.11 C ATOM 0 H PHE A 49 135.272 2.541 1.951 1.00 0.09 H new ATOM 0 HA PHE A 49 134.628 3.777 4.445 1.00 0.09 H new ATOM 0 HB2 PHE A 49 133.915 1.502 3.672 1.00 0.09 H new ATOM 0 HB3 PHE A 49 135.576 0.951 3.755 1.00 0.09 H new ATOM 0 HD1 PHE A 49 132.876 2.495 5.868 1.00 0.10 H new ATOM 0 HD2 PHE A 49 136.449 0.088 5.775 1.00 0.09 H new ATOM 0 HE1 PHE A 49 132.564 1.940 8.272 1.00 0.11 H new ATOM 0 HE2 PHE A 49 136.145 -0.458 8.183 1.00 0.10 H new ATOM 0 HZ PHE A 49 134.200 0.465 9.432 1.00 0.11 H new ATOM 758 N LEU A 50 137.746 2.833 4.100 1.00 0.09 N ATOM 759 CA LEU A 50 139.091 2.978 4.734 1.00 0.09 C ATOM 760 C LEU A 50 139.483 4.465 4.741 1.00 0.09 C ATOM 761 O LEU A 50 140.086 4.953 5.677 1.00 0.10 O ATOM 762 CB LEU A 50 140.120 2.158 3.951 1.00 0.08 C ATOM 763 CG LEU A 50 139.724 0.670 3.940 1.00 0.07 C ATOM 764 CD1 LEU A 50 140.727 -0.100 3.087 1.00 0.09 C ATOM 765 CD2 LEU A 50 139.734 0.075 5.354 1.00 0.14 C ATOM 0 H LEU A 50 137.739 2.376 3.188 1.00 0.09 H new ATOM 0 HA LEU A 50 139.062 2.610 5.760 1.00 0.09 H new ATOM 0 HB2 LEU A 50 140.189 2.530 2.929 1.00 0.08 H new ATOM 0 HB3 LEU A 50 141.106 2.275 4.400 1.00 0.08 H new ATOM 0 HG LEU A 50 138.715 0.589 3.535 1.00 0.07 H new ATOM 0 HD11 LEU A 50 140.457 -1.156 3.072 1.00 0.09 H new ATOM 0 HD12 LEU A 50 140.716 0.292 2.070 1.00 0.09 H new ATOM 0 HD13 LEU A 50 141.726 0.013 3.509 1.00 0.09 H new ATOM 0 HD21 LEU A 50 139.450 -0.976 5.308 1.00 0.14 H new ATOM 0 HD22 LEU A 50 140.734 0.162 5.778 1.00 0.14 H new ATOM 0 HD23 LEU A 50 139.025 0.616 5.981 1.00 0.14 H new ATOM 777 N VAL A 51 139.154 5.179 3.703 1.00 0.09 N ATOM 778 CA VAL A 51 139.504 6.634 3.632 1.00 0.10 C ATOM 779 C VAL A 51 138.721 7.411 4.703 1.00 0.11 C ATOM 780 O VAL A 51 139.159 8.437 5.185 1.00 0.12 O ATOM 781 CB VAL A 51 139.145 7.142 2.226 1.00 0.10 C ATOM 782 CG1 VAL A 51 139.417 8.644 2.094 1.00 0.19 C ATOM 783 CG2 VAL A 51 139.992 6.390 1.196 1.00 0.19 C ATOM 0 H VAL A 51 138.653 4.819 2.891 1.00 0.09 H new ATOM 0 HA VAL A 51 140.568 6.782 3.818 1.00 0.10 H new ATOM 0 HB VAL A 51 138.083 6.967 2.055 1.00 0.10 H new ATOM 0 HG11 VAL A 51 139.154 8.975 1.089 1.00 0.19 H new ATOM 0 HG12 VAL A 51 138.817 9.188 2.824 1.00 0.19 H new ATOM 0 HG13 VAL A 51 140.474 8.840 2.275 1.00 0.19 H new ATOM 0 HG21 VAL A 51 139.745 6.743 0.195 1.00 0.19 H new ATOM 0 HG22 VAL A 51 141.049 6.569 1.394 1.00 0.19 H new ATOM 0 HG23 VAL A 51 139.786 5.322 1.265 1.00 0.19 H new ATOM 793 N LEU A 52 137.563 6.936 5.070 1.00 0.11 N ATOM 794 CA LEU A 52 136.746 7.663 6.097 1.00 0.12 C ATOM 795 C LEU A 52 137.139 7.220 7.510 1.00 0.13 C ATOM 796 O LEU A 52 136.453 7.515 8.464 1.00 0.13 O ATOM 797 CB LEU A 52 135.262 7.390 5.868 1.00 0.12 C ATOM 798 CG LEU A 52 134.832 7.939 4.501 1.00 0.14 C ATOM 799 CD1 LEU A 52 133.374 7.566 4.273 1.00 0.16 C ATOM 800 CD2 LEU A 52 134.976 9.475 4.462 1.00 0.18 C ATOM 0 H LEU A 52 137.144 6.080 4.708 1.00 0.11 H new ATOM 0 HA LEU A 52 136.938 8.731 5.999 1.00 0.12 H new ATOM 0 HB2 LEU A 52 135.069 6.318 5.916 1.00 0.12 H new ATOM 0 HB3 LEU A 52 134.672 7.855 6.658 1.00 0.12 H new ATOM 0 HG LEU A 52 135.466 7.513 3.724 1.00 0.14 H new ATOM 0 HD11 LEU A 52 133.048 7.947 3.305 1.00 0.16 H new ATOM 0 HD12 LEU A 52 133.269 6.481 4.290 1.00 0.16 H new ATOM 0 HD13 LEU A 52 132.759 8.002 5.061 1.00 0.16 H new ATOM 0 HD21 LEU A 52 134.666 9.845 3.485 1.00 0.18 H new ATOM 0 HD22 LEU A 52 134.347 9.919 5.234 1.00 0.18 H new ATOM 0 HD23 LEU A 52 136.016 9.748 4.640 1.00 0.18 H new ATOM 812 N LYS A 53 138.229 6.534 7.668 1.00 0.12 N ATOM 813 CA LYS A 53 138.635 6.110 9.040 1.00 0.12 C ATOM 814 C LYS A 53 137.462 5.439 9.761 1.00 0.13 C ATOM 815 O LYS A 53 137.265 5.621 10.946 1.00 0.13 O ATOM 816 CB LYS A 53 139.032 7.329 9.877 1.00 0.13 C ATOM 817 CG LYS A 53 140.292 8.002 9.339 1.00 0.20 C ATOM 818 CD LYS A 53 140.579 9.229 10.212 1.00 0.22 C ATOM 819 CE LYS A 53 141.819 9.965 9.707 1.00 1.37 C ATOM 820 NZ LYS A 53 142.287 10.910 10.761 1.00 1.72 N ATOM 0 H LYS A 53 138.856 6.247 6.916 1.00 0.12 H new ATOM 0 HA LYS A 53 139.472 5.420 8.935 1.00 0.12 H new ATOM 0 HB2 LYS A 53 138.212 8.047 9.885 1.00 0.13 H new ATOM 0 HB3 LYS A 53 139.197 7.022 10.910 1.00 0.13 H new ATOM 0 HG2 LYS A 53 141.134 7.311 9.364 1.00 0.20 H new ATOM 0 HG3 LYS A 53 140.153 8.298 8.299 1.00 0.20 H new ATOM 0 HD2 LYS A 53 139.720 9.900 10.200 1.00 0.22 H new ATOM 0 HD3 LYS A 53 140.728 8.920 11.247 1.00 0.22 H new ATOM 0 HE2 LYS A 53 142.607 9.252 9.464 1.00 1.37 H new ATOM 0 HE3 LYS A 53 141.587 10.508 8.791 1.00 1.37 H new ATOM 0 HZ1 LYS A 53 143.131 11.415 10.424 1.00 1.72 H new ATOM 0 HZ2 LYS A 53 141.534 11.596 10.971 1.00 1.72 H new ATOM 0 HZ3 LYS A 53 142.522 10.379 11.624 1.00 1.72 H new ATOM 834 N LYS A 54 136.688 4.653 9.060 1.00 0.12 N ATOM 835 CA LYS A 54 135.532 3.951 9.690 1.00 0.12 C ATOM 836 C LYS A 54 134.589 4.969 10.341 1.00 0.13 C ATOM 837 O LYS A 54 133.791 4.609 11.183 1.00 0.14 O ATOM 838 CB LYS A 54 136.025 2.997 10.787 1.00 0.12 C ATOM 839 CG LYS A 54 137.246 2.200 10.316 1.00 0.12 C ATOM 840 CD LYS A 54 137.675 1.235 11.444 1.00 0.12 C ATOM 841 CE LYS A 54 139.141 0.778 11.275 1.00 0.11 C ATOM 842 NZ LYS A 54 139.177 -0.516 10.539 1.00 0.10 N ATOM 0 H LYS A 54 136.810 4.466 8.065 1.00 0.12 H new ATOM 0 HA LYS A 54 135.010 3.394 8.912 1.00 0.12 H new ATOM 0 HB2 LYS A 54 136.281 3.566 11.681 1.00 0.12 H new ATOM 0 HB3 LYS A 54 135.224 2.312 11.064 1.00 0.12 H new ATOM 0 HG2 LYS A 54 137.006 1.641 9.412 1.00 0.12 H new ATOM 0 HG3 LYS A 54 138.064 2.875 10.065 1.00 0.12 H new ATOM 0 HD2 LYS A 54 137.556 1.727 12.409 1.00 0.12 H new ATOM 0 HD3 LYS A 54 137.020 0.364 11.447 1.00 0.12 H new ATOM 0 HE2 LYS A 54 139.708 1.534 10.731 1.00 0.11 H new ATOM 0 HE3 LYS A 54 139.613 0.666 12.251 1.00 0.11 H new ATOM 0 HZ1 LYS A 54 140.164 -0.823 10.425 1.00 0.10 H new ATOM 0 HZ2 LYS A 54 138.650 -1.235 11.075 1.00 0.10 H new ATOM 0 HZ3 LYS A 54 138.742 -0.395 9.602 1.00 0.10 H new ATOM 856 N ASP A 55 134.641 6.221 9.977 1.00 0.14 N ATOM 857 CA ASP A 55 133.695 7.172 10.625 1.00 0.15 C ATOM 858 C ASP A 55 132.289 6.775 10.181 1.00 0.15 C ATOM 859 O ASP A 55 131.901 6.971 9.047 1.00 0.14 O ATOM 860 CB ASP A 55 134.040 8.606 10.225 1.00 0.15 C ATOM 861 CG ASP A 55 132.938 9.566 10.692 1.00 0.19 C ATOM 862 OD1 ASP A 55 131.777 9.201 10.607 1.00 0.80 O ATOM 863 OD2 ASP A 55 133.277 10.649 11.138 1.00 0.57 O ATOM 0 H ASP A 55 135.275 6.617 9.283 1.00 0.14 H new ATOM 0 HA ASP A 55 133.761 7.128 11.712 1.00 0.15 H new ATOM 0 HB2 ASP A 55 134.994 8.895 10.665 1.00 0.15 H new ATOM 0 HB3 ASP A 55 134.155 8.672 9.143 1.00 0.15 H new ATOM 868 N GLU A 56 131.540 6.193 11.067 1.00 0.15 N ATOM 869 CA GLU A 56 130.171 5.746 10.714 1.00 0.15 C ATOM 870 C GLU A 56 129.302 6.922 10.263 1.00 0.16 C ATOM 871 O GLU A 56 128.539 6.807 9.333 1.00 0.15 O ATOM 872 CB GLU A 56 129.536 5.077 11.934 1.00 0.15 C ATOM 873 CG GLU A 56 128.154 4.535 11.562 1.00 0.15 C ATOM 874 CD GLU A 56 127.575 3.759 12.747 1.00 0.16 C ATOM 875 OE1 GLU A 56 128.296 3.569 13.713 1.00 0.16 O ATOM 876 OE2 GLU A 56 126.423 3.366 12.667 1.00 0.16 O ATOM 0 H GLU A 56 131.820 6.006 12.030 1.00 0.15 H new ATOM 0 HA GLU A 56 130.238 5.040 9.887 1.00 0.15 H new ATOM 0 HB2 GLU A 56 130.172 4.266 12.289 1.00 0.15 H new ATOM 0 HB3 GLU A 56 129.449 5.794 12.750 1.00 0.15 H new ATOM 0 HG2 GLU A 56 127.490 5.356 11.292 1.00 0.15 H new ATOM 0 HG3 GLU A 56 128.229 3.886 10.690 1.00 0.15 H new ATOM 883 N ASP A 57 129.401 8.055 10.894 1.00 0.16 N ATOM 884 CA ASP A 57 128.548 9.199 10.459 1.00 0.17 C ATOM 885 C ASP A 57 129.011 9.707 9.095 1.00 0.17 C ATOM 886 O ASP A 57 128.205 10.022 8.245 1.00 0.17 O ATOM 887 CB ASP A 57 128.641 10.330 11.483 1.00 0.18 C ATOM 888 CG ASP A 57 127.932 9.914 12.772 1.00 0.19 C ATOM 889 OD1 ASP A 57 127.199 8.938 12.732 1.00 0.18 O ATOM 890 OD2 ASP A 57 128.131 10.577 13.775 1.00 0.19 O ATOM 0 H ASP A 57 130.024 8.241 11.680 1.00 0.16 H new ATOM 0 HA ASP A 57 127.514 8.861 10.383 1.00 0.17 H new ATOM 0 HB2 ASP A 57 129.686 10.562 11.689 1.00 0.18 H new ATOM 0 HB3 ASP A 57 128.186 11.236 11.082 1.00 0.18 H new ATOM 895 N LEU A 58 130.284 9.773 8.860 1.00 0.16 N ATOM 896 CA LEU A 58 130.737 10.249 7.523 1.00 0.16 C ATOM 897 C LEU A 58 130.414 9.183 6.474 1.00 0.15 C ATOM 898 O LEU A 58 129.990 9.488 5.376 1.00 0.15 O ATOM 899 CB LEU A 58 132.238 10.524 7.510 1.00 0.16 C ATOM 900 CG LEU A 58 132.557 11.757 8.362 1.00 0.17 C ATOM 901 CD1 LEU A 58 134.076 11.878 8.519 1.00 0.17 C ATOM 902 CD2 LEU A 58 132.001 13.024 7.683 1.00 0.23 C ATOM 0 H LEU A 58 131.022 9.524 9.518 1.00 0.16 H new ATOM 0 HA LEU A 58 130.216 11.179 7.297 1.00 0.16 H new ATOM 0 HB2 LEU A 58 132.777 9.658 7.894 1.00 0.16 H new ATOM 0 HB3 LEU A 58 132.577 10.682 6.486 1.00 0.16 H new ATOM 0 HG LEU A 58 132.093 11.651 9.343 1.00 0.17 H new ATOM 0 HD11 LEU A 58 134.311 12.754 9.124 1.00 0.17 H new ATOM 0 HD12 LEU A 58 134.464 10.984 9.008 1.00 0.17 H new ATOM 0 HD13 LEU A 58 134.536 11.982 7.536 1.00 0.17 H new ATOM 0 HD21 LEU A 58 132.232 13.896 8.295 1.00 0.23 H new ATOM 0 HD22 LEU A 58 132.457 13.140 6.700 1.00 0.23 H new ATOM 0 HD23 LEU A 58 130.920 12.934 7.573 1.00 0.23 H new ATOM 914 N PHE A 59 130.602 7.933 6.807 1.00 0.14 N ATOM 915 CA PHE A 59 130.295 6.849 5.831 1.00 0.13 C ATOM 916 C PHE A 59 128.809 6.845 5.486 1.00 0.13 C ATOM 917 O PHE A 59 128.434 6.806 4.331 1.00 0.13 O ATOM 918 CB PHE A 59 130.688 5.491 6.418 1.00 0.13 C ATOM 919 CG PHE A 59 130.318 4.398 5.441 1.00 0.12 C ATOM 920 CD1 PHE A 59 131.223 4.016 4.431 1.00 0.11 C ATOM 921 CD2 PHE A 59 129.066 3.760 5.542 1.00 0.12 C ATOM 922 CE1 PHE A 59 130.875 2.998 3.521 1.00 0.10 C ATOM 923 CE2 PHE A 59 128.719 2.741 4.632 1.00 0.11 C ATOM 924 CZ PHE A 59 129.623 2.361 3.622 1.00 0.10 C ATOM 0 H PHE A 59 130.954 7.617 7.711 1.00 0.14 H new ATOM 0 HA PHE A 59 130.868 7.031 4.922 1.00 0.13 H new ATOM 0 HB2 PHE A 59 131.759 5.466 6.621 1.00 0.13 H new ATOM 0 HB3 PHE A 59 130.179 5.332 7.369 1.00 0.13 H new ATOM 0 HD1 PHE A 59 132.184 4.504 4.354 1.00 0.11 H new ATOM 0 HD2 PHE A 59 128.372 4.052 6.317 1.00 0.12 H new ATOM 0 HE1 PHE A 59 131.568 2.706 2.746 1.00 0.10 H new ATOM 0 HE2 PHE A 59 127.759 2.252 4.710 1.00 0.11 H new ATOM 0 HZ PHE A 59 129.356 1.581 2.924 1.00 0.10 H new ATOM 934 N ARG A 60 127.953 6.862 6.473 1.00 0.14 N ATOM 935 CA ARG A 60 126.500 6.830 6.168 1.00 0.14 C ATOM 936 C ARG A 60 126.104 8.084 5.389 1.00 0.15 C ATOM 937 O ARG A 60 125.343 8.014 4.445 1.00 0.15 O ATOM 938 CB ARG A 60 125.689 6.723 7.469 1.00 0.15 C ATOM 939 CG ARG A 60 126.004 5.378 8.142 1.00 0.15 C ATOM 940 CD ARG A 60 124.991 5.058 9.238 1.00 0.15 C ATOM 941 NE ARG A 60 124.934 6.214 10.186 1.00 0.16 N ATOM 942 CZ ARG A 60 124.277 6.116 11.307 1.00 0.17 C ATOM 943 NH1 ARG A 60 123.819 4.956 11.689 1.00 0.17 N ATOM 944 NH2 ARG A 60 124.117 7.166 12.066 1.00 0.18 N ATOM 0 H ARG A 60 128.196 6.896 7.463 1.00 0.14 H new ATOM 0 HA ARG A 60 126.283 5.956 5.554 1.00 0.14 H new ATOM 0 HB2 ARG A 60 125.939 7.547 8.138 1.00 0.15 H new ATOM 0 HB3 ARG A 60 124.623 6.797 7.256 1.00 0.15 H new ATOM 0 HG2 ARG A 60 125.998 4.584 7.395 1.00 0.15 H new ATOM 0 HG3 ARG A 60 127.007 5.408 8.568 1.00 0.15 H new ATOM 0 HD2 ARG A 60 124.008 4.876 8.803 1.00 0.15 H new ATOM 0 HD3 ARG A 60 125.279 4.149 9.766 1.00 0.15 H new ATOM 0 HE ARG A 60 125.412 7.084 9.953 1.00 0.16 H new ATOM 0 HH11 ARG A 60 123.976 4.130 11.111 1.00 0.17 H new ATOM 0 HH12 ARG A 60 123.304 4.875 12.566 1.00 0.17 H new ATOM 0 HH21 ARG A 60 124.507 8.065 11.782 1.00 0.18 H new ATOM 0 HH22 ARG A 60 123.602 7.088 12.943 1.00 0.18 H new ATOM 958 N GLU A 61 126.617 9.232 5.748 1.00 0.16 N ATOM 959 CA GLU A 61 126.259 10.458 4.985 1.00 0.16 C ATOM 960 C GLU A 61 126.817 10.314 3.559 1.00 0.15 C ATOM 961 O GLU A 61 126.181 10.687 2.596 1.00 0.16 O ATOM 962 CB GLU A 61 126.826 11.708 5.675 1.00 0.17 C ATOM 963 CG GLU A 61 125.744 12.301 6.597 1.00 1.07 C ATOM 964 CD GLU A 61 126.237 13.604 7.215 1.00 1.63 C ATOM 965 OE1 GLU A 61 127.389 13.925 7.015 1.00 2.03 O ATOM 966 OE2 GLU A 61 125.446 14.266 7.870 1.00 2.39 O ATOM 0 H GLU A 61 127.260 9.371 6.527 1.00 0.16 H new ATOM 0 HA GLU A 61 125.176 10.574 4.946 1.00 0.16 H new ATOM 0 HB2 GLU A 61 127.714 11.450 6.252 1.00 0.17 H new ATOM 0 HB3 GLU A 61 127.132 12.443 4.931 1.00 0.17 H new ATOM 0 HG2 GLU A 61 124.831 12.482 6.030 1.00 1.07 H new ATOM 0 HG3 GLU A 61 125.495 11.588 7.383 1.00 1.07 H new ATOM 973 N TRP A 62 128.002 9.784 3.420 1.00 0.15 N ATOM 974 CA TRP A 62 128.592 9.630 2.058 1.00 0.14 C ATOM 975 C TRP A 62 127.774 8.655 1.206 1.00 0.14 C ATOM 976 O TRP A 62 127.420 8.947 0.084 1.00 0.14 O ATOM 977 CB TRP A 62 130.024 9.104 2.157 1.00 0.14 C ATOM 978 CG TRP A 62 130.586 9.029 0.774 1.00 0.18 C ATOM 979 CD1 TRP A 62 131.192 10.051 0.129 1.00 0.27 C ATOM 980 CD2 TRP A 62 130.588 7.903 -0.152 1.00 0.27 C ATOM 981 NE1 TRP A 62 131.563 9.628 -1.134 1.00 0.36 N ATOM 982 CE2 TRP A 62 131.214 8.310 -1.354 1.00 0.36 C ATOM 983 CE3 TRP A 62 130.113 6.582 -0.066 1.00 0.33 C ATOM 984 CZ2 TRP A 62 131.364 7.437 -2.433 1.00 0.48 C ATOM 985 CZ3 TRP A 62 130.260 5.702 -1.151 1.00 0.45 C ATOM 986 CH2 TRP A 62 130.884 6.129 -2.331 1.00 0.51 C ATOM 0 H TRP A 62 128.586 9.452 4.187 1.00 0.15 H new ATOM 0 HA TRP A 62 128.584 10.613 1.586 1.00 0.14 H new ATOM 0 HB2 TRP A 62 130.630 9.763 2.779 1.00 0.14 H new ATOM 0 HB3 TRP A 62 130.037 8.121 2.627 1.00 0.14 H new ATOM 0 HD1 TRP A 62 131.359 11.038 0.535 1.00 0.27 H new ATOM 0 HE1 TRP A 62 132.036 10.217 -1.819 1.00 0.36 H new ATOM 0 HE3 TRP A 62 129.632 6.242 0.840 1.00 0.33 H new ATOM 0 HZ2 TRP A 62 131.847 7.770 -3.340 1.00 0.48 H new ATOM 0 HZ3 TRP A 62 129.890 4.690 -1.075 1.00 0.45 H new ATOM 0 HH2 TRP A 62 130.994 5.447 -3.161 1.00 0.51 H new ATOM 997 N LEU A 63 127.479 7.501 1.724 1.00 0.13 N ATOM 998 CA LEU A 63 126.700 6.511 0.928 1.00 0.12 C ATOM 999 C LEU A 63 125.299 7.058 0.657 1.00 0.13 C ATOM 1000 O LEU A 63 124.801 7.003 -0.449 1.00 0.13 O ATOM 1001 CB LEU A 63 126.608 5.200 1.718 1.00 0.12 C ATOM 1002 CG LEU A 63 125.945 4.099 0.873 1.00 0.11 C ATOM 1003 CD1 LEU A 63 126.802 3.781 -0.361 1.00 0.10 C ATOM 1004 CD2 LEU A 63 125.778 2.834 1.727 1.00 0.11 C ATOM 0 H LEU A 63 127.741 7.197 2.662 1.00 0.13 H new ATOM 0 HA LEU A 63 127.196 6.328 -0.025 1.00 0.12 H new ATOM 0 HB2 LEU A 63 127.606 4.882 2.020 1.00 0.12 H new ATOM 0 HB3 LEU A 63 126.034 5.360 2.631 1.00 0.12 H new ATOM 0 HG LEU A 63 124.968 4.449 0.538 1.00 0.11 H new ATOM 0 HD11 LEU A 63 126.319 3.000 -0.948 1.00 0.10 H new ATOM 0 HD12 LEU A 63 126.910 4.678 -0.970 1.00 0.10 H new ATOM 0 HD13 LEU A 63 127.786 3.438 -0.042 1.00 0.10 H new ATOM 0 HD21 LEU A 63 125.308 2.052 1.131 1.00 0.11 H new ATOM 0 HD22 LEU A 63 126.756 2.493 2.067 1.00 0.11 H new ATOM 0 HD23 LEU A 63 125.151 3.058 2.590 1.00 0.11 H new ATOM 1016 N LYS A 64 124.667 7.585 1.660 1.00 0.14 N ATOM 1017 CA LYS A 64 123.302 8.145 1.474 1.00 0.14 C ATOM 1018 C LYS A 64 123.350 9.323 0.503 1.00 0.15 C ATOM 1019 O LYS A 64 122.579 9.409 -0.433 1.00 0.15 O ATOM 1020 CB LYS A 64 122.752 8.611 2.823 1.00 0.15 C ATOM 1021 CG LYS A 64 122.450 7.397 3.705 1.00 0.15 C ATOM 1022 CD LYS A 64 121.466 7.800 4.805 1.00 0.16 C ATOM 1023 CE LYS A 64 122.134 8.781 5.783 1.00 0.16 C ATOM 1024 NZ LYS A 64 121.155 9.163 6.838 1.00 0.17 N ATOM 0 H LYS A 64 125.037 7.654 2.608 1.00 0.14 H new ATOM 0 HA LYS A 64 122.651 7.373 1.064 1.00 0.14 H new ATOM 0 HB2 LYS A 64 123.475 9.260 3.317 1.00 0.15 H new ATOM 0 HB3 LYS A 64 121.846 9.198 2.674 1.00 0.15 H new ATOM 0 HG2 LYS A 64 122.029 6.592 3.103 1.00 0.15 H new ATOM 0 HG3 LYS A 64 123.371 7.017 4.147 1.00 0.15 H new ATOM 0 HD2 LYS A 64 120.583 8.261 4.362 1.00 0.16 H new ATOM 0 HD3 LYS A 64 121.127 6.914 5.342 1.00 0.16 H new ATOM 0 HE2 LYS A 64 123.013 8.321 6.235 1.00 0.16 H new ATOM 0 HE3 LYS A 64 122.477 9.668 5.250 1.00 0.16 H new ATOM 0 HZ1 LYS A 64 121.602 9.827 7.502 1.00 0.17 H new ATOM 0 HZ2 LYS A 64 120.330 9.617 6.398 1.00 0.17 H new ATOM 0 HZ3 LYS A 64 120.849 8.312 7.352 1.00 0.17 H new ATOM 1038 N ASP A 65 124.245 10.241 0.734 1.00 0.15 N ATOM 1039 CA ASP A 65 124.346 11.432 -0.153 1.00 0.16 C ATOM 1040 C ASP A 65 124.810 10.999 -1.544 1.00 0.15 C ATOM 1041 O ASP A 65 124.489 11.621 -2.536 1.00 0.16 O ATOM 1042 CB ASP A 65 125.336 12.467 0.438 1.00 0.17 C ATOM 1043 CG ASP A 65 124.796 13.901 0.296 1.00 1.10 C ATOM 1044 OD1 ASP A 65 123.604 14.061 0.086 1.00 1.71 O ATOM 1045 OD2 ASP A 65 125.588 14.820 0.425 1.00 1.57 O ATOM 0 H ASP A 65 124.914 10.217 1.503 1.00 0.15 H new ATOM 0 HA ASP A 65 123.364 11.898 -0.229 1.00 0.16 H new ATOM 0 HB2 ASP A 65 125.512 12.245 1.490 1.00 0.17 H new ATOM 0 HB3 ASP A 65 126.297 12.386 -0.070 1.00 0.17 H new ATOM 1050 N THR A 66 125.590 9.955 -1.623 1.00 0.14 N ATOM 1051 CA THR A 66 126.105 9.503 -2.946 1.00 0.14 C ATOM 1052 C THR A 66 125.032 8.726 -3.719 1.00 0.14 C ATOM 1053 O THR A 66 124.970 8.827 -4.929 1.00 0.14 O ATOM 1054 CB THR A 66 127.340 8.610 -2.724 1.00 0.13 C ATOM 1055 OG1 THR A 66 128.323 9.357 -2.021 1.00 0.13 O ATOM 1056 CG2 THR A 66 127.949 8.139 -4.065 1.00 0.13 C ATOM 0 H THR A 66 125.893 9.395 -0.826 1.00 0.14 H new ATOM 0 HA THR A 66 126.377 10.378 -3.536 1.00 0.14 H new ATOM 0 HB THR A 66 127.029 7.732 -2.158 1.00 0.13 H new ATOM 0 HG1 THR A 66 128.027 9.501 -1.098 1.00 0.13 H new ATOM 0 HG21 THR A 66 128.818 7.511 -3.869 1.00 0.13 H new ATOM 0 HG22 THR A 66 127.206 7.567 -4.621 1.00 0.13 H new ATOM 0 HG23 THR A 66 128.252 9.006 -4.651 1.00 0.13 H new ATOM 1064 N CYS A 67 124.218 7.917 -3.072 1.00 0.13 N ATOM 1065 CA CYS A 67 123.200 7.105 -3.825 1.00 0.13 C ATOM 1066 C CYS A 67 121.786 7.290 -3.270 1.00 0.13 C ATOM 1067 O CYS A 67 120.813 7.123 -3.979 1.00 0.13 O ATOM 1068 CB CYS A 67 123.580 5.629 -3.714 1.00 0.12 C ATOM 1069 SG CYS A 67 123.351 5.074 -2.007 1.00 0.12 S ATOM 0 H CYS A 67 124.214 7.784 -2.061 1.00 0.13 H new ATOM 0 HA CYS A 67 123.198 7.443 -4.861 1.00 0.13 H new ATOM 0 HB2 CYS A 67 122.965 5.032 -4.387 1.00 0.12 H new ATOM 0 HB3 CYS A 67 124.617 5.485 -4.018 1.00 0.12 H new ATOM 0 HG CYS A 67 123.749 6.005 -1.191 1.00 0.12 H new ATOM 1075 N GLY A 68 121.658 7.615 -2.010 1.00 0.14 N ATOM 1076 CA GLY A 68 120.298 7.793 -1.405 1.00 0.14 C ATOM 1077 C GLY A 68 119.962 6.568 -0.551 1.00 0.14 C ATOM 1078 O GLY A 68 118.831 6.372 -0.153 1.00 0.14 O ATOM 0 H GLY A 68 122.437 7.766 -1.369 1.00 0.14 H new ATOM 0 HA2 GLY A 68 120.274 8.695 -0.793 1.00 0.14 H new ATOM 0 HA3 GLY A 68 119.552 7.920 -2.189 1.00 0.14 H new ATOM 1082 N ALA A 69 120.933 5.745 -0.253 1.00 0.13 N ATOM 1083 CA ALA A 69 120.654 4.544 0.587 1.00 0.13 C ATOM 1084 C ALA A 69 119.909 4.982 1.845 1.00 0.13 C ATOM 1085 O ALA A 69 120.006 6.115 2.270 1.00 0.14 O ATOM 1086 CB ALA A 69 121.969 3.878 0.990 1.00 0.12 C ATOM 0 H ALA A 69 121.902 5.852 -0.553 1.00 0.13 H new ATOM 0 HA ALA A 69 120.050 3.836 0.020 1.00 0.13 H new ATOM 0 HB1 ALA A 69 121.760 3.001 1.603 1.00 0.12 H new ATOM 0 HB2 ALA A 69 122.512 3.574 0.095 1.00 0.12 H new ATOM 0 HB3 ALA A 69 122.574 4.583 1.559 1.00 0.12 H new ATOM 1092 N ASN A 70 119.166 4.098 2.445 1.00 0.13 N ATOM 1093 CA ASN A 70 118.413 4.473 3.674 1.00 0.14 C ATOM 1094 C ASN A 70 119.287 4.238 4.901 1.00 0.14 C ATOM 1095 O ASN A 70 120.307 3.579 4.838 1.00 0.14 O ATOM 1096 CB ASN A 70 117.159 3.604 3.782 1.00 0.14 C ATOM 1097 CG ASN A 70 116.166 4.004 2.690 1.00 0.14 C ATOM 1098 OD1 ASN A 70 116.558 4.321 1.584 1.00 0.14 O ATOM 1099 ND2 ASN A 70 114.890 4.005 2.955 1.00 0.15 N ATOM 0 H ASN A 70 119.047 3.132 2.139 1.00 0.13 H new ATOM 0 HA ASN A 70 118.133 5.525 3.620 1.00 0.14 H new ATOM 0 HB2 ASN A 70 117.423 2.551 3.680 1.00 0.14 H new ATOM 0 HB3 ASN A 70 116.703 3.725 4.765 1.00 0.14 H new ATOM 0 HD21 ASN A 70 114.220 4.272 2.234 1.00 0.15 H new ATOM 0 HD22 ASN A 70 114.562 3.739 3.883 1.00 0.15 H new ATOM 1106 N ALA A 71 118.889 4.764 6.022 1.00 0.15 N ATOM 1107 CA ALA A 71 119.684 4.566 7.261 1.00 0.16 C ATOM 1108 C ALA A 71 119.872 3.068 7.476 1.00 0.15 C ATOM 1109 O ALA A 71 120.857 2.624 8.016 1.00 0.15 O ATOM 1110 CB ALA A 71 118.915 5.160 8.450 1.00 0.17 C ATOM 0 H ALA A 71 118.044 5.325 6.134 1.00 0.15 H new ATOM 0 HA ALA A 71 120.653 5.057 7.175 1.00 0.16 