HEADER ANTIMICROBIAL PROTEIN 09-APR-09 SMS20080 TITLE STRUCTURE AND INTERACTIONS IN MEMBRANES OF HUMAN AND BOVINE CATESTATIN TITLE 2 BY SOLUTION AND SOLID-STATE NMR SPECTROSCOPY COMPND MOL_ID: 1; COMPND 2 MOLECULE: CHROMOGRANIN-A; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 370-390; COMPND 5 SYNONYM: CGA, PITUITARY SECRETORY PROTEIN I, SP-I, AL-11; COMPND 6 ENGINEERED: YES; COMPND 7 OTHER_DETAILS: HCGA(G364S) SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 4 ORGANISM_COMMON: HUMAN; SOURCE 5 ORGANISM_TAXID: 9606; SOURCE 6 OTHER_DETAILS: SYNTHESIZED BY AUTOMATED SOLID-PHASE PEPTIDE SOURCE 7 SYNTHESIS USING THE FMOC CHEMISTRY KEYWDS ALPHA-HELIX, ANTIMICROBIAL PROTEIN EXPDTA SOLUTION NMR NUMMDL 10 AUTHOR M.SUGAWARA,J.M.RESENDE,C.M.MORAES,J.F.CHICH,A.MARQUETTE,M.H.METZ- AUTHOR 2 BOUTIGUE,B.BECHINGER JRNL AUTH M.SUGAWARA,J.M.RESENDE,C.M.MORAES,A.MARQUETTE,J.F.CHICH, JRNL AUTH 2 M.H.METZ-BOUTIGUE,B.BECHINGER JRNL TITL MEMBRANE STRUCTURE AND INTERACTIONS OF HUMAN CATESTATIN BY JRNL TITL 2 MULTIDIMENSIONAL SOLUTION AND SOLID-STATE NMR SPECTROSCOPY JRNL REF FASEB J. V. 24 1737 2010 JRNL REFN ISSN 0892-6638 JRNL PMID 20103720 JRNL DOI 10.1096/FJ.09-142554 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR_NIH REMARK 3 AUTHORS : SCHWIETERS, KUSZEWSKI, TJANDRA AND CLORE REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NOE INTENSITIES OBTAINED AT 200 MS REMARK 3 MIXING TIME WERE CONVERTED INTO SEMI-QUANTITATIVE DISTANCE REMARK 3 RESTRAINS. THE UPPER LIMITS OF THE DISTANCES RESTRAINS THUS REMARK 3 OBTAINED WERE 2.8, 3.4 AND 5.0 Ǻ (STRONG, MEDIUM, AND WEAK REMARK 3 NOE, RESPECTIVELY). STRUCTURE CALCULATIONS WERE PERFORMED USING REMARK 3 THE XPLOR-NIH SOFTWARE, VERSION 2.14.0 . STARTING WITH AN REMARK 3 EXTENDED CONFORMATION, 100 STRUCTURES WERE GENERATED USING A REMARK 3 SIMULATED ANNEALING PROTOCOL. THIS WAS FOLLOWED BY 15000 STEPS OF REMARK 3 SIMULATED ANNEALING AT 1000 K AND A SUBSEQUENT DECREASE IN REMARK 3 TEMPERATURE IN 14000 STEPS IN THE FIRST SLOW-COOL ANNEALING STAGE. REMARK 4 REMARK 4 NULL COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 06-OCT-10. REMARK 100 THE BMRB ID CODE IS SMS20080. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298.0 REMARK 210 PH : 5.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 2.0MM HCGA(G364S); 400MM [U-2H] REMARK 210 DPC-D38; 95% V/V [U-2H] D2O; 5% REMARK 210 V/V H2O; 95% H2O/5% D2O IN THE REMARK 210 PRESENCE OF DPC MICELLS REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D DQF-COSY; 2D 1H-1H TOCSY; 2D REMARK 210 1H-1H NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XWINNMR, NMRPIPE, NMRVIEW, X- REMARK 210 PLOR_NIH, MOLMOL REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 10 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST ENERGY REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 5 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 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 HB2 PRO A 19 HN1 NH2 A 22 1.60 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 1 MET A 3 78.50 -110.01 REMARK 500 1 LEU A 5 -174.89 -172.53 REMARK 500 1 PHE A 7 -71.57 -58.74 REMARK 500 1 ALA A 11 58.30 -160.27 REMARK 500 1 TYR A 12 46.84 -107.52 REMARK 500 1 SER A 13 52.87 -94.28 REMARK 500 2 LEU A 5 -177.33 -55.74 REMARK 500 2 SER A 6 66.17 -112.17 REMARK 500 2 ALA A 11 46.93 -169.12 REMARK 500 2 TYR A 12 54.97 -110.74 REMARK 500 2 SER A 13 83.42 52.11 REMARK 500 2 ARG A 15 -121.66 -118.93 REMARK 500 3 SER A 13 52.80 -156.35 REMARK 500 3 ARG A 15 102.43 -175.59 REMARK 500 3 PRO A 17 43.48 -99.09 REMARK 500 4 LEU A 5 177.47 -57.46 REMARK 500 4 SER A 6 51.68 -155.33 REMARK 500 4 ALA A 11 46.76 -143.64 REMARK 500 4 SER A 13 47.10 -142.92 REMARK 500 4 ARG A 15 -122.18 -126.43 REMARK 500 5 MET A 3 55.63 -150.76 REMARK 500 5 LYS A 4 -67.13 -167.98 REMARK 500 5 ALA A 11 46.56 -143.28 REMARK 500 5 SER A 13 51.27 -100.54 REMARK 500 5 ARG A 15 101.66 64.27 REMARK 500 5 GLN A 20 -76.00 -57.46 REMARK 500 6 TYR A 12 62.49 -115.56 REMARK 500 6 SER A 13 70.85 52.47 REMARK 500 6 PHE A 14 -61.93 -90.20 REMARK 500 6 ARG A 15 101.79 64.82 REMARK 500 6 PRO A 17 -69.82 -98.56 REMARK 500 6 GLN A 20 -179.29 -58.10 REMARK 500 7 SER A 2 67.22 -155.64 REMARK 500 7 MET A 3 74.53 52.28 REMARK 500 7 ALA A 11 47.63 -177.28 REMARK 500 7 ARG A 15 -122.01 -124.18 REMARK 500 8 LEU A 5 -172.32 -57.26 REMARK 500 8 ALA A 11 46.04 -140.97 REMARK 500 8 ARG A 15 -121.52 -126.99 REMARK 500 9 LEU A 5 -178.89 -56.61 REMARK 500 9 ALA A 11 56.16 -148.24 REMARK 500 9 TYR A 12 50.36 -105.65 REMARK 500 9 SER A 13 78.52 51.82 REMARK 500 10 MET A 3 116.44 -160.88 REMARK 500 10 LEU A 5 -161.71 -172.85 REMARK 500 10 ALA A 11 53.10 -143.90 REMARK 500 10 TYR A 12 49.96 -109.61 REMARK 500 10 SER A 13 57.32 -99.24 REMARK 500 10 ARG A 15 102.02 67.49 REMARK 500 10 GLN A 20 -173.73 -58.90 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 1 ARG A 8 0.20 SIDE CHAIN REMARK 500 1 ARG A 10 0.30 SIDE CHAIN REMARK 500 1 ARG A 15 0.31 SIDE CHAIN REMARK 500 2 ARG A 8 0.25 SIDE CHAIN REMARK 500 2 ARG A 10 0.21 SIDE CHAIN REMARK 500 2 ARG A 15 0.23 SIDE CHAIN REMARK 500 3 ARG A 8 0.21 SIDE CHAIN REMARK 500 3 ARG A 10 0.22 SIDE CHAIN REMARK 500 3 ARG A 15 0.31 SIDE CHAIN REMARK 500 4 ARG A 8 0.22 SIDE CHAIN REMARK 500 4 ARG A 10 0.23 SIDE CHAIN REMARK 500 4 ARG A 15 0.24 SIDE CHAIN REMARK 500 5 ARG A 8 0.21 SIDE CHAIN REMARK 500 5 ARG A 10 0.23 SIDE CHAIN REMARK 500 5 ARG A 15 0.22 SIDE CHAIN REMARK 500 6 ARG A 8 0.31 SIDE CHAIN REMARK 500 6 ARG A 10 0.21 SIDE CHAIN REMARK 500 6 ARG A 15 0.28 SIDE CHAIN REMARK 500 7 ARG A 8 0.26 SIDE CHAIN REMARK 500 7 ARG A 10 0.32 SIDE CHAIN REMARK 500 7 ARG A 15 0.28 SIDE CHAIN REMARK 500 8 ARG A 8 0.24 SIDE CHAIN REMARK 500 8 ARG A 10 0.21 SIDE CHAIN REMARK 500 8 ARG A 15 0.23 SIDE CHAIN REMARK 500 9 ARG A 8 0.23 SIDE CHAIN REMARK 500 9 ARG A 10 0.24 SIDE CHAIN REMARK 500 9 ARG A 15 0.23 SIDE CHAIN REMARK 500 10 ARG A 8 0.30 SIDE CHAIN REMARK 500 10 ARG A 10 0.31 SIDE CHAIN REMARK 500 10 ARG A 15 0.23 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 20080 RELATED DB: BMRB REMARK 999 REMARK 999 SEQUENCE REMARK 999 THE USING REFERENCE SEQUENCE IS A HUMAN VARIANT REFERRED IN REF_21 REMARK 999 OF UNIPROT P10645. DBREF A 1 21 UNP P10645 CMGA_HUMAN 370 390 SEQADV NH2 A 22 UNP