H new ATOM 0 HB1 ALA A 71 119.492 5.019 9.364 1.00 0.17 H new ATOM 0 HB2 ALA A 71 118.754 6.225 8.284 1.00 0.17 H new ATOM 0 HB3 ALA A 71 117.952 4.658 8.548 1.00 0.17 H new ATOM 1116 N LYS A 72 118.901 2.302 7.086 1.00 0.15 N ATOM 1117 CA LYS A 72 118.936 0.827 7.285 1.00 0.14 C ATOM 1118 C LYS A 72 119.979 0.148 6.383 1.00 0.13 C ATOM 1119 O LYS A 72 120.757 -0.681 6.825 1.00 0.13 O ATOM 1120 CB LYS A 72 117.537 0.339 6.919 1.00 0.14 C ATOM 1121 CG LYS A 72 117.302 -1.109 7.340 1.00 0.14 C ATOM 1122 CD LYS A 72 115.807 -1.405 7.157 1.00 0.14 C ATOM 1123 CE LYS A 72 115.499 -2.893 7.381 1.00 0.14 C ATOM 1124 NZ LYS A 72 114.194 -3.006 8.093 1.00 0.15 N ATOM 0 H LYS A 72 118.058 2.644 6.624 1.00 0.15 H new ATOM 0 HA LYS A 72 119.215 0.582 8.310 1.00 0.14 H new ATOM 0 HB2 LYS A 72 116.795 0.979 7.396 1.00 0.14 H new ATOM 0 HB3 LYS A 72 117.392 0.430 5.843 1.00 0.14 H new ATOM 0 HG2 LYS A 72 117.904 -1.787 6.735 1.00 0.14 H new ATOM 0 HG3 LYS A 72 117.599 -1.260 8.378 1.00 0.14 H new ATOM 0 HD2 LYS A 72 115.227 -0.803 7.856 1.00 0.14 H new ATOM 0 HD3 LYS A 72 115.497 -1.115 6.153 1.00 0.14 H new ATOM 0 HE2 LYS A 72 115.456 -3.418 6.427 1.00 0.14 H new ATOM 0 HE3 LYS A 72 116.291 -3.359 7.967 1.00 0.14 H new ATOM 0 HZ1 LYS A 72 113.971 -4.009 8.252 1.00 0.15 H new ATOM 0 HZ2 LYS A 72 114.254 -2.515 9.008 1.00 0.15 H new ATOM 0 HZ3 LYS A 72 113.445 -2.572 7.516 1.00 0.15 H new ATOM 1138 N GLN A 73 119.975 0.458 5.118 1.00 0.13 N ATOM 1139 CA GLN A 73 120.927 -0.205 4.184 1.00 0.12 C ATOM 1140 C GLN A 73 122.359 0.217 4.480 1.00 0.12 C ATOM 1141 O GLN A 73 123.292 -0.533 4.268 1.00 0.11 O ATOM 1142 CB GLN A 73 120.556 0.157 2.746 1.00 0.11 C ATOM 1143 CG GLN A 73 119.100 -0.260 2.494 1.00 0.11 C ATOM 1144 CD GLN A 73 118.837 -0.384 0.996 1.00 0.11 C ATOM 1145 OE1 GLN A 73 119.049 0.546 0.245 1.00 0.11 O ATOM 1146 NE2 GLN A 73 118.376 -1.513 0.530 1.00 0.10 N ATOM 0 H GLN A 73 119.353 1.143 4.689 1.00 0.13 H new ATOM 0 HA GLN A 73 120.861 -1.285 4.318 1.00 0.12 H new ATOM 0 HB2 GLN A 73 120.676 1.228 2.583 1.00 0.11 H new ATOM 0 HB3 GLN A 73 121.221 -0.349 2.045 1.00 0.11 H new ATOM 0 HG2 GLN A 73 118.897 -1.211 2.986 1.00 0.11 H new ATOM 0 HG3 GLN A 73 118.423 0.475 2.929 1.00 0.11 H new ATOM 0 HE21 GLN A 73 118.199 -2.292 1.164 1.00 0.10 H new ATOM 0 HE22 GLN A 73 118.193 -1.616 -0.468 1.00 0.10 H new ATOM 1155 N SER A 74 122.550 1.401 4.972 1.00 0.12 N ATOM 1156 CA SER A 74 123.929 1.836 5.276 1.00 0.12 C ATOM 1157 C SER A 74 124.455 1.045 6.482 1.00 0.12 C ATOM 1158 O SER A 74 125.623 0.718 6.548 1.00 0.12 O ATOM 1159 CB SER A 74 123.944 3.336 5.557 1.00 0.13 C ATOM 1160 OG SER A 74 123.253 3.604 6.769 1.00 0.14 O ATOM 0 H SER A 74 121.817 2.081 5.175 1.00 0.12 H new ATOM 0 HA SER A 74 124.578 1.642 4.422 1.00 0.12 H new ATOM 0 HB2 SER A 74 124.972 3.692 5.627 1.00 0.13 H new ATOM 0 HB3 SER A 74 123.475 3.875 4.733 1.00 0.13 H new ATOM 0 HG SER A 74 122.469 3.019 6.835 1.00 0.14 H new ATOM 1166 N ARG A 75 123.607 0.716 7.434 1.00 0.13 N ATOM 1167 CA ARG A 75 124.088 -0.071 8.611 1.00 0.13 C ATOM 1168 C ARG A 75 124.643 -1.404 8.132 1.00 0.12 C ATOM 1169 O ARG A 75 125.624 -1.897 8.655 1.00 0.12 O ATOM 1170 CB ARG A 75 122.950 -0.344 9.596 1.00 0.14 C ATOM 1171 CG ARG A 75 122.561 0.943 10.320 1.00 0.15 C ATOM 1172 CD ARG A 75 121.750 0.601 11.562 1.00 0.16 C ATOM 1173 NE ARG A 75 121.346 1.900 12.191 1.00 0.17 N ATOM 1174 CZ ARG A 75 121.071 1.987 13.453 1.00 0.17 C ATOM 1175 NH1 ARG A 75 121.285 0.966 14.237 1.00 0.18 N ATOM 1176 NH2 ARG A 75 120.619 3.106 13.946 1.00 0.18 N ATOM 0 H ARG A 75 122.616 0.957 7.444 1.00 0.13 H new ATOM 0 HA ARG A 75 124.860 0.511 9.115 1.00 0.13 H new ATOM 0 HB2 ARG A 75 122.087 -0.746 9.064 1.00 0.14 H new ATOM 0 HB3 ARG A 75 123.258 -1.098 10.320 1.00 0.14 H new ATOM 0 HG2 ARG A 75 123.455 1.501 10.599 1.00 0.15 H new ATOM 0 HG3 ARG A 75 121.979 1.584 9.658 1.00 0.15 H new ATOM 0 HD2 ARG A 75 120.873 0.010 11.299 1.00 0.16 H new ATOM 0 HD3 ARG A 75 122.341 0.003 12.256 1.00 0.16 H new ATOM 0 HE ARG A 75 121.286 2.736 11.610 1.00 0.17 H new ATOM 0 HH11 ARG A 75 121.668 0.101 13.855 1.00 0.18 H new ATOM 0 HH12 ARG A 75 121.069 1.033 15.232 1.00 0.18 H new ATOM 0 HH21 ARG A 75 120.482 3.913 13.337 1.00 0.18 H new ATOM 0 HH22 ARG A 75 120.402 3.175 14.940 1.00 0.18 H new ATOM 1190 N ASP A 76 124.024 -2.015 7.163 1.00 0.12 N ATOM 1191 CA ASP A 76 124.511 -3.332 6.682 1.00 0.11 C ATOM 1192 C ASP A 76 125.871 -3.161 6.016 1.00 0.10 C ATOM 1193 O ASP A 76 126.752 -3.980 6.182 1.00 0.10 O ATOM 1194 CB ASP A 76 123.511 -3.909 5.678 1.00 0.11 C ATOM 1195 CG ASP A 76 122.233 -4.318 6.412 1.00 0.11 C ATOM 1196 OD1 ASP A 76 122.299 -4.503 7.616 1.00 0.12 O ATOM 1197 OD2 ASP A 76 121.210 -4.438 5.758 1.00 0.11 O ATOM 0 H ASP A 76 123.199 -1.656 6.683 1.00 0.12 H new ATOM 0 HA ASP A 76 124.609 -4.015 7.526 1.00 0.11 H new ATOM 0 HB2 ASP A 76 123.282 -3.170 4.910 1.00 0.11 H new ATOM 0 HB3 ASP A 76 123.944 -4.771 5.171 1.00 0.11 H new ATOM 1202 N CYS A 77 126.069 -2.102 5.284 1.00 0.10 N ATOM 1203 CA CYS A 77 127.390 -1.895 4.640 1.00 0.09 C ATOM 1204 C CYS A 77 128.440 -1.571 5.707 1.00 0.10 C ATOM 1205 O CYS A 77 129.563 -2.025 5.638 1.00 0.09 O ATOM 1206 CB CYS A 77 127.292 -0.728 3.658 1.00 0.09 C ATOM 1207 SG CYS A 77 126.280 -1.220 2.243 1.00 0.09 S ATOM 0 H CYS A 77 125.376 -1.375 5.105 1.00 0.10 H new ATOM 0 HA CYS A 77 127.682 -2.802 4.110 1.00 0.09 H new ATOM 0 HB2 CYS A 77 126.852 0.140 4.150 1.00 0.09 H new ATOM 0 HB3 CYS A 77 128.287 -0.435 3.323 1.00 0.09 H new ATOM 0 HG CYS A 77 126.343 -2.510 2.092 1.00 0.09 H new ATOM 1213 N PHE A 78 128.098 -0.782 6.690 1.00 0.11 N ATOM 1214 CA PHE A 78 129.109 -0.440 7.728 1.00 0.11 C ATOM 1215 C PHE A 78 129.597 -1.714 8.414 1.00 0.11 C ATOM 1216 O PHE A 78 130.767 -2.041 8.379 1.00 0.11 O ATOM 1217 CB PHE A 78 128.473 0.491 8.765 1.00 0.12 C ATOM 1218 CG PHE A 78 129.487 0.835 9.828 1.00 0.13 C ATOM 1219 CD1 PHE A 78 130.315 1.964 9.673 1.00 0.13 C ATOM 1220 CD2 PHE A 78 129.599 0.033 10.980 1.00 0.13 C ATOM 1221 CE1 PHE A 78 131.257 2.288 10.667 1.00 0.13 C ATOM 1222 CE2 PHE A 78 130.542 0.357 11.976 1.00 0.14 C ATOM 1223 CZ PHE A 78 131.370 1.485 11.819 1.00 0.14 C ATOM 0 H PHE A 78 127.176 -0.365 6.818 1.00 0.11 H new ATOM 0 HA PHE A 78 129.957 0.059 7.259 1.00 0.11 H new ATOM 0 HB2 PHE A 78 128.116 1.400 8.281 1.00 0.12 H new ATOM 0 HB3 PHE A 78 127.606 0.009 9.218 1.00 0.12 H new ATOM 0 HD1 PHE A 78 130.227 2.581 8.791 1.00 0.13 H new ATOM 0 HD2 PHE A 78 128.962 -0.831 11.100 1.00 0.13 H new ATOM 0 HE1 PHE A 78 131.893 3.152 10.547 1.00 0.13 H new ATOM 0 HE2 PHE A 78 130.629 -0.259 12.859 1.00 0.14 H new ATOM 0 HZ PHE A 78 132.092 1.735 12.582 1.00 0.14 H new ATOM 1233 N GLY A 79 128.712 -2.428 9.048 1.00 0.12 N ATOM 1234 CA GLY A 79 129.120 -3.676 9.748 1.00 0.12 C ATOM 1235 C GLY A 79 129.645 -4.706 8.744 1.00 0.11 C ATOM 1236 O GLY A 79 130.545 -5.462 9.032 1.00 0.11 O ATOM 0 H GLY A 79 127.720 -2.200 9.112 1.00 0.12 H new ATOM 0 HA2 GLY A 79 129.891 -3.451 10.485 1.00 0.12 H new ATOM 0 HA3 GLY A 79 128.271 -4.089 10.292 1.00 0.12 H new ATOM 1240 N CYS A 80 129.106 -4.736 7.562 1.00 0.10 N ATOM 1241 CA CYS A 80 129.601 -5.723 6.562 1.00 0.09 C ATOM 1242 C CYS A 80 131.012 -5.348 6.114 1.00 0.09 C ATOM 1243 O CYS A 80 131.907 -6.169 6.105 1.00 0.09 O ATOM 1244 CB CYS A 80 128.667 -5.743 5.356 1.00 0.09 C ATOM 1245 SG CYS A 80 129.310 -6.888 4.111 1.00 0.08 S ATOM 0 H CYS A 80 128.351 -4.128 7.244 1.00 0.10 H new ATOM 0 HA CYS A 80 129.624 -6.713 7.018 1.00 0.09 H new ATOM 0 HB2 CYS A 80 127.666 -6.048 5.663 1.00 0.09 H new ATOM 0 HB3 CYS A 80 128.580 -4.742 4.934 1.00 0.09 H new ATOM 0 HG CYS A 80 129.341 -6.298 2.953 1.00 0.08 H new ATOM 1251 N LEU A 81 131.234 -4.112 5.765 1.00 0.09 N ATOM 1252 CA LEU A 81 132.608 -3.716 5.350 1.00 0.08 C ATOM 1253 C LEU A 81 133.519 -3.735 6.578 1.00 0.09 C ATOM 1254 O LEU A 81 134.663 -4.137 6.509 1.00 0.08 O ATOM 1255 CB LEU A 81 132.580 -2.293 4.786 1.00 0.08 C ATOM 1256 CG LEU A 81 131.697 -2.237 3.528 1.00 0.08 C ATOM 1257 CD1 LEU A 81 131.479 -0.771 3.112 1.00 0.08 C ATOM 1258 CD2 LEU A 81 132.367 -3.009 2.375 1.00 0.07 C ATOM 0 H LEU A 81 130.536 -3.369 5.749 1.00 0.09 H new ATOM 0 HA LEU A 81 132.975 -4.408 4.592 1.00 0.08 H new ATOM 0 HB2 LEU A 81 132.198 -1.603 5.538 1.00 0.08 H new ATOM 0 HB3 LEU A 81 133.592 -1.970 4.543 1.00 0.08 H new ATOM 0 HG LEU A 81 130.734 -2.697 3.751 1.00 0.08 H new ATOM 0 HD11 LEU A 81 130.853 -0.735 2.220 1.00 0.08 H new ATOM 0 HD12 LEU A 81 130.988 -0.232 3.922 1.00 0.08 H new ATOM 0 HD13 LEU A 81 132.442 -0.306 2.898 1.00 0.08 H new ATOM 0 HD21 LEU A 81 131.733 -2.963 1.489 1.00 0.07 H new ATOM 0 HD22 LEU A 81 133.335 -2.561 2.152 1.00 0.07 H new ATOM 0 HD23 LEU A 81 132.507 -4.050 2.667 1.00 0.07 H new ATOM 1270 N ARG A 82 133.024 -3.280 7.698 1.00 0.09 N ATOM 1271 CA ARG A 82 133.867 -3.247 8.923 1.00 0.10 C ATOM 1272 C ARG A 82 134.227 -4.661 9.379 1.00 0.10 C ATOM 1273 O ARG A 82 135.339 -4.913 9.802 1.00 0.10 O ATOM 1274 CB ARG A 82 133.135 -2.518 10.051 1.00 0.11 C ATOM 1275 CG ARG A 82 134.065 -2.441 11.263 1.00 0.12 C ATOM 1276 CD ARG A 82 133.422 -1.642 12.382 1.00 0.13 C ATOM 1277 NE ARG A 82 134.493 -1.462 13.420 1.00 0.13 N ATOM 1278 CZ ARG A 82 134.239 -1.438 14.689 1.00 0.14 C ATOM 1279 NH1 ARG A 82 133.023 -1.631 15.118 1.00 0.15 N ATOM 1280 NH2 ARG A 82 135.210 -1.244 15.537 1.00 0.14 N ATOM 0 H ARG A 82 132.073 -2.931 7.815 1.00 0.09 H new ATOM 0 HA ARG A 82 134.786 -2.713 8.682 1.00 0.10 H new ATOM 0 HB2 ARG A 82 132.847 -1.517 9.731 1.00 0.11 H new ATOM 0 HB3 ARG A 82 132.217 -3.046 10.311 1.00 0.11 H new ATOM 0 HG2 ARG A 82 134.297 -3.446 11.614 1.00 0.12 H new ATOM 0 HG3 ARG A 82 135.009 -1.978 10.975 1.00 0.12 H new ATOM 0 HD2 ARG A 82 133.063 -0.679 12.019 1.00 0.13 H new ATOM 0 HD3 ARG A 82 132.561 -2.168 12.795 1.00 0.13 H new ATOM 0 HE ARG A 82 135.460 -1.354 13.112 1.00 0.13 H new ATOM 0 HH11 ARG A 82 132.269 -1.802 14.453 1.00 0.15 H new ATOM 0 HH12 ARG A 82 132.826 -1.611 16.119 1.00 0.15 H new ATOM 0 HH21 ARG A 82 136.163 -1.112 15.199 1.00 0.14 H new ATOM 0 HH22 ARG A 82 135.016 -1.224 16.538 1.00 0.14 H new ATOM 1294 N GLU A 83 133.314 -5.589 9.311 1.00 0.10 N ATOM 1295 CA GLU A 83 133.651 -6.967 9.762 1.00 0.11 C ATOM 1296 C GLU A 83 134.630 -7.596 8.773 1.00 0.10 C ATOM 1297 O GLU A 83 135.528 -8.315 9.165 1.00 0.10 O ATOM 1298 CB GLU A 83 132.385 -7.835 9.892 1.00 0.11 C ATOM 1299 CG GLU A 83 131.562 -7.430 11.153 1.00 0.12 C ATOM 1300 CD GLU A 83 131.000 -8.672 11.857 1.00 0.13 C ATOM 1301 OE1 GLU A 83 130.897 -9.704 11.215 1.00 0.12 O ATOM 1302 OE2 GLU A 83 130.683 -8.566 13.031 1.00 0.14 O ATOM 0 H GLU A 83 132.363 -5.456 8.968 1.00 0.10 H new ATOM 0 HA GLU A 83 134.114 -6.911 10.747 1.00 0.11 H new ATOM 0 HB2 GLU A 83 131.769 -7.724 8.999 1.00 0.11 H new ATOM 0 HB3 GLU A 83 132.665 -8.886 9.957 1.00 0.11 H new ATOM 0 HG2 GLU A 83 132.195 -6.871 11.842 1.00 0.12 H new ATOM 0 HG3 GLU A 83 130.745 -6.769 10.863 1.00 0.12 H new ATOM 1309 N TRP A 84 134.509 -7.313 7.501 1.00 0.09 N ATOM 1310 CA TRP A 84 135.485 -7.886 6.537 1.00 0.08 C ATOM 1311 C TRP A 84 136.869 -7.384 6.950 1.00 0.08 C ATOM 1312 O TRP A 84 137.831 -8.124 6.984 1.00 0.08 O ATOM 1313 CB TRP A 84 135.157 -7.408 5.115 1.00 0.07 C ATOM 1314 CG TRP A 84 136.099 -8.044 4.142 1.00 0.07 C ATOM 1315 CD1 TRP A 84 135.867 -9.208 3.481 1.00 0.07 C ATOM 1316 CD2 TRP A 84 137.415 -7.587 3.709 1.00 0.06 C ATOM 1317 NE1 TRP A 84 136.963 -9.501 2.685 1.00 0.06 N ATOM 1318 CE2 TRP A 84 137.941 -8.535 2.786 1.00 0.06 C ATOM 1319 CE3 TRP A 84 138.203 -6.453 4.024 1.00 0.06 C ATOM 1320 CZ2 TRP A 84 139.203 -8.367 2.198 1.00 0.06 C ATOM 1321 CZ3 TRP A 84 139.476 -6.281 3.433 1.00 0.06 C ATOM 1322 CH2 TRP A 84 139.972 -7.239 2.522 1.00 0.05 C ATOM 0 H TRP A 84 133.786 -6.718 7.096 1.00 0.09 H new ATOM 0 HA TRP A 84 135.448 -8.975 6.545 1.00 0.08 H new ATOM 0 HB2 TRP A 84 134.128 -7.665 4.862 1.00 0.07 H new ATOM 0 HB3 TRP A 84 135.237 -6.322 5.058 1.00 0.07 H new ATOM 0 HD1 TRP A 84 134.973 -9.808 3.563 1.00 0.07 H new ATOM 0 HE1 TRP A 84 137.037 -10.331 2.096 1.00 0.06 H new ATOM 0 HE3 TRP A 84 137.830 -5.716 4.719 1.00 0.06 H new ATOM 0 HZ2 TRP A 84 139.580 -9.101 1.501 1.00 0.06 H new ATOM 0 HZ3 TRP A 84 140.071 -5.414 3.679 1.00 0.06 H new ATOM 0 HH2 TRP A 84 140.945 -7.103 2.074 1.00 0.05 H new ATOM 1333 N CYS A 85 136.963 -6.122 7.274 1.00 0.08 N ATOM 1334 CA CYS A 85 138.269 -5.540 7.697 1.00 0.08 C ATOM 1335 C CYS A 85 138.766 -6.241 8.967 1.00 0.09 C ATOM 1336 O CYS A 85 139.936 -6.526 9.120 1.00 0.09 O ATOM 1337 CB CYS A 85 138.058 -4.047 7.984 1.00 0.08 C ATOM 1338 SG CYS A 85 137.937 -3.147 6.421 1.00 0.08 S ATOM 0 H CYS A 85 136.184 -5.464 7.263 1.00 0.08 H new ATOM 0 HA CYS A 85 139.011 -5.675 6.910 1.00 0.08 H new ATOM 0 HB2 CYS A 85 137.151 -3.903 8.571 1.00 0.08 H new ATOM 0 HB3 CYS A 85 138.886 -3.659 8.577 1.00 0.08 H new ATOM 0 HG CYS A 85 136.721 -3.227 5.967 1.00 0.08 H new ATOM 1344 N ASP A 86 137.885 -6.525 9.878 1.00 0.10 N ATOM 1345 CA ASP A 86 138.300 -7.206 11.135 1.00 0.11 C ATOM 1346 C ASP A 86 138.933 -8.565 10.819 1.00 0.11 C ATOM 1347 O ASP A 86 139.834 -9.014 11.500 1.00 0.11 O ATOM 1348 CB ASP A 86 137.077 -7.412 12.030 1.00 0.12 C ATOM 1349 CG ASP A 86 136.608 -6.058 12.567 1.00 0.12 C ATOM 1350 OD1 ASP A 86 137.427 -5.158 12.646 1.00 0.12 O ATOM 1351 OD2 ASP A 86 135.436 -5.946 12.888 1.00 0.12 O ATOM 0 H ASP A 86 136.889 -6.315 9.808 1.00 0.10 H new ATOM 0 HA ASP A 86 139.033 -6.584 11.648 1.00 0.11 H new ATOM 0 HB2 ASP A 86 136.276 -7.889 11.466 1.00 0.12 H new ATOM 0 HB3 ASP A 86 137.325 -8.078 12.857 1.00 0.12 H new ATOM 1356 N ALA A 87 138.458 -9.233 9.804 1.00 0.10 N ATOM 1357 CA ALA A 87 139.016 -10.578 9.457 1.00 0.10 C ATOM 1358 C ALA A 87 140.127 -10.439 8.408 1.00 0.10 C ATOM 1359 O ALA A 87 141.034 -11.246 8.339 1.00 0.10 O ATOM 1360 CB ALA A 87 137.872 -11.456 8.895 1.00 0.10 C ATOM 0 H ALA A 87 137.706 -8.908 9.197 1.00 0.10 H new ATOM 0 HA ALA A 87 139.440 -11.040 10.349 1.00 0.10 H new ATOM 0 HB1 ALA A 87 138.262 -12.441 8.637 1.00 0.10 H new ATOM 0 HB2 ALA A 87 137.091 -11.561 9.648 1.00 0.10 H new ATOM 0 HB3 ALA A 87 137.456 -10.985 8.004 1.00 0.10 H new ATOM 1366 N PHE A 88 140.013 -9.465 7.545 1.00 0.09 N ATOM 1367 CA PHE A 88 141.002 -9.300 6.435 1.00 0.08 C ATOM 1368 C PHE A 88 141.893 -8.058 6.616 1.00 0.07 C ATOM 1369 O PHE A 88 142.760 -7.797 5.805 1.00 0.07 O ATOM 1370 CB PHE A 88 140.198 -9.149 5.148 1.00 0.07 C ATOM 1371 CG PHE A 88 139.564 -10.472 4.761 1.00 0.08 C ATOM 1372 CD1 PHE A 88 140.352 -11.520 4.232 1.00 0.08 C ATOM 1373 CD2 PHE A 88 138.175 -10.647 4.893 1.00 0.08 C ATOM 1374 CE1 PHE A 88 139.752 -12.728 3.843 1.00 0.08 C ATOM 1375 CE2 PHE A 88 137.573 -11.858 4.494 1.00 0.08 C ATOM 1376 CZ PHE A 88 138.364 -12.896 3.969 1.00 0.09 C ATOM 0 H PHE A 88 139.269 -8.768 7.560 1.00 0.09 H new ATOM 0 HA PHE A 88 141.665 -10.165 6.418 1.00 0.08 H new ATOM 0 HB2 PHE A 88 139.424 -8.393 5.282 1.00 0.07 H new ATOM 0 HB3 PHE A 88 140.848 -8.801 4.345 1.00 0.07 H new ATOM 0 HD1 PHE A 88 141.419 -11.391 4.127 1.00 0.08 H new ATOM 0 HD2 PHE A 88 137.568 -9.852 5.301 1.00 0.08 H new ATOM 0 HE1 PHE A 88 140.359 -13.529 3.446 1.00 0.08 H new ATOM 0 HE2 PHE A 88 136.505 -11.989 4.591 1.00 0.08 H new ATOM 0 HZ PHE A 88 137.903 -13.823 3.662 1.00 0.09 H new ATOM 1386 N LEU A 89 141.672 -7.269 7.635 1.00 0.08 N ATOM 1387 CA LEU A 89 142.488 -6.020 7.819 1.00 0.08 C ATOM 1388 C LEU A 89 142.827 -5.838 9.300 1.00 0.09 C ATOM 1389 O LEU A 89 141.928 -5.519 10.059 1.00 0.09 O ATOM 1390 CB LEU A 89 141.639 -4.838 7.345 1.00 0.07 C ATOM 1391 CG LEU A 89 142.461 -3.540 7.253 1.00 0.07 C ATOM 1392 CD1 LEU A 89 143.389 -3.580 6.027 1.00 0.06 C ATOM 1393 CD2 LEU A 89 141.483 -2.372 7.108 1.00 0.07 C ATOM 1394 OXT LEU A 89 143.983 -6.019 9.648 1.00 0.09 O ATOM 0 H LEU A 89 140.963 -7.431 8.350 1.00 0.08 H new ATOM 0 HA LEU A 89 143.416 -6.084 7.251 1.00 0.08 H new ATOM 0 HB2 LEU A 89 141.212 -5.067 6.369 1.00 0.07 H new ATOM 0 HB3 LEU A 89 140.805 -4.692 8.032 1.00 0.07 H new ATOM 0 HG LEU A 89 143.074 -3.426 8.147 1.00 0.07 H new ATOM 0 HD11 LEU A 89 143.964 -2.655 5.975 1.00 0.06 H new ATOM 0 HD12 LEU A 89 144.070 -4.426 6.114 1.00 0.06 H new ATOM 0 HD13 LEU A 89 142.791 -3.687 5.122 1.00 0.06 H new ATOM 0 HD21 LEU A 89 142.040 -1.437 7.041 1.00 0.07 H new ATOM 0 HD22 LEU A 89 140.888 -2.506 6.205 1.00 0.07 H new ATOM 0 HD23 LEU A 89 140.824 -2.340 7.975 1.00 0.07 H new TER 1406 LEU A 89 ATOM 1407 N MET B 1 164.656 -4.566 -6.790 1.00 0.11 N ATOM 1408 CA MET B 1 163.926 -3.505 -6.048 1.00 0.10 C ATOM 1409 C MET B 1 164.321 -3.640 -4.577 1.00 0.09 C ATOM 1410 O MET B 1 163.596 -4.170 -3.763 1.00 0.09 O ATOM 1411 CB MET B 1 162.384 -3.647 -6.251 1.00 0.10 C ATOM 1412 CG MET B 1 162.067 -4.620 -7.410 1.00 0.10 C ATOM 1413 SD MET B 1 160.511 -4.135 -8.202 1.00 0.10 S ATOM 1414 CE MET B 1 159.396 -5.108 -7.165 1.00 0.10 C ATOM 0 H1 MET B 1 164.595 -4.380 -7.811 1.00 0.11 H new ATOM 0 H2 MET B 1 165.654 -4.570 -6.498 1.00 0.11 H new ATOM 0 H3 MET B 1 164.231 -5.492 -6.580 1.00 0.11 H new ATOM 0 HA MET B 1 164.190 -2.514 -6.417 1.00 0.10 H new ATOM 0 HB2 MET B 1 161.924 -4.008 -5.331 1.00 0.10 H new ATOM 0 HB3 MET B 1 161.950 -2.670 -6.462 1.00 0.10 H new ATOM 0 HG2 MET B 1 162.877 -4.609 -8.139 1.00 0.10 H new ATOM 0 HG3 MET B 1 161.992 -5.640 -7.032 1.00 0.10 H new ATOM 0 HE1 MET B 1 158.367 -4.951 -7.490 1.00 0.10 H new ATOM 0 HE2 MET B 1 159.647 -6.165 -7.253 1.00 0.10 H new ATOM 0 HE3 MET B 1 159.500 -4.796 -6.126 1.00 0.10 H new ATOM 1426 N THR B 2 165.508 -3.189 -4.269 1.00 0.09 N ATOM 1427 CA THR B 2 166.059 -3.283 -2.887 1.00 0.09 C ATOM 1428 C THR B 2 165.126 -2.620 -1.867 1.00 0.08 C ATOM 1429 O THR B 2 165.499 -1.684 -1.187 1.00 0.08 O ATOM 1430 CB THR B 2 167.425 -2.577 -2.880 1.00 0.09 C ATOM 1431 OG1 THR B 2 167.334 -1.409 -3.684 1.00 0.09 O ATOM 1432 CG2 THR B 2 168.519 -3.500 -3.461 1.00 0.10 C ATOM 0 H THR B 2 166.136 -2.746 -4.940 1.00 0.09 H new ATOM 0 HA THR B 2 166.158 -4.331 -2.605 1.00 0.09 H new ATOM 0 HB THR B 2 167.690 -2.323 -1.854 1.00 0.09 H new ATOM 0 HG1 THR B 2 168.198 -0.946 -3.688 1.00 0.09 H new ATOM 0 HG21 THR B 2 169.478 -2.981 -3.447 1.00 0.10 H new ATOM 0 HG22 THR B 2 168.588 -4.406 -2.859 1.00 0.10 H new ATOM 0 HG23 THR B 2 168.265 -3.765 -4.487 1.00 0.10 H new ATOM 1440 N THR B 3 163.929 -3.113 -1.736 1.00 0.08 N ATOM 1441 CA THR B 3 162.991 -2.533 -0.746 1.00 0.07 C ATOM 1442 C THR B 3 163.456 -2.941 0.653 1.00 0.07 C ATOM 1443 O THR B 3 164.084 -3.966 0.830 1.00 0.07 O ATOM 1444 CB THR B 3 161.579 -3.078 -0.995 1.00 0.07 C ATOM 1445 OG1 THR B 3 161.578 -4.483 -0.785 1.00 0.07 O ATOM 1446 CG2 THR B 3 161.125 -2.780 -2.438 1.00 0.07 C ATOM 0 H THR B 3 163.560 -3.896 -2.275 1.00 0.08 H new ATOM 0 HA THR B 3 162.973 -1.447 -0.836 1.00 0.07 H new ATOM 0 HB THR B 3 160.889 -2.592 -0.305 1.00 0.07 H new ATOM 0 HG1 THR B 3 160.727 -4.859 -1.093 1.00 0.07 H new ATOM 0 HG21 THR B 3 160.121 -3.175 -2.593 1.00 0.07 H new ATOM 0 HG22 THR B 3 161.120 -1.703 -2.603 1.00 0.07 H new ATOM 0 HG23 THR B 3 161.813 -3.251 -3.140 1.00 0.07 H new ATOM 1454 N SER B 4 163.165 -2.152 1.644 1.00 0.06 N ATOM 1455 CA SER B 4 163.604 -2.504 3.025 1.00 0.06 C ATOM 1456 C SER B 4 162.786 -3.694 3.540 1.00 0.06 C ATOM 1457 O SER B 4 161.757 -4.044 2.996 1.00 0.06 O ATOM 1458 CB SER B 4 163.398 -1.296 3.943 1.00 0.06 C ATOM 1459 OG SER B 4 164.231 -1.429 5.086 1.00 0.06 O ATOM 0 H SER B 4 162.643 -1.279 1.562 1.00 0.06 H new ATOM 0 HA SER B 4 164.659 -2.777 3.015 1.00 0.06 H new ATOM 0 HB2 SER B 4 163.636 -0.375 3.411 1.00 0.06 H new ATOM 0 HB3 SER B 4 162.353 -1.229 4.246 1.00 0.06 H new ATOM 0 HG SER B 4 164.103 -0.657 5.675 1.00 0.06 H new ATOM 1465 N GLN B 5 163.253 -4.318 4.591 1.00 0.07 N ATOM 1466 CA GLN B 5 162.535 -5.494 5.171 1.00 0.07 C ATOM 1467 C GLN B 5 161.068 -5.133 5.415 1.00 0.07 C ATOM 1468 O GLN B 5 160.219 -5.993 5.538 1.00 0.07 O ATOM 1469 CB GLN B 5 163.193 -5.863 6.520 1.00 0.07 C ATOM 1470 CG GLN B 5 164.224 -6.980 6.341 1.00 0.08 C ATOM 1471 CD GLN B 5 164.956 -7.192 7.668 1.00 0.09 C ATOM 1472 OE1 GLN B 5 165.200 -6.249 8.395 1.00 0.08 O ATOM 1473 NE2 GLN B 5 165.310 -8.396 8.023 1.00 0.09 N ATOM 0 H GLN B 5 164.111 -4.060 5.078 1.00 0.07 H new ATOM 0 HA GLN B 5 162.591 -6.335 4.480 1.00 0.07 H new ATOM 0 HB2 GLN B 5 163.675 -4.983 6.946 1.00 0.07 H new ATOM 0 HB3 GLN B 5 162.427 -6.180 7.227 1.00 0.07 H new ATOM 0 HG2 GLN B 5 163.732 -7.902 6.030 1.00 0.08 H new ATOM 0 HG3 GLN B 5 164.933 -6.717 5.556 1.00 0.08 H new ATOM 0 HE21 GLN B 5 165.106 -9.188 7.414 1.00 0.09 H new ATOM 0 HE22 GLN B 5 165.791 -8.545 8.910 1.00 0.09 H new ATOM 1482 N LYS B 6 160.770 -3.873 5.512 1.00 0.06 N ATOM 1483 CA LYS B 6 159.371 -3.456 5.779 1.00 0.06 C ATOM 1484 C LYS B 6 158.463 -3.929 4.646 1.00 0.06 C ATOM 1485 O LYS B 6 157.338 -4.325 4.871 1.00 0.06 O ATOM 1486 CB LYS B 6 159.330 -1.938 5.908 1.00 0.06 C ATOM 1487 CG LYS B 6 160.127 -1.553 7.153 1.00 0.06 C ATOM 1488 CD LYS B 6 160.124 -0.039 7.340 1.00 0.06 C ATOM 1489 CE LYS B 6 160.929 0.306 8.593 1.00 0.07 C ATOM 1490 NZ LYS B 6 160.716 1.736 8.945 1.00 0.07 N ATOM 0 H LYS B 6 161.439 -3.109 5.417 1.00 0.06 H new ATOM 0 HA LYS B 6 159.015 -3.905 6.706 1.00 0.06 H new ATOM 0 HB2 LYS B 6 159.756 -1.468 5.022 1.00 0.06 H new ATOM 0 HB3 LYS B 6 158.301 -1.589 5.991 1.00 0.06 H new ATOM 0 HG2 LYS B 6 159.697 -2.035 8.031 1.00 0.06 H new ATOM 0 HG3 LYS B 6 161.152 -1.912 7.062 1.00 0.06 H new ATOM 0 HD2 LYS B 6 160.557 0.450 6.467 1.00 0.06 H new ATOM 0 HD3 LYS B 6 159.102 0.327 7.436 1.00 0.06 H new ATOM 0 HE2 LYS B 6 160.623 -0.332 9.422 1.00 0.07 H new ATOM 0 HE3 LYS B 6 161.989 0.117 8.420 1.00 0.07 H new ATOM 0 HZ1 LYS B 6 161.264 1.969 9.797 1.00 0.07 H new ATOM 0 HZ2 LYS B 6 161.029 2.338 8.157 1.00 0.07 H new ATOM 0 HZ3 LYS B 6 159.706 1.902 9.127 1.00 0.07 H new ATOM 1504 N HIS B 7 158.932 -3.896 3.435 1.00 0.06 N ATOM 1505 CA HIS B 7 158.077 -4.348 2.306 1.00 0.06 C ATOM 1506 C HIS B 7 157.676 -5.813 2.504 1.00 0.06 C ATOM 1507 O HIS B 7 156.514 -6.157 2.419 1.00 0.06 O ATOM 1508 CB HIS B 7 158.848 -4.174 0.994 1.00 0.06 C ATOM 1509 CG HIS B 7 158.127 -4.850 -0.144 1.00 0.06 C ATOM 1510 ND1 HIS B 7 157.313 -4.154 -1.027 1.00 0.06 N ATOM 1511 CD2 HIS B 7 158.111 -6.156 -0.569 1.00 0.07 C ATOM 1512 CE1 HIS B 7 156.850 -5.035 -1.933 1.00 0.06 C ATOM 1513 NE2 HIS B 7 157.306 -6.266 -1.697 1.00 0.07 N ATOM 0 H HIS B 7 159.866 -3.577 3.177 1.00 0.06 H new ATOM 0 HA HIS B 7 157.168 -3.748 2.270 1.00 0.06 H new ATOM 0 HB2 HIS B 7 158.968 -3.113 0.775 1.00 0.06 H new ATOM 0 HB3 HIS B 7 159.849 -4.593 1.097 1.00 0.06 H new ATOM 0 HD2 HIS B 7 158.642 -6.971 -0.100 1.00 0.07 H new ATOM 0 HE1 HIS B 7 156.191 -4.777 -2.749 1.00 0.06 H new ATOM 0 HE2 HIS B 7 157.106 -7.111 -2.232 1.00 0.07 H new ATOM 1521 N ARG B 8 158.624 -6.685 2.779 1.00 0.07 N ATOM 1522 CA ARG B 8 158.296 -8.127 2.989 1.00 0.07 C ATOM 1523 C ARG B 8 157.538 -8.310 4.302 1.00 0.07 C ATOM 1524 O ARG B 8 156.650 -9.130 4.410 1.00 0.08 O ATOM 1525 CB ARG B 8 159.585 -8.945 3.088 1.00 0.08 C ATOM 1526 CG ARG B 8 160.294 -9.024 1.734 1.00 0.08 C ATOM 1527 CD ARG B 8 161.469 -9.991 1.865 1.00 0.09 C ATOM 1528 NE ARG B 8 162.444 -9.750 0.751 1.00 0.09 N ATOM 1529 CZ ARG B 8 162.214 -10.141 -0.465 1.00 0.10 C ATOM 1530 NH1 ARG B 8 161.151 -10.845 -0.743 1.00 0.10 N ATOM 1531 NH2 ARG B 8 163.070 -9.853 -1.407 1.00 0.10 N ATOM 0 H ARG B 8 159.613 -6.453 2.866 1.00 0.07 H new ATOM 0 HA ARG B 8 157.689 -8.461 2.148 1.00 0.07 H new ATOM 0 HB2 ARG B 8 160.250 -8.493 3.824 1.00 0.08 H new ATOM 0 HB3 ARG B 8 159.355 -9.950 3.441 1.00 0.08 H new ATOM 0 HG2 ARG B 8 159.604 -9.367 0.963 1.00 0.08 H new ATOM 0 HG3 ARG B 8 160.646 -8.038 1.431 1.00 0.08 H new ATOM 0 HD2 ARG B 8 161.960 -9.854 2.828 1.00 0.09 H new ATOM 0 HD3 ARG B 8 161.112 -11.020 1.833 1.00 0.09 H new ATOM 0 HE ARG B 8 163.316 -9.263 0.956 1.00 0.09 H new ATOM 0 HH11 ARG B 8 160.494 -11.091 -0.002 1.00 0.10 H new ATOM 0 HH12 ARG B 8 160.977 -11.149 -1.701 1.00 0.10 H new ATOM 0 HH21 ARG B 8 163.913 -9.324 -1.185 1.00 0.10 H new ATOM 0 HH22 ARG B 8 162.896 -10.157 -2.365 1.00 0.10 H new ATOM 1545 N ASP B 9 157.891 -7.558 5.303 1.00 0.07 N ATOM 1546 CA ASP B 9 157.204 -7.696 6.615 1.00 0.07 C ATOM 1547 C ASP B 9 155.771 -7.212 6.469 1.00 0.07 C ATOM 1548 O ASP B 9 154.848 -7.769 7.026 1.00 0.07 O ATOM 1549 CB ASP B 9 157.919 -6.854 7.669 1.00 0.07 C ATOM 1550 CG ASP B 9 159.278 -7.477 7.988 1.00 0.08 C ATOM 1551 OD1 ASP B 9 159.450 -8.652 7.706 1.00 0.08 O ATOM 1552 OD2 ASP B 9 160.126 -6.769 8.506 1.00 0.08 O ATOM 0 H ASP B 9 158.627 -6.852 5.270 1.00 0.07 H new ATOM 0 HA ASP B 9 157.218 -8.740 6.927 1.00 0.07 H new ATOM 0 HB2 ASP B 9 158.051 -5.835 7.306 1.00 0.07 H new ATOM 0 HB3 ASP B 9 157.314 -6.795 8.573 1.00 0.07 H new ATOM 1557 N PHE B 10 155.583 -6.169 5.722 1.00 0.06 N ATOM 1558 CA PHE B 10 154.219 -5.627 5.529 1.00 0.06 C ATOM 1559 C PHE B 10 153.339 -6.658 4.809 1.00 0.06 C ATOM 1560 O PHE B 10 152.240 -6.951 5.237 1.00 0.06 O ATOM 1561 CB PHE B 10 154.339 -4.360 4.691 1.00 0.05 C ATOM 1562 CG PHE B 10 153.028 -3.632 4.662 1.00 0.05 C ATOM 1563 CD1 PHE B 10 152.690 -2.762 5.712 1.00 0.05 C ATOM 1564 CD2 PHE B 10 152.154 -3.800 3.572 1.00 0.05 C ATOM 1565 CE1 PHE B 10 151.478 -2.057 5.672 1.00 0.05 C ATOM 1566 CE2 PHE B 10 150.940 -3.098 3.534 1.00 0.05 C ATOM 1567 CZ PHE B 10 150.606 -2.225 4.581 1.00 0.05 C ATOM 0 H PHE B 10 156.322 -5.664 5.233 1.00 0.06 H new ATOM 0 HA PHE B 10 153.757 -5.404 6.491 1.00 0.06 H new ATOM 0 HB2 PHE B 10 155.113 -3.714 5.105 1.00 0.05 H new ATOM 0 HB3 PHE B 10 154.645 -4.614 3.676 1.00 0.05 H new ATOM 0 HD1 PHE B 10 153.362 -2.636 6.548 1.00 0.05 H new ATOM 0 HD2 PHE B 10 152.417 -4.469 2.766 1.00 0.05 H new ATOM 0 HE1 PHE B 10 151.215 -1.387 6.477 1.00 0.05 H new ATOM 0 HE2 PHE B 10 150.264 -3.229 2.702 1.00 0.05 H new ATOM 0 HZ PHE B 10 149.675 -1.679 4.549 1.00 0.05 H new ATOM 1577 N VAL B 11 153.808 -7.205 3.715 1.00 0.06 N ATOM 1578 CA VAL B 11 152.987 -8.207 2.969 1.00 0.06 C ATOM 1579 C VAL B 11 153.138 -9.605 3.592 1.00 0.07 C ATOM 1580 O VAL B 11 152.702 -10.588 3.028 1.00 0.08 O ATOM 1581 CB VAL B 11 153.439 -8.274 1.510 1.00 0.06 C ATOM 1582 CG1 VAL B 11 153.314 -6.886 0.847 1.00 0.06 C ATOM 1583 CG2 VAL B 11 154.887 -8.757 1.461 1.00 0.07 C ATOM 0 H VAL B 11 154.721 -7.002 3.308 1.00 0.06 H new ATOM 0 HA VAL B 11 151.944 -7.895 3.024 1.00 0.06 H new ATOM 0 HB VAL B 11 152.804 -8.971 0.963 1.00 0.06 H new ATOM 0 HG11 VAL B 11 153.639 -6.948 -0.192 1.00 0.06 H new ATOM 0 HG12 VAL B 11 152.275 -6.558 0.883 1.00 0.06 H new ATOM 0 HG13 VAL B 11 153.939 -6.170 1.381 1.00 0.06 H new ATOM 0 HG21 VAL B 11 155.219 -8.808 0.424 1.00 0.07 H new ATOM 0 HG22 VAL B 11 155.521 -8.062 2.011 1.00 0.07 H new ATOM 0 HG23 VAL B 11 154.956 -9.746 1.913 1.00 0.07 H new ATOM 1593 N ALA B 12 153.747 -9.702 4.752 1.00 0.08 N ATOM 1594 CA ALA B 12 153.922 -11.039 5.417 1.00 0.09 C ATOM 1595 C ALA B 12 152.973 -11.163 6.611 1.00 0.09 C ATOM 1596 O ALA B 12 152.744 -12.241 7.122 1.00 0.10 O ATOM 1597 CB ALA B 12 155.358 -11.184 5.912 1.00 0.09 C ATOM 0 H ALA B 12 154.132 -8.912 5.269 1.00 0.08 H new ATOM 0 HA ALA B 12 153.698 -11.821 4.691 1.00 0.09 H new ATOM 0 HB1 ALA B 12 155.481 -12.154 6.393 1.00 0.09 H new ATOM 0 HB2 ALA B 12 156.043 -11.109 5.068 1.00 0.09 H new ATOM 0 HB3 ALA B 12 155.577 -10.393 6.629 1.00 0.09 H new ATOM 1603 N GLU B 13 152.413 -10.071 7.057 1.00 0.08 N ATOM 1604 CA GLU B 13 151.472 -10.128 8.214 1.00 0.09 C ATOM 1605 C GLU B 13 150.496 -8.946 8.115 1.00 0.08 C ATOM 1606 O GLU B 13 150.840 -7.911 7.579 1.00 0.08 O ATOM 1607 CB GLU B 13 152.265 -10.037 9.523 1.00 0.09 C ATOM 1608 CG GLU B 13 153.250 -8.870 9.443 1.00 0.09 C ATOM 1609 CD GLU B 13 153.853 -8.613 10.825 1.00 0.09 C ATOM 1610 OE1 GLU B 13 153.759 -9.495 11.663 1.00 0.10 O ATOM 1611 OE2 GLU B 13 154.402 -7.541 11.020 1.00 0.09 O ATOM 0 H GLU B 13 152.567 -9.140 6.670 1.00 0.08 H new ATOM 0 HA GLU B 13 150.918 -11.066 8.199 1.00 0.09 H new ATOM 0 HB2 GLU B 13 151.585 -9.896 10.363 1.00 0.09 H new ATOM 0 HB3 GLU B 13 152.802 -10.969 9.701 1.00 0.09 H new ATOM 0 HG2 GLU B 13 154.040 -9.096 8.727 1.00 0.09 H new ATOM 0 HG3 GLU B 13 152.741 -7.975 9.085 1.00 0.09 H new ATOM 1618 N PRO B 14 149.294 -9.078 8.625 1.00 0.09 N ATOM 1619 CA PRO B 14 148.291 -7.976 8.576 1.00 0.08 C ATOM 1620 C PRO B 14 148.928 -6.603 8.838 1.00 0.08 C ATOM 1621 O PRO B 14 150.006 -6.506 9.391 1.00 0.08 O ATOM 1622 CB PRO B 14 147.312 -8.345 9.695 1.00 0.09 C ATOM 1623 CG PRO B 14 147.348 -9.843 9.766 1.00 0.10 C ATOM 1624 CD PRO B 14 148.749 -10.276 9.298 1.00 0.09 C ATOM 0 HA PRO B 14 147.821 -7.886 7.597 1.00 0.08 H new ATOM 0 HB2 PRO B 14 147.610 -7.898 10.643 1.00 0.09 H new ATOM 0 HB3 PRO B 14 146.307 -7.985 9.475 1.00 0.09 H new ATOM 0 HG2 PRO B 14 147.156 -10.187 10.783 1.00 0.10 H new ATOM 0 HG3 PRO B 14 146.576 -10.279 9.131 1.00 0.10 H new ATOM 0 HD2 PRO B 14 149.373 -10.579 10.138 1.00 0.09 H new ATOM 0 HD3 PRO B 14 148.696 -11.126 8.617 1.00 0.09 H new ATOM 1632 N MET B 15 148.272 -5.545 8.440 1.00 0.07 N ATOM 1633 CA MET B 15 148.841 -4.180 8.661 1.00 0.07 C ATOM 1634 C MET B 15 148.390 -3.655 10.026 1.00 0.08 C ATOM 1635 O MET B 15 149.031 -2.815 10.624 1.00 0.08 O ATOM 1636 CB MET B 15 148.297 -3.212 7.599 1.00 0.07 C ATOM 1637 CG MET B 15 146.794 -3.468 7.405 1.00 0.07 C ATOM 1638 SD MET B 15 145.976 -1.961 6.817 1.00 0.07 S ATOM 1639 CE MET B 15 146.865 -1.737 5.265 1.00 0.06 C ATOM 0 H MET B 15 147.366 -5.566 7.971 1.00 0.07 H new ATOM 0 HA MET B 15 149.928 -4.244 8.605 1.00 0.07 H new ATOM 0 HB2 MET B 15 148.465 -2.181 7.909 1.00 0.07 H new ATOM 0 HB3 MET B 15 148.827 -3.352 6.657 1.00 0.07 H new ATOM 0 HG2 MET B 15 146.644 -4.276 6.688 1.00 0.07 H new ATOM 0 HG3 MET B 15 146.348 -3.790 8.346 1.00 0.07 H new ATOM 0 HE1 MET B 15 146.320 -1.037 4.631 1.00 0.06 H new ATOM 0 HE2 MET B 15 147.860 -1.342 5.469 1.00 0.06 H new ATOM 0 HE3 MET B 15 146.953 -2.696 4.754 1.00 0.06 H new ATOM 1649 N GLY B 16 147.270 -4.120 10.499 1.00 0.09 N ATOM 1650 CA GLY B 16 146.749 -3.626 11.803 1.00 0.09 C ATOM 1651 C GLY B 16 146.604 -2.101 11.729 1.00 0.10 C ATOM 1652 O GLY B 16 146.146 -1.560 10.742 1.00 0.09 O ATOM 0 H GLY B 16 146.691 -4.822 10.039 1.00 0.09 H new ATOM 0 HA2 GLY B 16 145.786 -4.087 12.024 1.00 0.09 H new ATOM 0 HA3 GLY B 16 147.428 -3.902 12.610 1.00 0.09 H new ATOM 1656 N GLU B 17 146.979 -1.406 12.775 1.00 0.10 N ATOM 1657 CA GLU B 17 146.858 0.090 12.797 1.00 0.10 C ATOM 1658 C GLU B 17 148.254 0.720 12.756 1.00 0.10 C ATOM 1659 O GLU B 17 148.506 1.732 13.377 1.00 0.11 O ATOM 1660 CB GLU B 17 146.157 0.516 14.087 1.00 0.12 C ATOM 1661 CG GLU B 17 144.688 0.095 14.032 1.00 0.12 C ATOM 1662 CD GLU B 17 143.990 0.521 15.325 1.00 0.13 C ATOM 1663 OE1 GLU B 17 144.683 0.929 16.242 1.00 0.13 O ATOM 1664 OE2 GLU B 17 142.775 0.432 15.377 1.00 0.13 O ATOM 0 H GLU B 17 147.368 -1.814 13.625 1.00 0.10 H new ATOM 0 HA GLU B 17 146.283 0.421 11.932 1.00 0.10 H new ATOM 0 HB2 GLU B 17 146.646 0.058 14.947 1.00 0.12 H new ATOM 0 HB3 GLU B 17 146.232 1.596 14.215 1.00 0.12 H new ATOM 0 HG2 GLU B 17 144.198 0.554 13.173 1.00 0.12 H new ATOM 0 HG3 GLU B 17 144.612 -0.985 13.903 1.00 0.12 H new ATOM 1671 N LYS B 18 149.164 0.116 12.046 1.00 0.10 N ATOM 1672 CA LYS B 18 150.548 0.665 11.987 1.00 0.09 C ATOM 1673 C LYS B 18 150.524 2.075 11.369 1.00 0.09 C ATOM 1674 O LYS B 18 149.666 2.388 10.568 1.00 0.09 O ATOM 1675 CB LYS B 18 151.412 -0.277 11.144 1.00 0.09 C ATOM 1676 CG LYS B 18 151.631 -1.568 11.936 1.00 0.09 C ATOM 1677 CD LYS B 18 152.539 -2.519 11.160 1.00 0.08 C ATOM 1678 CE LYS B 18 152.762 -3.783 11.993 1.00 0.09 C ATOM 1679 NZ LYS B 18 153.878 -4.578 11.409 1.00 0.09 N ATOM 0 H LYS B 18 149.010 -0.734 11.504 1.00 0.10 H new ATOM 0 HA LYS B 18 150.966 0.740 12.991 1.00 0.09 H new ATOM 0 HB2 LYS B 18 150.923 -0.493 10.194 1.00 0.09 H new ATOM 0 HB3 LYS B 18 152.368 0.192 10.911 1.00 0.09 H new ATOM 0 HG2 LYS B 18 152.077 -1.338 12.904 1.00 0.09 H new ATOM 0 HG3 LYS B 18 150.673 -2.049 12.133 1.00 0.09 H new ATOM 0 HD2 LYS B 18 152.086 -2.774 10.202 1.00 0.08 H new ATOM 0 HD3 LYS B 18 153.493 -2.037 10.944 1.00 0.08 H new ATOM 0 HE2 LYS B 18 152.994 -3.515 13.024 1.00 0.09 H new ATOM 0 HE3 LYS B 18 151.851 -4.380 12.017 1.00 0.09 H new ATOM 0 HZ1 LYS B 18 153.642 -5.590 11.450 1.00 0.09 H new ATOM 0 HZ2 LYS B 18 154.024 -4.296 10.418 1.00 0.09 H new ATOM 0 HZ3 LYS B 18 154.749 -4.403 11.950 1.00 0.09 H new ATOM 1693 N PRO B 19 151.445 2.934 11.761 1.00 0.10 N ATOM 1694 CA PRO B 19 151.505 4.344 11.256 1.00 0.10 C ATOM 1695 C PRO B 19 151.749 4.422 9.747 1.00 0.09 C ATOM 1696 O PRO B 19 152.342 3.546 9.150 1.00 0.09 O ATOM 1697 CB PRO B 19 152.676 4.973 12.040 1.00 0.11 C ATOM 1698 CG PRO B 19 153.507 3.817 12.494 1.00 0.10 C ATOM 1699 CD PRO B 19 152.531 2.666 12.724 1.00 0.10 C ATOM 0 HA PRO B 19 150.559 4.863 11.408 1.00 0.10 H new ATOM 0 HB2 PRO B 19 153.253 5.650 11.410 1.00 0.11 H new ATOM 0 HB3 PRO B 19 152.315 5.556 12.887 1.00 0.11 H new ATOM 0 HG2 PRO B 19 154.252 3.553 11.744 1.00 0.10 H new ATOM 0 HG3 PRO B 19 154.048 4.060 13.409 1.00 0.10 H new ATOM 0 HD2 PRO B 19 153.000 1.700 12.540 1.00 0.10 H new ATOM 0 HD3 PRO B 19 152.163 2.652 13.750 1.00 0.10 H new ATOM 1707 N VAL B 20 151.282 5.473 9.132 1.00 0.10 N ATOM 1708 CA VAL B 20 151.462 5.628 7.666 1.00 0.09 C ATOM 1709 C VAL B 20 152.940 5.497 7.295 1.00 0.09 C ATOM 1710 O VAL B 20 153.290 4.869 6.316 1.00 0.08 O ATOM 1711 CB VAL B 20 150.938 6.999 7.232 1.00 0.10 C ATOM 1712 CG1 VAL B 20 151.692 8.112 7.974 1.00 0.11 C ATOM 1713 CG2 VAL B 20 151.127 7.151 5.719 1.00 0.09 C ATOM 0 H VAL B 20 150.780 6.235 9.588 1.00 0.10 H new ATOM 0 HA VAL B 20 150.904 4.844 7.154 1.00 0.09 H new ATOM 0 HB VAL B 20 149.879 7.078 7.476 1.00 0.10 H new ATOM 0 HG11 VAL B 20 151.311 9.083 7.658 1.00 0.11 H new ATOM 0 HG12 VAL B 20 151.545 7.997 9.048 1.00 0.11 H new ATOM 0 HG13 VAL B 20 152.755 8.047 7.744 1.00 0.11 H new ATOM 0 HG21 VAL B 20 150.756 8.126 5.402 1.00 0.09 H new ATOM 0 HG22 VAL B 20 152.186 7.069 5.475 1.00 0.09 H new ATOM 0 HG23 VAL B 20 150.574 6.367 5.203 1.00 0.09 H new ATOM 1723 N GLY B 21 153.810 6.099 8.065 1.00 0.09 N ATOM 1724 CA GLY B 21 155.266 6.028 7.757 1.00 0.09 C ATOM 1725 C GLY B 21 155.737 4.576 7.728 1.00 0.08 C ATOM 1726 O GLY B 21 156.884 4.298 7.439 1.00 0.08 O ATOM 0 H GLY B 21 153.571 6.639 8.897 1.00 0.09 H new ATOM 0 HA2 GLY B 21 155.463 6.500 6.794 1.00 0.09 H new ATOM 0 HA3 GLY B 21 155.830 6.584 8.506 1.00 0.09 H new ATOM 1730 N SER B 22 154.876 3.642 8.026 1.00 0.08 N ATOM 1731 CA SER B 22 155.296 2.212 8.014 1.00 0.07 C ATOM 1732 C SER B 22 155.228 1.657 6.587 1.00 0.06 C ATOM 1733 O SER B 22 155.877 0.683 6.263 1.00 0.06 O ATOM 1734 CB SER B 22 154.363 1.406 8.916 1.00 0.07 C ATOM 1735 OG SER B 22 154.772 0.045 8.917 1.00 0.07 O ATOM 0 H SER B 22 153.901 3.807 8.277 1.00 0.08 H new ATOM 0 HA SER B 22 156.321 2.136 8.378 1.00 0.07 H new ATOM 0 HB2 SER B 22 154.384 1.805 9.930 1.00 0.07 H new ATOM 0 HB3 SER B 22 153.335 1.489 8.562 1.00 0.07 H new ATOM 0 HG SER B 22 154.176 -0.475 9.496 1.00 0.07 H new ATOM 1741 N LEU B 23 154.443 2.258 5.732 1.00 0.06 N ATOM 1742 CA LEU B 23 154.339 1.742 4.336 1.00 0.06 C ATOM 1743 C LEU B 23 155.688 1.880 3.631 1.00 0.06 C ATOM 1744 O LEU B 23 156.376 2.872 3.763 1.00 0.06 O ATOM 1745 CB LEU B 23 153.284 2.540 3.564 1.00 0.06 C ATOM 1746 CG LEU B 23 151.900 2.318 4.191 1.00 0.06 C ATOM 1747 CD1 LEU B 23 150.925 3.351 3.620 1.00 0.07 C ATOM 1748 CD2 LEU B 23 151.381 0.879 3.897 1.00 0.05 C ATOM 0 H LEU B 23 153.873 3.078 5.938 1.00 0.06 H new ATOM 0 HA LEU B 23 154.050 0.692 4.369 1.00 0.06 H new ATOM 0 HB2 LEU B 23 153.534 3.601 3.580 1.00 0.06 H new ATOM 0 HB3 LEU B 23 153.274 2.230 2.519 1.00 0.06 H new ATOM 0 HG LEU B 23 151.977 2.434 5.272 1.00 0.06 H new ATOM 0 HD11 LEU B 23 149.939 3.202 4.059 1.00 0.07 H new ATOM 0 HD12 LEU B 23 151.279 4.355 3.856 1.00 0.07 H new ATOM 0 HD13 LEU B 23 150.862 3.233 2.538 1.00 0.07 H new ATOM 0 HD21 LEU B 23 150.399 0.746 4.352 1.00 0.05 H new ATOM 0 HD22 LEU B 23 151.305 0.733 2.820 1.00 0.05 H new ATOM 0 HD23 LEU B 23 152.075 0.150 4.314 1.00 0.05 H new ATOM 1760 N ALA B 24 156.061 0.888 2.877 1.00 0.05 N ATOM 1761 CA ALA B 24 157.359 0.955 2.153 1.00 0.06 C ATOM 1762 C ALA B 24 157.312 2.080 1.113 1.00 0.06 C ATOM 1763 O ALA B 24 156.347 2.242 0.394 1.00 0.06 O ATOM 1764 CB ALA B 24 157.627 -0.383 1.457 1.00 0.05 C ATOM 0 H ALA B 24 155.524 0.033 2.730 1.00 0.05 H new ATOM 0 HA ALA B 24 158.160 1.158 2.864 1.00 0.06 H new ATOM 0 HB1 ALA B 24 158.578 -0.333 0.927 1.00 0.05 H new ATOM 0 HB2 ALA B 24 157.668 -1.178 2.201 1.00 0.05 H new ATOM 0 HB3 ALA B 24 156.826 -0.591 0.747 1.00 0.05 H new ATOM 1770 N GLY B 25 158.357 2.857 1.042 1.00 0.06 N ATOM 1771 CA GLY B 25 158.399 3.985 0.058 1.00 0.07 C ATOM 1772 C GLY B 25 157.996 5.284 0.759 1.00 0.08 C ATOM 1773 O GLY B 25 158.329 6.366 0.317 1.00 0.08 O ATOM 0 H GLY B 25 159.189 2.762 1.624 1.00 0.06 H new ATOM 0 HA2 GLY B 25 159.401 4.080 -0.361 1.00 0.07 H new ATOM 0 HA3 GLY B 25 157.724 3.783 -0.773 1.00 0.07 H new ATOM 1777 N ILE B 26 157.293 5.186 1.858 1.00 0.07 N ATOM 1778 CA ILE B 26 156.877 6.414 2.603 1.00 0.08 C ATOM 1779 C ILE B 26 157.860 6.619 3.753 1.00 0.08 C ATOM 1780 O ILE B 26 157.916 5.823 4.668 1.00 0.08 O ATOM 1781 CB ILE B 26 155.463 6.223 3.167 1.00 0.08 C ATOM 1782 CG1 ILE B 26 154.508 5.783 2.038 1.00 0.08 C ATOM 1783 CG2 ILE B 26 154.969 7.532 3.810 1.00 0.09 C ATOM 1784 CD1 ILE B 26 154.557 6.764 0.858 1.00 0.08 C ATOM 0 H ILE B 26 156.988 4.306 2.273 1.00 0.07 H new ATOM 0 HA ILE B 26 156.877 7.279 1.939 1.00 0.08 H new ATOM 0 HB ILE B 26 155.483 5.448 3.933 1.00 0.08 H new ATOM 0 HG12 ILE B 26 154.780 4.784 1.696 1.00 0.08 H new ATOM 0 HG13 ILE B 26 153.490 5.722 2.422 1.00 0.08 H new ATOM 0 HG21 ILE B 26 153.965 7.386 4.207 1.00 0.09 H new ATOM 0 HG22 ILE B 26 155.641 7.816 4.619 1.00 0.09 H new ATOM 0 HG23 ILE B 26 154.951 8.322 3.059 1.00 0.09 H new ATOM 0 HD11 ILE B 26 153.874 6.429 0.077 1.00 0.08 H new ATOM 0 HD12 ILE B 26 154.261 7.757 1.197 1.00 0.08 H new ATOM 0 HD13 ILE B 26 155.571 6.804 0.460 1.00 0.08 H new ATOM 1796 N GLY B 27 158.645 7.667 3.732 1.00 0.09 N ATOM 1797 CA GLY B 27 159.616 7.887 4.843 1.00 0.09 C ATOM 1798 C GLY B 27 158.984 8.777 5.914 1.00 0.10 C ATOM 1799 O GLY B 27 157.845 9.188 5.805 1.00 0.10 O ATOM 0 H GLY B 27 158.655 8.375 2.998 1.00 0.09 H new ATOM 0 HA2 GLY B 27 159.908 6.931 5.277 1.00 0.09 H new ATOM 0 HA3 GLY B 27 160.523 8.353 4.459 1.00 0.09 H new ATOM 1803 N GLU B 28 159.708 9.050 6.960 1.00 0.10 N ATOM 1804 CA GLU B 28 159.138 9.890 8.054 1.00 0.11 C ATOM 1805 C GLU B 28 158.717 11.260 7.505 1.00 0.12 C ATOM 1806 O GLU B 28 157.689 11.791 7.877 1.00 0.12 O ATOM 1807 CB GLU B 28 160.176 10.065 9.164 1.00 0.11 C ATOM 1808 CG GLU B 28 160.452 8.706 9.817 1.00 0.11 C ATOM 1809 CD GLU B 28 161.241 8.906 11.111 1.00 0.11 C ATOM 1810 OE1 GLU B 28 161.527 10.046 11.438 1.00 0.12 O ATOM 1811 OE2 GLU B 28 161.541 7.914 11.758 1.00 0.11 O ATOM 0 H GLU B 28 160.666 8.731 7.108 1.00 0.10 H new ATOM 0 HA GLU B 28 158.258 9.393 8.463 1.00 0.11 H new ATOM 0 HB2 GLU B 28 161.098 10.479 8.754 1.00 0.11 H new ATOM 0 HB3 GLU B 28 159.813 10.773 9.909 1.00 0.11 H new ATOM 0 HG2 GLU B 28 159.512 8.196 10.028 1.00 0.11 H new ATOM 0 HG3 GLU B 28 161.013 8.070 9.132 1.00 0.11 H new ATOM 1818 N VAL B 29 159.492 11.837 6.628 1.00 0.12 N ATOM 1819 CA VAL B 29 159.117 13.173 6.070 1.00 0.13 C ATOM 1820 C VAL B 29 157.838 13.027 5.241 1.00 0.13 C ATOM 1821 O VAL B 29 156.925 13.822 5.348 1.00 0.13 O ATOM 1822 CB VAL B 29 160.272 13.685 5.180 1.00 0.13 C ATOM 1823 CG1 VAL B 29 159.883 14.994 4.448 1.00 0.14 C ATOM 1824 CG2 VAL B 29 161.536 13.917 6.045 1.00 0.13 C ATOM 0 H VAL B 29 160.365 11.446 6.273 1.00 0.12 H new ATOM 0 HA VAL B 29 158.941 13.885 6.876 1.00 0.13 H new ATOM 0 HB VAL B 29 160.480 12.928 4.424 1.00 0.13 H new ATOM 0 HG11 VAL B 29 160.717 15.327 3.831 1.00 0.14 H new ATOM 0 HG12 VAL B 29 159.014 14.813 3.816 1.00 0.14 H new ATOM 0 HG13 VAL B 29 159.644 15.764 5.182 1.00 0.14 H new ATOM 0 HG21 VAL B 29 162.348 14.278 5.414 1.00 0.13 H new ATOM 0 HG22 VAL B 29 161.319 14.657 6.815 1.00 0.13 H new ATOM 0 HG23 VAL B 29 161.832 12.979 