P10645 AMIDATION SEQRES 1 A 22 SER SER MET LYS LEU SER PHE ARG ALA ARG ALA TYR SER SEQRES 2 A 22 PHE ARG GLY PRO GLY PRO GLN LEU NH2 HET NH2 A 22 3 HETNAM NH2 AMINO GROUP FORMUL 1 NH2 H2 N HELIX 1 1 PHE A 7 TYR A 12 5 6 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 MODEL 1 ATOM 1 N SER A 1 -7.716 14.369 -14.317 1.00 0.00 N ATOM 2 CA SER A 1 -7.834 13.015 -14.932 1.00 0.00 C ATOM 3 C SER A 1 -8.053 11.958 -13.845 1.00 0.00 C ATOM 4 O SER A 1 -8.489 12.261 -12.752 1.00 0.00 O ATOM 5 CB SER A 1 -6.502 12.785 -15.644 1.00 0.00 C ATOM 6 OG SER A 1 -6.230 13.888 -16.499 1.00 0.00 O ATOM 7 H1 SER A 1 -7.759 15.093 -15.062 1.00 0.00 H ATOM 8 H2 SER A 1 -6.808 14.442 -13.813 1.00 0.00 H ATOM 9 H3 SER A 1 -8.497 14.516 -13.648 1.00 0.00 H ATOM 10 HA SER A 1 -8.642 12.994 -15.646 1.00 0.00 H ATOM 11 HB2 SER A 1 -5.713 12.698 -14.916 1.00 0.00 H ATOM 12 HB3 SER A 1 -6.557 11.872 -16.223 1.00 0.00 H ATOM 13 HG SER A 1 -5.288 14.067 -16.461 1.00 0.00 H ATOM 14 N SER A 2 -7.751 10.721 -14.138 1.00 0.00 N ATOM 15 CA SER A 2 -7.941 9.644 -13.123 1.00 0.00 C ATOM 16 C SER A 2 -6.910 9.790 -12.000 1.00 0.00 C ATOM 17 O SER A 2 -5.718 9.772 -12.233 1.00 0.00 O ATOM 18 CB SER A 2 -7.723 8.336 -13.883 1.00 0.00 C ATOM 19 OG SER A 2 -6.344 8.201 -14.199 1.00 0.00 O ATOM 20 H SER A 2 -7.400 10.501 -15.027 1.00 0.00 H ATOM 21 HA SER A 2 -8.942 9.675 -12.722 1.00 0.00 H ATOM 22 HB2 SER A 2 -8.030 7.505 -13.270 1.00 0.00 H ATOM 23 HB3 SER A 2 -8.312 8.348 -14.791 1.00 0.00 H ATOM 24 HG SER A 2 -6.190 7.294 -14.475 1.00 0.00 H ATOM 25 N MET A 3 -7.362 9.934 -10.782 1.00 0.00 N ATOM 26 CA MET A 3 -6.411 10.082 -9.643 1.00 0.00 C ATOM 27 C MET A 3 -6.439 8.828 -8.763 1.00 0.00 C ATOM 28 O MET A 3 -7.047 8.811 -7.711 1.00 0.00 O ATOM 29 CB MET A 3 -6.913 11.297 -8.861 1.00 0.00 C ATOM 30 CG MET A 3 -6.023 12.505 -9.163 1.00 0.00 C ATOM 31 SD MET A 3 -4.436 12.310 -8.315 1.00 0.00 S ATOM 32 CE MET A 3 -4.228 14.039 -7.822 1.00 0.00 C ATOM 33 H MET A 3 -8.328 9.945 -10.618 1.00 0.00 H ATOM 34 HA MET A 3 -5.412 10.264 -10.007 1.00 0.00 H ATOM 35 HB2 MET A 3 -7.930 11.517 -9.153 1.00 0.00 H ATOM 36 HB3 MET A 3 -6.880 11.084 -7.803 1.00 0.00 H ATOM 37 HG2 MET A 3 -5.857 12.572 -10.228 1.00 0.00 H ATOM 38 HG3 MET A 3 -6.508 13.405 -8.817 1.00 0.00 H ATOM 39 HE1 MET A 3 -4.961 14.287 -7.066 1.00 0.00 H ATOM 40 HE2 MET A 3 -4.362 14.677 -8.685 1.00 0.00 H ATOM 41 HE3 MET A 3 -3.238 14.184 -7.421 1.00 0.00 H ATOM 42 N LYS A 4 -5.783 7.781 -9.186 1.00 0.00 N ATOM 43 CA LYS A 4 -5.769 6.528 -8.376 1.00 0.00 C ATOM 44 C LYS A 4 -4.327 6.076 -8.127 1.00 0.00 C ATOM 45 O LYS A 4 -3.418 6.453 -8.841 1.00 0.00 O ATOM 46 CB LYS A 4 -6.515 5.497 -9.224 1.00 0.00 C ATOM 47 CG LYS A 4 -6.795 4.251 -8.382 1.00 0.00 C ATOM 48 CD LYS A 4 -7.923 3.441 -9.026 1.00 0.00 C ATOM 49 CE LYS A 4 -7.388 2.704 -10.256 1.00 0.00 C ATOM 50 NZ LYS A 4 -7.816 3.533 -11.417 1.00 0.00 N ATOM 51 H LYS A 4 -5.299 7.818 -10.037 1.00 0.00 H ATOM 52 HA LYS A 4 -6.285 6.678 -7.440 1.00 0.00 H ATOM 53 HB2 LYS A 4 -7.449 5.920 -9.565 1.00 0.00 H ATOM 54 HB3 LYS A 4 -5.910 5.226 -10.075 1.00 0.00 H ATOM 55 HG2 LYS A 4 -5.902 3.645 -8.328 1.00 0.00 H ATOM 56 HG3 LYS A 4 -7.090 4.547 -7.387 1.00 0.00 H ATOM 57 HD2 LYS A 4 -8.302 2.724 -8.313 1.00 0.00 H ATOM 58 HD3 LYS A 4 -8.718 4.107 -9.325 1.00 0.00 H ATOM 59 HE2 LYS A 4 -6.309 2.639 -10.215 1.00 0.00 H ATOM 60 HE3 LYS A 4 -7.823 1.720 -10.324 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -8.855 3.566 -11.456 1.00 0.00 H ATOM 62 HZ2 LYS A 4 -7.453 3.113 -12.296 1.00 0.00 H ATOM 63 HZ3 LYS A 4 -7.441 4.498 -11.312 1.00 0.00 H ATOM 64 N LEU A 5 -4.113 5.271 -7.120 1.00 0.00 N ATOM 65 CA LEU A 5 -2.734 4.791 -6.822 1.00 0.00 C ATOM 66 C LEU A 5 -2.772 3.725 -5.723 1.00 0.00 C ATOM 67 O LEU A 5 -3.826 3.311 -5.283 1.00 0.00 O ATOM 68 CB LEU A 5 -1.971 6.028 -6.344 1.00 0.00 C ATOM 69 CG LEU A 5 -0.524 5.968 -6.848 1.00 0.00 C ATOM 70 CD1 LEU A 5 -0.185 7.261 -7.594 1.00 0.00 C ATOM 71 CD2 LEU A 5 0.426 5.806 -5.658 1.00 0.00 C ATOM 72 H LEU A 5 -4.859 4.979 -6.561 1.00 0.00 H ATOM 73 HA LEU A 5 -2.278 4.397 -7.712 1.00 0.00 H ATOM 74 HB2 LEU A 5 -2.451 6.917 -6.728 1.00 0.00 H ATOM 75 HB3 LEU A 5 -1.974 6.057 -5.265 1.00 0.00 H ATOM 76 HG LEU A 5 -0.410 5.128 -7.518 1.00 0.00 H ATOM 77 HD11 LEU A 5 0.762 7.146 -8.100 1.00 0.00 H ATOM 78 HD12 LEU A 5 -0.121 8.077 -6.889 1.00 0.00 H ATOM 79 HD13 LEU A 5 -0.958 7.471 -8.318 1.00 0.00 H ATOM 80 HD21 LEU A 5 0.782 6.777 -5.346 1.00 0.00 H ATOM 81 HD22 LEU A 5 1.264 5.191 -5.948 1.00 0.00 H ATOM 82 HD23 LEU A 5 -0.100 5.336 -4.840 1.00 0.00 H ATOM 83 N SER A 6 -1.626 3.278 -5.277 1.00 0.00 N ATOM 84 CA SER A 6 -1.586 2.236 -4.204 1.00 0.00 C ATOM 85 C SER A 6 -2.428 1.021 -4.607 1.00 0.00 C ATOM 86 O SER A 6 -3.316 0.604 -3.890 1.00 0.00 O ATOM 87 CB SER A 6 -2.178 2.914 -2.966 1.00 0.00 C ATOM 88 OG SER A 6 -1.403 2.568 -1.826 1.00 0.00 O ATOM 89 H SER A 6 -0.789 3.627 -5.647 1.00 0.00 H ATOM 90 HA SER A 6 -0.568 1.939 -4.008 1.00 0.00 H ATOM 91 HB2 SER A 6 -2.161 3.983 -3.096 1.00 0.00 H ATOM 92 HB3 SER A 6 -3.201 2.587 -2.833 1.00 0.00 H ATOM 93 HG SER A 6 -0.516 2.912 -1.955 1.00 0.00 H ATOM 94 N PHE A 7 -2.154 0.451 -5.751 1.00 0.00 N ATOM 95 CA PHE A 7 -2.935 -0.735 -6.205 1.00 0.00 C ATOM 96 C PHE A 7 -2.822 -1.871 -5.183 1.00 0.00 C ATOM 97 O PHE A 7 -3.763 -2.182 -4.480 1.00 0.00 O ATOM 98 CB PHE A 7 -2.295 -1.141 -7.532 1.00 0.00 C ATOM 99 CG PHE A 7 -2.976 -0.410 -8.664 1.00 0.00 C ATOM 100 CD1 PHE A 7 -4.295 -0.726 -9.009 1.00 0.00 C ATOM 101 CD2 PHE A 7 -2.287 0.585 -9.369 1.00 0.00 C ATOM 102 CE1 PHE A 7 -4.926 -0.047 -10.058 1.00 0.00 C ATOM 103 CE2 PHE A 7 -2.918 1.264 -10.418 1.00 0.00 C ATOM 104 CZ PHE A 7 -4.238 0.948 -10.763 1.00 0.00 C ATOM 105 H PHE A 7 -1.435 0.804 -6.313 1.00 0.00 H ATOM 106 HA PHE A 7 -3.967 -0.467 -6.361 1.00 0.00 H ATOM 107 HB2 PHE A 7 -1.245 -0.885 -7.518 1.00 0.00 H ATOM 108 HB3 PHE A 7 -2.404 -2.204 -7.674 1.00 0.00 H ATOM 109 HD1 PHE A 7 -4.826 -1.493 -8.466 1.00 0.00 H ATOM 110 HD2 PHE A 7 -1.269 0.829 -9.102 1.00 0.00 H ATOM 111 HE1 PHE A 7 -5.944 -0.291 -10.324 1.00 0.00 H ATOM 112 HE2 PHE A 7 -2.387 2.032 -10.961 1.00 0.00 H ATOM 113 HZ PHE A 7 -4.725 1.472 -11.572 1.00 0.00 H ATOM 114 N ARG A 8 -1.675 -2.490 -5.097 1.00 0.00 N ATOM 115 CA ARG A 8 -1.496 -3.607 -4.122 1.00 0.00 C ATOM 116 C ARG A 8 -1.331 -3.047 -2.707 1.00 0.00 C ATOM 117 O ARG A 8 -1.739 -3.651 -1.734 1.00 0.00 O ATOM 118 CB ARG A 8 -0.222 -4.326 -4.582 1.00 0.00 C ATOM 119 CG ARG A 8 0.286 -5.252 -3.473 1.00 0.00 C ATOM 120 CD ARG A 8 1.519 -6.015 -3.965 1.00 0.00 C ATOM 121 NE ARG A 8 2.679 -5.336 -3.321 1.00 0.00 N ATOM 122 CZ ARG A 8 3.894 -5.745 -3.568 1.00 0.00 C ATOM 123 NH1 ARG A 8 4.153 -7.022 -3.632 1.00 0.00 N ATOM 124 NH2 ARG A 8 4.851 -4.876 -3.750 1.00 0.00 N ATOM 125 H ARG A 8 -0.930 -2.221 -5.675 1.00 0.00 H ATOM 126 HA ARG A 8 -2.333 -4.277 -4.163 1.00 0.00 H ATOM 127 HB2 ARG A 8 -0.439 -4.910 -5.465 1.00 0.00 H ATOM 128 HB3 ARG A 8 0.539 -3.596 -4.813 1.00 0.00 H ATOM 129 HG2 ARG A 8 0.548 -4.661 -2.607 1.00 0.00 H ATOM 130 HG3 ARG A 8 -0.489 -5.956 -3.207 1.00 0.00 H ATOM 131 HD2 ARG A 8 1.467 -7.050 -3.654 1.00 0.00 H ATOM 132 HD3 ARG A 8 1.600 -5.948 -5.039 1.00 0.00 H ATOM 133 HE ARG A 8 2.531 -4.582 -2.713 1.00 0.00 H ATOM 134 HH11 ARG A 8 3.420 -7.688 -3.493 1.00 0.00 H ATOM 135 HH12 ARG A 8 5.084 -7.335 -3.821 1.00 0.00 H ATOM 136 HH21 ARG A 8 4.653 -3.897 -3.700 1.00 0.00 H ATOM 137 HH22 ARG A 8 5.781 -5.189 -3.938 1.00 0.00 H ATOM 138 N ALA A 9 -0.729 -1.901 -2.594 1.00 0.00 N ATOM 139 CA ALA A 9 -0.518 -1.284 -1.253 1.00 0.00 C ATOM 140 C ALA A 9 -1.835 -0.743 -0.680 1.00 0.00 C ATOM 141 O ALA A 9 -1.874 -0.244 0.428 1.00 0.00 O ATOM 142 CB ALA A 9 0.466 -0.141 -1.494 1.00 0.00 C ATOM 143 H ALA A 9 -0.408 -1.448 -3.394 1.00 0.00 H ATOM 144 HA ALA A 9 -0.084 -2.002 -0.582 1.00 0.00 H ATOM 145 HB1 ALA A 9 1.005 -0.317 -2.412 1.00 0.00 H ATOM 146 HB2 ALA A 9 1.163 -0.088 -0.671 1.00 0.00 H ATOM 147 HB3 ALA A 9 -0.076 0.790 -1.567 1.00 0.00 H ATOM 148 N ARG A 10 -2.914 -0.837 -1.415 1.00 0.00 N ATOM 149 CA ARG A 10 -4.214 -0.329 -0.898 1.00 0.00 C ATOM 150 C ARG A 10 -4.658 -1.146 0.326 1.00 0.00 C ATOM 151 O ARG A 10 -5.577 -0.773 1.029 1.00 0.00 O ATOM 152 CB ARG A 10 -5.179 -0.452 -2.086 1.00 0.00 C ATOM 153 CG ARG A 10 -6.609 -0.700 -1.607 1.00 0.00 C ATOM 154 CD ARG A 10 -6.751 -2.176 -1.272 1.00 0.00 C ATOM 155 NE ARG A 10 -7.644 -2.221 -0.082 1.00 0.00 N ATOM 156 CZ ARG A 10 -8.780 -2.860 -0.143 1.00 0.00 C ATOM 157 NH1 ARG A 10 -8.793 -4.164 -0.200 1.00 0.00 N ATOM 158 NH2 ARG A 10 -9.903 -2.196 -0.148 1.00 0.00 N ATOM 159 H ARG A 10 -2.871 -1.242 -2.303 1.00 0.00 H ATOM 160 HA ARG A 10 -4.122 0.692 -0.630 1.00 0.00 H ATOM 161 HB2 ARG A 10 -5.152 0.461 -2.661 1.00 0.00 H ATOM 162 HB3 ARG A 10 -4.863 -1.270 -2.705 1.00 0.00 H ATOM 163 HG2 ARG A 10 -6.807 -0.104 -0.728 1.00 0.00 H ATOM 164 HG3 ARG A 10 -7.306 -0.439 -2.389 1.00 0.00 H ATOM 165 HD2 ARG A 10 -7.190 -2.712 -2.103 1.00 0.00 H ATOM 166 HD3 ARG A 10 -5.780 -2.580 -1.026 1.00 0.00 H ATOM 167 HE ARG A 10 -7.379 -1.771 0.747 1.00 0.00 H ATOM 168 HH11 ARG A 10 -7.932 -4.673 -0.196 1.00 0.00 H ATOM 169 HH12 ARG A 10 -9.664 -4.654 -0.246 1.00 0.00 H ATOM 170 HH21 ARG A 10 -9.893 -1.197 -0.106 1.00 0.00 H ATOM 171 HH22 ARG A 10 -10.774 -2.685 -0.195 1.00 0.00 H ATOM 172 N ALA A 11 -4.008 -2.252 0.591 1.00 0.00 N ATOM 173 CA ALA A 11 -4.386 -3.081 1.769 1.00 0.00 C ATOM 174 C ALA A 11 -3.231 -4.006 2.152 1.00 0.00 C ATOM 175 O ALA A 11 -3.370 -5.214 2.168 1.00 0.00 O ATOM 176 CB ALA A 11 -5.603 -3.892 1.322 1.00 0.00 C ATOM 177 H ALA A 11 -3.269 -2.534 0.022 1.00 0.00 H ATOM 178 HA ALA A 11 -4.644 -2.450 2.594 1.00 0.00 H ATOM 179 HB1 ALA A 11 -5.594 -4.853 1.815 1.00 0.00 H ATOM 180 HB2 ALA A 11 -5.568 -4.036 0.253 1.00 0.00 H ATOM 181 HB3 ALA A 11 -6.505 -3.361 1.586 1.00 0.00 H ATOM 182 N TYR A 12 -2.089 -3.449 2.448 1.00 0.00 N ATOM 183 CA TYR A 12 -0.927 -4.275 2.813 1.00 0.00 C ATOM 184 C TYR A 12 -0.637 -4.158 4.313 1.00 0.00 C ATOM 185 O TYR A 12 0.491 -3.969 4.725 1.00 0.00 O ATOM 186 CB TYR A 12 0.204 -3.678 1.988 1.00 0.00 C ATOM 187 CG TYR A 12 0.782 -4.736 1.082 1.00 0.00 C ATOM 188 CD1 TYR A 12 -0.066 -5.453 0.231 1.00 0.00 C ATOM 189 CD2 TYR A 12 2.156 -4.999 1.090 1.00 0.00 C ATOM 190 CE1 TYR A 12 0.460 -6.436 -0.615 1.00 0.00 C ATOM 191 CE2 TYR A 12 2.683 -5.983 0.244 1.00 0.00 C ATOM 192 CZ TYR A 12 1.835 -6.701 -0.609 1.00 0.00 C ATOM 193 OH TYR A 12 2.355 -7.670 -1.443 1.00 0.00 O ATOM 194 H TYR A 12 -1.987 -2.484 2.418 1.00 0.00 H ATOM 195 HA TYR A 12 -1.090 -5.294 2.534 1.00 0.00 H ATOM 196 HB2 TYR A 12 -0.181 -2.865 1.387 1.00 0.00 H ATOM 197 HB3 TYR A 12 0.958 -3.303 2.645 1.00 0.00 H ATOM 198 HD1 TYR A 12 -1.129 -5.246 0.229 1.00 0.00 H ATOM 199 HD2 TYR A 12 2.809 -4.445 1.747 1.00 0.00 H ATOM 200 HE1 TYR A 12 -0.194 -6.990 -1.272 1.00 0.00 H ATOM 201 HE2 TYR A 12 3.744 -6.187 0.248 1.00 0.00 H ATOM 202 HH TYR A 12 2.106 -8.528 -1.092 1.00 0.00 H ATOM 203 N SER A 13 -1.650 -4.270 5.130 1.00 0.00 N ATOM 204 CA SER A 13 -1.439 -4.165 6.604 1.00 0.00 C ATOM 205 C SER A 13 -1.256 -5.558 7.213 1.00 0.00 C ATOM 206 O SER A 13 -1.931 -5.929 8.154 1.00 0.00 O ATOM 207 CB SER A 13 -2.711 -3.509 7.139 1.00 0.00 C ATOM 208 OG SER A 13 -3.842 -4.248 6.699 1.00 0.00 O ATOM 209 H SER A 13 -2.550 -4.422 4.774 1.00 0.00 H ATOM 210 HA SER A 13 -0.585 -3.543 6.819 1.00 0.00 H ATOM 211 HB2 SER A 13 -2.689 -3.502 8.216 1.00 0.00 H ATOM 212 HB3 SER A 13 -2.769 -2.491 6.776 1.00 0.00 H ATOM 213 HG SER A 13 -4.416 -4.391 7.455 1.00 0.00 H ATOM 214 N PHE A 14 -0.346 -6.331 6.683 1.00 0.00 N ATOM 215 CA PHE A 14 -0.115 -7.699 7.227 1.00 0.00 C ATOM 216 C PHE A 14 0.579 -7.628 8.591 1.00 0.00 C ATOM 217 O PHE A 14 0.564 -8.575 9.352 1.00 0.00 O ATOM 218 CB PHE A 14 0.785 -8.381 6.205 1.00 0.00 C ATOM 219 CG PHE A 14 0.444 -9.850 6.131 1.00 0.00 C ATOM 220 CD1 PHE A 14 0.875 -10.721 7.139 1.00 0.00 C ATOM 221 CD2 PHE A 14 -0.303 -10.342 5.054 1.00 0.00 C ATOM 222 CE1 PHE A 14 0.559 -12.083 7.070 1.00 0.00 C ATOM 223 CE2 PHE A 14 -0.619 -11.704 4.985 1.00 0.00 C ATOM 224 CZ PHE A 14 -0.188 -12.574 5.993 1.00 0.00 C ATOM 225 H PHE A 14 0.186 -6.011 5.925 1.00 0.00 H ATOM 226 HA PHE A 14 -1.041 -8.235 7.306 1.00 0.00 H ATOM 227 HB2 PHE A 14 0.640 -7.926 5.236 1.00 0.00 H ATOM 228 HB3 PHE A 14 1.806 -8.265 6.508 1.00 0.00 H ATOM 229 HD1 PHE A 14 1.451 -10.341 7.970 1.00 0.00 H ATOM 230 HD2 PHE A 14 -0.636 -9.670 4.276 1.00 0.00 H ATOM 231 HE1 PHE A 14 0.891 -12.754 7.848 1.00 0.00 H ATOM 232 HE2 PHE A 14 -1.195 -12.083 4.154 1.00 0.00 H ATOM 