6.516 1.00 0.13 H new ATOM 1834 N LEU B 30 157.770 12.027 4.407 1.00 0.12 N ATOM 1835 CA LEU B 30 156.561 11.838 3.559 1.00 0.12 C ATOM 1836 C LEU B 30 155.372 11.435 4.431 1.00 0.12 C ATOM 1837 O LEU B 30 154.260 11.877 4.221 1.00 0.12 O ATOM 1838 CB LEU B 30 156.836 10.744 2.521 1.00 0.11 C ATOM 1839 CG LEU B 30 157.993 11.160 1.591 1.00 0.11 C ATOM 1840 CD1 LEU B 30 158.401 9.958 0.682 1.00 0.11 C ATOM 1841 CD2 LEU B 30 157.563 12.372 0.731 1.00 0.12 C ATOM 0 H LEU B 30 158.503 11.330 4.276 1.00 0.12 H new ATOM 0 HA LEU B 30 156.326 12.773 3.050 1.00 0.12 H new ATOM 0 HB2 LEU B 30 157.085 9.810 3.025 1.00 0.11 H new ATOM 0 HB3 LEU B 30 155.937 10.559 1.933 1.00 0.11 H new ATOM 0 HG LEU B 30 158.855 11.448 2.192 1.00 0.11 H new ATOM 0 HD11 LEU B 30 159.219 10.258 0.027 1.00 0.11 H new ATOM 0 HD12 LEU B 30 158.723 9.123 1.305 1.00 0.11 H new ATOM 0 HD13 LEU B 30 157.547 9.652 0.078 1.00 0.11 H new ATOM 0 HD21 LEU B 30 158.384 12.662 0.075 1.00 0.12 H new ATOM 0 HD22 LEU B 30 156.696 12.101 0.129 1.00 0.12 H new ATOM 0 HD23 LEU B 30 157.306 13.207 1.382 1.00 0.12 H new ATOM 1853 N GLY B 31 155.595 10.599 5.401 1.00 0.11 N ATOM 1854 CA GLY B 31 154.472 10.179 6.279 1.00 0.11 C ATOM 1855 C GLY B 31 153.875 11.419 6.946 1.00 0.12 C ATOM 1856 O GLY B 31 152.690 11.491 7.201 1.00 0.12 O ATOM 0 H GLY B 31 156.502 10.189 5.624 1.00 0.11 H new ATOM 0 HA2 GLY B 31 153.711 9.661 5.696 1.00 0.11 H new ATOM 0 HA3 GLY B 31 154.826 9.478 7.035 1.00 0.11 H new ATOM 1860 N LYS B 32 154.698 12.391 7.236 1.00 0.13 N ATOM 1861 CA LYS B 32 154.197 13.633 7.895 1.00 0.14 C ATOM 1862 C LYS B 32 153.277 14.407 6.940 1.00 0.14 C ATOM 1863 O LYS B 32 152.279 14.969 7.349 1.00 0.15 O ATOM 1864 CB LYS B 32 155.413 14.518 8.273 1.00 0.14 C ATOM 1865 CG LYS B 32 155.466 14.782 9.789 1.00 0.15 C ATOM 1866 CD LYS B 32 156.352 16.005 10.069 1.00 0.16 C ATOM 1867 CE LYS B 32 156.851 15.963 11.512 1.00 0.16 C ATOM 1868 NZ LYS B 32 157.748 14.786 11.683 1.00 0.15 N ATOM 0 H LYS B 32 155.700 12.378 7.044 1.00 0.13 H new ATOM 0 HA LYS B 32 153.630 13.369 8.788 1.00 0.14 H new ATOM 0 HB2 LYS B 32 156.334 14.029 7.955 1.00 0.14 H new ATOM 0 HB3 LYS B 32 155.355 15.466 7.739 1.00 0.14 H new ATOM 0 HG2 LYS B 32 154.461 14.953 10.174 1.00 0.15 H new ATOM 0 HG3 LYS B 32 155.861 13.908 10.307 1.00 0.15 H new ATOM 0 HD2 LYS B 32 157.198 16.017 9.382 1.00 0.16 H new ATOM 0 HD3 LYS B 32 155.788 16.921 9.896 1.00 0.16 H new ATOM 0 HE2 LYS B 32 157.386 16.882 11.752 1.00 0.16 H new ATOM 0 HE3 LYS B 32 156.008 15.896 12.200 1.00 0.16 H new ATOM 0 HZ1 LYS B 32 158.480 15.007 12.388 1.00 0.15 H new ATOM 0 HZ2 LYS B 32 157.191 13.969 12.006 1.00 0.15 H new ATOM 0 HZ3 LYS B 32 158.200 14.559 10.774 1.00 0.15 H new ATOM 1882 N LYS B 33 153.613 14.471 5.684 1.00 0.14 N ATOM 1883 CA LYS B 33 152.761 15.243 4.739 1.00 0.15 C ATOM 1884 C LYS B 33 151.429 14.519 4.562 1.00 0.14 C ATOM 1885 O LYS B 33 150.379 15.122 4.621 1.00 0.15 O ATOM 1886 CB LYS B 33 153.493 15.368 3.402 1.00 0.15 C ATOM 1887 CG LYS B 33 154.787 16.156 3.628 1.00 0.15 C ATOM 1888 CD LYS B 33 155.554 16.305 2.306 1.00 0.15 C ATOM 1889 CE LYS B 33 156.861 17.100 2.528 1.00 0.16 C ATOM 1890 NZ LYS B 33 156.685 18.490 2.022 1.00 0.17 N ATOM 0 H LYS B 33 154.434 14.026 5.273 1.00 0.14 H new ATOM 0 HA LYS B 33 152.565 16.242 5.128 1.00 0.15 H new ATOM 0 HB2 LYS B 33 153.717 14.380 2.999 1.00 0.15 H new ATOM 0 HB3 LYS B 33 152.863 15.876 2.671 1.00 0.15 H new ATOM 0 HG2 LYS B 33 154.556 17.140 4.036 1.00 0.15 H new ATOM 0 HG3 LYS B 33 155.409 15.645 4.362 1.00 0.15 H new ATOM 0 HD2 LYS B 33 155.784 15.320 1.899 1.00 0.15 H new ATOM 0 HD3 LYS B 33 154.931 16.815 1.572 1.00 0.15 H new ATOM 0 HE2 LYS B 33 157.115 17.116 3.588 1.00 0.16 H new ATOM 0 HE3 LYS B 33 157.688 16.614 2.010 1.00 0.16 H new ATOM 0 HZ1 LYS B 33 157.563 19.027 2.170 1.00 0.17 H new ATOM 0 HZ2 LYS B 33 156.462 18.464 1.006 1.00 0.17 H new ATOM 0 HZ3 LYS B 33 155.907 18.950 2.536 1.00 0.17 H new ATOM 1904 N LEU B 34 151.453 13.228 4.387 1.00 0.13 N ATOM 1905 CA LEU B 34 150.171 12.485 4.256 1.00 0.13 C ATOM 1906 C LEU B 34 149.390 12.652 5.568 1.00 0.13 C ATOM 1907 O LEU B 34 148.187 12.811 5.585 1.00 0.14 O ATOM 1908 CB LEU B 34 150.449 11.000 3.979 1.00 0.12 C ATOM 1909 CG LEU B 34 151.159 10.835 2.623 1.00 0.11 C ATOM 1910 CD1 LEU B 34 151.856 9.463 2.580 1.00 0.10 C ATOM 1911 CD2 LEU B 34 150.137 10.936 1.453 1.00 0.12 C ATOM 0 H LEU B 34 152.298 12.659 4.329 1.00 0.13 H new ATOM 0 HA LEU B 34 149.587 12.877 3.423 1.00 0.13 H new ATOM 0 HB2 LEU B 34 151.067 10.584 4.774 1.00 0.12 H new ATOM 0 HB3 LEU B 34 149.513 10.441 3.978 1.00 0.12 H new ATOM 0 HG LEU B 34 151.895 11.631 2.511 1.00 0.11 H new ATOM 0 HD11 LEU B 34 152.360 9.341 1.621 1.00 0.10 H new ATOM 0 HD12 LEU B 34 152.588 9.401 3.386 1.00 0.10 H new ATOM 0 HD13 LEU B 34 151.114 8.674 2.702 1.00 0.10 H new ATOM 0 HD21 LEU B 34 150.658 10.817 0.503 1.00 0.12 H new ATOM 0 HD22 LEU B 34 149.387 10.152 1.556 1.00 0.12 H new ATOM 0 HD23 LEU B 34 149.649 11.910 1.479 1.00 0.12 H new ATOM 1923 N GLU B 35 150.088 12.610 6.667 1.00 0.13 N ATOM 1924 CA GLU B 35 149.413 12.760 7.991 1.00 0.14 C ATOM 1925 C GLU B 35 148.711 14.120 8.050 1.00 0.15 C ATOM 1926 O GLU B 35 147.594 14.236 8.512 1.00 0.15 O ATOM 1927 CB GLU B 35 150.464 12.664 9.100 1.00 0.14 C ATOM 1928 CG GLU B 35 149.799 12.795 10.472 1.00 0.15 C ATOM 1929 CD GLU B 35 150.850 12.595 11.565 1.00 0.15 C ATOM 1930 OE1 GLU B 35 151.945 13.111 11.409 1.00 0.15 O ATOM 1931 OE2 GLU B 35 150.548 11.919 12.536 1.00 0.15 O ATOM 0 H GLU B 35 151.099 12.478 6.709 1.00 0.13 H new ATOM 0 HA GLU B 35 148.673 11.971 8.125 1.00 0.14 H new ATOM 0 HB2 GLU B 35 150.989 11.711 9.032 1.00 0.14 H new ATOM 0 HB3 GLU B 35 151.210 13.449 8.973 1.00 0.14 H new ATOM 0 HG2 GLU B 35 149.336 13.777 10.572 1.00 0.15 H new ATOM 0 HG3 GLU B 35 149.005 12.056 10.576 1.00 0.15 H new ATOM 1938 N GLU B 36 149.355 15.146 7.565 1.00 0.15 N ATOM 1939 CA GLU B 36 148.730 16.499 7.565 1.00 0.17 C ATOM 1940 C GLU B 36 147.558 16.494 6.574 1.00 0.16 C ATOM 1941 O GLU B 36 146.699 17.354 6.600 1.00 0.17 O ATOM 1942 CB GLU B 36 149.763 17.574 7.167 1.00 0.17 C ATOM 1943 CG GLU B 36 150.119 18.425 8.396 1.00 1.16 C ATOM 1944 CD GLU B 36 151.031 19.582 7.984 1.00 1.78 C ATOM 1945 OE1 GLU B 36 151.397 19.638 6.823 1.00 2.17 O ATOM 1946 OE2 GLU B 36 151.341 20.397 8.838 1.00 2.57 O ATOM 0 H GLU B 36 150.293 15.105 7.166 1.00 0.15 H new ATOM 0 HA GLU B 36 148.370 16.737 8.566 1.00 0.17 H new ATOM 0 HB2 GLU B 36 150.660 17.101 6.767 1.00 0.17 H new ATOM 0 HB3 GLU B 36 149.358 18.208 6.378 1.00 0.17 H new ATOM 0 HG2 GLU B 36 149.210 18.813 8.856 1.00 1.16 H new ATOM 0 HG3 GLU B 36 150.616 17.808 9.144 1.00 1.16 H new ATOM 1953 N ARG B 37 147.543 15.539 5.688 1.00 0.16 N ATOM 1954 CA ARG B 37 146.457 15.473 4.669 1.00 0.16 C ATOM 1955 C ARG B 37 145.288 14.635 5.209 1.00 0.15 C ATOM 1956 O ARG B 37 144.291 14.452 4.539 1.00 0.15 O ATOM 1957 CB ARG B 37 147.007 14.833 3.394 1.00 0.15 C ATOM 1958 CG ARG B 37 148.077 15.726 2.765 1.00 0.18 C ATOM 1959 CD ARG B 37 147.458 16.965 2.135 1.00 0.29 C ATOM 1960 NE ARG B 37 148.327 17.367 0.992 1.00 1.04 N ATOM 1961 CZ ARG B 37 147.990 18.362 0.229 1.00 1.57 C ATOM 1962 NH1 ARG B 37 146.986 19.119 0.563 1.00 2.03 N ATOM 1963 NH2 ARG B 37 148.679 18.621 -0.849 1.00 2.31 N ATOM 0 H ARG B 37 148.240 14.797 5.625 1.00 0.16 H new ATOM 0 HA ARG B 37 146.099 16.479 4.449 1.00 0.16 H new ATOM 0 HB2 ARG B 37 147.430 13.855 3.624 1.00 0.15 H new ATOM 0 HB3 ARG B 37 146.197 14.670 2.683 1.00 0.15 H new ATOM 0 HG2 ARG B 37 148.799 16.023 3.525 1.00 0.18 H new ATOM 0 HG3 ARG B 37 148.624 15.164 2.008 1.00 0.18 H new ATOM 0 HD2 ARG B 37 146.445 16.755 1.791 1.00 0.29 H new ATOM 0 HD3 ARG B 37 147.387 17.771 2.865 1.00 0.29 H new ATOM 0 HE ARG B 37 149.191 16.857 0.808 1.00 1.04 H new ATOM 0 HH11 ARG B 37 146.468 18.930 1.421 1.00 2.03 H new ATOM 0 HH12 ARG B 37 146.717 19.902 -0.033 1.00 2.03 H new ATOM 0 HH21 ARG B 37 149.482 18.042 -1.092 1.00 2.31 H new ATOM 0 HH22 ARG B 37 148.414 19.403 -1.448 1.00 2.31 H new ATOM 1977 N GLY B 38 145.386 14.152 6.429 1.00 0.15 N ATOM 1978 CA GLY B 38 144.257 13.359 7.022 1.00 0.15 C ATOM 1979 C GLY B 38 144.557 11.858 6.993 1.00 0.14 C ATOM 1980 O GLY B 38 143.702 11.051 7.296 1.00 0.14 O ATOM 0 H GLY B 38 146.196 14.272 7.037 1.00 0.15 H new ATOM 0 HA2 GLY B 38 144.086 13.678 8.050 1.00 0.15 H new ATOM 0 HA3 GLY B 38 143.339 13.559 6.469 1.00 0.15 H new ATOM 1984 N PHE B 39 145.756 11.467 6.643 1.00 0.13 N ATOM 1985 CA PHE B 39 146.105 10.010 6.610 1.00 0.12 C ATOM 1986 C PHE B 39 147.026 9.692 7.793 1.00 0.12 C ATOM 1987 O PHE B 39 148.218 9.521 7.637 1.00 0.12 O ATOM 1988 CB PHE B 39 146.852 9.691 5.318 1.00 0.12 C ATOM 1989 CG PHE B 39 145.957 9.947 4.132 1.00 0.14 C ATOM 1990 CD1 PHE B 39 145.936 11.210 3.553 1.00 0.18 C ATOM 1991 CD2 PHE B 39 145.156 8.928 3.613 1.00 0.19 C ATOM 1992 CE1 PHE B 39 145.117 11.470 2.451 1.00 0.23 C ATOM 1993 CE2 PHE B 39 144.331 9.180 2.509 1.00 0.24 C ATOM 1994 CZ PHE B 39 144.310 10.454 1.928 1.00 0.25 C ATOM 0 H PHE B 39 146.514 12.096 6.377 1.00 0.13 H new ATOM 0 HA PHE B 39 145.192 9.418 6.666 1.00 0.12 H new ATOM 0 HB2 PHE B 39 147.750 10.304 5.246 1.00 0.12 H new ATOM 0 HB3 PHE B 39 147.176 8.650 5.322 1.00 0.12 H new ATOM 0 HD1 PHE B 39 146.557 11.996 3.957 1.00 0.18 H new ATOM 0 HD2 PHE B 39 145.172 7.946 4.062 1.00 0.19 H new ATOM 0 HE1 PHE B 39 145.107 12.453 2.004 1.00 0.23 H new ATOM 0 HE2 PHE B 39 143.712 8.392 2.106 1.00 0.24 H new ATOM 0 HZ PHE B 39 143.673 10.652 1.079 1.00 0.25 H new ATOM 2004 N ASP B 40 146.483 9.643 8.977 1.00 0.13 N ATOM 2005 CA ASP B 40 147.333 9.369 10.172 1.00 0.13 C ATOM 2006 C ASP B 40 147.620 7.871 10.302 1.00 0.12 C ATOM 2007 O ASP B 40 148.437 7.463 11.104 1.00 0.12 O ATOM 2008 CB ASP B 40 146.602 9.840 11.427 1.00 0.14 C ATOM 2009 CG ASP B 40 145.309 9.039 11.596 1.00 0.14 C ATOM 2010 OD1 ASP B 40 144.860 8.467 10.617 1.00 0.13 O ATOM 2011 OD2 ASP B 40 144.791 9.012 12.700 1.00 0.14 O ATOM 0 H ASP B 40 145.491 9.780 9.170 1.00 0.13 H new ATOM 0 HA ASP B 40 148.277 9.902 10.056 1.00 0.13 H new ATOM 0 HB2 ASP B 40 147.239 9.711 12.302 1.00 0.14 H new ATOM 0 HB3 ASP B 40 146.376 10.904 11.351 1.00 0.14 H new ATOM 2016 N LYS B 41 146.952 7.045 9.534 1.00 0.11 N ATOM 2017 CA LYS B 41 147.179 5.563 9.622 1.00 0.11 C ATOM 2018 C LYS B 41 147.432 5.009 8.213 1.00 0.10 C ATOM 2019 O LYS B 41 146.951 5.542 7.233 1.00 0.10 O ATOM 2020 CB LYS B 41 145.922 4.899 10.206 1.00 0.11 C ATOM 2021 CG LYS B 41 145.622 5.445 11.619 1.00 0.12 C ATOM 2022 CD LYS B 41 146.566 4.814 12.656 1.00 0.12 C ATOM 2023 CE LYS B 41 146.200 5.289 14.079 1.00 0.13 C ATOM 2024 NZ LYS B 41 146.388 4.165 15.039 1.00 0.13 N ATOM 0 H LYS B 41 146.256 7.332 8.846 1.00 0.11 H new ATOM 0 HA LYS B 41 148.039 5.356 10.260 1.00 0.11 H new ATOM 0 HB2 LYS B 41 145.070 5.083 9.551 1.00 0.11 H new ATOM 0 HB3 LYS B 41 146.063 3.819 10.250 1.00 0.11 H new ATOM 0 HG2 LYS B 41 145.736 6.529 11.628 1.00 0.12 H new ATOM 0 HG3 LYS B 41 144.587 5.232 11.885 1.00 0.12 H new ATOM 0 HD2 LYS B 41 146.502 3.727 12.601 1.00 0.12 H new ATOM 0 HD3 LYS B 41 147.597 5.084 12.430 1.00 0.12 H new ATOM 0 HE2 LYS B 41 146.826 6.134 14.365 1.00 0.13 H new ATOM 0 HE3 LYS B 41 145.167 5.635 14.104 1.00 0.13 H new ATOM 0 HZ1 LYS B 41 146.460 4.542 16.005 1.00 0.13 H new ATOM 0 HZ2 LYS B 41 145.576 3.518 14.979 1.00 0.13 H new ATOM 0 HZ3 LYS B 41 147.260 3.649 14.803 1.00 0.13 H new ATOM 2038 N ALA B 42 148.191 3.951 8.104 1.00 0.09 N ATOM 2039 CA ALA B 42 148.487 3.368 6.759 1.00 0.08 C ATOM 2040 C ALA B 42 147.201 2.872 6.087 1.00 0.08 C ATOM 2041 O ALA B 42 147.002 3.060 4.904 1.00 0.07 O ATOM 2042 CB ALA B 42 149.458 2.194 6.929 1.00 0.07 C ATOM 0 H ALA B 42 148.621 3.463 8.890 1.00 0.09 H new ATOM 0 HA ALA B 42 148.931 4.139 6.129 1.00 0.08 H new ATOM 0 HB1 ALA B 42 149.680 1.762 5.953 1.00 0.07 H new ATOM 0 HB2 ALA B 42 150.381 2.549 7.388 1.00 0.07 H new ATOM 0 HB3 ALA B 42 149.004 1.436 7.567 1.00 0.07 H new ATOM 2048 N TYR B 43 146.344 2.212 6.813 1.00 0.08 N ATOM 2049 CA TYR B 43 145.104 1.672 6.189 1.00 0.07 C ATOM 2050 C TYR B 43 144.293 2.799 5.523 1.00 0.08 C ATOM 2051 O TYR B 43 143.472 2.544 4.665 1.00 0.07 O ATOM 2052 CB TYR B 43 144.267 0.918 7.235 1.00 0.08 C ATOM 2053 CG TYR B 43 143.510 1.878 8.113 1.00 0.09 C ATOM 2054 CD1 TYR B 43 142.351 2.492 7.622 1.00 0.09 C ATOM 2055 CD2 TYR B 43 143.954 2.151 9.422 1.00 0.10 C ATOM 2056 CE1 TYR B 43 141.633 3.380 8.428 1.00 0.10 C ATOM 2057 CE2 TYR B 43 143.231 3.044 10.234 1.00 0.10 C ATOM 2058 CZ TYR B 43 142.069 3.659 9.736 1.00 0.11 C ATOM 2059 OH TYR B 43 141.357 4.538 10.528 1.00 0.12 O ATOM 0 H TYR B 43 146.448 2.023 7.810 1.00 0.08 H new ATOM 0 HA TYR B 43 145.383 0.965 5.408 1.00 0.07 H new ATOM 0 HB2 TYR B 43 143.568 0.249 6.733 1.00 0.08 H new ATOM 0 HB3 TYR B 43 144.919 0.296 7.848 1.00 0.08 H new ATOM 0 HD1 TYR B 43 142.012 2.279 6.619 1.00 0.09 H new ATOM 0 HD2 TYR B 43 144.847 1.676 9.801 1.00 0.10 H new ATOM 0 HE1 TYR B 43 140.741 3.853 8.045 1.00 0.10 H new ATOM 0 HE2 TYR B 43 143.568 3.257 11.238 1.00 0.10 H new ATOM 0 HH TYR B 43 141.793 4.618 11.402 1.00 0.12 H new ATOM 2069 N VAL B 44 144.534 4.041 5.867 1.00 0.09 N ATOM 2070 CA VAL B 44 143.783 5.148 5.189 1.00 0.09 C ATOM 2071 C VAL B 44 144.432 5.366 3.820 1.00 0.09 C ATOM 2072 O VAL B 44 143.787 5.693 2.841 1.00 0.09 O ATOM 2073 CB VAL B 44 143.877 6.463 5.991 1.00 0.10 C ATOM 2074 CG1 VAL B 44 143.001 7.554 5.325 1.00 0.11 C ATOM 2075 CG2 VAL B 44 143.436 6.242 7.453 1.00 0.11 C ATOM 0 H VAL B 44 145.206 4.335 6.576 1.00 0.09 H new ATOM 0 HA VAL B 44 142.731 4.874 5.106 1.00 0.09 H new ATOM 0 HB VAL B 44 144.915 6.795 5.993 1.00 0.10 H new ATOM 0 HG11 VAL B 44 143.073 8.479 5.898 1.00 0.11 H new ATOM 0 HG12 VAL B 44 143.350 7.729 4.307 1.00 0.11 H new ATOM 0 HG13 VAL B 44 141.963 7.223 5.301 1.00 0.11 H new ATOM 0 HG21 VAL B 44 143.510 7.181 8.001 1.00 0.11 H new ATOM 0 HG22 VAL B 44 142.404 5.890 7.473 1.00 0.11 H new ATOM 0 HG23 VAL B 44 144.082 5.498 7.919 1.00 0.11 H new ATOM 2085 N VAL B 45 145.722 5.176 3.769 1.00 0.08 N ATOM 2086 CA VAL B 45 146.465 5.364 2.494 1.00 0.08 C ATOM 2087 C VAL B 45 146.188 4.172 1.586 1.00 0.07 C ATOM 2088 O VAL B 45 145.995 4.324 0.396 1.00 0.07 O ATOM 2089 CB VAL B 45 147.970 5.460 2.769 1.00 0.08 C ATOM 2090 CG1 VAL B 45 148.761 5.436 1.431 1.00 0.08 C ATOM 2091 CG2 VAL B 45 148.246 6.755 3.551 1.00 0.09 C ATOM 0 H VAL B 45 146.297 4.896 4.564 1.00 0.08 H new ATOM 0 HA VAL B 45 146.137 6.286 2.014 1.00 0.08 H new ATOM 0 HB VAL B 45 148.298 4.607 3.363 1.00 0.08 H new ATOM 0 HG11 VAL B 45 149.829 5.505 1.638 1.00 0.08 H new ATOM 0 HG12 VAL B 45 148.553 4.506 0.902 1.00 0.08 H new ATOM 0 HG13 VAL B 45 148.456 6.281 0.813 1.00 0.08 H new ATOM 0 HG21 VAL B 45 149.314 6.837 3.754 1.00 0.09 H new ATOM 0 HG22 VAL B 45 147.922 7.612 2.961 1.00 0.09 H new ATOM 0 HG23 VAL B 45 147.698 6.735 4.493 1.00 0.09 H new ATOM 2101 N LEU B 46 146.132 2.988 2.127 1.00 0.07 N ATOM 2102 CA LEU B 46 145.829 1.822 1.261 1.00 0.06 C ATOM 2103 C LEU B 46 144.460 2.077 0.640 1.00 0.06 C ATOM 2104 O LEU B 46 144.196 1.708 -0.484 1.00 0.06 O ATOM 2105 CB LEU B 46 145.819 0.518 2.092 1.00 0.05 C ATOM 2106 CG LEU B 46 145.254 -0.675 1.280 1.00 0.05 C ATOM 2107 CD1 LEU B 46 146.202 -1.082 0.143 1.00 0.04 C ATOM 2108 CD2 LEU B 46 145.075 -1.879 2.202 1.00 0.04 C ATOM 0 H LEU B 46 146.280 2.781 3.115 1.00 0.07 H new ATOM 0 HA LEU B 46 146.588 1.703 0.487 1.00 0.06 H new ATOM 0 HB2 LEU B 46 146.833 0.288 2.420 1.00 0.05 H new ATOM 0 HB3 LEU B 46 145.219 0.664 2.990 1.00 0.05 H new ATOM 0 HG LEU B 46 144.301 -0.362 0.853 1.00 0.05 H new ATOM 0 HD11 LEU B 46 145.774 -1.921 -0.405 1.00 0.04 H new ATOM 0 HD12 LEU B 46 146.341 -0.239 -0.534 1.00 0.04 H new ATOM 0 HD13 LEU B 46 147.166 -1.375 0.560 1.00 0.04 H new ATOM 0 HD21 LEU B 46 144.678 -2.718 1.631 1.00 0.04 H new ATOM 0 HD22 LEU B 46 146.038 -2.155 2.631 1.00 0.04 H new ATOM 0 HD23 LEU B 46 144.381 -1.624 3.003 1.00 0.04 H new ATOM 2120 N GLY B 47 143.589 2.711 1.374 1.00 0.07 N ATOM 2121 CA GLY B 47 142.234 2.999 0.842 1.00 0.07 C ATOM 2122 C GLY B 47 142.351 3.844 -0.417 1.00 0.07 C ATOM 2123 O GLY B 47 141.646 3.637 -1.381 1.00 0.07 O ATOM 0 H GLY B 47 143.761 3.042 2.323 1.00 0.07 H new ATOM 0 HA2 GLY B 47 141.714 2.067 0.620 1.00 0.07 H new ATOM 0 HA3 GLY B 47 141.642 3.524 1.591 1.00 0.07 H new ATOM 2127 N GLN B 48 143.238 4.796 -0.422 1.00 0.08 N ATOM 2128 CA GLN B 48 143.396 5.649 -1.628 1.00 0.08 C ATOM 2129 C GLN B 48 143.779 4.762 -2.817 1.00 0.08 C ATOM 2130 O GLN B 48 143.269 4.908 -3.905 1.00 0.08 O ATOM 2131 CB GLN B 48 144.470 6.701 -1.347 1.00 0.09 C ATOM 2132 CG GLN B 48 143.826 7.852 -0.555 1.00 0.73 C ATOM 2133 CD GLN B 48 143.155 8.829 -1.525 1.00 0.96 C ATOM 2134 OE1 GLN B 48 141.880 9.062 -1.417 1.00 1.68 O flip ATOM 2135 NE2 GLN B 48 143.795 9.385 -2.393 1.00 1.55 N flip ATOM 0 H GLN B 48 143.859 5.020 0.355 1.00 0.08 H new ATOM 0 HA GLN B 48 142.465 6.161 -1.870 1.00 0.08 H new ATOM 0 HB2 GLN B 48 145.291 6.263 -0.779 1.00 0.09 H new ATOM 0 HB3 GLN B 48 144.891 7.072 -2.281 1.00 0.09 H new ATOM 0 HG2 GLN B 48 143.091 7.458 0.147 1.00 0.73 H new ATOM 0 HG3 GLN B 48 144.583 8.370 0.034 1.00 0.73 H new ATOM 0 HE21 GLN B 48 144.795 9.206 -2.483 1.00 1.55 H new ATOM 0 HE22 GLN B 48 143.333 10.031 -3.033 1.00 1.55 H new ATOM 2144 N PHE B 49 144.667 3.831 -2.601 1.00 0.07 N ATOM 2145 CA PHE B 49 145.092 2.909 -3.697 1.00 0.07 C ATOM 2146 C PHE B 49 143.877 2.129 -4.216 1.00 0.07 C ATOM 2147 O PHE B 49 143.725 1.900 -5.400 1.00 0.07 O ATOM 2148 CB PHE B 49 146.133 1.942 -3.125 1.00 0.06 C ATOM 2149 CG PHE B 49 146.605 0.980 -4.188 1.00 0.06 C ATOM 2150 CD1 PHE B 49 147.480 1.419 -5.199 1.00 0.07 C ATOM 2151 CD2 PHE B 49 146.187 -0.365 -4.154 1.00 0.05 C ATOM 2152 CE1 PHE B 49 147.936 0.513 -6.177 1.00 0.07 C ATOM 2153 CE2 PHE B 49 146.639 -1.268 -5.131 1.00 0.06 C ATOM 2154 CZ PHE B 49 147.516 -0.831 -6.143 1.00 0.06 C ATOM 0 H PHE B 49 145.122 3.667 -1.703 1.00 0.07 H new ATOM 0 HA PHE B 49 145.520 3.473 -4.526 1.00 0.07 H new ATOM 0 HB2 PHE B 49 146.981 2.503 -2.732 1.00 0.06 H new ATOM 0 HB3 PHE B 49 145.703 1.388 -2.291 1.00 0.06 H new ATOM 0 HD1 PHE B 49 147.802 2.450 -5.225 1.00 0.07 H new ATOM 0 HD2 PHE B 49 145.518 -0.702 -3.376 1.00 0.05 H new ATOM 0 HE1 PHE B 49 148.608 0.849 -6.953 1.00 0.07 H new ATOM 0 HE2 PHE B 49 146.314 -2.298 -5.106 1.00 0.06 H new ATOM 0 HZ PHE B 49 147.866 -1.526 -6.892 1.00 0.06 H new ATOM 2164 N LEU B 50 143.029 1.713 -3.332 1.00 0.06 N ATOM 2165 CA LEU B 50 141.830 0.935 -3.762 1.00 0.06 C ATOM 2166 C LEU B 50 140.881 1.868 -4.529 1.00 0.07 C ATOM 2167 O LEU B 50 140.259 1.478 -5.497 1.00 0.07 O ATOM 2168 CB LEU B 50 141.129 0.353 -2.534 1.00 0.05 C ATOM 2169 CG LEU B 50 142.093 -0.539 -1.726 1.00 0.05 C ATOM 2170 CD1 LEU B 50 141.369 -1.018 -0.469 1.00 0.05 C ATOM 2171 CD2 LEU B 50 142.554 -1.776 -2.523 1.00 0.04 C ATOM 0 H LEU B 50 143.107 1.874 -2.328 1.00 0.06 H new ATOM 0 HA LEU B 50 142.130 0.113 -4.412 1.00 0.06 H new ATOM 0 HB2 LEU B 50 140.759 1.161 -1.903 1.00 0.05 H new ATOM 0 HB3 LEU B 50 140.262 -0.230 -2.846 1.00 0.05 H new ATOM 0 HG LEU B 50 142.976 0.054 -1.486 1.00 0.05 H new ATOM 0 HD11 LEU B 50 142.036 -1.651 0.116 1.00 0.05 H new ATOM 0 HD12 LEU B 50 141.069 -0.157 0.129 1.00 0.05 H new ATOM 0 HD13 LEU B 50 140.485 -1.588 -0.753 1.00 0.05 H new ATOM 0 HD21 LEU B 50 143.231 -2.372 -1.911 1.00 0.04 H new ATOM 0 HD22 LEU B 50 141.687 -2.377 -2.795 1.00 0.04 H new ATOM 0 HD23 LEU B 50 143.071 -1.454 -3.427 1.00 0.04 H new ATOM 2183 N VAL B 51 140.762 3.090 -4.096 1.00 0.07 N ATOM 2184 CA VAL B 51 139.855 4.060 -4.788 1.00 0.08 C ATOM 2185 C VAL B 51 140.391 4.355 -6.199 1.00 0.09 C ATOM 2186 O VAL B 51 139.638 4.658 -7.104 1.00 0.09 O ATOM 2187 CB VAL B 51 139.781 5.359 -3.974 1.00 0.09 C ATOM 2188 CG1 VAL B 51 139.049 6.452 -4.780 1.00 0.11 C ATOM 2189 CG2 VAL B 51 139.025 5.084 -2.669 1.00 0.09 C ATOM 0 H VAL B 51 141.256 3.466 -3.287 1.00 0.07 H new ATOM 0 HA VAL B 51 138.857 3.630 -4.871 1.00 0.08 H new ATOM 0 HB VAL B 51 140.790 5.707 -3.753 1.00 0.09 H new ATOM 0 