233 HZ PHE A 14 -0.432 -13.625 5.940 1.00 0.00 H ATOM 234 N ARG A 15 1.186 -6.513 8.908 1.00 0.00 N ATOM 235 CA ARG A 15 1.877 -6.391 10.228 1.00 0.00 C ATOM 236 C ARG A 15 1.350 -5.180 10.991 1.00 0.00 C ATOM 237 O ARG A 15 2.045 -4.579 11.784 1.00 0.00 O ATOM 238 CB ARG A 15 3.362 -6.214 9.911 1.00 0.00 C ATOM 239 CG ARG A 15 3.524 -5.177 8.802 1.00 0.00 C ATOM 240 CD ARG A 15 3.528 -5.893 7.454 1.00 0.00 C ATOM 241 NE ARG A 15 2.817 -4.972 6.526 1.00 0.00 N ATOM 242 CZ ARG A 15 3.472 -4.015 5.928 1.00 0.00 C ATOM 243 NH1 ARG A 15 4.255 -4.290 4.921 1.00 0.00 N ATOM 244 NH2 ARG A 15 3.343 -2.782 6.336 1.00 0.00 N ATOM 245 H ARG A 15 1.186 -5.759 8.283 1.00 0.00 H ATOM 246 HA ARG A 15 1.727 -7.283 10.799 1.00 0.00 H ATOM 247 HB2 ARG A 15 3.882 -5.880 10.797 1.00 0.00 H ATOM 248 HB3 ARG A 15 3.776 -7.156 9.583 1.00 0.00 H ATOM 249 HG2 ARG A 15 2.697 -4.480 8.841 1.00 0.00 H ATOM 250 HG3 ARG A 15 4.453 -4.646 8.933 1.00 0.00 H ATOM 251 HD2 ARG A 15 4.543 -6.062 7.121 1.00 0.00 H ATOM 252 HD3 ARG A 15 2.993 -6.829 7.533 1.00 0.00 H ATOM 253 HE ARG A 15 1.857 -5.084 6.364 1.00 0.00 H ATOM 254 HH11 ARG A 15 4.354 -5.235 4.608 1.00 0.00 H ATOM 255 HH12 ARG A 15 4.757 -3.556 4.463 1.00 0.00 H ATOM 256 HH21 ARG A 15 2.742 -2.571 7.107 1.00 0.00 H ATOM 257 HH22 ARG A 15 3.844 -2.048 5.878 1.00 0.00 H ATOM 258 N GLY A 16 0.123 -4.829 10.748 1.00 0.00 N ATOM 259 CA GLY A 16 -0.499 -3.657 11.441 1.00 0.00 C ATOM 260 C GLY A 16 0.438 -2.446 11.392 1.00 0.00 C ATOM 261 O GLY A 16 0.501 -1.753 10.396 1.00 0.00 O ATOM 262 H GLY A 16 -0.396 -5.345 10.102 1.00 0.00 H ATOM 263 HA2 GLY A 16 -1.427 -3.406 10.947 1.00 0.00 H ATOM 264 HA3 GLY A 16 -0.703 -3.905 12.472 1.00 0.00 H ATOM 265 N PRO A 17 1.127 -2.217 12.483 1.00 0.00 N ATOM 266 CA PRO A 17 2.048 -1.080 12.594 1.00 0.00 C ATOM 267 C PRO A 17 3.493 -1.530 12.355 1.00 0.00 C ATOM 268 O PRO A 17 4.158 -2.012 13.251 1.00 0.00 O ATOM 269 CB PRO A 17 1.830 -0.654 14.047 1.00 0.00 C ATOM 270 CG PRO A 17 1.302 -1.877 14.755 1.00 0.00 C ATOM 271 CD PRO A 17 1.135 -2.965 13.735 1.00 0.00 C ATOM 272 HA PRO A 17 1.769 -0.283 11.925 1.00 0.00 H ATOM 273 HB2 PRO A 17 2.765 -0.338 14.487 1.00 0.00 H ATOM 274 HB3 PRO A 17 1.105 0.138 14.103 1.00 0.00 H ATOM 275 HG2 PRO A 17 1.992 -2.184 15.520 1.00 0.00 H ATOM 276 HG3 PRO A 17 0.339 -1.663 15.188 1.00 0.00 H ATOM 277 HD2 PRO A 17 1.970 -3.653 13.773 1.00 0.00 H ATOM 278 HD3 PRO A 17 0.204 -3.478 13.883 1.00 0.00 H ATOM 279 N GLY A 18 3.981 -1.375 11.154 1.00 0.00 N ATOM 280 CA GLY A 18 5.380 -1.795 10.856 1.00 0.00 C ATOM 281 C GLY A 18 6.198 -0.577 10.416 1.00 0.00 C ATOM 282 O GLY A 18 5.646 0.463 10.116 1.00 0.00 O ATOM 283 H GLY A 18 3.426 -0.985 10.446 1.00 0.00 H ATOM 284 HA2 GLY A 18 5.822 -2.226 11.743 1.00 0.00 H ATOM 285 HA3 GLY A 18 5.376 -2.526 10.062 1.00 0.00 H ATOM 286 N PRO A 19 7.496 -0.746 10.391 1.00 0.00 N ATOM 287 CA PRO A 19 8.402 0.339 9.987 1.00 0.00 C ATOM 288 C PRO A 19 8.629 0.334 8.473 1.00 0.00 C ATOM 289 O PRO A 19 8.791 -0.705 7.865 1.00 0.00 O ATOM 290 CB PRO A 19 9.681 0.030 10.739 1.00 0.00 C ATOM 291 CG PRO A 19 9.632 -1.432 11.043 1.00 0.00 C ATOM 292 CD PRO A 19 8.246 -1.949 10.730 1.00 0.00 C ATOM 293 HA PRO A 19 8.022 1.277 10.320 1.00 0.00 H ATOM 294 HB2 PRO A 19 10.539 0.256 10.121 1.00 0.00 H ATOM 295 HB3 PRO A 19 9.721 0.595 11.657 1.00 0.00 H ATOM 296 HG2 PRO A 19 10.370 -1.961 10.458 1.00 0.00 H ATOM 297 HG3 PRO A 19 9.825 -1.561 12.085 1.00 0.00 H ATOM 298 HD2 PRO A 19 8.277 -2.631 9.892 1.00 0.00 H ATOM 299 HD3 PRO A 19 7.814 -2.426 11.596 1.00 0.00 H ATOM 300 N GLN A 20 8.641 1.489 7.862 1.00 0.00 N ATOM 301 CA GLN A 20 8.855 1.555 6.387 1.00 0.00 C ATOM 302 C GLN A 20 10.203 0.928 6.017 1.00 0.00 C ATOM 303 O GLN A 20 10.368 0.381 4.944 1.00 0.00 O ATOM 304 CB GLN A 20 8.848 3.047 6.050 1.00 0.00 C ATOM 305 CG GLN A 20 8.928 3.227 4.533 1.00 0.00 C ATOM 306 CD GLN A 20 7.624 2.748 3.892 1.00 0.00 C ATOM 307 OE1 GLN A 20 6.580 2.786 4.512 1.00 0.00 O ATOM 308 NE2 GLN A 20 7.641 2.297 2.668 1.00 0.00 N ATOM 309 H GLN A 20 8.506 2.313 8.373 1.00 0.00 H ATOM 310 HA GLN A 20 8.053 1.058 5.870 1.00 0.00 H ATOM 311 HB2 GLN A 20 7.934 3.495 6.419 1.00 0.00 H ATOM 312 HB3 GLN A 20 9.701 3.525 6.513 1.00 0.00 H ATOM 313 HG2 GLN A 20 9.082 4.271 4.302 1.00 0.00 H ATOM 314 HG3 GLN A 20 9.752 2.647 4.144 1.00 0.00 H ATOM 315 HE21 GLN A 20 8.483 2.266 2.168 1.00 0.00 H ATOM 316 HE22 GLN A 20 6.810 1.988 2.249 1.00 0.00 H ATOM 317 N LEU A 21 11.166 1.006 6.896 1.00 0.00 N ATOM 318 CA LEU A 21 12.503 0.415 6.595 1.00 0.00 C ATOM 319 C LEU A 21 12.772 -0.779 7.515 1.00 0.00 C ATOM 320 O LEU A 21 13.582 -1.615 7.147 1.00 0.00 O ATOM 321 CB LEU A 21 13.507 1.542 6.867 1.00 0.00 C ATOM 322 CG LEU A 21 14.422 1.731 5.652 1.00 0.00 C ATOM 323 CD1 LEU A 21 15.173 0.429 5.363 1.00 0.00 C ATOM 324 CD2 LEU A 21 13.582 2.117 4.432 1.00 0.00 C ATOM 325 H LEU A 21 11.010 1.452 7.754 1.00 0.00 H ATOM 326 HA LEU A 21 12.557 0.114 5.561 1.00 0.00 H ATOM 327 HB2 LEU A 21 12.971 2.460 7.059 1.00 0.00 H ATOM 328 HB3 LEU A 21 14.106 1.289 7.729 1.00 0.00 H ATOM 329 HG LEU A 21 15.136 2.516 5.861 1.00 0.00 H ATOM 330 HD11 LEU A 21 15.341 -0.103 6.287 1.00 0.00 H ATOM 331 HD12 LEU A 21 16.123 0.656 4.901 1.00 0.00 H ATOM 332 HD13 LEU A 21 14.586 -0.184 4.695 1.00 0.00 H ATOM 333 HD21 LEU A 21 12.700 2.650 4.756 1.00 0.00 H ATOM 334 HD22 LEU A 21 13.287 1.224 3.901 1.00 0.00 H ATOM 335 HD23 LEU A 21 14.164 2.749 3.778 1.00 0.00 H HETATM 336 N NH2 A 22 12.143 -0.880 8.654 1.00 0.00 N HETATM 337 HN1 NH2 A 22 11.495 -0.193 8.923 1.00 0.00 H HETATM 338 HN2 NH2 A 22 12.312 -1.645 9.249 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 2 ATOM 1 N SER A 1 -5.454 7.486 -19.418 1.00 0.00 N ATOM 2 CA SER A 1 -6.906 7.266 -19.675 1.00 0.00 C ATOM 3 C SER A 1 -7.669 7.168 -18.351 1.00 0.00 C ATOM 4 O SER A 1 -8.617 7.891 -18.115 1.00 0.00 O ATOM 5 CB SER A 1 -6.979 5.942 -20.435 1.00 0.00 C ATOM 6 OG SER A 1 -8.332 5.669 -20.774 1.00 0.00 O ATOM 7 H1 SER A 1 -5.040 6.626 -19.006 1.00 0.00 H ATOM 8 H2 SER A 1 -5.335 8.281 -18.757 1.00 0.00 H ATOM 9 H3 SER A 1 -4.972 7.704 -20.313 1.00 0.00 H ATOM 10 HA SER A 1 -7.307 8.062 -20.283 1.00 0.00 H ATOM 11 HB2 SER A 1 -6.394 6.010 -21.337 1.00 0.00 H ATOM 12 HB3 SER A 1 -6.586 5.149 -19.812 1.00 0.00 H ATOM 13 HG SER A 