HG11 VAL B 51 139.003 7.369 -4.192 1.00 0.11 H new ATOM 0 HG12 VAL B 51 139.589 6.643 -5.708 1.00 0.11 H new ATOM 0 HG13 VAL B 51 138.037 6.118 -5.011 1.00 0.11 H new ATOM 0 HG21 VAL B 51 138.966 6.001 -2.082 1.00 0.09 H new ATOM 0 HG22 VAL B 51 138.018 4.735 -2.898 1.00 0.09 H new ATOM 0 HG23 VAL B 51 139.552 4.320 -2.097 1.00 0.09 H new ATOM 2199 N LEU B 52 141.680 4.279 -6.394 1.00 0.09 N ATOM 2200 CA LEU B 52 142.250 4.577 -7.749 1.00 0.09 C ATOM 2201 C LEU B 52 142.254 3.320 -8.623 1.00 0.09 C ATOM 2202 O LEU B 52 142.890 3.282 -9.654 1.00 0.09 O ATOM 2203 CB LEU B 52 143.672 5.089 -7.598 1.00 0.09 C ATOM 2204 CG LEU B 52 143.667 6.407 -6.815 1.00 0.11 C ATOM 2205 CD1 LEU B 52 145.114 6.846 -6.586 1.00 0.13 C ATOM 2206 CD2 LEU B 52 142.909 7.490 -7.609 1.00 0.14 C ATOM 0 H LEU B 52 142.364 4.025 -5.681 1.00 0.09 H new ATOM 0 HA LEU B 52 141.630 5.335 -8.228 1.00 0.09 H new ATOM 0 HB2 LEU B 52 144.282 4.349 -7.079 1.00 0.09 H new ATOM 0 HB3 LEU B 52 144.120 5.240 -8.580 1.00 0.09 H new ATOM 0 HG LEU B 52 143.166 6.265 -5.857 1.00 0.11 H new ATOM 0 HD11 LEU B 52 145.126 7.783 -6.030 1.00 0.13 H new ATOM 0 HD12 LEU B 52 145.641 6.080 -6.018 1.00 0.13 H new ATOM 0 HD13 LEU B 52 145.607 6.988 -7.547 1.00 0.13 H new ATOM 0 HD21 LEU B 52 142.911 8.423 -7.045 1.00 0.14 H new ATOM 0 HD22 LEU B 52 143.399 7.646 -8.570 1.00 0.14 H new ATOM 0 HD23 LEU B 52 141.881 7.168 -7.774 1.00 0.14 H new ATOM 2218 N LYS B 53 141.546 2.297 -8.245 1.00 0.08 N ATOM 2219 CA LYS B 53 141.512 1.066 -9.088 1.00 0.08 C ATOM 2220 C LYS B 53 142.931 0.617 -9.459 1.00 0.08 C ATOM 2221 O LYS B 53 143.166 0.119 -10.541 1.00 0.09 O ATOM 2222 CB LYS B 53 140.739 1.346 -10.378 1.00 0.09 C ATOM 2223 CG LYS B 53 139.280 1.669 -10.060 1.00 0.14 C ATOM 2224 CD LYS B 53 138.536 1.952 -11.367 1.00 0.36 C ATOM 2225 CE LYS B 53 137.102 2.387 -11.063 1.00 1.29 C ATOM 2226 NZ LYS B 53 136.416 2.745 -12.337 1.00 1.84 N ATOM 0 H LYS B 53 140.989 2.256 -7.391 1.00 0.08 H new ATOM 0 HA LYS B 53 141.024 0.278 -8.515 1.00 0.08 H new ATOM 0 HB2 LYS B 53 141.196 2.180 -10.910 1.00 0.09 H new ATOM 0 HB3 LYS B 53 140.792 0.480 -11.037 1.00 0.09 H new ATOM 0 HG2 LYS B 53 138.815 0.834 -9.535 1.00 0.14 H new ATOM 0 HG3 LYS B 53 139.221 2.533 -9.399 1.00 0.14 H new ATOM 0 HD2 LYS B 53 139.051 2.732 -11.928 1.00 0.36 H new ATOM 0 HD3 LYS B 53 138.530 1.060 -11.993 1.00 0.36 H new ATOM 0 HE2 LYS B 53 136.564 1.583 -10.561 1.00 1.29 H new ATOM 0 HE3 LYS B 53 137.105 3.241 -10.385 1.00 1.29 H new ATOM 0 HZ1 LYS B 53 135.440 3.042 -12.134 1.00 1.84 H new ATOM 0 HZ2 LYS B 53 136.926 3.525 -12.799 1.00 1.84 H new ATOM 0 HZ3 LYS B 53 136.403 1.919 -12.968 1.00 1.84 H new ATOM 2240 N LYS B 54 143.876 0.785 -8.570 1.00 0.08 N ATOM 2241 CA LYS B 54 145.283 0.368 -8.853 1.00 0.08 C ATOM 2242 C LYS B 54 145.815 1.125 -10.074 1.00 0.09 C ATOM 2243 O LYS B 54 146.786 0.709 -10.674 1.00 0.09 O ATOM 2244 CB LYS B 54 145.350 -1.133 -9.170 1.00 0.08 C ATOM 2245 CG LYS B 54 144.504 -1.949 -8.187 1.00 0.07 C ATOM 2246 CD LYS B 54 144.655 -3.448 -8.531 1.00 0.07 C ATOM 2247 CE LYS B 54 143.485 -4.283 -7.967 1.00 0.06 C ATOM 2248 NZ LYS B 54 143.861 -4.827 -6.633 1.00 0.06 N ATOM 0 H LYS B 54 143.731 1.198 -7.649 1.00 0.08 H new ATOM 0 HA LYS B 54 145.881 0.590 -7.969 1.00 0.08 H new ATOM 0 HB2 LYS B 54 144.999 -1.308 -10.187 1.00 0.08 H new ATOM 0 HB3 LYS B 54 146.386 -1.470 -9.128 1.00 0.08 H new ATOM 0 HG2 LYS B 54 144.828 -1.762 -7.163 1.00 0.07 H new ATOM 0 HG3 LYS B 54 143.458 -1.650 -8.250 1.00 0.07 H new ATOM 0 HD2 LYS B 54 144.701 -3.570 -9.613 1.00 0.07 H new ATOM 0 HD3 LYS B 54 145.596 -3.821 -8.128 1.00 0.07 H new ATOM 0 HE2 LYS B 54 142.591 -3.665 -7.881 1.00 0.06 H new ATOM 0 HE3 LYS B 54 143.244 -5.098 -8.649 1.00 0.06 H new ATOM 0 HZ1 LYS B 54 143.073 -5.389 -6.253 1.00 0.06 H new ATOM 0 HZ2 LYS B 54 144.703 -5.430 -6.729 1.00 0.06 H new ATOM 0 HZ3 LYS B 54 144.070 -4.042 -5.984 1.00 0.06 H new ATOM 2262 N ASP B 55 145.235 2.230 -10.449 1.00 0.09 N ATOM 2263 CA ASP B 55 145.801 2.949 -11.622 1.00 0.10 C ATOM 2264 C ASP B 55 147.177 3.457 -11.201 1.00 0.11 C ATOM 2265 O ASP B 55 147.300 4.348 -10.385 1.00 0.11 O ATOM 2266 CB ASP B 55 144.869 4.087 -12.035 1.00 0.11 C ATOM 2267 CG ASP B 55 145.565 4.992 -13.058 1.00 0.15 C ATOM 2268 OD1 ASP B 55 146.742 5.254 -12.894 1.00 0.66 O ATOM 2269 OD2 ASP B 55 144.907 5.397 -14.001 1.00 0.46 O ATOM 0 H ASP B 55 144.419 2.656 -10.010 1.00 0.09 H new ATOM 0 HA ASP B 55 145.898 2.298 -12.491 1.00 0.10 H new ATOM 0 HB2 ASP B 55 143.952 3.680 -12.462 1.00 0.11 H new ATOM 0 HB3 ASP B 55 144.582 4.669 -11.159 1.00 0.11 H new ATOM 2274 N GLU B 56 148.212 2.876 -11.730 1.00 0.11 N ATOM 2275 CA GLU B 56 149.583 3.292 -11.348 1.00 0.11 C ATOM 2276 C GLU B 56 149.840 4.755 -11.713 1.00 0.12 C ATOM 2277 O GLU B 56 150.453 5.483 -10.972 1.00 0.12 O ATOM 2278 CB GLU B 56 150.588 2.395 -12.071 1.00 0.11 C ATOM 2279 CG GLU B 56 152.008 2.748 -11.629 1.00 0.11 C ATOM 2280 CD GLU B 56 152.993 1.763 -12.259 1.00 0.11 C ATOM 2281 OE1 GLU B 56 152.538 0.807 -12.866 1.00 0.12 O ATOM 2282 OE2 GLU B 56 154.187 1.979 -12.122 1.00 0.12 O ATOM 0 H GLU B 56 148.165 2.124 -12.417 1.00 0.11 H new ATOM 0 HA GLU B 56 149.694 3.193 -10.268 1.00 0.11 H new ATOM 0 HB2 GLU B 56 150.379 1.348 -11.852 1.00 0.11 H new ATOM 0 HB3 GLU B 56 150.491 2.520 -13.149 1.00 0.11 H new ATOM 0 HG2 GLU B 56 152.252 3.767 -11.930 1.00 0.11 H new ATOM 0 HG3 GLU B 56 152.083 2.710 -10.542 1.00 0.11 H new ATOM 2289 N ASP B 57 149.381 5.204 -12.845 1.00 0.12 N ATOM 2290 CA ASP B 57 149.636 6.625 -13.217 1.00 0.13 C ATOM 2291 C ASP B 57 148.837 7.555 -12.305 1.00 0.13 C ATOM 2292 O ASP B 57 149.328 8.574 -11.873 1.00 0.14 O ATOM 2293 CB ASP B 57 149.223 6.856 -14.671 1.00 0.14 C ATOM 2294 CG ASP B 57 150.197 6.129 -15.600 1.00 0.15 C ATOM 2295 OD1 ASP B 57 151.249 5.731 -15.128 1.00 0.14 O ATOM 2296 OD2 ASP B 57 149.876 5.987 -16.769 1.00 0.15 O ATOM 0 H ASP B 57 148.847 4.659 -13.522 1.00 0.12 H new ATOM 0 HA ASP B 57 150.699 6.838 -13.102 1.00 0.13 H new ATOM 0 HB2 ASP B 57 148.208 6.493 -14.834 1.00 0.14 H new ATOM 0 HB3 ASP B 57 149.219 7.923 -14.894 1.00 0.14 H new ATOM 2301 N LEU B 58 147.629 7.210 -11.992 1.00 0.13 N ATOM 2302 CA LEU B 58 146.839 8.092 -11.085 1.00 0.13 C ATOM 2303 C LEU B 58 147.417 8.007 -9.672 1.00 0.12 C ATOM 2304 O LEU B 58 147.507 8.994 -8.969 1.00 0.12 O ATOM 2305 CB LEU B 58 145.361 7.696 -11.056 1.00 0.12 C ATOM 2306 CG LEU B 58 144.686 8.013 -12.404 1.00 0.17 C ATOM 2307 CD1 LEU B 58 143.287 7.358 -12.462 1.00 0.16 C ATOM 2308 CD2 LEU B 58 144.540 9.536 -12.570 1.00 0.23 C ATOM 0 H LEU B 58 147.153 6.368 -12.316 1.00 0.13 H new ATOM 0 HA LEU B 58 146.904 9.112 -11.462 1.00 0.13 H new ATOM 0 HB2 LEU B 58 145.269 6.632 -10.839 1.00 0.12 H new ATOM 0 HB3 LEU B 58 144.852 8.230 -10.254 1.00 0.12 H new ATOM 0 HG LEU B 58 145.305 7.616 -13.208 1.00 0.17 H new ATOM 0 HD11 LEU B 58 142.817 7.587 -13.418 1.00 0.16 H new ATOM 0 HD12 LEU B 58 143.386 6.278 -12.356 1.00 0.16 H new ATOM 0 HD13 LEU B 58 142.670 7.746 -11.652 1.00 0.16 H new ATOM 0 HD21 LEU B 58 144.062 9.754 -13.525 1.00 0.23 H new ATOM 0 HD22 LEU B 58 143.929 9.933 -11.760 1.00 0.23 H new ATOM 0 HD23 LEU B 58 145.525 10.001 -12.543 1.00 0.23 H new ATOM 2320 N PHE B 59 147.823 6.838 -9.256 1.00 0.11 N ATOM 2321 CA PHE B 59 148.409 6.696 -7.893 1.00 0.11 C ATOM 2322 C PHE B 59 149.713 7.485 -7.788 1.00 0.11 C ATOM 2323 O PHE B 59 149.918 8.237 -6.856 1.00 0.11 O ATOM 2324 CB PHE B 59 148.678 5.219 -7.585 1.00 0.10 C ATOM 2325 CG PHE B 59 149.324 5.099 -6.224 1.00 0.09 C ATOM 2326 CD1 PHE B 59 148.524 5.005 -5.068 1.00 0.09 C ATOM 2327 CD2 PHE B 59 150.728 5.079 -6.111 1.00 0.09 C ATOM 2328 CE1 PHE B 59 149.129 4.894 -3.800 1.00 0.08 C ATOM 2329 CE2 PHE B 59 151.332 4.967 -4.844 1.00 0.09 C ATOM 2330 CZ PHE B 59 150.532 4.875 -3.688 1.00 0.08 C ATOM 0 H PHE B 59 147.774 5.977 -9.800 1.00 0.11 H new ATOM 0 HA PHE B 59 147.696 7.091 -7.170 1.00 0.11 H new ATOM 0 HB2 PHE B 59 147.745 4.656 -7.608 1.00 0.10 H new ATOM 0 HB3 PHE B 59 149.328 4.790 -8.347 1.00 0.10 H new ATOM 0 HD1 PHE B 59 147.447 5.018 -5.154 1.00 0.09 H new ATOM 0 HD2 PHE B 59 151.342 5.150 -6.997 1.00 0.09 H new ATOM 0 HE1 PHE B 59 148.516 4.823 -2.914 1.00 0.08 H new ATOM 0 HE2 PHE B 59 152.408 4.952 -4.758 1.00 0.09 H new ATOM 0 HZ PHE B 59 150.995 4.790 -2.716 1.00 0.08 H new ATOM 2340 N ARG B 60 150.612 7.307 -8.721 1.00 0.11 N ATOM 2341 CA ARG B 60 151.903 8.037 -8.631 1.00 0.12 C ATOM 2342 C ARG B 60 151.655 9.544 -8.716 1.00 0.13 C ATOM 2343 O ARG B 60 152.245 10.313 -7.984 1.00 0.13 O ATOM 2344 CB ARG B 60 152.862 7.586 -9.744 1.00 0.12 C ATOM 2345 CG ARG B 60 153.191 6.099 -9.536 1.00 0.11 C ATOM 2346 CD ARG B 60 154.361 5.661 -10.416 1.00 0.12 C ATOM 2347 NE ARG B 60 154.069 6.052 -11.830 1.00 0.13 N ATOM 2348 CZ ARG B 60 154.833 5.642 -12.800 1.00 0.13 C ATOM 2349 NH1 ARG B 60 155.754 4.745 -12.565 1.00 0.13 N ATOM 2350 NH2 ARG B 60 154.658 6.094 -14.011 1.00 0.14 N ATOM 0 H ARG B 60 150.507 6.695 -9.530 1.00 0.11 H new ATOM 0 HA ARG B 60 152.368 7.808 -7.672 1.00 0.12 H new ATOM 0 HB2 ARG B 60 152.405 7.739 -10.722 1.00 0.12 H new ATOM 0 HB3 ARG B 60 153.774 8.182 -9.722 1.00 0.12 H new ATOM 0 HG2 ARG B 60 153.435 5.921 -8.489 1.00 0.11 H new ATOM 0 HG3 ARG B 60 152.314 5.495 -9.766 1.00 0.11 H new ATOM 0 HD2 ARG B 60 155.285 6.130 -10.077 1.00 0.12 H new ATOM 0 HD3 ARG B 60 154.505 4.583 -10.344 1.00 0.12 H new ATOM 0 HE ARG B 60 153.265 6.645 -12.035 1.00 0.13 H new ATOM 0 HH11 ARG B 60 155.872 4.369 -11.624 1.00 0.13 H new ATOM 0 HH12 ARG B 60 156.355 4.421 -13.323 1.00 0.13 H new ATOM 0 HH21 ARG B 60 153.920 6.772 -14.201 1.00 0.14 H new ATOM 0 HH22 ARG B 60 155.259 5.770 -14.768 1.00 0.14 H new ATOM 2364 N GLU B 61 150.781 9.986 -9.582 1.00 0.13 N ATOM 2365 CA GLU B 61 150.510 11.448 -9.664 1.00 0.14 C ATOM 2366 C GLU B 61 149.872 11.889 -8.337 1.00 0.14 C ATOM 2367 O GLU B 61 150.168 12.944 -7.814 1.00 0.15 O ATOM 2368 CB GLU B 61 149.568 11.734 -10.843 1.00 0.15 C ATOM 2369 CG GLU B 61 149.918 13.091 -11.469 1.00 1.14 C ATOM 2370 CD GLU B 61 149.109 13.287 -12.752 1.00 1.75 C ATOM 2371 OE1 GLU B 61 148.272 12.446 -13.036 1.00 2.11 O ATOM 2372 OE2 GLU B 61 149.348 14.270 -13.434 1.00 2.57 O ATOM 0 H GLU B 61 150.249 9.404 -10.229 1.00 0.13 H new ATOM 0 HA GLU B 61 151.434 12.003 -9.829 1.00 0.14 H new ATOM 0 HB2 GLU B 61 149.655 10.945 -11.590 1.00 0.15 H new ATOM 0 HB3 GLU B 61 148.533 11.737 -10.501 1.00 0.15 H new ATOM 0 HG2 GLU B 61 149.702 13.894 -10.765 1.00 1.14 H new ATOM 0 HG3 GLU B 61 150.985 13.137 -11.689 1.00 1.14 H new ATOM 2379 N TRP B 62 148.994 11.090 -7.798 1.00 0.13 N ATOM 2380 CA TRP B 62 148.336 11.464 -6.512 1.00 0.13 C ATOM 2381 C TRP B 62 149.355 11.540 -5.371 1.00 0.13 C ATOM 2382 O TRP B 62 149.390 12.495 -4.627 1.00 0.13 O ATOM 2383 CB TRP B 62 147.252 10.435 -6.180 1.00 0.12 C ATOM 2384 CG TRP B 62 146.770 10.667 -4.787 1.00 0.29 C ATOM 2385 CD1 TRP B 62 146.148 11.788 -4.351 1.00 0.52 C ATOM 2386 CD2 TRP B 62 146.865 9.779 -3.645 1.00 0.42 C ATOM 2387 NE1 TRP B 62 145.874 11.647 -3.002 1.00 0.69 N ATOM 2388 CE2 TRP B 62 146.297 10.422 -2.522 1.00 0.63 C ATOM 2389 CE3 TRP B 62 147.393 8.491 -3.478 1.00 0.52 C ATOM 2390 CZ2 TRP B 62 146.259 9.804 -1.273 1.00 0.80 C ATOM 2391 CZ3 TRP B 62 147.358 7.865 -2.226 1.00 0.72 C ATOM 2392 CH2 TRP B 62 146.795 8.518 -1.126 1.00 0.82 C ATOM 0 H TRP B 62 148.703 10.195 -8.191 1.00 0.13 H new ATOM 0 HA TRP B 62 147.886 12.450 -6.625 1.00 0.13 H new ATOM 0 HB2 TRP B 62 146.424 10.521 -6.884 1.00 0.12 H new ATOM 0 HB3 TRP B 62 147.650 9.425 -6.277 1.00 0.12 H new ATOM 0 HD1 TRP B 62 145.906 12.649 -4.956 1.00 0.52 H new ATOM 0 HE1 TRP B 62 145.417 12.359 -2.432 1.00 0.69 H new ATOM 0 HE3 TRP B 62 147.830 7.978 -4.322 1.00 0.52 H new ATOM 0 HZ2 TRP B 62 145.820 10.312 -0.427 1.00 0.80 H new ATOM 0 HZ3 TRP B 62 147.768 6.873 -2.110 1.00 0.72 H new ATOM 0 HH2 TRP B 62 146.773 8.031 -0.162 1.00 0.82 H new ATOM 2403 N LEU B 63 150.175 10.545 -5.219 1.00 0.12 N ATOM 2404 CA LEU B 63 151.169 10.573 -4.111 1.00 0.12 C ATOM 2405 C LEU B 63 152.177 11.697 -4.350 1.00 0.13 C ATOM 2406 O LEU B 63 152.467 12.486 -3.474 1.00 0.13 O ATOM 2407 CB LEU B 63 151.891 9.220 -4.062 1.00 0.11 C ATOM 2408 CG LEU B 63 151.927 8.673 -2.625 1.00 0.10 C ATOM 2409 CD1 LEU B 63 152.709 9.628 -1.707 1.00 0.11 C ATOM 2410 CD2 LEU B 63 150.491 8.515 -2.102 1.00 0.10 C ATOM 0 H LEU B 63 150.203 9.714 -5.810 1.00 0.12 H new ATOM 0 HA LEU B 63 150.664 10.754 -3.162 1.00 0.12 H new ATOM 0 HB2 LEU B 63 151.385 8.509 -4.714 1.00 0.11 H new ATOM 0 HB3 LEU B 63 152.908 9.331 -4.439 1.00 0.11 H new ATOM 0 HG LEU B 63 152.426 7.704 -2.628 1.00 0.10 H new ATOM 0 HD11 LEU B 63 152.725 9.227 -0.694 1.00 0.11 H new ATOM 0 HD12 LEU B 63 153.730 9.730 -2.073 1.00 0.11 H new ATOM 0 HD13 LEU B 63 152.226 10.605 -1.702 1.00 0.11 H new ATOM 0 HD21 LEU B 63 150.515 8.127 -1.084 1.00 0.10 H new ATOM 0 HD22 LEU B 63 149.992 9.484 -2.110 1.00 0.10 H new ATOM 0 HD23 LEU B 63 149.945 7.821 -2.741 1.00 0.10 H new ATOM 2422 N LYS B 64 152.707 11.771 -5.533 1.00 0.13 N ATOM 2423 CA LYS B 64 153.695 12.838 -5.852 1.00 0.14 C ATOM 2424 C LYS B 64 153.054 14.218 -5.685 1.00 0.15 C ATOM 2425 O LYS B 64 153.600 15.099 -5.051 1.00 0.15 O ATOM 2426 CB LYS B 64 154.176 12.665 -7.294 1.00 0.14 C ATOM 2427 CG LYS B 64 155.324 13.636 -7.580 1.00 0.15 C ATOM 2428 CD LYS B 64 155.944 13.303 -8.938 1.00 0.15 C ATOM 2429 CE LYS B 64 157.140 14.231 -9.218 1.00 0.16 C ATOM 2430 NZ LYS B 64 157.821 13.787 -10.466 1.00 0.16 N ATOM 0 H LYS B 64 152.498 11.134 -6.302 1.00 0.13 H new ATOM 0 HA LYS B 64 154.541 12.759 -5.170 1.00 0.14 H new ATOM 0 HB2 LYS B 64 154.507 11.639 -7.456 1.00 0.14 H new ATOM 0 HB3 LYS B 64 153.353 12.847 -7.985 1.00 0.14 H new ATOM 0 HG2 LYS B 64 154.956 14.662 -7.577 1.00 0.15 H new ATOM 0 HG3 LYS B 64 156.078 13.566 -6.796 1.00 0.15 H new ATOM 0 HD2 LYS B 64 156.270 12.263 -8.952 1.00 0.15 H new ATOM 0 HD3 LYS B 64 155.197 13.413 -9.724 1.00 0.15 H new ATOM 0 HE2 LYS B 64 156.800 15.261 -9.322 1.00 0.16 H new ATOM 0 HE3 LYS B 64 157.838 14.208 -8.381 1.00 0.16 H new ATOM 0 HZ1 LYS B 64 158.630 14.410 -10.660 1.00 0.16 H new ATOM 0 HZ2 LYS B 64 158.157 12.810 -10.349 1.00 0.16 H new ATOM 0 HZ3 LYS B 64 157.152 13.830 -11.261 1.00 0.16 H new ATOM 2444 N ASP B 65 151.905 14.411 -6.268 1.00 0.15 N ATOM 2445 CA ASP B 65 151.223 15.732 -6.172 1.00 0.16 C ATOM 2446 C ASP B 65 150.772 15.980 -4.730 1.00 0.16 C ATOM 2447 O ASP B 65 150.649 17.107 -4.295 1.00 0.17 O ATOM 2448 CB ASP B 65 150.007 15.762 -7.115 1.00 0.16 C ATOM 2449 CG ASP B 65 149.761 17.186 -7.637 1.00 1.11 C ATOM 2450 OD1 ASP B 65 150.594 18.045 -7.401 1.00 1.75 O ATOM 2451 OD2 ASP B 65 148.744 17.387 -8.281 1.00 1.43 O ATOM 0 H ASP B 65 151.405 13.706 -6.810 1.00 0.15 H new ATOM 0 HA ASP B 65 151.920 16.516 -6.466 1.00 0.16 H new ATOM 0 HB2 ASP B 65 150.174 15.086 -7.953 1.00 0.16 H new ATOM 0 HB3 ASP B 65 149.122 15.404 -6.588 1.00 0.16 H new ATOM 2456 N THR B 66 150.504 14.936 -3.995 1.00 0.15 N ATOM 2457 CA THR B 66 150.033 15.106 -2.589 1.00 0.15 C ATOM 2458 C THR B 66 151.213 15.369 -1.644 1.00 0.15 C ATOM 2459 O THR B 66 151.059 16.071 -0.664 1.00 0.15 O ATOM 2460 CB THR B 66 149.278 13.835 -2.152 1.00 0.14 C ATOM 2461 OG1 THR B 66 148.176 13.637 -3.025 1.00 0.14 O ATOM 2462 CG2 THR B 66 148.739 13.959 -0.708 1.00 0.14 C ATOM 0 H THR B 66 150.591 13.969 -4.308 1.00 0.15 H new ATOM 0 HA THR B 66 149.366 15.967 -2.541 1.00 0.15 H new ATOM 0 HB THR B 66 149.974 12.997 -2.191 1.00 0.14 H new ATOM 0 HG1 THR B 66 148.326 12.832 -3.563 1.00 0.14 H new ATOM 0 HG21 THR B 66 148.213 13.044 -0.436 1.00 0.14 H new ATOM 0 HG22 THR B 66 149.571 14.117 -0.021 1.00 0.14 H new ATOM 0 HG23 THR B 66 148.053 14.804 -0.647 1.00 0.14 H new ATOM 2470 N CYS B 67 152.378 14.803 -1.883 1.00 0.14 N ATOM 2471 CA CYS B 67 153.527 15.017 -0.935 1.00 0.14 C ATOM 2472 C CYS B 67 154.812 15.419 -1.664 1.00 0.15 C ATOM 2473 O CYS B 67 155.658 16.090 -1.109 1.00 0.15 O ATOM 2474 CB CYS B 67 153.781 13.715 -0.176 1.00 0.13 C ATOM 2475 SG CYS B 67 154.427 12.468 -1.317 1.00 0.13 S ATOM 0 H CYS B 67 152.582 14.208 -2.686 1.00 0.14 H new ATOM 0 HA CYS B 67 153.259 15.829 -0.259 1.00 0.14 H new ATOM 0 HB2 CYS B 67 154.491 13.886 0.633 1.00 0.13 H new ATOM 0 HB3 CYS B 67 152.857 13.361 0.281 1.00 0.13 H new ATOM 0 HG CYS B 67 153.749 12.501 -2.425 1.00 0.13 H new ATOM 2481 N GLY B 68 154.977 15.001 -2.894 1.00 0.15 N ATOM 2482 CA GLY B 68 156.223 15.345 -3.653 1.00 0.15 C ATOM 2483 C GLY B 68 157.120 14.108 -3.734 1.00 0.14 C ATOM 2484 O GLY B 68 158.275 14.193 -4.100 1.00 0.14 O ATOM 0 H GLY B 68 154.302 14.435 -3.408 1.00 0.15 H new ATOM 0 HA2 GLY B 68 155.969 15.691 -4.655 1.00 0.15 H new ATOM 0 HA3 GLY B 68 156.751 16.160 -3.158 1.00 0.15 H new ATOM 2488 N ALA B 69 156.599 12.955 -3.408 1.00 0.13 N ATOM 2489 CA ALA B 69 157.430 11.720 -3.482 1.00 0.13 C ATOM 2490 C ALA B 69 158.077 11.647 -4.861 1.00 0.13 C ATOM 2491 O ALA B 69 157.574 12.203 -5.818 1.00 0.14 O ATOM 2492 CB ALA B 69 156.548 10.489 -3.277 1.00 0.12 C ATOM 0 H ALA B 69 155.638 12.816 -3.095 1.00 0.13 H new ATOM 0 HA ALA B 69 158.195 11.747 -2.706 1.00 0.13 H new ATOM 0 HB1 ALA B 69 157.161 9.589 -3.332 1.00 0.12 H new ATOM 0 HB2 ALA B 69 156.070 10.543 -2.299 1.00 0.12 H new ATOM 0 HB3 ALA B 69 155.784 10.456 -4.053 1.00 0.12 H new ATOM 2498 N ASN B 70 159.186 10.977 -4.982 1.00 0.13 N ATOM 2499 CA ASN B 70 159.856 10.892 -6.309 1.00 0.13 C ATOM 2500 C ASN B 70 159.310 9.697 -7.084 1.00 0.13 C ATOM 2501 O ASN B 70 158.630 8.847 -6.544 1.00 0.12 O ATOM 2502 CB ASN B 70 161.360 10.702 -6.101 1.00 0.13 C ATOM 2503 CG ASN B 70 161.963 11.984 -5.530 1.00 0.14 C ATOM 2504 OD1 ASN B 70 161.336 12.668 -4.746 1.00 0.14 O ATOM 2505 ND2 ASN B 70 163.163 12.343 -5.895 1.00 0.14 N ATOM 0 H ASN B 70 159.657 10.485 -4.223 1.00 0.13 H new ATOM 0 HA ASN B 70 159.667 11.808 -6.868 1.00 0.13 H new ATOM 0 HB2 ASN B 70 161.541 9.869 -5.422 1.00 0.13 H new ATOM 0 HB3 ASN B 70 161.840 10.452 -7.047 1.00 0.13 H new ATOM 0 HD21 ASN B 70 163.575 13.198 -5.522 1.00 0.14 H new ATOM 0 HD22 ASN B 70 163.689 11.768 -6.553 1.00 0.14 H new ATOM 2512 N ALA B 71 159.616 9.622 -8.345 1.00 0.13 N ATOM 2513 CA ALA B 71 159.131 8.481 -9.161 1.00 0.13 C ATOM 2514 C ALA B 71 159.586 7.187 -8.494 1.00 0.12 C ATOM 2515 O ALA B 71 158.940 6.170 -8.576 1.00 0.12 O ATOM 2516 CB ALA B 71 159.743 8.574 -10.565 1.00 0.14 C ATOM 0 H ALA B 71 160.183 10.305 -8.848 1.00 0.13 H new ATOM 0 HA ALA B 71 158.044 8.501 -9.238 1.00 0.13 H new ATOM 0 HB1 ALA B 71 159.392 7.739 -11.171 1.00 0.14 H new ATOM 0 HB2 ALA B 71 159.443 9.512 -11.031 1.00 0.14 H new ATOM 0 HB3 ALA B 71 160.830 8.537 -10.491 1.00 0.14 H new ATOM 2522 N LYS B 72 160.724 7.226 -7.871 1.00 0.12 N ATOM 2523 CA LYS B 72 161.306 6.018 -7.222 1.00 0.11 C ATOM 2524 C LYS B 72 160.514 5.593 -5.977 1.00 0.10 C ATOM 2525 O LYS B 72 160.189 4.431 -5.797 1.00 0.10 O ATOM 2526 CB LYS B 72 162.725 6.422 -6.827 1.00 0.12 C ATOM 2527 CG LYS B 72 163.573 5.223 -6.414 1.00 0.11 C ATOM 2528 CD LYS B 72 165.026 5.707 -6.286 1.00 0.11 C ATOM 2529 CE LYS B 72 165.932 4.617 -5.691 1.00 0.11 C ATOM 2530 NZ LYS B 72 167.230 4.627 -6.424 1.00 0.12 N ATOM 0 H LYS B 72 161.294 8.067 -7.780 1.00 0.12 H new ATOM 0 HA LYS B 72 161.282 5.164 -7.899 1.00 0.11 H new ATOM 0 HB2 LYS B 72 163.202 6.931 -7.665 1.00 0.12 H new ATOM 0 HB3 LYS B 72 162.682 7.135 -6.004 1.00 0.12 H new ATOM 0 HG2 LYS B 72 163.221 4.812 -5.468 1.00 0.11 H new ATOM 0 HG3 LYS B 72 163.498 4.427 -7.155 1.00 0.11 H new ATOM 0 HD2 LYS B 72 165.401 5.998 -7.267 1.00 0.11 H new ATOM 0 HD3 LYS B 72 165.061 6.595 -5.655 1.00 0.11 H new ATOM 0 HE2 LYS B 72 166.096 4.799 -4.629 1.00 0.11 H new ATOM 0 HE3 LYS B 72 165.456 3.640 -5.777 1.00 0.11 H new ATOM 0 HZ1 LYS B 72 167.855 3.894 -6.033 1.00 0.12 H new ATOM 0 HZ2 LYS B 72 167.061 4.436 -7.432 1.00 0.12 H new ATOM 0 HZ3 LYS B 72 167.681 5.558 -6.319 1.00 0.12 H new ATOM 2544 N GLN B 73 160.236 6.511 -5.094 1.00 0.10 N ATOM 2545 CA GLN B 73 159.515 6.153 -3.842 1.00 0.10 C ATOM 2546 C GLN B 73 158.084 5.733 -4.141 1.00 0.09 C ATOM 2547 O GLN B 73 157.503 4.926 -3.441 1.00 0.09 O ATOM 2548 CB GLN B 73 159.526 7.353 -2.895 1.00 0.10 C ATOM 2549 CG GLN B 73 160.982 7.769 -2.646 1.00 0.10 C ATOM 2550 CD GLN B 73 161.083 8.603 -1.370 1.00 0.10 C ATOM 2551 OE1 GLN B 73 160.427 9.615 -1.234 1.00 0.11 O ATOM 2552 NE2 GLN B 73 161.891 8.209 -0.423 1.00 0.10 N ATOM 0 H GLN B 73 160.478 7.497 -5.186 1.00 0.10 H new ATOM 0 HA GLN B 73 160.020 5.310 -3.371 1.00 0.10 H new ATOM 0 HB2 GLN B 73 158.965 8.181 -3.328 1.00 0.10 H new ATOM 0 HB3 GLN B 73 159.040 7.096 -1.954 1.00 0.10 H new ATOM 0 HG2 GLN B 73 161.611 6.883 -2.561 1.00 0.10 H new ATOM 0 HG3 GLN B 73 161.354 8.343 -3.495 1.00 0.10 H new ATOM 0 HE21 GLN B 73 162.440 7.358 -0.542 1.00 0.10 H new ATOM 0 HE22 GLN B 73 161.973 8.752 0.436 1.00 0.10 H new ATOM 2561 N SER B 74 157.508 6.264 -5.174 1.00 0.10 N ATOM 2562 CA SER B 74 156.120 5.876 -5.501 1.00 0.10 C ATOM 2563 C SER B 74 156.107 4.425 -6.001 1.00 0.09 C ATOM 2564 O SER B 74 155.178 3.686 -5.738 1.00 0.09 O ATOM 2565 CB SER B 74 155.553 6.824 -6.554 1.00 0.11 C ATOM 2566 OG SER B 74 156.197 6.596 -7.799 1.00 0.11 O ATOM 0 H SER B 74 157.935 6.945 -5.802 1.00 0.10 H new ATOM 0 HA SER B 74 155.494 5.945 -4.611 1.00 0.10 H new ATOM 0 HB2 SER B 74 154.479 6.670 -6.656 1.00 0.11 H new ATOM 0 HB3 SER B 74 155.698 7.858 -6.242 1.00 0.11 H new ATOM 0 HG SER B 74 157.165 6.530 -7.659 1.00 0.11 H new ATOM 2572 N ARG B 75 157.131 3.994 -6.707 1.00 0.10 N ATOM 2573 CA ARG B 75 157.154 2.579 -7.190 1.00 0.09 C ATOM 2574 C ARG B 75 157.120 1.634 -5.998 1.00 0.08 C ATOM 2575 O ARG B 75 156.489 0.596 -6.044 1.00 0.08 O ATOM 2576 CB ARG B 75 158.421 2.292 -8.000 1.00 0.10 C ATOM 2577 CG ARG B 75 158.352 2.997 -9.354 1.00 0.11 C ATOM 2578 CD ARG B 75 159.380 2.387 -10.296 1.00 0.12 C ATOM 2579 NE ARG B 75 159.315 3.163 -11.575 1.00 0.13 N ATOM 2580 CZ ARG B 75 159.687 2.646 -12.702 1.00 0.13 C ATOM 2581 NH1 ARG B 75 159.990 1.378 -12.769 1.00 0.13 N ATOM 2582 NH2 ARG B 75 159.720 3.383 -13.778 1.00 0.14 N ATOM 0 H ARG B 75 157.941 4.557 -6.965 1.00 0.10 H new ATOM 0 HA ARG B 75 156.283 2.427 -7.827 1.00 0.09 H new ATOM 0 HB2 ARG B 75 159.298 2.631 -7.449 1.00 0.10 H new ATOM 0 HB3 ARG B 75 158.532 1.218 -8.146 1.00 0.10 H new ATOM 0 HG2 ARG B 75 157.352 2.899 -9.777 1.00 0.11 H new ATOM 0 HG3 ARG B 75 158.543 4.063 -9.231 1.00 0.11 H new ATOM 0 HD2 ARG B 75 160.379 2.440 -9.863 1.00 0.12 H new ATOM 0 HD3 ARG B 75 159.164 1.333 -10.473 1.00 0.12 H new ATOM 0 HE ARG B 75 158.969 4.122 -11.558 1.00 0.13 H new ATOM 0 HH11 ARG B 75 159.934 0.795 -11.934 1.00 0.13 H new ATOM 0 HH12 ARG B 75 160.283 0.970 -13.657 1.00 0.13 H new ATOM 0 HH21 ARG B 75 159.453 4.366 -13.731 1.00 0.14 H new ATOM 0 HH22 ARG B 75 160.013 2.976 -14.666 1.00 0.14 H new ATOM 2596 N ASP B 76 157.803 1.953 -4.935 1.00 0.08 N ATOM 2597 CA ASP B 76 157.821 1.047 -3.758 1.00 0.07 C ATOM 2598 C ASP B 76 156.433 0.993 -3.133 1.00 0.07 C ATOM 2599 O ASP B 76 155.975 -0.053 -2.718 1.00 0.06 O ATOM 2600 CB ASP B 76 158.832 1.567 -2.734 1.00 0.07 C ATOM 2601 CG ASP B 76 160.249 1.378 -3.277 1.00 0.08 C ATOM 2602 OD1 ASP B 76 160.418 0.558 -4.165 1.00 0.08 O ATOM 2603 OD2 ASP B 76 161.143 2.056 -2.796 1.00 0.08 O ATOM 0 H ASP B 76 158.352 2.807 -4.832 1.00 0.08 H new ATOM 0 HA ASP B 76 158.109 0.044 -4.073 1.00 0.07 H new ATOM 0 HB2 ASP B 76 158.648 2.621 -2.528 1.00 0.07 H new ATOM 0 HB3 ASP B 76 158.718 1.033 -1.791 1.00 0.07 H new ATOM 2608 N CYS B 77 155.746 2.098 -3.073 1.00 0.07 N ATOM 2609 CA CYS B 77 154.382 2.080 -2.488 1.00 0.07 C ATOM 2610 C CYS B 77 153.436 1.319 -3.420 1.00 0.06 C ATOM 2611 O CYS B 77 152.586 0.576 -2.978 1.00 0.06 O ATOM 2612 CB CYS B 77 153.887 3.517 -2.325 1.00 0.07 C ATOM 2613 SG CYS B 77 154.825 4.330 -1.010 1.00 0.07 S ATOM 0 H CYS B 77 156.069 3.008 -3.402 1.00 0.07 H new ATOM 0 HA CYS B 77 154.407 1.587 -1.516 1.00 0.07 H new ATOM 0 HB2 CYS B 77 154.005 4.062 -3.261 1.00 0.07 H new ATOM 0 HB3 CYS B 77 152.824 3.522 -2.085 1.00 0.07 H new ATOM 0 HG CYS B 77 155.185 3.448 -0.125 1.00 0.07 H new ATOM 2619 N PHE B 78 153.562 1.498 -4.707 1.00 0.07 N ATOM 2620 CA PHE B 78 152.641 0.780 -5.630 1.00 0.07 C ATOM 2621 C PHE B 78 152.793 -0.728 -5.442 1.00 0.07 C ATOM 2622 O PHE B 78 151.855 -1.418 -5.096 1.00 0.06 O ATOM 2623 CB PHE B 78 152.977 1.154 -7.077 1.00 0.08 C ATOM 2624 CG PHE B 78 152.051 0.420 -8.018 1.00 0.08 C ATOM 2625 CD1 PHE B 78 150.827 1.004 -8.399 1.00 0.09 C ATOM 2626 CD2 PHE B 78 152.414 -0.845 -8.519 1.00 0.08 C ATOM 2627 CE1 PHE B 78 149.965 0.321 -9.279 1.00 0.09 C ATOM 2628 CE2 PHE B 78 151.553 -1.527 -9.400 1.00 0.09 C ATOM 2629 CZ PHE B 78 150.328 -0.944 -9.780 1.00 0.09 C ATOM 0 H PHE B 78 154.253 2.101 -5.153 1.00 0.07 H new ATOM 0 HA PHE B 78 151.613 1.066 -5.409 1.00 0.07 H new ATOM 0 HB2 PHE B 78 152.877 2.230 -7.218 1.00 0.08 H new ATOM 0 HB3 PHE B 78 154.013 0.899 -7.298 1.00 0.08 H new ATOM 0 HD1 PHE B 78 150.550 1.975 -8.016 1.00 0.09 H new ATOM 0 HD2 PHE B 78 153.353 -1.292 -8.227 1.00 0.08 H new ATOM 0 HE1 PHE B 78 149.026 0.768 -9.570 1.00 0.09 H new ATOM 0 HE2 PHE B 78 151.832 -2.497 -9.784 1.00 0.09 H new ATOM 0 HZ PHE B 78 149.667 -1.467 -10.455 1.00 0.09 H new ATOM 2639 N GLY B 79 153.966 -1.249 -5.676 1.00 0.07 N ATOM 2640 CA GLY B 79 154.181 -2.714 -5.523 1.00 0.07 C ATOM 2641 C GLY B 79 153.977 -3.138 -4.065 1.00 0.06 C ATOM 2642 O GLY B 79 153.500 -4.215 -3.785 1.00 0.06 O ATOM 0 H GLY B 79 154.788 -0.720 -5.968 1.00 0.07 H new ATOM 0 HA2 GLY B 79 153.489 -3.258 -6.166 1.00 0.07 H new ATOM 0 HA3 GLY B 79 155.189 -2.975 -5.846 1.00 0.07 H new ATOM 2646 N CYS B 80 154.323 -2.300 -3.131 1.00 0.06 N ATOM 2647 CA CYS B 80 154.138 -2.680 -1.701 1.00 0.05 C ATOM 2648 C CYS B 80 152.649 -2.725 -1.363 1.00 0.05 C ATOM 2649 O CYS B 80 152.160 -3.683 -0.797 1.00 0.05 O ATOM 2650 CB CYS B 80 154.837 -1.657 -0.809 1.00 0.05 C ATOM 2651 SG CYS B 80 154.552 -2.073 0.929 1.00 0.05 S ATOM 0 H CYS B 80 154.723 -1.375 -3.291 1.00 0.06 H new ATOM 0 HA CYS B 80 154.571 -3.666 -1.532 1.00 0.05 H new ATOM 0 HB2 CYS B 80 155.906 -1.646 -1.020 1.00 0.05 H new ATOM 0 HB3 CYS B 80 154.460 -0.657 -1.021 1.00 0.05 H new ATOM 0 HG CYS B 80 154.137 -1.018 1.565 1.00 0.05 H new ATOM 2657 N LEU B 81 151.919 -1.711 -1.725 1.00 0.05 N ATOM 2658 CA LEU B 81 150.459 -1.734 -1.435 1.00 0.05 C ATOM 2659 C LEU B 81 149.802 -2.783 -2.332 1.00 0.05 C ATOM 2660 O LEU B 81 148.910 -3.499 -1.919 1.00 0.04 O ATOM 2661 CB LEU B 81 149.851 -0.366 -1.750 1.00 0.05 C ATOM 2662 CG LEU B 81 150.471 0.714 -0.847 1.00 0.05 C ATOM 2663 CD1 LEU B 81 150.033 2.110 -1.329 1.00 0.06 C ATOM 2664 CD2 LEU B 81 150.023 0.508 0.613 1.00 0.05 C ATOM 0 H LEU B 81 152.262 -0.878 -2.203 1.00 0.05 H new ATOM 0 HA LEU B 81 150.296 -1.972 -0.384 1.00 0.05 H new ATOM 0 HB2 LEU B 81 150.022 -0.117 -2.797 1.00 0.05 H new ATOM 0 HB3 LEU B 81 148.771 -0.397 -1.602 1.00 0.05 H new ATOM 0 HG LEU B 81 151.557 0.636 -0.900 1.00 0.05 H new ATOM 0 HD11 LEU B 81 150.474 2.872 -0.686 1.00 0.06 H new ATOM 0 HD12 LEU B 81 150.368 2.262 -2.355 1.00 0.06 H new ATOM 0 HD13 LEU B 81 148.946 2.185 -1.287 1.00 0.06 H new ATOM 0 HD21 LEU B 81 150.468 1.278 1.242 1.00 0.05 H new ATOM 0 HD22 LEU B 81 148.937 0.574 0.673 1.00 0.05 H new ATOM 0 HD23 LEU B 81 150.347 -0.474 0.958 1.00 0.05 H new ATOM 2676 N ARG B 82 150.223 -2.865 -3.566 1.00 0.05 N ATOM 2677 CA ARG B 82 149.607 -3.852 -4.495 1.00 0.05 C ATOM 2678 C ARG B 82 149.921 -5.289 -4.072 1.00 0.06 C ATOM 2679 O ARG B 82 149.073 -6.156 -4.149 1.00 0.06 O ATOM 2680 CB ARG B 82 150.110 -3.625 -5.919 1.00 0.06 C ATOM 2681 CG ARG B 82 149.383 -4.599 -6.848 1.00 0.07 C ATOM 2682 CD ARG B 82 149.781 -4.358 -8.293 1.00 0.08 C ATOM 2683 NE ARG B 82 148.869 -5.223 -9.115 1.00 0.08 N ATOM 2684 CZ ARG B 82 149.254 -5.812 -10.200 1.00 0.09 C ATOM 2685 NH1 ARG B 82 150.494 -5.714 -10.597 1.00 0.09 N ATOM 2686 NH2 ARG B 82 148.404 -6.524 -10.885 1.00 0.09 N ATOM 0 H ARG B 82 150.965 -2.292 -3.969 1.00 0.05 H new ATOM 0 HA ARG B 82 148.527 -3.707 -4.458 1.00 0.05 H new ATOM 0 HB2 ARG B 82 149.924 -2.596 -6.228 1.00 0.06 H new ATOM 0 HB3 ARG B 82 151.187 -3.784 -5.971 1.00 0.06 H new ATOM 0 HG2 ARG B 82 149.621 -5.625 -6.566 1.00 0.07 H new ATOM 0 HG3 ARG B 82 148.305 -4.480 -6.737 1.00 0.07 H new ATOM 0 HD2 ARG B 82 149.670 -3.307 -8.560 1.00 0.08 H new ATOM 0 HD3 ARG B 82 150.826 -4.620 -8.460 1.00 0.08 H new ATOM 0 HE ARG B 82 147.906 -5.351 -8.805 1.00 0.08 H new ATOM 0 HH11 ARG B 82 151.163 -5.171 -10.051 1.00 0.09 H new ATOM 0 HH12 ARG B 82 150.794 -6.180 -11.453 1.00 0.09 H new ATOM 0 HH21 ARG B 82 147.440 -6.615 -10.565 1.00 0.09 H new ATOM 0 HH22 ARG B 82 148.703 -6.990 -11.741 1.00 0.09 H new ATOM 2700 N GLU B 83 151.119 -5.567 -3.633 1.00 0.06 N ATOM 2701 CA GLU B 83 151.433 -6.969 -3.229 1.00 0.06 C ATOM 2702 C GLU B 83 150.679 -7.291 -1.956 1.00 0.06 C ATOM 2703 O GLU B 83 150.205 -8.395 -1.771 1.00 0.06 O ATOM 2704 CB GLU B 83 152.942 -7.163 -3.008 1.00 0.06 C ATOM 2705 CG GLU B 83 153.698 -7.212 -4.369 1.00 0.07 C ATOM 2706 CD GLU B 83 154.779 -8.301 -4.346 1.00 0.08 C ATOM 2707 OE1 GLU B 83 155.211 -8.664 -3.264 1.00 0.08 O ATOM 2708 OE2 GLU B 83 155.152 -8.754 -5.415 1.00 0.09 O ATOM 0 H GLU B 83 151.883 -4.897 -3.537 1.00 0.06 H new ATOM 0 HA GLU B 83 151.127 -7.642 -4.029 1.00 0.06 H new ATOM 0 HB2 GLU B 83 153.333 -6.348 -2.399 1.00 0.06 H new ATOM 0 HB3 GLU B 83 153.118 -8.086 -2.456 1.00 0.06 H new ATOM 0 HG2 GLU B 83 152.993 -7.409 -5.176 1.00 0.07 H new ATOM 0 HG3 GLU B 83 154.154 -6.243 -4.573 1.00 0.07 H new ATOM 2715 N TRP B 84 150.513 -6.338 -1.084 1.00 0.05 N ATOM 2716 CA TRP B 84 149.740 -6.614 0.141 1.00 0.05 C ATOM 2717 C TRP B 84 148.355 -7.040 -0.333 1.00 0.05 C ATOM 2718 O TRP B 84 147.841 -8.056 0.051 1.00 0.05 O ATOM 2719 CB TRP B 84 149.650 -5.324 0.973 1.00 0.04 C ATOM 2720 CG TRP B 84 148.931 -5.574 2.258 1.00 0.05 C ATOM 2721 CD1 TRP B 84 149.525 -5.897 3.429 1.00 0.05 C ATOM 2722 CD2 TRP B 84 147.503 -5.523 2.522 1.00 0.05 C ATOM 2723 NE1 TRP B 84 148.555 -6.051 4.402 1.00 0.05 N ATOM 2724 CE2 TRP B 84 147.286 -5.831 3.896 1.00 0.05 C ATOM 2725 CE3 TRP B 84 146.379 -5.244 1.712 1.00 0.04 C ATOM 2726 CZ2 TRP B 84 145.997 -5.856 4.441 1.00 0.05 C ATOM 2727 CZ3 TRP B 84 145.080 -5.277 2.257 1.00 0.04 C ATOM 2728 CH2 TRP B 84 144.892 -5.579 3.618 1.00 0.05 C ATOM 0 H TRP B 84 150.878 -5.390 -1.171 1.00 0.05 H new ATOM 0 HA TRP B 84 150.197 -7.385 0.761 1.00 0.05 H new ATOM 0 HB2 TRP B 84 150.652 -4.947 1.178 1.00 0.04 H new ATOM 0 HB3 TRP B 84 149.130 -4.554 0.404 1.00 0.04 H new ATOM 0 HD1 TRP B 84 150.588 -6.016 3.580 1.00 0.05 H new ATOM 0 HE1 TRP B 84 148.751 -6.296 5.373 1.00 0.05 H new ATOM 0 HE3 TRP B 84 146.517 -5.004 0.668 1.00 0.04 H new ATOM 0 HZ2 TRP B 84 145.853 -6.086 5.486 1.00 0.05 H new ATOM 0 HZ3 TRP B 84 144.227 -5.070 1.628 1.00 0.04 H new ATOM 0 HH2 TRP B 84 143.895 -5.598 4.032 1.00 0.05 H new ATOM 2739 N CYS B 85 147.788 -6.280 -1.221 1.00 0.05 N ATOM 2740 CA CYS B 85 146.444 -6.615 -1.769 1.00 0.05 C ATOM 2741 C CYS B 85 146.463 -8.008 -2.417 1.00 0.05 C ATOM 2742 O CYS B 85 145.532 -8.766 -2.300 1.00 0.05 O ATOM 2743 CB CYS B 85 146.073 -5.557 -2.814 1.00 0.04 C ATOM 2744 SG CYS B 85 145.535 -4.047 -1.972 1.00 0.04 S ATOM 0 H CYS B 85 148.203 -5.428 -1.598 1.00 0.05 H new ATOM 0 HA CYS B 85 145.709 -6.624 -0.965 1.00 0.05 H new ATOM 0 HB2 CYS B 85 146.930 -5.345 -3.454 1.00 0.04 H new ATOM 0 HB3 CYS B 85 145.278 -5.930 -3.460 1.00 0.04 H new ATOM 0 HG CYS B 85 145.221 -3.146 -2.855 1.00 0.04 H new ATOM 2750 N ASP B 86 147.501 -8.352 -3.112 1.00 0.06 N ATOM 2751 CA ASP B 86 147.551 -9.698 -3.761 1.00 0.07 C ATOM 2752 C ASP B 86 147.478 -10.819 -2.718 1.00 0.07 C ATOM 2753 O ASP B 86 146.897 -11.860 -2.954 1.00 0.08 O ATOM 2754 CB ASP B 86 148.847 -9.837 -4.547 1.00 0.07 C ATOM 2755 CG ASP B 86 148.796 -8.923 -5.770 1.00 0.07 C ATOM 2756 OD1 ASP B 86 147.699 -8.624 -6.215 1.00 0.07 O ATOM 2757 OD2 ASP B 86 149.852 -8.538 -6.239 1.00 0.08 O ATOM 0 H ASP B 86 148.321 -7.765 -3.264 1.00 0.06 H new ATOM 0 HA ASP B 86 146.693 -9.785 -4.427 1.00 0.07 H new ATOM 0 HB2 ASP B 86 149.697 -9.574 -3.918 1.00 0.07 H new ATOM 0 HB3 ASP B 86 148.988 -10.872 -4.858 1.00 0.07 H new ATOM 2762 N ALA B 87 148.060 -10.624 -1.569 1.00 0.07 N ATOM 2763 CA ALA B 87 148.020 -11.688 -0.525 1.00 0.07 C ATOM 2764 C ALA B 87 146.788 -11.461 0.326 1.00 0.07 C ATOM 2765 O ALA B 87 146.312 -12.335 1.025 1.00 0.08 O ATOM 2766 CB ALA B 87 149.283 -11.564 0.368 1.00 0.08 C ATOM 0 H ALA B 87 148.561 -9.776 -1.306 1.00 0.07 H new ATOM 0 HA ALA B 87 147.991 -12.677 -0.983 1.00 0.07 H new ATOM 0 HB1 ALA B 87 149.264 -12.338 1.135 1.00 0.08 H new ATOM 0 HB2 ALA B 87 150.176 -11.684 -0.246 1.00 0.08 H new ATOM 0 HB3 ALA B 87 149.298 -10.583 0.843 1.00 0.08 H new ATOM 2772 N PHE B 88 146.366 -10.239 0.355 1.00 0.06 N ATOM 2773 CA PHE B 88 145.268 -9.835 1.247 1.00 0.06 C ATOM 2774 C PHE B 88 143.981 -9.365 0.521 1.00 0.06 C ATOM 2775 O PHE B 88 143.021 -8.984 1.143 1.00 0.05 O ATOM 2776 CB PHE B 88 145.870 -8.650 2.080 1.00 0.06 C ATOM 2777 CG PHE B 88 146.974 -9.129 3.240 1.00 0.06 C ATOM 2778 CD1 PHE B 88 146.594 -9.795 4.530 1.00 0.07 C ATOM 2779 CD2 PHE B 88 148.369 -8.861 3.056 1.00 0.06 C ATOM 2780 CE1 PHE B 88 147.568 -10.132 5.478 1.00 0.08 C ATOM 2781 CE2 PHE B 88 149.304 -9.219 4.057 1.00 0.07 C ATOM 2782 CZ PHE B 88 148.901 -9.846 5.244 1.00 0.07 C ATOM 0 H PHE B 88 146.748 -9.486 -0.218 1.00 0.06 H new ATOM 0 HA PHE B 88 144.941 -10.690 1.839 1.00 0.06 H new ATOM 0 HB2 PHE B 88 146.354 -7.950 1.399 1.00 0.06 H new ATOM 0 HB3 PHE B 88 145.057 -8.111 2.567 1.00 0.06 H new ATOM 0 HD1 PHE B 88 145.556 -10.017 4.730 1.00 0.07 H new ATOM 0 HD2 PHE B 88 148.709 -8.383 2.149 1.00 0.06 H new ATOM 0 HE1 PHE B 88 147.277 -10.618 6.397 1.00 0.08 H new ATOM 0 HE2 PHE B 88 150.351 -9.004 3.903 1.00 0.07 H new ATOM 0 HZ PHE B 88 149.641 -10.109 5.986 1.00 0.07 H new ATOM 2792 N LEU B 89 143.959 -9.298 -0.759 1.00 0.05 N ATOM 2793 CA LEU B 89 142.729 -8.765 -1.437 1.00 0.05 C ATOM 2794 C LEU B 89 142.523 -9.469 -2.777 1.00 0.05 C ATOM 2795 O LEU B 89 143.314 -9.233 -3.675 1.00 0.06 O ATOM 2796 CB LEU B 89 142.960 -7.273 -1.653 1.00 0.04 C ATOM 2797 CG LEU B 89 141.657 -6.530 -1.997 1.00 0.04 C ATOM 2798 CD1 LEU B 89 140.775 -6.367 -0.742 1.00 0.04 C ATOM 2799 CD2 LEU B 89 142.040 -5.148 -2.520 1.00 0.04 C ATOM 2800 OXT LEU B 89 141.576 -10.230 -2.883 1.00 0.06 O ATOM 0 H LEU B 89 144.719 -9.580 -1.378 1.00 0.05 H new ATOM 0 HA LEU B 89 141.839 -8.938 -0.832 1.00 0.05 H new ATOM 0 HB2 LEU B 89 143.397 -6.840 -0.753 1.00 0.04 H new ATOM 0 HB3 LEU B 89 143.681 -7.131 -2.458 1.00 0.04 H new ATOM 0 HG LEU B 89 141.094 -7.095 -2.740 1.00 0.04 H new ATOM 0 HD11 LEU B 89 139.859 -5.839 -1.007 1.00 0.04 H new ATOM 0 HD12 LEU B 89 140.525 -7.350 -0.343 1.00 0.04 H new ATOM 0 HD13 LEU B 89 141.317 -5.796 0.012 1.00 0.04 H new ATOM 0 HD21 LEU B 89 141.137 -4.592 -2.774 1.00 0.04 H new ATOM 0 HD22 LEU B 89 142.594 -4.609 -1.751 1.00 0.04 H new ATOM 0 HD23 LEU B 89 142.663 -5.255 -3.408 1.00 0.04 H new TER 2812 LEU B 89 ATOM 2813 N HIS C 1 136.874 26.617 -8.383 1.00 0.25 N ATOM 2814 CA HIS C 1 136.062 27.687 -9.046 1.00 0.25 C ATOM 2815 C HIS C 1 134.991 28.189 -8.068 1.00 0.24 C ATOM 2816 O HIS C 1 134.631 29.347 -8.055 1.00 0.24 O ATOM 2817 CB HIS C 1 135.360 27.145 -10.316 1.00 0.26 C ATOM 2818 CG HIS C 1 135.851 25.766 -10.695 1.00 0.26 C ATOM 2819 ND1 HIS C 1 136.169 24.786 -9.760 1.00 0.26 N ATOM 2820 CD2 HIS C 1 136.054 25.187 -11.924 1.00 0.27 C ATOM 2821 CE1 HIS C 1 136.543 23.686 -10.440 1.00 0.27 C ATOM 2822 NE2 HIS C 1 136.488 23.879 -11.758 1.00 0.28 N ATOM 0 H1 HIS C 1 137.701 26.394 -8.972 1.00 0.25 H new ATOM 0 H2 HIS C 1 137.193 26.951 -7.451 1.00 0.25 H new ATOM 0 H3 HIS C 1 136.292 25.763 -8.265 1.00 0.25 H new ATOM 0 HA HIS C 1 136.732 28.498 -9.332 1.00 0.25 H new ATOM 0 HB2 HIS C 1 134.284 27.112 -10.148 1.00 0.26 H new ATOM 0 HB3 HIS C 1 135.533 27.831 -11.145 1.00 0.26 H new ATOM 0 HD2 HIS C 1 135.899 25.675 -12.875 1.00 0.27 H new ATOM 0 HE1 HIS C 1 136.850 22.761 -9.975 1.00 0.27 H new ATOM 0 HE2 HIS C 1 136.717 23.207 -12.490 1.00 0.28 H new ATOM 2833 N ASP C 2 134.530 27.318 -7.226 1.00 0.24 N ATOM 2834 CA ASP C 2 133.520 27.715 -6.204 1.00 0.23 C ATOM 2835 C ASP C 2 134.221 28.530 -5.115 1.00 0.23 C ATOM 2836 O ASP C 2 135.378 28.309 -4.814 1.00 0.23 O ATOM 2837 CB ASP C 2 132.862 26.478 -5.585 1.00 0.24 C ATOM 2838 CG ASP C 2 131.702 26.027 -6.472 1.00 0.24 C ATOM 2839 OD1 ASP C 2 131.602 26.533 -7.579 1.00 0.24 O ATOM 2840 OD2 ASP C 2 130.929 25.198 -6.027 1.00 0.24 O ATOM 0 H ASP C 2 134.809 26.337 -7.197 1.00 0.24 H new ATOM 0 HA ASP C 2 132.741 28.312 -6.678 1.00 0.23 H new ATOM 0 HB2 ASP C 2 133.592 25.675 -5.485 1.00 0.24 H new ATOM 0 HB3 ASP C 2 132.501 26.707 -4.582 1.00 0.24 H new ATOM 2845 N ASN C 3 133.542 29.481 -4.539 1.00 0.22 N ATOM 2846 CA ASN C 3 134.185 30.320 -3.487 1.00 0.22 C ATOM 2847 C ASN C 3 135.008 29.413 -2.572 1.00 0.22 C ATOM 2848 O ASN C 3 136.179 29.641 -2.346 1.00 0.22 O ATOM 2849 CB ASN C 3 133.084 31.037 -2.675 1.00 0.21 C ATOM 2850 CG ASN C 3 133.172 32.562 -2.862 1.00 0.21 C ATOM 2851 OD1 ASN C 3 134.169 33.076 -3.329 1.00 0.21 O ATOM 2852 ND2 ASN C 3 132.165 33.310 -2.505 1.00 0.20 N ATOM 0 H ASN C 3 132.572 29.715 -4.749 1.00 0.22 H new ATOM 0 HA ASN C 3 134.838 31.066 -3.939 1.00 0.22 H new ATOM 0 HB2 ASN C 3 132.103 30.683 -2.993 1.00 0.21 H new ATOM 0 HB3 ASN C 3 133.186 30.789 -1.618 1.00 0.21 H new ATOM 0 HD21 ASN C 3 132.216 34.322 -2.618 1.00 0.20 H new ATOM 0 HD22 ASN C 3 131.326 32.883 -2.113 1.00 0.20 H new ATOM 2859 N TYR C 4 134.412 28.376 -2.060 1.00 0.22 N ATOM 2860 CA TYR C 4 135.162 27.468 -1.160 1.00 0.22 C ATOM 2861 C TYR C 4 136.133 26.612 -1.977 1.00 0.23 C ATOM 2862 O TYR C 4 137.062 26.044 -1.448 1.00 0.23 O ATOM 2863 CB TYR C 4 134.171 26.572 -0.420 1.00 0.22 C ATOM 2864 CG TYR C 4 133.278 27.445 0.423 1.00 0.21 C ATOM 2865 CD1 TYR C 4 132.172 28.078 -0.160 1.00 0.21 C ATOM 2866 CD2 TYR C 4 133.555 27.631 1.781 1.00 0.21 C ATOM 2867 CE1 TYR C 4 131.346 28.898 0.617 1.00 0.20 C ATOM 2868 CE2 TYR C 4 132.727 28.450 2.558 1.00 0.20 C ATOM 2869 CZ TYR C 4 131.622 29.084 1.976 1.00 0.20 C ATOM 2870 OH TYR C 4 130.811 29.894 2.742 1.00 0.19 O ATOM 0 H TYR C 4 133.439 28.120 -2.227 1.00 0.22 H new ATOM 0 HA TYR C 4 135.733 28.053 -0.440 1.00 0.22 H new ATOM 0 HB2 TYR C 4 133.577 25.996 -1.130 1.00 0.22 H new ATOM 0 HB3 TYR C 4 134.702 25.856 0.207 1.00 0.22 H new ATOM 0 HD1 TYR C 4 131.957 27.933 -1.208 1.00 0.21 H new ATOM 0 HD2 TYR C 4 134.407 27.143 2.230 1.00 0.21 H new ATOM 0 HE1 TYR C 4 130.495 29.388 0.167 1.00 0.20 H new ATOM 0 HE2 TYR C 4 132.940 28.593 3.607 1.00 0.20 H new ATOM 0 HH TYR C 4 131.144 29.912 3.664 1.00 0.19 H new ATOM 2880 N ALA C 5 135.938 26.515 -3.263 1.00 0.23 N ATOM 2881 CA ALA C 5 136.875 25.687 -4.076 1.00 0.24 C ATOM 2882 C ALA C 5 138.220 26.406 -4.216 1.00 0.24 C ATOM 2883 O ALA C 5 139.228 25.797 -4.510 1.00 0.24 O ATOM 2884 CB ALA C 5 136.278 25.439 -5.451 1.00 0.24 C ATOM 0 H ALA C 5 135.183 26.965 -3.781 1.00 0.23 H new ATOM 0 HA ALA C 5 137.034 24.732 -3.576 1.00 0.24 H new ATOM 0 HB1 ALA C 5 136.965 24.834 -6.042 1.00 0.24 H new ATOM 0 HB2 ALA C 5 135.329 24.913 -5.346 1.00 0.24 H new ATOM 0 HB3 ALA C 5 136.111 26.392 -5.952 1.00 0.24 H new ATOM 2890 N ASP C 6 138.257 27.695 -4.027 1.00 0.23 N ATOM 2891 CA ASP C 6 139.566 28.406 -4.166 1.00 0.23 C ATOM 2892 C ASP C 6 140.390 28.218 -2.889 1.00 0.23 C ATOM 2893 O ASP C 6 141.551 28.573 -2.826 1.00 0.23 O ATOM 2894 CB ASP C 6 139.335 29.898 -4.397 1.00 0.23 C ATOM 2895 CG ASP C 6 138.688 30.102 -5.767 1.00 0.23 C ATOM 2896 OD1 ASP C 6 138.722 29.176 -6.560 1.00 0.24 O ATOM 2897 OD2 ASP C 6 138.167 31.179 -5.998 1.00 0.23 O ATOM 0 H ASP C 6 137.457 28.281 -3.787 1.00 0.23 H new ATOM 0 HA ASP C 6 140.103 27.990 -5.019 1.00 0.23 H new ATOM 0 HB2 ASP C 6 138.693 30.304 -3.615 1.00 0.23 H new ATOM 0 HB3 ASP C 6 140.281 30.437 -4.345 1.00 0.23 H new ATOM 2902 N LEU C 7 139.799 27.650 -1.878 1.00 0.23 N ATOM 2903 CA LEU C 7 140.544 27.430 -0.615 1.00 0.23 C ATOM 2904 C LEU C 7 141.476 26.227 -0.800 1.00 0.23 C ATOM 2905 O LEU C 7 141.130 25.247 -1.433 1.00 