1 -8.735 5.205 -20.036 1.00 0.00 H ATOM 14 N SER A 2 -7.262 6.276 -17.487 1.00 0.00 N ATOM 15 CA SER A 2 -7.962 6.128 -16.177 1.00 0.00 C ATOM 16 C SER A 2 -6.951 6.170 -15.029 1.00 0.00 C ATOM 17 O SER A 2 -6.070 5.337 -14.935 1.00 0.00 O ATOM 18 CB SER A 2 -8.641 4.761 -16.243 1.00 0.00 C ATOM 19 OG SER A 2 -7.662 3.743 -16.088 1.00 0.00 O ATOM 20 H SER A 2 -6.496 5.704 -17.698 1.00 0.00 H ATOM 21 HA SER A 2 -8.703 6.902 -16.056 1.00 0.00 H ATOM 22 HB2 SER A 2 -9.367 4.678 -15.452 1.00 0.00 H ATOM 23 HB3 SER A 2 -9.138 4.653 -17.198 1.00 0.00 H ATOM 24 HG SER A 2 -7.952 3.157 -15.384 1.00 0.00 H ATOM 25 N MET A 3 -7.071 7.134 -14.156 1.00 0.00 N ATOM 26 CA MET A 3 -6.117 7.231 -13.012 1.00 0.00 C ATOM 27 C MET A 3 -6.730 6.596 -11.761 1.00 0.00 C ATOM 28 O MET A 3 -7.859 6.870 -11.404 1.00 0.00 O ATOM 29 CB MET A 3 -5.900 8.732 -12.803 1.00 0.00 C ATOM 30 CG MET A 3 -4.535 9.134 -13.365 1.00 0.00 C ATOM 31 SD MET A 3 -4.576 10.876 -13.857 1.00 0.00 S ATOM 32 CE MET A 3 -4.002 10.645 -15.557 1.00 0.00 C ATOM 33 H MET A 3 -7.790 7.794 -14.252 1.00 0.00 H ATOM 34 HA MET A 3 -5.183 6.752 -13.259 1.00 0.00 H ATOM 35 HB2 MET A 3 -6.677 9.283 -13.312 1.00 0.00 H ATOM 36 HB3 MET A 3 -5.932 8.956 -11.747 1.00 0.00 H ATOM 37 HG2 MET A 3 -3.777 8.992 -12.610 1.00 0.00 H ATOM 38 HG3 MET A 3 -4.306 8.524 -14.226 1.00 0.00 H ATOM 39 HE1 MET A 3 -4.855 10.505 -16.209 1.00 0.00 H ATOM 40 HE2 MET A 3 -3.360 9.777 -15.605 1.00 0.00 H ATOM 41 HE3 MET A 3 -3.451 11.515 -15.875 1.00 0.00 H ATOM 42 N LYS A 4 -5.992 5.750 -11.094 1.00 0.00 N ATOM 43 CA LYS A 4 -6.530 5.094 -9.865 1.00 0.00 C ATOM 44 C LYS A 4 -5.435 4.982 -8.801 1.00 0.00 C ATOM 45 O LYS A 4 -4.833 3.942 -8.622 1.00 0.00 O ATOM 46 CB LYS A 4 -6.985 3.703 -10.318 1.00 0.00 C ATOM 47 CG LYS A 4 -5.820 2.968 -10.992 1.00 0.00 C ATOM 48 CD LYS A 4 -5.730 1.539 -10.447 1.00 0.00 C ATOM 49 CE LYS A 4 -6.464 0.585 -11.392 1.00 0.00 C ATOM 50 NZ LYS A 4 -7.911 0.797 -11.105 1.00 0.00 N ATOM 51 H LYS A 4 -5.085 5.543 -11.401 1.00 0.00 H ATOM 52 HA LYS A 4 -7.372 5.648 -9.482 1.00 0.00 H ATOM 53 HB2 LYS A 4 -7.320 3.139 -9.460 1.00 0.00 H ATOM 54 HB3 LYS A 4 -7.798 3.804 -11.022 1.00 0.00 H ATOM 55 HG2 LYS A 4 -5.985 2.937 -12.059 1.00 0.00 H ATOM 56 HG3 LYS A 4 -4.896 3.487 -10.785 1.00 0.00 H ATOM 57 HD2 LYS A 4 -4.692 1.247 -10.374 1.00 0.00 H ATOM 58 HD3 LYS A 4 -6.187 1.497 -9.469 1.00 0.00 H ATOM 59 HE2 LYS A 4 -6.243 0.831 -12.421 1.00 0.00 H ATOM 60 HE3 LYS A 4 -6.192 -0.437 -11.181 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -8.077 0.712 -10.082 1.00 0.00 H ATOM 62 HZ2 LYS A 4 -8.473 0.080 -11.606 1.00 0.00 H ATOM 63 HZ3 LYS A 4 -8.191 1.747 -11.425 1.00 0.00 H ATOM 64 N LEU A 5 -5.172 6.050 -8.094 1.00 0.00 N ATOM 65 CA LEU A 5 -4.113 6.013 -7.040 1.00 0.00 C ATOM 66 C LEU A 5 -4.401 4.892 -6.037 1.00 0.00 C ATOM 67 O LEU A 5 -5.351 4.146 -6.180 1.00 0.00 O ATOM 68 CB LEU A 5 -4.184 7.379 -6.352 1.00 0.00 C ATOM 69 CG LEU A 5 -2.950 8.204 -6.719 1.00 0.00 C ATOM 70 CD1 LEU A 5 -3.172 9.663 -6.318 1.00 0.00 C ATOM 71 CD2 LEU A 5 -1.730 7.653 -5.977 1.00 0.00 C ATOM 72 H LEU A 5 -5.668 6.878 -8.257 1.00 0.00 H ATOM 73 HA LEU A 5 -3.143 5.876 -7.489 1.00 0.00 H ATOM 74 HB2 LEU A 5 -5.075 7.899 -6.674 1.00 0.00 H ATOM 75 HB3 LEU A 5 -4.215 7.241 -5.281 1.00 0.00 H ATOM 76 HG LEU A 5 -2.782 8.145 -7.785 1.00 0.00 H ATOM 77 HD11 LEU A 5 -3.370 9.719 -5.258 1.00 0.00 H ATOM 78 HD12 LEU A 5 -4.014 10.062 -6.864 1.00 0.00 H ATOM 79 HD13 LEU A 5 -2.289 10.239 -6.550 1.00 0.00 H ATOM 80 HD21 LEU A 5 -0.966 8.415 -5.925 1.00 0.00 H ATOM 81 HD22 LEU A 5 -1.345 6.792 -6.505 1.00 0.00 H ATOM 82 HD23 LEU A 5 -2.018 7.363 -4.977 1.00 0.00 H ATOM 83 N SER A 6 -3.587 4.769 -5.022 1.00 0.00 N ATOM 84 CA SER A 6 -3.811 3.697 -4.009 1.00 0.00 C ATOM 85 C SER A 6 -4.213 4.314 -2.666 1.00 0.00 C ATOM 86 O SER A 6 -3.490 4.232 -1.693 1.00 0.00 O ATOM 87 CB SER A 6 -2.466 2.981 -3.889 1.00 0.00 C ATOM 88 OG SER A 6 -2.484 1.811 -4.698 1.00 0.00 O ATOM 89 H SER A 6 -2.829 5.382 -4.927 1.00 0.00 H ATOM 90 HA SER A 6 -4.567 3.007 -4.350 1.00 0.00 H ATOM 91 HB2 SER A 6 -1.677 3.632 -4.226 1.00 0.00 H ATOM 92 HB3 SER A 6 -2.292 2.714 -2.855 1.00 0.00 H ATOM 93 HG SER A 6 -1.622 1.724 -5.112 1.00 0.00 H ATOM 94 N PHE A 7 -5.363 4.932 -2.608 1.00 0.00 N ATOM 95 CA PHE A 7 -5.818 5.555 -1.329 1.00 0.00 C ATOM 96 C PHE A 7 -5.850 4.509 -0.211 1.00 0.00 C ATOM 97 O PHE A 7 -5.393 4.747 0.889 1.00 0.00 O ATOM 98 CB PHE A 7 -7.229 6.073 -1.618 1.00 0.00 C ATOM 99 CG PHE A 7 -7.188 7.571 -1.810 1.00 0.00 C ATOM 100 CD1 PHE A 7 -6.638 8.388 -0.816 1.00 0.00 C ATOM 101 CD2 PHE A 7 -7.703 8.141 -2.981 1.00 0.00 C ATOM 102 CE1 PHE A 7 -6.601 9.776 -0.992 1.00 0.00 C ATOM 103 CE2 PHE A 7 -7.666 9.529 -3.157 1.00 0.00 C ATOM 104 CZ PHE A 7 -7.115 10.347 -2.162 1.00 0.00 C ATOM 105 H PHE A 7 -5.930 4.986 -3.405 1.00 0.00 H ATOM 106 HA PHE A 7 -5.171 6.375 -1.062 1.00 0.00 H ATOM 107 HB2 PHE A 7 -7.607 5.606 -2.515 1.00 0.00 H ATOM 108 HB3 PHE A 7 -7.876 5.836 -0.787 1.00 0.00 H ATOM 109 HD1 PHE A 7 -6.242 7.946 0.087 1.00 0.00 H ATOM 110 HD2 PHE A 7 -8.128 7.510 -3.747 1.00 0.00 H ATOM 111 HE1 PHE A 7 -6.177 10.407 -0.225 1.00 0.00 H ATOM 112 HE2 PHE A 7 -8.062 9.969 -4.060 1.00 0.00 H ATOM 113 HZ PHE A 7 -7.086 11.418 -2.298 1.00 0.00 H ATOM 114 N ARG A 8 -6.388 3.354 -0.490 1.00 0.00 N ATOM 115 CA ARG A 8 -6.452 2.285 0.550 1.00 0.00 C ATOM 116 C ARG A 8 -5.074 1.647 0.730 1.00 0.00 C ATOM 117 O ARG A 8 -4.646 1.357 1.829 1.00 0.00 O ATOM 118 CB ARG A 8 -7.461 1.267 0.003 1.00 0.00 C ATOM 119 CG ARG A 8 -7.465 0.015 0.884 1.00 0.00 C ATOM 120 CD ARG A 8 -8.402 -1.032 0.274 1.00 0.00 C ATOM 121 NE ARG A 8 -7.648 -1.602 -0.878 1.00 0.00 N ATOM 122 CZ ARG A 8 -8.195 -2.522 -1.624 1.00 0.00 C ATOM 123 NH1 ARG A 8 -8.711 -3.586 -1.072 1.00 0.00 N ATOM 124 NH2 ARG A 8 -8.225 -2.379 -2.921 1.00 0.00 N ATOM 125 H ARG A 8 -6.750 3.187 -1.385 1.00 0.00 H ATOM 126 HA ARG A 8 -6.802 2.688 1.480 1.00 0.00 H ATOM 127 HB2 ARG A 8 -8.447 1.708 0.000 1.00 0.00 H ATOM 128 HB3 ARG A 8 -7.185 0.996 -1.004 1.00 0.00 H ATOM 129 HG2 ARG A 8 -6.464 -0.387 0.941 1.00 0.00 H ATOM 130 HG3 ARG A 8 -7.809 0.270 1.874 1.00 0.00 H ATOM 131 HD2 ARG A 8 -8.624 -1.803 1.000 1.00 0.00 H ATOM 132 HD3 ARG A 8 -9.311 -0.567 -0.072 1.00 0.00 H ATOM 133 HE ARG A 8 -6.741 -1.286 -1.077 1.00 0.00 H ATOM 134 HH11 ARG A 8 -8.688 -3.696 -0.078 1.00 0.00 H ATOM 135 HH12 ARG A 8 -9.131 -4.292 -1.643 1.00 0.00 H ATOM 136 HH21 ARG A 8 -7.830 -1.564 -3.343 1.00 0.00 H ATOM 137 HH22 ARG A 8 -8.644 -3.085 -3.492 1.00 0.00 H ATOM 138 N ALA A 9 -4.386 1.426 -0.351 1.00 0.00 N ATOM 139 CA ALA A 9 -3.034 0.805 -0.274 1.00 0.00 C ATOM 140 C ALA A 9 -2.010 1.787 0.307 1.00 0.00 C ATOM 141 O ALA A 9 -0.873 1.431 0.553 1.00 0.00 O ATOM 142 CB ALA A 9 -2.675 0.456 -1.717 1.00 0.00 C ATOM 143 H ALA A 9 -4.764 1.667 -1.215 1.00 0.00 H ATOM 144 HA ALA A 9 -3.073 -0.093 0.318 1.00 0.00 H ATOM 145 HB1 ALA A 9 -3.283 1.042 -2.390 1.00 0.00 H ATOM 146 HB2 ALA A 9 -2.856 -0.594 -1.889 1.00 0.00 H ATOM 147 HB3 ALA A 9 -1.632 0.676 -1.891 1.00 0.00 H ATOM 148 N ARG A 10 -2.397 3.016 0.534 1.00 0.00 N ATOM 149 CA ARG A 10 -1.442 4.005 1.101 1.00 0.00 C ATOM 150 C ARG A 10 -1.106 3.644 2.555 1.00 0.00 C ATOM 151 O ARG A 10 -0.218 4.218 3.156 1.00 0.00 O ATOM 152 CB ARG A 10 -2.162 5.353 0.968 1.00 0.00 C ATOM 153 CG ARG A 10 -1.693 6.332 2.044 1.00 0.00 C ATOM 154 CD ARG A 10 -2.439 6.016 3.331 1.00 0.00 C ATOM 155 NE ARG A 10 -1.441 6.213 4.418 1.00 0.00 N ATOM 156 CZ ARG A 10 -1.809 6.736 5.557 1.00 0.00 C ATOM 157 NH1 ARG A 10 -2.922 6.352 6.121 1.00 0.00 N ATOM 158 NH2 ARG A 10 -1.066 7.642 6.130 1.00 0.00 N ATOM 159 H ARG A 10 -3.313 3.288 0.335 1.00 0.00 H ATOM 160 HA ARG A 10 -0.556 4.026 0.522 1.00 0.00 H ATOM 161 HB2 ARG A 10 -1.959 5.770 -0.007 1.00 0.00 H ATOM 162 HB3 ARG A 10 -3.219 5.190 1.070 1.00 0.00 H ATOM 163 HG2 ARG A 10 -0.630 6.219 2.200 1.00 0.00 H ATOM 164 HG3 ARG A 10 -1.912 7.343 1.738 1.00 0.00 H ATOM 165 HD2 ARG A 10 -3.280 6.687 3.455 1.00 0.00 H ATOM 166 HD3 ARG A 10 -2.769 4.989 3.309 1.00 0.00 H ATOM 167 HE ARG A 10 -0.507 5.950 4.280 1.00 0.00 H ATOM 168 HH11 ARG A 10 -3.492 5.658 5.683 1.00 0.00 H ATOM 169 HH12 ARG A 10 -3.203 6.753 6.993 1.00 0.00 H ATOM 170 HH21 ARG A 10 -0.213 7.936 5.697 1.00 0.00 H ATOM 171 HH22 ARG A 10 -1.348 8.042 7.001 1.00 0.00 H ATOM 172 N ALA A 11 -1.802 2.691 3.124 1.00 0.00 N ATOM 173 CA ALA A 11 -1.517 2.289 4.529 1.00 0.00 C ATOM 174 C ALA A 11 -2.261 1.000 4.870 1.00 0.00 C ATOM 175 O ALA A 11 -2.901 0.894 5.898 1.00 0.00 O ATOM 176 CB ALA A 11 -2.019 3.445 5.394 1.00 0.00 C ATOM 177 H ALA A 11 -2.506 2.236 2.625 1.00 0.00 H ATOM 178 HA ALA A 11 -0.464 2.155 4.669 1.00 0.00 H ATOM 179 HB1 ALA A 11 -1.236 4.178 5.505 1.00 0.00 H ATOM 180 HB2 ALA A 11 -2.302 3.070 6.366 1.00 0.00 H ATOM 181 HB3 ALA A 11 -2.877 3.902 4.923 1.00 0.00 H ATOM 182 N TYR A 12 -2.193 0.021 4.009 1.00 0.00 N ATOM 183 CA TYR A 12 -2.895 -1.247 4.263 1.00 0.00 C ATOM 184 C TYR A 12 -1.889 -2.369 4.542 1.00 0.00 C ATOM 185 O TYR A 12 -1.897 -3.398 3.895 1.00 0.00 O ATOM 186 CB TYR A 12 -3.653 -1.496 2.967 1.00 0.00 C ATOM 187 CG TYR A 12 -5.128 -1.599 3.260 1.00 0.00 C ATOM 188 CD1 TYR A 12 -5.761 -0.578 3.979 1.00 0.00 C ATOM 189 CD2 TYR A 12 -5.863 -2.705 2.817 1.00 0.00 C ATOM 190 CE1 TYR A 12 -7.130 -0.663 4.256 1.00 0.00 C ATOM 191 CE2 TYR A 12 -7.232 -2.790 3.093 1.00 0.00 C ATOM 192 CZ TYR A 12 -7.866 -1.769 3.813 1.00 0.00 C ATOM 193 OH TYR A 12 -9.216 -1.853 4.087 1.00 0.00 O ATOM 194 H TYR A 12 -1.690 0.122 3.185 1.00 0.00 H ATOM 195 HA TYR A 12 -3.581 -1.138 5.076 1.00 0.00 H ATOM 196 HB2 TYR A 12 -3.480 -0.674 2.287 1.00 0.00 H ATOM 197 HB3 TYR A 12 -3.302 -2.401 2.523 1.00 0.00 H ATOM 198 HD1 TYR A 12 -5.187 0.276 4.321 1.00 0.00 H ATOM 199 HD2 TYR A 12 -5.372 -3.492 2.262 1.00 0.00 H ATOM 200 HE1 TYR A 12 -7.619 0.125 4.811 1.00 0.00 H ATOM 201 HE2 TYR A 12 -7.800 -3.643 2.752 1.00 0.00 H ATOM 202 HH TYR A 12 -9.695 -1.545 3.313 1.00 0.00 H ATOM 203 N SER A 13 -1.022 -2.175 5.503 1.00 0.00 N ATOM 204 CA SER A 13 -0.009 -3.226 5.831 1.00 0.00 C ATOM 205 C SER A 13 0.746 -3.654 4.569 1.00 0.00 C ATOM 206 O SER A 13 0.413 -4.642 3.942 1.00 0.00 O ATOM 207 CB SER A 13 -0.813 -4.395 6.400 1.00 0.00 C ATOM 208 OG SER A 13 0.053 -5.502 6.610 1.00 0.00 O ATOM 209 H SER A 13 -1.036 -1.337 6.010 1.00 0.00 H ATOM 210 HA SER A 13 0.682 -2.860 6.576 1.00 0.00 H ATOM 211 HB2 SER A 13 -1.256 -4.108 7.340 1.00 0.00 H ATOM 212 HB3 SER A 13 -1.597 -4.664 5.704 1.00 0.00 H ATOM 213 HG SER A 13 -0.036 -5.779 7.525 1.00 0.00 H ATOM 214 N PHE A 14 1.758 -2.919 4.193 1.00 0.00 N ATOM 215 CA PHE A 14 2.535 -3.281 2.974 1.00 0.00 C ATOM 216 C PHE A 14 3.460 -4.470 3.259 1.00 0.00 C ATOM 217 O PHE A 14 3.987 -5.084 2.352 1.00 0.00 O ATOM 218 CB PHE A 14 3.350 -2.037 2.645 1.00 0.00 C ATOM 219 CG PHE A 14 3.480 -1.897 1.148 1.00 0.00 C ATOM 220 CD1 PHE A 14 4.335 -2.748 0.438 1.00 0.00 C ATOM 221 CD2 PHE A 14 2.745 -0.917 0.471 1.00 0.00 C ATOM 222 CE1 PHE A 14 4.456 -2.619 -0.951 1.00 0.00 C ATOM 223 CE2 PHE A 14 2.866 -0.788 -0.918 1.00 0.00 C ATOM 224 CZ PHE A 14 3.721 -1.639 -1.630 1.00 0.00 C ATOM 225 H PHE A 14 2.008 -2.128 4.715 1.00 0.00 H ATOM 226 HA PHE A 14 1.876 -3.506 2.159 1.00 0.00 H ATOM 227 HB2 PHE A 14 2.857 -1.164 3.050 1.00 0.00 H ATOM 228 HB3 PHE A 14 4.325 -2.133 3.083 1.00 0.00 H ATOM 229 HD1 PHE A 14 4.902 -3.505 0.961 1.00 0.00 H ATOM 230 HD2 PHE A 14 2.086 -0.261 1.018 1.00 0.00 H ATOM 231 HE1 PHE A 14 5.115 -3.276 -1.499 1.00 0.00 H ATOM 232 HE2 PHE A 14 2.300 -0.031 -1.442 1.00 0.00 H ATOM 233 HZ PHE A 14 3.814 -1.539 -2.701 1.00 0.00 H ATOM 234 N ARG A 15 3.658 -4.800 4.508 1.00 0.00 N ATOM 235 CA ARG A 15 4.539 -5.939 4.853 1.00 0.00 C ATOM 236 C ARG A 15 3.728 -6.997 5.599 1.00 0.00 C ATOM 237 O ARG A 15 2.748 -7.514 5.101 1.00 0.00 O ATOM 238 CB ARG A 15 5.632 -5.314 5.730 1.00 0.00 C ATOM 239 CG ARG A 15 6.837 -6.256 5.799 1.00 0.00 C ATOM 240 CD ARG A 15 7.633 -6.163 4.495 1.00 0.00 C ATOM 241 NE ARG A 15 8.678 -7.217 4.608 1.00 0.00 N ATOM 242 CZ ARG A 15 9.718 -7.028 5.373 1.00 0.00 C ATOM 243 NH1 ARG A 15 10.383 -5.906 5.305 1.00 0.00 N ATOM 244 NH2 ARG A 15 10.094 -7.959 6.207 1.00 0.00 N ATOM 245 H ARG A 15 3.227 -4.299 5.227 1.00 0.00 H ATOM 246 HA ARG A 15 4.977 -6.368 3.983 1.00 0.00 H ATOM 247 HB2 ARG A 15 5.938 -4.371 5.301 1.00 0.00 H ATOM 248 HB3 ARG A 15 5.248 -5.147 6.725 1.00 0.00 H ATOM 249 HG2 ARG A 15 7.468 -5.971 6.629 1.00 0.00 H ATOM 250 HG3 ARG A 15 6.495 -7.270 5.938 1.00 0.00 H ATOM 251 HD2 ARG A 15 6.990 -6.355 3.648 1.00 0.00 H ATOM 252 HD3 ARG A 15 8.096 -5.192 4.405 1.00 0.00 H ATOM 253 HE ARG A 15 8.584 -8.056 4.109 1.00 0.00 H ATOM 254 HH11 ARG A 15 10.095 -5.193 4.666 1.00 0.00 H ATOM 255 HH12 ARG A 15 11.179 -5.761 5.891 1.00 0.00 H ATOM 256 HH21 ARG A 15 9.585 -8.818 6.259 1.00 0.00 H ATOM 257 HH22 ARG A 15 10.891 -7.813 6.794 1.00 0.00 H ATOM 258 N GLY A 16 4.134 -7.315 6.778 1.00 0.00 N ATOM 259 CA GLY A 16 3.407 -8.338 7.583 1.00 0.00 C ATOM 260 C GLY A 16 3.928 -8.329 9.019 1.00 0.00 C ATOM 261 O GLY A 16 3.322 -7.753 9.901 1.00 0.00 O ATOM 262 H GLY A 16 4.919 -6.876 7.133 1.00 0.00 H ATOM 263 HA2 GLY A 16 2.349 -8.117 7.580 1.00 0.00 H ATOM 264 HA3 GLY A 16 3.573 -9.321 7.159 1.00 0.00 H ATOM 265 N PRO A 17 5.032 -8.997 9.203 1.00 0.00 N ATOM 266 CA PRO A 17 5.665 -9.121 10.521 1.00 0.00 C ATOM 267 C PRO A 17 6.813 -8.118 10.668 1.00 0.00 C ATOM 268 O PRO A 17 7.508 -7.813 9.718 1.00 0.00 O ATOM 269 CB PRO A 17 6.182 -10.560 10.472 1.00 0.00 C ATOM 270 CG PRO A 17 6.323 -10.894 9.006 1.00 0.00 C ATOM 271 CD PRO A 17 5.818 -9.719 8.215 1.00 0.00 C ATOM 272 HA PRO A 17 4.944 -9.011 11.313 1.00 0.00 H ATOM 273 HB2 PRO A 17 7.141 -10.629 10.967 1.00 0.00 H ATOM 274 HB3 PRO A 17 5.477 -11.230 10.928 1.00 0.00 H ATOM 275 HG2 PRO A 17 7.354 -11.086 8.773 1.00 0.00 H ATOM 276 HG3 PRO A 17 5.720 -11.756 8.768 1.00 0.00 H ATOM 277 HD2 PRO A 17 6.643 -9.117 7.858 1.00 0.00 H ATOM 278 HD3 PRO A 17 5.196 -10.046 7.400 1.00 0.00 H ATOM 279 N GLY A 18 7.017 -7.606 11.853 1.00 0.00 N ATOM 280 CA GLY A 18 8.118 -6.624 12.066 1.00 0.00 C ATOM 281 C GLY A 18 7.523 -5.227 12.275 1.00 0.00 C ATOM 282 O GLY A 18 6.398 -4.972 11.893 1.00 0.00 O ATOM 283 H GLY A 18 6.444 -7.868 12.603 1.00 0.00 H ATOM 284 HA2 GLY A 18 8.688 -6.909 12.938 1.00 0.00 H ATOM 285 HA3 GLY A 18 8.762 -6.611 11.201 1.00 0.00 H ATOM 286 N PRO A 19 8.300 -4.361 12.877 1.00 0.00 N ATOM 287 CA PRO A 19 7.852 -2.986 13.139 1.00 0.00 C ATOM 288 C PRO A 19 8.174 -2.065 11.960 1.00 0.00 C ATOM 289 O PRO A 19 9.119 -1.301 11.997 1.00 0.00 O ATOM 290 CB PRO A 19 8.634 -2.589 14.376 1.00 0.00 C ATOM 291 CG PRO A 19 9.835 -3.477 14.401 1.00 0.00 C ATOM 292 CD PRO A 19 9.657 -4.568 13.370 1.00 0.00 C ATOM 293 HA PRO A 19 6.812 -2.976 13.368 1.00 0.00 H ATOM 294 HB2 PRO A 19 8.934 -1.552 14.309 1.00 0.00 H ATOM 295 HB3 PRO A 19 8.039 -2.751 15.261 1.00 0.00 H ATOM 296 HG2 PRO A 19 10.727 -2.905 14.193 1.00 0.00 H ATOM 297 HG3 PRO A 19 9.899 -3.921 15.370 1.00 0.00 H ATOM 298 HD2 PRO A 19 10.377 -4.453 12.571 1.00 0.00 H ATOM 299 HD3 PRO A 19 9.744 -5.541 13.827 1.00 0.00 H ATOM 300 N GLN A 20 7.396 -2.132 10.911 1.00 0.00 N ATOM 301 CA GLN A 20 7.656 -1.261 9.728 1.00 0.00 C ATOM 302 C GLN A 20 7.618 0.215 10.134 1.00 0.00 C ATOM 303 O GLN A 20 8.532 0.967 9.862 1.00 0.00 O ATOM 304 CB GLN A 20 6.528 -1.576 8.744 1.00 0.00 C ATOM 305 CG GLN A 20 7.008 -1.310 7.316 1.00 0.00 C ATOM 306 CD GLN A 20 8.104 -2.314 6.950 1.00 0.00 C ATOM 307 OE1 GLN A 20 9.158 -1.935 6.480 1.00 0.00 O ATOM 308 NE2 GLN A 20 7.897 -3.587 7.147 1.00 0.00 N ATOM 309 H GLN A 20 6.642 -2.756 10.903 1.00 0.00 H ATOM 310 HA GLN A 20 8.608 -1.506 9.286 1.00 0.00 H ATOM 311 HB2 GLN A 20 6.244 -2.616 8.843 1.00 0.00 H ATOM 312 HB3 GLN A 20 5.676 -0.944 8.959 1.00 0.00 H ATOM 313 HG2 GLN A 20 6.178 -1.417 6.632 1.00 0.00 H ATOM 314 HG3 GLN A 20 7.404 -0.308 7.250 1.00 0.00 H ATOM 315 HE21 GLN A 20 7.046 -3.893 7.526 1.00 0.00 H ATOM 316 HE22 GLN A 20 8.592 -4.238 6.915 1.00 0.00 H ATOM 317 N LEU A 21 6.565 0.633 10.786 1.00 0.00 N ATOM 318 CA LEU A 21 6.467 2.061 11.210 1.00 0.00 C ATOM 319 C LEU A 21 7.245 2.282 12.512 1.00 0.00 C ATOM 320 O LEU A 21 7.566 3.422 12.800 1.00 0.00 O ATOM 321 CB LEU A 21 4.972 2.314 11.426 1.00 0.00 C ATOM 322 CG LEU A 21 4.430 1.364 12.503 1.00 0.00 C ATOM 323 CD1 LEU A 21 3.643 2.162 13.543 1.00 0.00 C ATOM 324 CD2 LEU A 21 3.508 0.328 11.853 1.00 0.00 C ATOM 325 H LEU A 21 5.840 0.009 10.995 1.00 0.00 H ATOM 326 HA LEU A 21 6.841 2.710 10.435 1.00 0.00 H ATOM 327 HB2 LEU A 21 4.824 3.337 11.741 1.00 0.00 H ATOM 328 HB3 LEU A 21 4.442 2.144 10.499 1.00 0.00 H ATOM 329 HG LEU A 21 5.256 0.860 12.986 1.00 0.00 H ATOM 330 HD11 LEU A 21 4.039 3.166 13.604 1.00 0.00 H ATOM 331 HD12 LEU A 21 3.730 1.683 14.507 1.00 0.00 H ATOM 332 HD13 LEU A 21 2.602 2.203 13.255 1.00 0.00 H ATOM 333 HD21 LEU A 21 2.483 0.660 11.932 1.00 0.00 H ATOM 334 HD22 LEU A 21 3.619 -0.620 12.359 1.00 0.00 H ATOM 335 HD23 LEU A 21 3.771 0.214 10.812 1.00 0.00 H HETATM 336 N NH2 A 22 7.544 1.267 13.272 1.00 0.00 N HETATM 337 HN1 NH2 A 22 7.268 0.358 13.009 1.00 0.00 H HETATM 338 HN2 NH2 A 22 8.044 1.411 14.108 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 3 ATOM 1 N SER A 1 -12.477 9.980 -13.036 1.00 0.00 N ATOM 2 CA SER A 1 -11.540 8.836 -13.233 1.00 0.00 C ATOM 3 C SER A 1 -10.093 9.297 -13.047 1.00 0.00 C ATOM 4 O SER A 1 -9.548 10.007 -13.869 1.00 0.00 O ATOM 5 CB SER A 1 -11.778 8.376 -14.670 1.00 0.00 C ATOM 6 OG SER A 1 -11.621 9.481 -15.549 1.00 0.00 O ATOM 7 H1 SER A 1 -13.454 9.628 -13.005 1.00 0.00 H ATOM 8 H2 SER A 1 -12.374 10.652 -13.823 1.00 0.00 H ATOM 9 H3 SER A 1 -12.255 10.460 -12.139 1.00 0.00 H ATOM 10 HA SER A 1 -11.773 8.037 -12.547 1.00 0.00 H ATOM 11 HB2 SER A 1 -11.063 7.613 -14.929 1.00 0.00 H ATOM 12 HB3 SER A 1 -12.778 7.972 -14.757 1.00 0.00 H ATOM 13 HG SER A 1 -12.495 9.795 -15.789 1.00 0.00 H ATOM 14 N SER A 2 -9.468 8.900 -11.971 1.00 0.00 N ATOM 15 CA SER A 2 -8.055 9.316 -11.729 1.00 0.00 C ATOM 16 C SER A 2 -7.094 8.219 -12.198 1.00 0.00 C ATOM 17 O SER A 2 -7.502 7.232 -12.779 1.00 0.00 O ATOM 18 CB SER A 2 -7.952 9.510 -10.218 1.00 0.00 C ATOM 19 OG SER A 2 -8.990 10.378 -9.783 1.00 0.00 O ATOM 20 H SER A 2 -9.927 8.330 -11.321 1.00 0.00 H ATOM 21 HA SER A 2 -7.842 10.244 -12.235 1.00 0.00 H ATOM 22 HB2 SER A 2 -8.055 8.558 -9.722 1.00 0.00 H ATOM 23 HB3 SER A 2 -6.987 9.936 -9.975 1.00 0.00 H ATOM 24 HG SER A 2 -8.921 11.196 -10.283 1.00 0.00 H ATOM 25 N MET A 3 -5.823 8.384 -11.949 1.00 0.00 N ATOM 26 CA MET A 3 -4.835 7.352 -12.379 1.00 0.00 C ATOM 27 C MET A 3 -3.892 7.007 -11.222 1.00 0.00 C ATOM 28 O MET A 3 -2.689 6.956 -11.384 1.00 0.00 O ATOM 29 CB MET A 3 -4.059 7.995 -13.532 1.00 0.00 C ATOM 30 CG MET A 3 -3.415 9.303 -13.061 1.00 0.00 C ATOM 31 SD MET A 3 -1.719 9.407 -13.685 1.00 0.00 S ATOM 32 CE MET