0.24 O ATOM 2906 CB LEU C 7 139.542 27.162 0.517 1.00 0.22 C ATOM 2907 CG LEU C 7 138.503 28.296 0.577 1.00 0.21 C ATOM 2908 CD1 LEU C 7 137.454 27.969 1.642 1.00 0.21 C ATOM 2909 CD2 LEU C 7 139.180 29.622 0.940 1.00 0.21 C ATOM 0 H LEU C 7 138.831 27.329 -1.874 1.00 0.23 H new ATOM 0 HA LEU C 7 141.137 28.309 -0.360 1.00 0.23 H new ATOM 0 HB2 LEU C 7 139.042 26.207 0.353 1.00 0.22 H new ATOM 0 HB3 LEU C 7 140.067 27.088 1.469 1.00 0.22 H new ATOM 0 HG LEU C 7 138.031 28.389 -0.401 1.00 0.21 H new ATOM 0 HD11 LEU C 7 136.717 28.771 1.686 1.00 0.21 H new ATOM 0 HD12 LEU C 7 136.957 27.033 1.387 1.00 0.21 H new ATOM 0 HD13 LEU C 7 137.940 27.869 2.613 1.00 0.21 H new ATOM 0 HD21 LEU C 7 138.432 30.414 0.978 1.00 0.21 H new ATOM 0 HD22 LEU C 7 139.662 29.530 1.914 1.00 0.21 H new ATOM 0 HD23 LEU C 7 139.929 29.866 0.187 1.00 0.21 H new ATOM 2921 N SER C 8 142.651 26.295 -0.248 1.00 0.23 N ATOM 2922 CA SER C 8 143.611 25.157 -0.382 1.00 0.24 C ATOM 2923 C SER C 8 143.302 24.093 0.682 1.00 0.24 C ATOM 2924 O SER C 8 142.660 24.367 1.669 1.00 0.23 O ATOM 2925 CB SER C 8 145.041 25.680 -0.213 1.00 0.24 C ATOM 2926 OG SER C 8 145.855 24.656 0.326 1.00 0.24 O ATOM 0 H SER C 8 142.994 27.089 0.293 1.00 0.23 H new ATOM 0 HA SER C 8 143.511 24.704 -1.368 1.00 0.24 H new ATOM 0 HB2 SER C 8 145.437 26.006 -1.175 1.00 0.24 H new ATOM 0 HB3 SER C 8 145.047 26.549 0.445 1.00 0.24 H new ATOM 0 HG SER C 8 146.771 24.988 0.433 1.00 0.24 H new ATOM 2932 N ASP C 9 143.715 22.870 0.464 1.00 0.25 N ATOM 2933 CA ASP C 9 143.424 21.780 1.453 1.00 0.25 C ATOM 2934 C ASP C 9 143.828 22.211 2.864 1.00 0.24 C ATOM 2935 O ASP C 9 143.098 22.008 3.812 1.00 0.24 O ATOM 2936 CB ASP C 9 144.243 20.548 1.052 1.00 0.26 C ATOM 2937 CG ASP C 9 144.438 20.513 -0.468 1.00 1.28 C ATOM 2938 OD1 ASP C 9 143.721 21.216 -1.159 1.00 2.14 O ATOM 2939 OD2 ASP C 9 145.299 19.775 -0.916 1.00 1.67 O ATOM 0 H ASP C 9 144.243 22.576 -0.358 1.00 0.25 H new ATOM 0 HA ASP C 9 142.356 21.560 1.451 1.00 0.25 H new ATOM 0 HB2 ASP C 9 145.212 20.569 1.550 1.00 0.26 H new ATOM 0 HB3 ASP C 9 143.735 19.642 1.382 1.00 0.26 H new ATOM 2944 N THR C 10 144.981 22.797 3.017 1.00 0.24 N ATOM 2945 CA THR C 10 145.417 23.221 4.375 1.00 0.23 C ATOM 2946 C THR C 10 144.435 24.253 4.936 1.00 0.23 C ATOM 2947 O THR C 10 144.059 24.204 6.087 1.00 0.22 O ATOM 2948 CB THR C 10 146.819 23.835 4.299 1.00 0.23 C ATOM 2949 OG1 THR C 10 147.668 22.975 3.554 1.00 0.24 O ATOM 2950 CG2 THR C 10 147.394 24.021 5.710 1.00 0.23 C ATOM 0 H THR C 10 145.638 23.000 2.264 1.00 0.24 H new ATOM 0 HA THR C 10 145.439 22.351 5.031 1.00 0.23 H new ATOM 0 HB THR C 10 146.756 24.808 3.811 1.00 0.23 H new ATOM 0 HG1 THR C 10 148.565 23.366 3.502 1.00 0.24 H new ATOM 0 HG21 THR C 10 148.390 24.458 5.642 1.00 0.23 H new ATOM 0 HG22 THR C 10 146.745 24.684 6.283 1.00 0.23 H new ATOM 0 HG23 THR C 10 147.455 23.054 6.208 1.00 0.23 H new ATOM 2958 N GLU C 11 144.022 25.187 4.132 1.00 0.22 N ATOM 2959 CA GLU C 11 143.068 26.223 4.623 1.00 0.22 C ATOM 2960 C GLU C 11 141.688 25.600 4.841 1.00 0.22 C ATOM 2961 O GLU C 11 140.969 25.953 5.737 1.00 0.21 O ATOM 2962 CB GLU C 11 142.974 27.363 3.610 1.00 0.21 C ATOM 2963 CG GLU C 11 144.370 27.965 3.399 1.00 0.22 C ATOM 2964 CD GLU C 11 144.252 29.445 3.021 1.00 0.21 C ATOM 2965 OE1 GLU C 11 143.138 29.916 2.872 1.00 0.21 O ATOM 2966 OE2 GLU C 11 145.284 30.084 2.896 1.00 0.21 O ATOM 0 H GLU C 11 144.302 25.281 3.156 1.00 0.22 H new ATOM 0 HA GLU C 11 143.430 26.620 5.571 1.00 0.22 H new ATOM 0 HB2 GLU C 11 142.577 26.994 2.664 1.00 0.21 H new ATOM 0 HB3 GLU C 11 142.285 28.128 3.968 1.00 0.21 H new ATOM 0 HG2 GLU C 11 144.961 27.860 4.308 1.00 0.22 H new ATOM 0 HG3 GLU C 11 144.894 27.421 2.613 1.00 0.22 H new ATOM 2973 N LEU C 12 141.298 24.688 4.023 1.00 0.22 N ATOM 2974 CA LEU C 12 139.961 24.070 4.222 1.00 0.22 C ATOM 2975 C LEU C 12 139.948 23.308 5.553 1.00 0.22 C ATOM 2976 O LEU C 12 139.004 23.378 6.314 1.00 0.22 O ATOM 2977 CB LEU C 12 139.674 23.106 3.068 1.00 0.23 C ATOM 2978 CG LEU C 12 138.175 22.795 2.979 1.00 0.23 C ATOM 2979 CD1 LEU C 12 137.455 23.938 2.252 1.00 0.23 C ATOM 2980 CD2 LEU C 12 137.969 21.479 2.203 1.00 0.24 C ATOM 0 H LEU C 12 141.834 24.339 3.228 1.00 0.22 H new ATOM 0 HA LEU C 12 139.194 24.844 4.244 1.00 0.22 H new ATOM 0 HB2 LEU C 12 140.016 23.543 2.130 1.00 0.23 H new ATOM 0 HB3 LEU C 12 140.234 22.182 3.212 1.00 0.23 H new ATOM 0 HG LEU C 12 137.766 22.692 3.984 1.00 0.23 H new ATOM 0 HD11 LEU C 12 136.390 23.716 2.189 1.00 0.23 H new ATOM 0 HD12 LEU C 12 137.600 24.868 2.802 1.00 0.23 H new ATOM 0 HD13 LEU C 12 137.863 24.044 1.247 1.00 0.23 H new ATOM 0 HD21 LEU C 12 136.904 21.257 2.139 1.00 0.24 H new ATOM 0 HD22 LEU C 12 138.379 21.581 1.198 1.00 0.24 H new ATOM 0 HD23 LEU C 12 138.478 20.667 2.722 1.00 0.24 H new ATOM 2992 N THR C 13 140.996 22.577 5.828 1.00 0.23 N ATOM 2993 CA THR C 13 141.063 21.785 7.092 1.00 0.23 C ATOM 2994 C THR C 13 140.991 22.712 8.307 1.00 0.22 C ATOM 2995 O THR C 13 140.283 22.443 9.258 1.00 0.22 O ATOM 2996 CB THR C 13 142.386 21.015 7.131 1.00 0.23 C ATOM 2997 OG1 THR C 13 142.571 20.329 5.900 1.00 0.28 O ATOM 2998 CG2 THR C 13 142.358 20.008 8.282 1.00 0.29 C ATOM 0 H THR C 13 141.815 22.494 5.226 1.00 0.23 H new ATOM 0 HA THR C 13 140.221 21.094 7.121 1.00 0.23 H new ATOM 0 HB THR C 13 143.209 21.713 7.283 1.00 0.23 H new ATOM 0 HG1 THR C 13 142.910 20.954 5.225 1.00 0.28 H new ATOM 0 HG21 THR C 13 143.300 19.460 8.309 1.00 0.29 H new ATOM 0 HG22 THR C 13 142.218 20.537 9.225 1.00 0.29 H new ATOM 0 HG23 THR C 13 141.536 19.308 8.133 1.00 0.29 H new ATOM 3006 N THR C 14 141.718 23.796 8.299 1.00 0.22 N ATOM 3007 CA THR C 14 141.669 24.708 9.473 1.00 0.21 C ATOM 3008 C THR C 14 140.254 25.287 9.612 1.00 0.21 C ATOM 3009 O THR C 14 139.808 25.582 10.699 1.00 0.20 O ATOM 3010 CB THR C 14 142.702 25.841 9.317 1.00 0.21 C ATOM 3011 OG1 THR C 14 142.890 26.474 10.573 1.00 0.20 O ATOM 3012 CG2 THR C 14 142.209 26.876 8.309 1.00 0.20 C ATOM 0 H THR C 14 142.335 24.086 7.541 1.00 0.22 H new ATOM 0 HA THR C 14 141.915 24.146 10.374 1.00 0.21 H new ATOM 0 HB THR C 14 143.641 25.417 8.961 1.00 0.21 H new ATOM 0 HG1 THR C 14 143.547 27.195 10.481 1.00 0.20 H new ATOM 0 HG21 THR C 14 142.950 27.669 8.210 1.00 0.20 H new ATOM 0 HG22 THR C 14 142.058 26.398 7.341 1.00 0.20 H new ATOM 0 HG23 THR C 14 141.267 27.301 8.655 1.00 0.20 H new ATOM 3020 N LEU C 15 139.549 25.461 8.523 1.00 0.21 N ATOM 3021 CA LEU C 15 138.168 26.031 8.611 1.00 0.20 C ATOM 3022 C LEU C 15 137.210 25.044 9.291 1.00 0.20 C ATOM 3023 O LEU C 15 136.433 25.408 10.161 1.00 0.20 O ATOM 3024 CB LEU C 15 137.651 26.334 7.204 1.00 0.20 C ATOM 3025 CG LEU C 15 138.329 27.599 6.657 1.00 0.20 C ATOM 3026 CD1 LEU C 15 138.060 27.732 5.141 1.00 0.20 C ATOM 3027 CD2 LEU C 15 137.803 28.851 7.402 1.00 0.19 C ATOM 0 H LEU C 15 139.867 25.235 7.581 1.00 0.21 H new ATOM 0 HA LEU C 15 138.212 26.945 9.204 1.00 0.20 H new ATOM 0 HB2 LEU C 15 137.851 25.490 6.544 1.00 0.20 H new ATOM 0 HB3 LEU C 15 136.570 26.471 7.227 1.00 0.20 H new ATOM 0 HG LEU C 15 139.404 27.519 6.819 1.00 0.20 H new ATOM 0 HD11 LEU C 15 138.545 28.632 4.763 1.00 0.20 H new ATOM 0 HD12 LEU C 15 138.459 26.860 4.623 1.00 0.20 H new ATOM 0 HD13 LEU C 15 136.986 27.798 4.966 1.00 0.20 H new ATOM 0 HD21 LEU C 15 138.291 29.742 7.006 1.00 0.19 H new ATOM 0 HD22 LEU C 15 136.726 28.933 7.259 1.00 0.19 H new ATOM 0 HD23 LEU C 15 138.022 28.760 8.466 1.00 0.19 H new ATOM 3039 N LEU C 16 137.266 23.799 8.909 1.00 0.21 N ATOM 3040 CA LEU C 16 136.366 22.788 9.530 1.00 0.21 C ATOM 3041 C LEU C 16 136.674 22.740 11.011 1.00 0.21 C ATOM 3042 O LEU C 16 135.803 22.590 11.844 1.00 0.21 O ATOM 3043 CB LEU C 16 136.631 21.409 8.910 1.00 0.22 C ATOM 3044 CG LEU C 16 136.093 21.351 7.475 1.00 0.22 C ATOM 3045 CD1 LEU C 16 136.644 20.104 6.783 1.00 0.23 C ATOM 3046 CD2 LEU C 16 134.562 21.255 7.498 1.00 0.22 C ATOM 0 H LEU C 16 137.896 23.438 8.193 1.00 0.21 H new ATOM 0 HA LEU C 16 135.323 23.055 9.362 1.00 0.21 H new ATOM 0 HB2 LEU C 16 137.701 21.203 8.912 1.00 0.22 H new ATOM 0 HB3 LEU C 16 136.157 20.635 9.514 1.00 0.22 H new ATOM 0 HG LEU C 16 136.400 22.251 6.942 1.00 0.22 H new ATOM 0 HD11 LEU C 16 136.265 20.057 5.762 1.00 0.23 H new ATOM 0 HD12 LEU C 16 137.733 20.150 6.764 1.00 0.23 H new ATOM 0 HD13 LEU C 16 136.327 19.215 7.329 1.00 0.23 H new ATOM 0 HD21 LEU C 16 134.185 21.214 6.476 1.00 0.22 H new ATOM 0 HD22 LEU C 16 134.262 20.353 8.032 1.00 0.22 H new ATOM 0 HD23 LEU C 16 134.150 22.129 8.002 1.00 0.22 H new ATOM 3058 N ARG C 17 137.921 22.858 11.339 1.00 0.21 N ATOM 3059 CA ARG C 17 138.327 22.815 12.761 1.00 0.21 C ATOM 3060 C ARG C 17 137.674 23.970 13.522 1.00 0.20 C ATOM 3061 O ARG C 17 137.100 23.788 14.575 1.00 0.20 O ATOM 3062 CB ARG C 17 139.862 22.902 12.869 1.00 0.21 C ATOM 3063 CG ARG C 17 140.324 22.020 14.045 1.00 1.10 C ATOM 3064 CD ARG C 17 141.821 22.188 14.313 1.00 1.45 C ATOM 3065 NE ARG C 17 142.513 20.964 13.758 1.00 2.04 N ATOM 3066 CZ ARG C 17 143.353 20.257 14.453 1.00 2.63 C ATOM 3067 NH1 ARG C 17 143.623 20.582 15.689 1.00 2.91 N ATOM 3068 NH2 ARG C 17 143.926 19.211 13.920 1.00 3.47 N ATOM 0 H ARG C 17 138.685 22.984 10.675 1.00 0.21 H new ATOM 0 HA ARG C 17 137.997 21.874 13.202 1.00 0.21 H new ATOM 0 HB2 ARG C 17 140.326 22.568 11.941 1.00 0.21 H new ATOM 0 HB3 ARG C 17 140.172 23.935 13.027 1.00 0.21 H new ATOM 0 HG2 ARG C 17 139.761 22.281 14.941 1.00 1.10 H new ATOM 0 HG3 ARG C 17 140.107 20.975 13.825 1.00 1.10 H new ATOM 0 HD2 ARG C 17 142.198 23.093 13.836 1.00 1.45 H new ATOM 0 HD3 ARG C 17 142.012 22.287 15.382 1.00 1.45 H new ATOM 0 HE ARG C 17 142.312 20.681 12.799 1.00 2.04 H new ATOM 0 HH11 ARG C 17 143.174 21.394 16.113 1.00 2.91 H new ATOM 0 HH12 ARG C 17 144.283 20.024 16.231 1.00 2.91 H new ATOM 0 HH21 ARG C 17 143.714 18.949 12.957 1.00 3.47 H new ATOM 0 HH22 ARG C 17 144.585 18.657 14.466 1.00 3.47 H new ATOM 3082 N ARG C 18 137.738 25.154 12.987 1.00 0.20 N ATOM 3083 CA ARG C 18 137.120 26.313 13.679 1.00 0.19 C ATOM 3084 C ARG C 18 135.669 25.999 14.009 1.00 0.19 C ATOM 3085 O ARG C 18 135.171 26.364 15.055 1.00 0.19 O ATOM 3086 CB ARG C 18 137.169 27.541 12.766 1.00 0.19 C ATOM 3087 CG ARG C 18 136.372 28.692 13.402 1.00 0.18 C ATOM 3088 CD ARG C 18 136.388 29.926 12.493 1.00 0.18 C ATOM 3089 NE ARG C 18 136.898 31.084 13.276 1.00 0.17 N ATOM 3090 CZ ARG C 18 137.118 32.223 12.689 1.00 0.17 C ATOM 3091 NH1 ARG C 18 136.834 32.364 11.423 1.00 0.17 N ATOM 3092 NH2 ARG C 18 137.601 33.223 13.370 1.00 0.16 N ATOM 0 H ARG C 18 138.192 25.369 12.099 1.00 0.20 H new ATOM 0 HA ARG C 18 137.670 26.514 14.598 1.00 0.19 H new ATOM 0 HB2 ARG C 18 138.203 27.847 12.607 1.00 0.19 H new ATOM 0 HB3 ARG C 18 136.755 27.296 11.788 1.00 0.19 H new ATOM 0 HG2 ARG C 18 135.344 28.376 13.577 1.00 0.18 H new ATOM 0 HG3 ARG C 18 136.798 28.943 14.373 1.00 0.18 H new ATOM 0 HD2 ARG C 18 137.022 29.748 11.624 1.00 0.18 H new ATOM 0 HD3 ARG C 18 135.385 30.134 12.119 1.00 0.18 H new ATOM 0 HE ARG C 18 137.075 30.984 14.275 1.00 0.17 H new ATOM 0 HH11 ARG C 18 136.441 31.582 10.898 1.00 0.17 H new ATOM 0 HH12 ARG C 18 137.005 33.256 10.958 1.00 0.17 H new ATOM 0 HH21 ARG C 18 137.806 33.112 14.363 1.00 0.16 H new ATOM 0 HH22 ARG C 18 137.774 34.117 12.910 1.00 0.16 H new ATOM 3106 N TYR C 19 134.967 25.355 13.127 1.00 0.20 N ATOM 3107 CA TYR C 19 133.540 25.068 13.426 1.00 0.20 C ATOM 3108 C TYR C 19 133.423 23.733 14.155 1.00 0.20 C ATOM 3109 O TYR C 19 132.339 23.273 14.455 1.00 0.20 O ATOM 3110 CB TYR C 19 132.760 25.023 12.114 1.00 0.20 C ATOM 3111 CG TYR C 19 133.194 26.183 11.248 1.00 0.19 C ATOM 3112 CD1 TYR C 19 133.052 27.495 11.716 1.00 0.19 C ATOM 3113 CD2 TYR C 19 133.735 25.947 9.980 1.00 0.20 C ATOM 3114 CE1 TYR C 19 133.459 28.572 10.918 1.00 0.18 C ATOM 3115 CE2 TYR C 19 134.143 27.023 9.182 1.00 0.19 C ATOM 3116 CZ TYR C 19 133.998 28.335 9.648 1.00 0.19 C ATOM 3117 OH TYR C 19 134.400 29.396 8.859 1.00 0.18 O ATOM 0 H TYR C 19 135.310 25.019 12.227 1.00 0.20 H new ATOM 0 HA TYR C 19 133.130 25.850 14.066 1.00 0.20 H new ATOM 0 HB2 TYR C 19 132.942 24.079 11.599 1.00 0.20 H new ATOM 0 HB3 TYR C 19 131.689 25.078 12.310 1.00 0.20 H new ATOM 0 HD1 TYR C 19 132.628 27.677 12.693 1.00 0.19 H new ATOM 0 HD2 TYR C 19 133.838 24.935 9.616 1.00 0.20 H new ATOM 0 HE1 TYR C 19 133.357 29.584 11.282 1.00 0.18 H new ATOM 0 HE2 TYR C 19 134.570 26.841 8.207 1.00 0.19 H new ATOM 0 HH TYR C 19 133.764 30.135 8.955 1.00 0.18 H new ATOM 3127 N ASN C 20 134.532 23.107 14.448 1.00 0.21 N ATOM 3128 CA ASN C 20 134.486 21.802 15.158 1.00 0.21 C ATOM 3129 C ASN C 20 133.678 20.805 14.326 1.00 0.22 C ATOM 3130 O ASN C 20 132.823 20.115 14.841 1.00 0.22 O ATOM 3131 CB ASN C 20 133.826 21.989 16.533 1.00 0.21 C ATOM 3132 CG ASN C 20 134.503 23.149 17.262 1.00 0.21 C ATOM 3133 OD1 ASN C 20 135.726 23.471 16.948 1.00 0.20 O flip ATOM 3134 ND2 ASN C 20 133.912 23.769 18.127 1.00 0.20 N flip ATOM 0 H ASN C 20 135.468 23.446 14.225 1.00 0.21 H new ATOM 0 HA ASN C 20 135.498 21.422 15.297 1.00 0.21 H new ATOM 0 HB2 ASN C 20 132.761 22.190 16.414 1.00 0.21 H new ATOM 0 HB3 ASN C 20 133.914 21.074 17.119 1.00 0.21 H new ATOM 0 HD21 ASN C 20 132.955 23.516 18.372 1.00 0.20 H new ATOM 0 HD22 ASN C 20 134.374 24.541 18.607 1.00 0.20 H new ATOM 3141 N ILE C 21 133.937 20.729 13.041 1.00 0.22 N ATOM 3142 CA ILE C 21 133.175 19.778 12.179 1.00 0.22 C ATOM 3143 C ILE C 21 134.063 18.554 11.873 1.00 0.23 C ATOM 3144 O ILE C 21 135.084 18.689 11.224 1.00 0.23 O ATOM 3145 CB ILE C 21 132.793 20.465 10.865 1.00 0.22 C ATOM 3146 CG1 ILE C 21 131.644 21.446 11.125 1.00 0.21 C ATOM 3147 CG2 ILE C 21 132.324 19.406 9.867 1.00 0.23 C ATOM 3148 CD1 ILE C 21 131.451 22.393 9.932 1.00 0.21 C ATOM 0 H ILE C 21 134.642 21.284 12.556 1.00 0.22 H new ATOM 0 HA ILE C 21 132.270 19.462 12.697 1.00 0.22 H new ATOM 0 HB ILE C 21 133.654 21.000 10.465 1.00 0.22 H new ATOM 0 HG12 ILE C 21 130.723 20.893 11.308 1.00 0.21 H new ATOM 0 HG13 ILE C 21 131.852 22.026 12.024 1.00 0.21 H new ATOM 0 HG21 ILE C 21 132.050 19.887 8.928 1.00 0.23 H new ATOM 0 HG22 ILE C 21 133.129 18.693 9.688 1.00 0.23 H new ATOM 0 HG23 ILE C 21 131.458 18.882 10.272 1.00 0.23 H new ATOM 0 HD11 ILE C 21 130.630 23.079 10.141 1.00 0.21 H new ATOM 0 HD12 ILE C 21 132.366 22.962 9.767 1.00 0.21 H new ATOM 0 HD13 ILE C 21 131.219 21.812 9.040 1.00 0.21 H new ATOM 3160 N PRO C 22 133.695 17.377 12.330 1.00 0.24 N ATOM 3161 CA PRO C 22 134.500 16.142 12.084 1.00 0.25 C ATOM 3162 C PRO C 22 134.766 15.914 10.593 1.00 0.25 C ATOM 3163 O PRO C 22 133.890 16.091 9.767 1.00 0.25 O ATOM 3164 CB PRO C 22 133.631 14.998 12.630 1.00 0.25 C ATOM 3165 CG PRO C 22 132.634 15.626 13.547 1.00 0.34 C ATOM 3166 CD PRO C 22 132.492 17.091 13.137 1.00 0.24 C ATOM 0 HA PRO C 22 135.478 16.212 12.561 1.00 0.25 H new ATOM 0 HB2 PRO C 22 133.132 14.468 11.819 1.00 0.25 H new ATOM 0 HB3 PRO C 22 134.240 14.267 13.161 1.00 0.25 H new ATOM 0 HG2 PRO C 22 131.674 15.114 13.478 1.00 0.34 H new ATOM 0 HG3 PRO C 22 132.964 15.548 14.583 1.00 0.34 H new ATOM 0 HD2 PRO C 22 131.581 17.254 12.560 1.00 0.24 H new ATOM 0 HD3 PRO C 22 132.437 17.742 14.009 1.00 0.24 H new ATOM 3174 N HIS C 23 135.959 15.507 10.243 1.00 0.25 N ATOM 3175 CA HIS C 23 136.248 15.260 8.808 1.00 0.26 C ATOM 3176 C HIS C 23 137.417 14.295 8.638 1.00 0.26 C ATOM 3177 O HIS C 23 138.203 14.067 9.539 1.00 0.26 O ATOM 3178 CB HIS C 23 136.573 16.573 8.118 1.00 0.25 C ATOM 3179 CG HIS C 23 137.646 17.302 8.878 1.00 0.25 C ATOM 3180 ND1 HIS C 23 137.368 18.097 9.986 1.00 0.24 N ATOM 3181 CD2 HIS C 23 139.008 17.371 8.704 1.00 0.25 C ATOM 3182 CE1 HIS C 23 138.537 18.602 10.426 1.00 0.24 C ATOM 3183 NE2 HIS C 23 139.563 18.188 9.680 1.00 0.24 N ATOM 0 H HIS C 23 136.734 15.338 10.884 1.00 0.25 H new ATOM 0 HA HIS C 23 135.363 14.811 8.357 1.00 0.26 H new ATOM 0 HB2 HIS C 23 136.904 16.384 7.097 1.00 0.25 H new ATOM 0 HB3 HIS C 23 135.677 17.191 8.054 1.00 0.25 H new ATOM 0 HD1 HIS C 23 136.447 18.266 10.391 1.00 0.24 H new ATOM 0 HD2 HIS C 23 139.562 16.866 7.926 1.00 0.25 H new ATOM 0 HE1 HIS C 23 138.632 19.260 11.277 1.00 0.24 H new ATOM 3192 N GLY C 24 137.520 13.741 7.464 1.00 0.27 N ATOM 3193 CA GLY C 24 138.619 12.788 7.159 1.00 0.28 C ATOM 3194 C GLY C 24 139.571 13.434 6.145 1.00 0.27 C ATOM 3195 O GLY C 24 139.759 14.635 6.150 1.00 0.27 O ATOM 0 H GLY C 24 136.878 13.912 6.690 1.00 0.27 H new ATOM 0 HA2 GLY C 24 139.158 12.530 8.071 1.00 0.28 H new ATOM 0 HA3 GLY C 24 138.212 11.860 6.756 1.00 0.28 H new ATOM 3199 N PRO C 25 140.173 12.648 5.287 1.00 0.28 N ATOM 3200 CA PRO C 25 141.125 13.171 4.269 1.00 0.28 C ATOM 3201 C PRO C 25 140.427 14.074 3.238 1.00 0.28 C ATOM 3202 O PRO C 25 139.359 13.758 2.755 1.00 0.28 O ATOM 3203 CB PRO C 25 141.684 11.910 3.584 1.00 0.29 C ATOM 3204 CG PRO C 25 141.310 10.768 4.470 1.00 0.39 C ATOM 3205 CD PRO C 25 140.041 11.187 5.202 1.00 0.29 C ATOM 0 HA PRO C 25 141.898 13.788 4.726 1.00 0.28 H new ATOM 0 HB2 PRO C 25 141.261 11.786 2.587 1.00 0.29 H new ATOM 0 HB3 PRO C 25 142.766 11.976 3.466 1.00 0.29 H new ATOM 0 HG2 PRO C 25 141.140 9.863 3.886 1.00 0.39 H new ATOM 0 HG3 PRO C 25 142.110 10.546 5.176 1.00 0.39 H new ATOM 0 HD2 PRO C 25 139.145 10.894 4.655 1.00 0.29 H new ATOM 0 HD3 PRO C 25 139.975 10.730 6.189 1.00 0.29 H new ATOM 3213 N VAL C 26 141.032 15.177 2.880 1.00 0.27 N ATOM 3214 CA VAL C 26 140.402 16.076 1.862 1.00 0.27 C ATOM 3215 C VAL C 26 140.993 15.767 0.477 1.00 0.28 C ATOM 3216 O VAL C 26 142.180 15.888 0.258 1.00 0.28 O ATOM 3217 CB VAL C 26 140.695 17.528 2.242 1.00 0.26 C ATOM 3218 CG1 VAL C 26 142.206 17.731 2.270 1.00 0.34 C ATOM 3219 CG2 VAL C 26 140.059 18.497 1.225 1.00 0.34 C ATOM 0 H VAL C 26 141.930 15.495 3.245 1.00 0.27 H new ATOM 0 HA VAL C 26 139.324 15.916 1.832 1.00 0.27 H new ATOM 0 HB VAL C 26 140.268 17.735 3.223 1.00 0.26 H new ATOM 0 HG11 VAL C 26 142.430 18.763 2.540 1.00 0.34 H new ATOM 0 HG12 VAL C 26 142.650 17.060 3.005 1.00 0.34 H new ATOM 0 HG13 VAL C 26 142.620 17.516 1.285 1.00 0.34 H new ATOM 0 HG21 VAL C 26 140.280 19.524 1.514 1.00 0.34 H new ATOM 0 HG22 VAL C 26 140.468 18.303 0.233 1.00 0.34 H new ATOM 0 HG23 VAL C 26 138.979 18.349 1.208 1.00 0.34 H new ATOM 3229 N VAL C 27 140.167 15.360 -0.454 1.00 0.28 N ATOM 3230 CA VAL C 27 140.667 15.035 -1.824 1.00 0.29 C ATOM 3231 C VAL C 27 139.612 15.483 -2.846 1.00 0.29 C ATOM 3232 O VAL C 27 138.430 15.460 -2.578 1.00 0.28 O ATOM 3233 CB VAL C 27 140.870 13.514 -1.988 1.00 0.30 C ATOM 3234 CG1 VAL C 27 141.585 13.244 -3.314 1.00 0.35 C ATOM 3235 CG2 VAL C 27 141.712 12.920 -0.843 1.00 0.35 C ATOM 0 H VAL C 27 139.163 15.238 -0.323 1.00 0.28 H new ATOM 0 HA VAL C 27 141.618 15.544 -1.979 1.00 0.29 H new ATOM 0 HB VAL C 27 139.888 13.042 -1.969 1.00 0.30 H new ATOM 0 HG11 VAL C 27 141.732 12.171 -3.436 1.00 0.35 H new ATOM 0 HG12 VAL C 27 140.980 13.624 -4.137 1.00 0.35 H new ATOM 0 HG13 VAL C 27 142.553 13.745 -3.314 1.00 0.35 H new ATOM 0 HG21 VAL C 27 141.831 11.848 -0.997 1.00 0.35 H new ATOM 0 HG22 VAL C 27 142.693 13.395 -0.828 1.00 0.35 H new ATOM 0 HG23 VAL C 27 141.209 13.096 0.108 1.00 0.35 H new ATOM 3245 N GLY C 28 140.030 15.887 -4.015 1.00 0.29 N ATOM 3246 CA GLY C 28 139.050 16.330 -5.050 1.00 0.29 C ATOM 3247 C GLY C 28 137.855 15.364 -5.087 1.00 0.29 C ATOM 3248 O GLY C 28 136.729 15.761 -5.317 1.00 0.29 O ATOM 0 H GLY C 28 141.009 15.930 -4.299 1.00 0.29 H new ATOM 0 HA2 GLY C 28 138.705 17.340 -4.828 1.00 0.29 H new ATOM 0 HA3 GLY C 28 139.531 16.365 -6.027 1.00 0.29 H new ATOM 3252 N SER C 29 138.093 14.098 -4.871 1.00 0.30 N ATOM 3253 CA SER C 29 136.977 13.104 -4.893 1.00 0.30 C ATOM 3254 C SER C 29 135.966 13.399 -3.775 1.00 0.29 C ATOM 3255 O SER C 29 134.778 13.212 -3.954 1.00 0.29 O ATOM 3256 CB SER C 29 137.549 11.693 -4.707 1.00 0.31 C ATOM 3257 OG SER C 29 137.002 11.110 -3.529 1.00 1.21 O ATOM 0 H SER C 29 139.015 13.707 -4.679 1.00 0.30 H new ATOM 0 HA SER C 29 136.465 13.174 -5.853 1.00 0.30 H new ATOM 0 HB2 SER C 29 137.313 11.076 -5.574 1.00 0.31 H new ATOM 0 HB3 SER C 29 138.636 11.736 -4.633 1.00 0.31 H new ATOM 0 HG SER C 29 137.366 10.208 -3.411 1.00 1.21 H new ATOM 3263 N THR C 30 136.420 13.855 -2.634 1.00 0.29 N ATOM 3264 CA THR C 30 135.471 14.151 -1.511 1.00 0.28 C ATOM 3265 C THR C 30 135.588 15.628 -1.123 1.00 0.27 C ATOM 3266 O THR C 30 134.940 16.099 -0.211 1.00 0.27 O ATOM 3267 CB THR C 30 135.831 13.260 -0.309 1.00 0.28 C ATOM 3268 OG1 THR C 30 136.177 11.965 -0.779 1.00 0.30 O ATOM 3269 CG2 THR C 30 134.647 13.138 0.666 1.00 0.30 C ATOM 0 H THR C 30 137.403 14.035 -2.430 1.00 0.29 H new ATOM 0 HA THR C 30 134.446 13.947 -1.821 1.00 0.28 H new ATOM 0 HB THR C 30 136.669 13.715 0.219 1.00 0.28 H new ATOM 0 HG1 THR C 30 136.409 11.392 -0.018 1.00 0.30 H new ATOM 0 HG21 THR C 30 134.931 12.503 1.505 1.00 0.30 H new ATOM 0 HG22 THR C 30 134.376 14.127 1.035 1.00 0.30 H new ATOM 0 HG23 THR C 30 133.794 12.697 0.149 1.00 0.30 H new ATOM 3277 N ARG C 31 136.406 16.363 -1.820 1.00 0.27 N ATOM 3278 CA ARG C 31 136.551 17.812 -1.499 1.00 0.26 C ATOM 3279 C ARG C 31 135.199 18.495 -1.656 1.00 0.26 C ATOM 3280 O ARG C 31 134.826 19.338 -0.864 1.00 0.25 O ATOM 3281 CB ARG C 31 137.524 18.473 -2.474 1.00 0.27 C ATOM 3282 CG ARG C 31 137.611 19.982 -2.171 1.00 0.26 C ATOM 3283 CD ARG C 31 138.253 20.735 -3.341 1.00 0.26 C ATOM 3284 NE ARG C 31 139.518 21.342 -2.855 1.00 0.26 N ATOM 3285 CZ ARG C 31 140.292 21.982 -3.677 1.00 0.26 C ATOM 3286 NH1 ARG C 31 139.908 22.178 -4.909 1.00 0.26 N ATOM 3287 NH2 ARG C 31 141.435 22.449 -3.263 1.00 0.26 N ATOM 0 H ARG C 31 136.979 16.027 -2.595 1.00 0.27 H new ATOM 0 HA ARG C 31 136.922 17.909 -0.479 1.00 0.26 H new ATOM 0 HB2 ARG C 31 138.510 18.016 -2.386 1.00 0.27 H new ATOM 0 HB3 ARG C 31 137.190 18.316 -3.500 1.00 0.27 H new ATOM 0 HG2 ARG C 31 136.613 20.378 -1.982 1.00 0.26 H new ATOM 0 HG3 ARG C 31 138.195 20.143 -1.265 1.00 0.26 H new ATOM 0 HD2 ARG C 31 138.450 20.055 -4.170 1.00 0.26 H new ATOM 0 HD3 ARG C 31 137.579 21.506 -3.714 1.00 0.26 H new ATOM 0 HE ARG C 31 139.779 21.256 -1.873 1.00 0.26 H new ATOM 0 HH11 ARG C 31 139.002 21.829 -5.223 1.00 0.26 H new ATOM 0 HH12 ARG C 31 140.513 22.681 -5.558 1.00 0.26 H new ATOM 0 HH21 ARG C 31 141.721 22.312 -2.294 1.00 0.26 H new ATOM 0 HH22 ARG C 31 142.044 22.952 -3.908 1.00 0.26 H new ATOM 3301 N ARG C 32 134.481 18.184 -2.695 1.00 0.26 N ATOM 3302 CA ARG C 32 133.179 18.861 -2.904 1.00 0.26 C ATOM 3303 C ARG C 32 132.274 18.625 -1.710 1.00 0.26 C ATOM 3304 O ARG C 32 131.624 19.529 -1.220 1.00 0.25 O ATOM 3305 CB ARG C 32 132.495 18.296 -4.142 1.00 0.26 C ATOM 3306 CG ARG C 32 131.114 18.944 -4.286 1.00 0.26 C ATOM 3307 CD ARG C 32 130.363 18.334 -5.464 1.00 0.27 C ATOM 3308 NE ARG C 32 129.655 19.429 -6.172 1.00 0.26 N ATOM 3309 CZ ARG C 32 129.072 19.194 -7.306 1.00 0.27 C ATOM 3310 NH1 ARG C 32 129.010 17.975 -7.759 1.00 0.27 N ATOM 3311 NH2 ARG C 32 128.532 20.174 -7.974 1.00 0.26 N ATOM 0 H ARG C 32 134.738 17.496 -3.403 1.00 0.26 H new ATOM 0 HA ARG C 32 133.361 19.928 -3.029 1.00 0.26 H new ATOM 0 HB2 ARG C 32 133.098 18.493 -5.029 1.00 0.26 H new ATOM 0 HB3 ARG C 32 132.396 17.214 -4.057 1.00 0.26 H new ATOM 0 HG2 ARG C 32 130.542 18.804 -3.369 1.00 0.26 H new ATOM 0 HG3 ARG C 32 131.223 20.019 -4.432 1.00 0.26 H new ATOM 0 HD2 ARG C 32 131.056 17.830 -6.138 1.00 0.27 H new ATOM 0 HD3 ARG C 32 129.653 17.583 -5.116 1.00 0.27 H new ATOM 0 HE ARG C 32 129.627 20.365 -5.767 1.00 0.26 H new ATOM 0 HH11 ARG C 32 129.419 17.210 -7.222 1.00 0.27 H new ATOM 0 HH12 ARG C 32 128.552 17.785 -8.651 1.00 0.27 H new ATOM 0 HH21 ARG C 32 128.568 21.124 -7.605 1.00 0.26 H new ATOM 0 HH22 ARG C 32 128.073 19.991 -8.866 1.00 0.26 H new ATOM 3325 N LEU C 33 132.206 17.422 -1.244 1.00 0.26 N ATOM 3326 CA LEU C 33 131.319 17.141 -0.097 1.00 0.26 C ATOM 3327 C LEU C 33 131.735 18.036 1.059 1.00 0.25 C ATOM 3328 O LEU C 33 130.912 18.553 1.784 1.00 0.24 O ATOM 3329 CB LEU C 33 131.413 15.662 0.295 1.00 0.26 C ATOM 3330 CG LEU C 33 130.521 15.346 1.518 1.00 0.29 C ATOM 3331 CD1 LEU C 33 129.025 15.471 1.169 1.00 0.40 C ATOM 3332 CD2 LEU C 33 130.795 13.904 1.993 1.00 0.32 C ATOM 0 H LEU C 33 132.724 16.621 -1.606 1.00 0.26 H new ATOM 0 HA LEU C 33 130.282 17.347 -0.363 1.00 0.26 H new ATOM 0 HB2 LEU C 33 131.111 15.040 -0.548 1.00 0.26 H new ATOM 0 HB3 LEU C 33 132.449 15.409 0.523 1.00 0.26 H new ATOM 0 HG LEU C 33 130.760 16.064 2.303 1.00 0.29 H new ATOM 0 HD11 LEU C 33 128.425 15.242 2.050 1.00 0.40 H new ATOM 0 HD12 LEU C 33 128.812 16.488 0.839 1.00 0.40 H new ATOM 0 HD13 LEU C 33 128.778 14.771 0.371 1.00 0.40 H new ATOM 0 HD21 LEU C 33 130.167 13.679 2.855 1.00 0.32 H new ATOM 0 HD22 LEU C 33 130.568 13.206 1.187 1.00 0.32 H new ATOM 0 HD23 LEU C 33 131.844 13.806 2.273 1.00 0.32 H new ATOM 3344 N TYR C 34 133.011 18.240 1.230 1.00 0.25 N ATOM 3345 CA TYR C 34 133.474 19.123 2.335 1.00 0.24 C ATOM 3346 C TYR C 34 133.082 20.578 2.064 1.00 0.24 C ATOM 3347 O TYR C 34 132.715 21.309 2.965 1.00 0.23 O ATOM 3348 CB TYR C 34 134.993 19.018 2.454 1.00 0.25 C ATOM 3349 CG TYR C 34 135.334 17.734 3.163 1.00 0.25 C ATOM 3350 CD1 TYR C 34 134.910 17.545 4.477 1.00 0.25 C ATOM 3351 CD2 TYR C 34 136.070 16.736 2.512 1.00 0.26 C ATOM 3352 CE1 TYR C 34 135.208 16.364 5.149 1.00 0.25 C ATOM 3353 CE2 TYR C 34 136.373 15.546 3.187 1.00 0.26 C ATOM 3354 CZ TYR C 34 135.943 15.361 4.508 1.00 0.26 C ATOM 3355 OH TYR C 34 136.241 14.191 5.173 1.00 0.27 O ATOM 0 H TYR C 34 133.750 17.835 0.655 1.00 0.25 H new ATOM 0 HA TYR C 34 133.002 18.805 3.264 1.00 0.24 H new ATOM 0 HB2 TYR C 34 135.452 19.037 1.465 1.00 0.25 H new ATOM 0 HB3 TYR C 34 135.389 19.871 3.006 1.00 0.25 H new ATOM 0 HD1 TYR C 34 134.347 18.320 4.976 1.00 0.25 H new ATOM 0 HD2 TYR C 34 136.402 16.883 1.495 1.00 0.26 H new ATOM 0 HE1 TYR C 34 134.872 16.221 6.165 1.00 0.25 H new ATOM 0 HE2 TYR C 34 136.938 14.772 2.689 1.00 0.26 H new ATOM 0 HH TYR C 34 136.756 13.602 4.583 1.00 0.27 H new ATOM 3365 N GLU C 35 133.157 21.010 0.837 1.00 0.24 N ATOM 3366 CA GLU C 35 132.794 22.423 0.530 1.00 0.23 C ATOM 3367 C GLU C 35 131.324 22.641 0.858 1.00 0.23 C ATOM 3368 O GLU C 35 130.935 23.685 1.351 1.00 0.22 O ATOM 3369 CB GLU C 35 133.010 22.726 -0.950 1.00 0.23 C ATOM 3370 CG GLU C 35 134.495 22.650 -1.282 1.00 0.24 C ATOM 3371 CD GLU C 35 134.701 23.038 -2.745 1.00 0.24 C ATOM 3372 OE1 GLU C 35 133.750 23.495 -3.356 1.00 0.24 O ATOM 3373 OE2 GLU C 35 135.804 22.869 -3.230 1.00 0.25 O ATOM 0 H GLU C 35 133.452 20.451 0.037 1.00 0.24 H new ATOM 0 HA GLU C 35 133.425 23.082 1.126 1.00 0.23 H new ATOM 0 HB2 GLU C 35 132.455 22.014 -1.561 1.00 0.23 H new ATOM 0 HB3 GLU C 35 132.625 23.718 -1.187 1.00 0.23 H new ATOM 0 HG2 GLU C 35 135.060 23.319 -0.633 1.00 0.24 H new ATOM 0 HG3 GLU C 35 134.869 21.642 -1.104 1.00 0.24 H new ATOM 3380 N LYS C 36 130.498 21.672 0.590 1.00 0.23 N ATOM 3381 CA LYS C 36 129.053 21.828 0.888 1.00 0.23 C ATOM 3382 C LYS C 36 128.836 21.868 2.402 1.00 0.22 C ATOM 3383 O LYS C 36 128.006 22.604 2.901 1.00 0.22 O ATOM 3384 CB LYS C 36 128.286 20.650 0.282 1.00 0.23 C ATOM 3385 CG LYS C 36 126.781 20.888 0.430 1.00 0.26 C ATOM 3386 CD LYS C 36 126.014 19.771 -0.281 1.00 0.86 C ATOM 3387 CE LYS C 36 124.510 20.021 -0.151 1.00 1.41 C ATOM 3388 NZ LYS C 36 123.767 18.775 -0.489 1.00 2.07 N ATOM 0 H LYS C 36 130.763 20.778 0.177 1.00 0.23 H new ATOM 0 HA LYS C 36 128.689 22.760 0.456 1.00 0.23 H new ATOM 0 HB2 LYS C 36 128.545 20.537 -0.771 1.00 0.23 H new ATOM 0 HB3 LYS C 36 128.569 19.723 0.781 1.00 0.23 H new ATOM 0 HG2 LYS C 36 126.509 20.916 1.485 1.00 0.26 H new ATOM 0 HG3 LYS C 36 126.512 21.855 0.006 1.00 0.26 H new ATOM 0 HD2 LYS C 36 126.297 19.733 -1.333 1.00 0.86 H new ATOM 0 HD3 LYS C 36 126.272 18.805 0.153 1.00 0.86 H new ATOM 0 HE2 LYS C 36 124.270 20.336 0.864 1.00 1.41 H new ATOM 0 HE3 LYS C 36 124.206 20.830 -0.816 1.00 1.41 H new ATOM 0 HZ1 LYS C 36 122.745 18.945 -0.400 1.00 2.07 H new ATOM 0 HZ2 LYS C 36 123.988 18.493 -1.465 1.00 2.07 H new ATOM 0 HZ3 LYS C 36 124.049 18.015 0.163 1.00 2.07 H new ATOM 3402 N LYS C 37 129.561 21.065 3.134 1.00 0.23 N ATOM 3403 CA LYS C 37 129.381 21.036 4.613 1.00 0.22 C ATOM 3404 C LYS C 37 129.702 22.396 5.216 1.00 0.22 C ATOM 3405 O LYS C 37 128.989 22.883 6.069 1.00 0.21 O ATOM 3406 CB LYS C 37 130.300 19.990 5.244 1.00 0.23 C ATOM 3407 CG LYS C 37 129.886 18.590 4.781 1.00 0.26 C ATOM 3408 CD LYS C 37 130.106 17.583 5.909 1.00 1.05 C ATOM 3409 CE LYS C 37 129.833 16.162 5.399 1.00 1.11 C ATOM 3410 NZ LYS C 37 128.749 15.562 6.214 1.00 1.93 N ATOM 0 H LYS C 37 130.270 20.428 2.771 1.00 0.23 H new ATOM 0 HA LYS C 37 128.341 20.781 4.818 1.00 0.22 H new ATOM 0 HB2 LYS C 37 131.335 20.185 4.963 1.00 0.23 H new ATOM 0 HB3 LYS C 37 130.247 20.054 6.331 1.00 0.23 H new ATOM 0 HG2 LYS C 37 128.838 18.591 4.482 1.00 0.26 H new ATOM 0 HG3 LYS C 37 130.467 18.301 3.905 1.00 0.26 H new ATOM 0 HD2 LYS C 37 131.129 17.656 6.279 1.00 1.05 H new ATOM 0 HD3 LYS C 37 129.447 17.811 6.746 1.00 1.05 H new ATOM 0 HE2 LYS C 37 129.545 16.187 4.348 1.00 1.11 H new ATOM 0 HE3 LYS C 37 130.737 15.556 5.468 1.00 1.11 H new ATOM 0 HZ1 LYS C 37 128.769 14.527 6.110 1.00 1.93 H new ATOM 0 HZ2 LYS C 37 128.887 15.812 7.214 1.00 1.93 H new ATOM 0 HZ3 LYS C 37 127.830 15.925 5.890 1.00 1.93 H new ATOM 3424 N ILE C 38 130.758 23.021 4.789 1.00 0.22 N ATOM 3425 CA ILE C 38 131.099 24.348 5.349 1.00 0.21 C ATOM 3426 C ILE C 38 130.033 25.355 4.930 1.00 0.20 C ATOM 3427 O ILE C 38 129.668 26.234 5.683 1.00 0.20 O ATOM 3428 CB ILE C 38 132.449 24.781 4.796 1.00 0.21 C ATOM 3429 CG1 ILE C 38 133.502 23.723 5.100 1.00 0.21 C ATOM 3430 CG2 ILE C 38 132.877 26.097 5.436 1.00 0.20 C ATOM 3431 CD1 ILE C 38 134.724 24.018 4.241 1.00 0.22 C ATOM 0 H ILE C 38 131.398 22.669 4.077 1.00 0.22 H new ATOM 0 HA ILE C 38 131.144 24.296 6.437 1.00 0.21 H new ATOM 0 HB ILE C 38 132.356 24.908 3.717 1.00 0.21 H new ATOM 0 HG12 ILE C 38 133.766 23.740 6.157 1.00 0.21 H new ATOM 0 HG13 ILE C 38 133.115 22.727 4.884 1.00 0.21 H new ATOM 0 HG21 ILE C 38 133.844 26.399 5.034 1.00 0.20 H new ATOM 0 HG22 ILE C 38 132.136 26.866 5.216 1.00 0.20 H new ATOM 0 HG23 ILE C 38 132.957 25.968 6.515 1.00 0.20 H new ATOM 0 HD11 ILE C 38 135.496 23.274 4.439 1.00 0.22 H new ATOM 0 HD12 ILE C 38 134.446 23.981 3.188 1.00 0.22 H new ATOM 0 HD13 ILE C 38 135.106 25.010 4.481 1.00 0.22 H new ATOM 3443 N PHE C 39 129.525 25.223 3.732 1.00 0.21 N ATOM 3444 CA PHE C 39 128.482 26.173 3.260 1.00 0.20 C ATOM 3445 C PHE C 39 127.247 26.068 4.160 1.00 0.20 C ATOM 3446 O PHE C 39 126.668 27.055 4.562 1.00 0.19 O ATOM 3447 CB PHE C 39 128.085 25.818 1.821 1.00 0.21 C ATOM 3448 CG PHE C 39 127.144 26.874 1.296 1.00 0.20 C ATOM 3449 CD1 PHE C 39 125.775 26.799 1.585 1.00 0.20 C ATOM 3450 CD2 PHE C 39 127.640 27.935 0.530 1.00 0.20 C ATOM 3451 CE1 PHE C 39 124.903 27.783 1.106 1.00 0.20 C ATOM 3452 CE2 PHE C 39 126.768 28.921 0.052 1.00 0.20 C ATOM 3453 CZ PHE C 39 125.400 28.845 0.340 1.00 0.20 C ATOM 0 H PHE C 39 129.789 24.499 3.064 1.00 0.21 H new ATOM 0 HA PHE C 39 128.876 27.189 3.296 1.00 0.20 H new ATOM 0 HB2 PHE C 39 128.972 25.757 1.190 1.00 0.21 H new ATOM 0 HB3 PHE C 39 127.606 24.839 1.793 1.00 0.21 H new ATOM 0 HD1 PHE C 39 125.393 25.981 2.178 1.00 0.20 H new ATOM 0 HD2 PHE C 39 128.695 27.993 0.308 1.00 0.20 H new ATOM 0 HE1 PHE C 39 123.847 27.724 1.327 1.00 0.20 H new ATOM 0 HE2 PHE C 39 127.151 29.740 -0.539 1.00 0.20 H new ATOM 0 HZ PHE C 39 124.728 29.606 -0.029 1.00 0.20 H new ATOM 3463 N GLU C 40 126.830 24.873 4.466 1.00 0.20 N ATOM 3464 CA GLU C 40 125.617 24.700 5.322 1.00 0.20 C ATOM 3465 C GLU C 40 125.845 25.325 6.708 1.00 0.20 C ATOM 3466 O GLU C 40 124.983 25.990 7.254 1.00 0.19 O ATOM 3467 CB GLU C 40 125.295 23.205 5.465 1.00 0.21 C ATOM 3468 CG GLU C 40 124.041 23.038 6.327 1.00 0.21 C ATOM 3469 CD GLU C 40 123.502 21.614 6.181 1.00 0.21 C ATOM 3470 OE1 GLU C 40 123.922 20.933 5.261 1.00 0.22 O ATOM 3471 OE2 GLU C 40 122.669 21.231 6.988 1.00 0.21 O ATOM 0 H GLU C 40 127.274 24.006 4.162 1.00 0.20 H new ATOM 0 HA GLU C 40 124.775 25.206 4.849 1.00 0.20 H new ATOM 0 HB2 GLU C 40 125.137 22.760 4.483 1.00 0.21 H new ATOM 0 HB3 GLU C 40 126.136 22.682 5.921 1.00 0.21 H new ATOM 0 HG2 GLU C 40 124.276 23.243 7.371 1.00 0.21 H new ATOM 0 HG3 GLU C 40 123.281 23.758 6.024 1.00 0.21 H new ATOM 3478 N TYR C 41 127.000 25.131 7.282 1.00 0.20 N ATOM 3479 CA TYR C 41 127.265 25.724 8.625 1.00 0.19 C ATOM 3480 C TYR C 41 127.352 27.249 8.502 1.00 0.19 C ATOM 3481 O TYR C 41 126.652 27.986 9.179 1.00 0.18 O ATOM 3482 CB TYR C 41 128.588 25.173 9.156 1.00 0.20 C ATOM 3483 CG TYR C 41 128.785 25.617 10.581 1.00 0.19 C ATOM 3484 CD1 TYR C 41 128.144 24.932 11.619 1.00 0.20 C ATOM 3485 CD2 TYR C 41 129.609 26.711 10.868 1.00 0.19 C ATOM 3486 CE1 TYR C 41 128.326 25.340 12.944 1.00 0.19 C ATOM 3487 CE2 TYR C 41 129.792 27.119 12.193 1.00 0.19 C ATOM 3488 CZ TYR C 41 129.151 26.434 13.232 1.00 0.19 C ATOM 3489 OH TYR C 41 129.333 26.835 14.538 1.00 0.19 O ATOM 0 H TYR C 41 127.768 24.591 6.883 1.00 0.20 H new ATOM 0 HA TYR C 41 126.458 25.467 9.311 1.00 0.19 H new ATOM 0 HB2 TYR C 41 128.589 24.084 9.100 1.00 0.20 H new ATOM 0 HB3 TYR C 41 129.414 25.524 8.538 1.00 0.20 H new ATOM 0 HD1 TYR C 41 127.508 24.088 11.397 1.00 0.20 H new ATOM 0 HD2 TYR C 41 130.103 27.240 10.067 1.00 0.19 H new ATOM 0 HE1 TYR C 41 127.830 24.811 13.745 1.00 0.19 H new ATOM 0 HE2 TYR C 41 130.428 27.963 12.415 1.00 0.19 H new ATOM 0 HH TYR C 41 129.935 27.608 14.562 1.00 0.19 H new ATOM 3499 N GLU C 42 128.203 27.721 7.629 1.00 0.19 N ATOM 3500 CA GLU C 42 128.363 29.189 7.435 1.00 0.18 C ATOM 3501 C GLU C 42 127.013 29.799 7.104 1.00 0.18 C ATOM 3502 O GLU C 42 126.719 30.916 7.492 1.00 0.17 O ATOM 3503 CB GLU C 42 129.305 29.438 6.260 1.00 0.18 C ATOM 3504 CG GLU C 42 130.688 28.872 6.566 1.00 0.19 C ATOM 3505 CD GLU C 42 131.464 29.839 7.461 1.00 0.18 C ATOM 3506 OE1 GLU C 42 131.906 30.858 6.952 1.00 0.18 O ATOM 3507 OE2 GLU C 42 131.629 29.535 8.631 1.00 0.18 O ATOM 0 H GLU C 42 128.800 27.144 7.036 1.00 0.19 H new ATOM 0 HA GLU C 42 128.766 29.635 8.344 1.00 0.18 H new ATOM 0 HB2 GLU C 42 128.905 28.973 5.359 1.00 0.18 H new ATOM 0 HB3 GLU C 42 129.377 30.507 6.062 1.00 0.18 H new ATOM 0 HG2 GLU C 42 130.593 27.904 7.059 1.00 0.19 H new ATOM 0 HG3 GLU C 42 131.235 28.705 5.638 1.00 0.19 H new ATOM 3514 N THR C 43 126.166 29.083 6.407 1.00 0.18 N ATOM 3515 CA THR C 43 124.828 29.631 6.087 1.00 0.18 C ATOM 3516 C THR C 43 124.092 29.888 7.390 1.00 0.18 C ATOM 3517 O THR C 43 123.471 30.920 7.574 1.00 0.17 O ATOM 3518 CB THR C 43 124.064 28.599 5.255 1.00 0.19 C ATOM 3519 OG1 THR C 43 124.723 28.404 4.011 1.00 0.19 O ATOM 3520 CG2 THR C 43 122.632 29.074 5.014 1.00 0.18 C ATOM 0 H THR C 43 126.350 28.145 6.050 1.00 0.18 H new ATOM 0 HA THR C 43 124.914 30.560 5.524 1.00 0.18 H new ATOM 0 HB THR C 43 124.035 27.655 5.799 1.00 0.19 H new ATOM 0 HG1 THR C 43 125.272 27.593 4.055 1.00 0.19 H new ATOM 0 HG21 THR C 43 122.097 28.332 4.421 1.00 0.18 H new ATOM 0 HG22 THR C 43 122.127 29.206 5.971 1.00 0.18 H new ATOM 0 HG23 THR C 43 122.649 30.023 4.478 1.00 0.18 H new ATOM 3528 N GLN C 44 124.156 28.962 8.315 1.00 0.18 N ATOM 3529 CA GLN C 44 123.449 29.190 9.597 1.00 0.18 C ATOM 3530 C GLN C 44 123.936 30.491 10.229 1.00 0.17 C ATOM 3531 O GLN C 44 123.146 31.314 10.642 1.00 0.17 O ATOM 3532 CB GLN C 44 123.722 28.038 10.574 1.00 0.18 C ATOM 3533 CG GLN C 44 122.694 26.924 10.380 1.00 0.19 C ATOM 3534 CD GLN C 44 122.838 25.908 11.513 1.00 0.19 C ATOM 3535 OE1 GLN C 44 123.672 26.068 12.383 1.00 0.19 O ATOM 3536 NE2 GLN C 44 122.043 24.876 11.553 1.00 0.19 N ATOM 0 H GLN C 44 124.658 28.078 8.235 1.00 0.18 H new ATOM 0 HA GLN C 44 122.380 29.247 9.394 1.00 0.18 H new ATOM 0 HB2 GLN C 44 124.727 27.647 10.414 1.00 0.18 H new ATOM 0 HB3 GLN C 44 123.682 28.405 11.600 1.00 0.18 H new ATOM 0 HG2 GLN C 44 121.686 27.339 10.373 1.00 0.19 H new ATOM 0 HG3 GLN C 44 122.845 26.437 9.417 1.00 0.19 H new ATOM 0 HE21 GLN C 44 121.344 24.742 10.823 1.00 0.19 H new ATOM 0 HE22 GLN C 44 122.120 24.202 12.315 1.00 0.19 H new ATOM 3545 N ARG C 45 125.224 30.679 10.338 1.00 0.17 N ATOM 3546 CA ARG C 45 125.731 31.920 10.974 1.00 0.17 C ATOM 3547 C ARG C 45 125.211 33.117 10.186 1.00 0.16 C ATOM 3548 O ARG C 45 124.988 34.178 10.737 1.00 0.16 O ATOM 3549 CB ARG C 45 127.271 31.901 11.024 1.00 0.17 C ATOM 3550 CG ARG C 45 127.764 30.475 11.387 1.00 0.17 C ATOM 3551 CD ARG C 45 128.567 30.472 12.690 1.00 0.17 C ATOM 3552 NE ARG C 45 129.947 30.958 12.404 1.00 0.17 N ATOM 3553 CZ ARG C 45 130.822 31.056 13.362 1.00 0.17 C ATOM 3554 NH1 ARG C 45 130.520 30.644 14.563 1.00 0.17 N ATOM 3555 NH2 ARG C 45 132.008 31.537 13.114 1.00 0.17 N ATOM 0 H ARG C 45 125.940 30.029 10.015 1.00 0.17 H new ATOM 0 HA ARG C 45 125.375 31.992 12.002 1.00 0.17 H new ATOM 0 HB2 ARG C 45 127.680 32.203 10.060 1.00 0.17 H new ATOM 0 HB3 ARG C 45 127.630 32.619 11.761 1.00 0.17 H new ATOM 0 HG2 ARG C 45 126.908 29.807 11.485 1.00 0.17 H new ATOM 0 HG3 ARG C 45 128.381 30.086 10.577 1.00 0.17 H new ATOM 0 HD2 ARG C 45 128.087 31.112 13.431 1.00 0.17 H new ATOM 0 HD3 ARG C 45 128.600 29.467 13.111 1.00 0.17 H new ATOM 0 HE ARG C 45 130.207 31.215 11.452 1.00 0.17 H new ATOM 0 HH11 ARG C 45 129.599 30.246 14.749 1.00 0.17 H new ATOM 0 HH12 ARG C 45 131.205 30.720 15.315 1.00 0.17 H new ATOM 0 HH21 ARG C 45 132.250 31.836 12.169 1.00 0.17 H new ATOM 0 HH22 ARG C 45 132.694 31.614 13.865 1.00 0.17 H new ATOM 3569 N ARG C 46 125.005 32.968 8.904 1.00 0.17 N ATOM 3570 CA ARG C 46 124.484 34.118 8.122 1.00 0.16 C ATOM 3571 C ARG C 46 123.003 34.323 8.446 1.00 0.16 C ATOM 3572 O ARG C 46 122.460 35.386 8.222 1.00 0.16 O ATOM 3573 CB ARG C 46 124.680 33.884 6.626 1.00 0.17 C ATOM 3574 CG ARG C 46 126.124 34.235 6.253 1.00 0.17 C ATOM 3575 CD ARG C 46 126.292 34.229 4.735 1.00 0.17 C ATOM 3576 NE ARG C 46 127.684 33.808 4.409 1.00 0.17 N ATOM 3577 CZ ARG C 46 128.017 33.536 3.178 1.00 0.18 C ATOM 3578 NH1 ARG C 46 127.166 33.747 2.211 1.00 0.18 N ATOM 3579 NH2 ARG C 46 129.207 33.074 2.911 1.00 0.18 N ATOM 0 H ARG C 46 125.173 32.112 8.375 1.00 0.17 H new ATOM 0 HA ARG C 46 125.037 35.016 8.395 1.00 0.16 H new ATOM 0 HB2 ARG C 46 124.468 32.844 6.376 1.00 0.17 H new ATOM 0 HB3 ARG C 46 123.983 34.497 6.054 1.00 0.17 H new ATOM 0 HG2 ARG C 46 126.382 35.216 6.651 1.00 0.17 H new ATOM 0 HG3 ARG C 46 126.809 33.518 6.705 1.00 0.17 H new ATOM 0 HD2 ARG C 46 125.575 33.547 4.278 1.00 0.17 H new ATOM 0 HD3 ARG C 46 126.092 35.221 4.329 1.00 0.17 H new ATOM 0 HE ARG C 46 128.379 33.732 5.152 1.00 0.17 H new ATOM 0 HH11 ARG C 46 126.241 34.124 2.419 1.00 0.18 H new ATOM 0 HH12 ARG C 46 127.426 33.535 1.248 1.00 0.18 H new ATOM 0 HH21 ARG C 46 129.877 32.925 3.665 1.00 0.18 H new ATOM 0 HH22 ARG C 46 129.467 32.861 1.948 1.00 0.18 H new ATOM 3593 N ARG C 47 122.339 33.327 8.975 1.00 0.16 N ATOM 3594 CA ARG C 47 120.897 33.492 9.322 1.00 0.16 C ATOM 3595 C ARG C 47 120.768 33.684 10.840 1.00 0.16 C ATOM 3596 O ARG C 47 121.196 32.800 11.564 1.00 0.16 O ATOM 3597 CB ARG C 47 120.130 32.231 8.896 1.00 0.17 C ATOM 3598 CG ARG C 47 119.400 32.486 7.570 1.00 0.17 C ATOM 3599 CD ARG C 47 118.535 31.270 7.200 1.00 0.17 C ATOM 3600 NE ARG C 47 119.123 30.592 6.012 1.00 0.18 N ATOM 3601 CZ ARG C 47 118.707 29.405 5.669 1.00 0.18 C ATOM 3602 NH1 ARG C 47 117.785 28.809 6.373 1.00 0.18 N ATOM 3603 NH2 ARG C 47 119.218 28.811 4.625 1.00 0.18 N ATOM 3604 OXT ARG C 47 120.242 34.704 11.250 1.00 0.16 O ATOM 0 H ARG C 47 122.733 32.409 9.181 1.00 0.16 H new ATOM 0 HA ARG C 47 120.485 34.360 8.807 1.00 0.16 H new ATOM 0 HB2 ARG C 47 120.820 31.395 8.786 1.00 0.17 H new ATOM 0 HB3 ARG C 47 119.413 31.953 9.668 1.00 0.17 H new ATOM 0 HG2 ARG C 47 118.774 33.374 7.656 1.00 0.17 H new ATOM 0 HG3 ARG C 47 120.124 32.681 6.779 1.00 0.17 H new ATOM 0 HD2 ARG C 47 118.483 30.577 8.040 1.00 0.17 H new ATOM 0 HD3 ARG C 47 117.515 31.587 6.984 1.00 0.17 H new ATOM 0 HE ARG C 47 119.850 31.056 5.467 1.00 0.18 H new ATOM 0 HH11 ARG C 47 117.390 29.272 7.192 1.00 0.18 H new ATOM 0 HH12 ARG C 47 117.459 27.880 6.105 1.00 0.18 H new ATOM 0 HH21 ARG C 47 119.943 29.276 4.078 1.00 0.18 H new ATOM 0 HH22 ARG C 47 118.893 27.882 4.357 1.00 0.18 H new TER 3618 ARG C 47 END