A 3 -1.947 10.872 -14.723 1.00 0.00 C ATOM 33 H MET A 3 -5.518 9.188 -11.478 1.00 0.00 H ATOM 34 HA MET A 3 -5.343 6.467 -12.726 1.00 0.00 H ATOM 35 HB2 MET A 3 -3.291 7.314 -13.870 1.00 0.00 H ATOM 36 HB3 MET A 3 -4.737 8.204 -14.347 1.00 0.00 H ATOM 37 HG2 MET A 3 -3.986 10.140 -13.434 1.00 0.00 H ATOM 38 HG3 MET A 3 -3.402 9.331 -11.981 1.00 0.00 H ATOM 39 HE1 MET A 3 -2.949 10.869 -15.132 1.00 0.00 H ATOM 40 HE2 MET A 3 -1.225 10.859 -15.527 1.00 0.00 H ATOM 41 HE3 MET A 3 -1.806 11.761 -14.130 1.00 0.00 H ATOM 42 N LYS A 4 -4.432 6.772 -10.056 1.00 0.00 N ATOM 43 CA LYS A 4 -3.569 6.430 -8.887 1.00 0.00 C ATOM 44 C LYS A 4 -2.850 5.099 -9.131 1.00 0.00 C ATOM 45 O LYS A 4 -3.387 4.197 -9.743 1.00 0.00 O ATOM 46 CB LYS A 4 -4.527 6.316 -7.698 1.00 0.00 C ATOM 47 CG LYS A 4 -5.592 5.252 -7.986 1.00 0.00 C ATOM 48 CD LYS A 4 -6.984 5.840 -7.749 1.00 0.00 C ATOM 49 CE LYS A 4 -7.433 5.538 -6.317 1.00 0.00 C ATOM 50 NZ LYS A 4 -7.144 6.783 -5.553 1.00 0.00 N ATOM 51 H LYS A 4 -5.406 6.819 -9.949 1.00 0.00 H ATOM 52 HA LYS A 4 -2.853 7.216 -8.708 1.00 0.00 H ATOM 53 HB2 LYS A 4 -3.971 6.039 -6.815 1.00 0.00 H ATOM 54 HB3 LYS A 4 -5.009 7.270 -7.534 1.00 0.00 H ATOM 55 HG2 LYS A 4 -5.509 4.926 -9.013 1.00 0.00 H ATOM 56 HG3 LYS A 4 -5.444 4.409 -7.329 1.00 0.00 H ATOM 57 HD2 LYS A 4 -6.952 6.909 -7.899 1.00 0.00 H ATOM 58 HD3 LYS A 4 -7.684 5.401 -8.444 1.00 0.00 H ATOM 59 HE2 LYS A 4 -8.491 5.316 -6.295 1.00 0.00 H ATOM 60 HE3 LYS A 4 -6.866 4.715 -5.911 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -7.490 7.606 -6.085 1.00 0.00 H ATOM 62 HZ2 LYS A 4 -6.119 6.872 -5.408 1.00 0.00 H ATOM 63 HZ3 LYS A 4 -7.624 6.741 -4.629 1.00 0.00 H ATOM 64 N LEU A 5 -1.640 4.975 -8.658 1.00 0.00 N ATOM 65 CA LEU A 5 -0.879 3.711 -8.862 1.00 0.00 C ATOM 66 C LEU A 5 -1.091 2.755 -7.693 1.00 0.00 C ATOM 67 O LEU A 5 -0.415 1.755 -7.553 1.00 0.00 O ATOM 68 CB LEU A 5 0.575 4.144 -8.929 1.00 0.00 C ATOM 69 CG LEU A 5 1.464 2.938 -9.257 1.00 0.00 C ATOM 70 CD1 LEU A 5 2.378 3.280 -10.436 1.00 0.00 C ATOM 71 CD2 LEU A 5 2.321 2.589 -8.036 1.00 0.00 C ATOM 72 H LEU A 5 -1.227 5.713 -8.175 1.00 0.00 H ATOM 73 HA LEU A 5 -1.179 3.253 -9.771 1.00 0.00 H ATOM 74 HB2 LEU A 5 0.692 4.901 -9.692 1.00 0.00 H ATOM 75 HB3 LEU A 5 0.856 4.549 -7.970 1.00 0.00 H ATOM 76 HG LEU A 5 0.844 2.093 -9.517 1.00 0.00 H ATOM 77 HD11 LEU A 5 2.592 4.340 -10.430 1.00 0.00 H ATOM 78 HD12 LEU A 5 1.886 3.018 -11.360 1.00 0.00 H ATOM 79 HD13 LEU A 5 3.301 2.726 -10.348 1.00 0.00 H ATOM 80 HD21 LEU A 5 1.824 1.827 -7.454 1.00 0.00 H ATOM 81 HD22 LEU A 5 2.460 3.472 -7.429 1.00 0.00 H ATOM 82 HD23 LEU A 5 3.282 2.223 -8.364 1.00 0.00 H ATOM 83 N SER A 6 -2.026 3.068 -6.864 1.00 0.00 N ATOM 84 CA SER A 6 -2.316 2.203 -5.683 1.00 0.00 C ATOM 85 C SER A 6 -3.824 2.153 -5.418 1.00 0.00 C ATOM 86 O SER A 6 -4.295 2.568 -4.377 1.00 0.00 O ATOM 87 CB SER A 6 -1.588 2.869 -4.517 1.00 0.00 C ATOM 88 OG SER A 6 -0.199 2.940 -4.809 1.00 0.00 O ATOM 89 H SER A 6 -2.535 3.879 -7.021 1.00 0.00 H ATOM 90 HA SER A 6 -1.928 1.209 -5.840 1.00 0.00 H ATOM 91 HB2 SER A 6 -1.971 3.865 -4.372 1.00 0.00 H ATOM 92 HB3 SER A 6 -1.747 2.290 -3.617 1.00 0.00 H ATOM 93 HG SER A 6 0.183 2.073 -4.650 1.00 0.00 H ATOM 94 N PHE A 7 -4.584 1.644 -6.352 1.00 0.00 N ATOM 95 CA PHE A 7 -6.062 1.563 -6.155 1.00 0.00 C ATOM 96 C PHE A 7 -6.385 0.749 -4.898 1.00 0.00 C ATOM 97 O PHE A 7 -6.959 1.251 -3.952 1.00 0.00 O ATOM 98 CB PHE A 7 -6.595 0.855 -7.403 1.00 0.00 C ATOM 99 CG PHE A 7 -7.353 1.839 -8.263 1.00 0.00 C ATOM 100 CD1 PHE A 7 -8.489 2.481 -7.756 1.00 0.00 C ATOM 101 CD2 PHE A 7 -6.920 2.108 -9.567 1.00 0.00 C ATOM 102 CE1 PHE A 7 -9.193 3.393 -8.554 1.00 0.00 C ATOM 103 CE2 PHE A 7 -7.624 3.018 -10.365 1.00 0.00 C ATOM 104 CZ PHE A 7 -8.759 3.661 -9.858 1.00 0.00 C ATOM 105 H PHE A 7 -4.183 1.315 -7.182 1.00 0.00 H ATOM 106 HA PHE A 7 -6.485 2.552 -6.083 1.00 0.00 H ATOM 107 HB2 PHE A 7 -5.769 0.447 -7.968 1.00 0.00 H ATOM 108 HB3 PHE A 7 -7.258 0.055 -7.108 1.00 0.00 H ATOM 109 HD1 PHE A 7 -8.823 2.275 -6.751 1.00 0.00 H ATOM 110 HD2 PHE A 7 -6.044 1.613 -9.959 1.00 0.00 H ATOM 111 HE1 PHE A 7 -10.069 3.888 -8.163 1.00 0.00 H ATOM 112 HE2 PHE A 7 -7.289 3.226 -11.371 1.00 0.00 H ATOM 113 HZ PHE A 7 -9.302 4.364 -10.474 1.00 0.00 H ATOM 114 N ARG A 8 -6.020 -0.505 -4.886 1.00 0.00 N ATOM 115 CA ARG A 8 -6.303 -1.358 -3.694 1.00 0.00 C ATOM 116 C ARG A 8 -5.066 -1.436 -2.796 1.00 0.00 C ATOM 117 O ARG A 8 -5.161 -1.480 -1.585 1.00 0.00 O ATOM 118 CB ARG A 8 -6.647 -2.735 -4.273 1.00 0.00 C ATOM 119 CG ARG A 8 -6.665 -3.782 -3.157 1.00 0.00 C ATOM 120 CD ARG A 8 -7.034 -5.148 -3.741 1.00 0.00 C ATOM 121 NE ARG A 8 -5.735 -5.762 -4.133 1.00 0.00 N ATOM 122 CZ ARG A 8 -5.159 -6.631 -3.346 1.00 0.00 C ATOM 123 NH1 ARG A 8 -5.143 -6.433 -2.055 1.00 0.00 N ATOM 124 NH2 ARG A 8 -4.599 -7.696 -3.850 1.00 0.00 N ATOM 125 H ARG A 8 -5.559 -0.887 -5.662 1.00 0.00 H ATOM 126 HA ARG A 8 -7.139 -0.970 -3.145 1.00 0.00 H ATOM 127 HB2 ARG A 8 -7.620 -2.694 -4.742 1.00 0.00 H ATOM 128 HB3 ARG A 8 -5.905 -3.010 -5.008 1.00 0.00 H ATOM 129 HG2 ARG A 8 -5.685 -3.836 -2.702 1.00 0.00 H ATOM 130 HG3 ARG A 8 -7.394 -3.502 -2.411 1.00 0.00 H ATOM 131 HD2 ARG A 8 -7.530 -5.753 -2.993 1.00 0.00 H ATOM 132 HD3 ARG A 8 -7.664 -5.028 -4.609 1.00 0.00 H ATOM 133 HE ARG A 8 -5.313 -5.514 -4.981 1.00 0.00 H ATOM 134 HH11 ARG A 8 -5.571 -5.616 -1.670 1.00 0.00 H ATOM 135 HH12 ARG A 8 -4.702 -7.099 -1.453 1.00 0.00 H ATOM 136 HH21 ARG A 8 -4.611 -7.846 -4.839 1.00 0.00 H ATOM 137 HH22 ARG A 8 -4.158 -8.361 -3.248 1.00 0.00 H ATOM 138 N ALA A 9 -3.910 -1.458 -3.391 1.00 0.00 N ATOM 139 CA ALA A 9 -2.649 -1.539 -2.595 1.00 0.00 C ATOM 140 C ALA A 9 -2.510 -0.332 -1.662 1.00 0.00 C ATOM 141 O ALA A 9 -1.700 -0.334 -0.755 1.00 0.00 O ATOM 142 CB ALA A 9 -1.526 -1.541 -3.630 1.00 0.00 C ATOM 143 H ALA A 9 -3.872 -1.427 -4.365 1.00 0.00 H ATOM 144 HA ALA A 9 -2.626 -2.453 -2.030 1.00 0.00 H ATOM 145 HB1 ALA A 9 -1.369 -0.536 -3.992 1.00 0.00 H ATOM 146 HB2 ALA A 9 -1.798 -2.183 -4.454 1.00 0.00 H ATOM 147 HB3 ALA A 9 -0.618 -1.906 -3.173 1.00 0.00 H ATOM 148 N ARG A 10 -3.290 0.696 -1.870 1.00 0.00 N ATOM 149 CA ARG A 10 -3.196 1.897 -0.990 1.00 0.00 C ATOM 150 C ARG A 10 -3.428 1.506 0.478 1.00 0.00 C ATOM 151 O ARG A 10 -3.108 2.251 1.383 1.00 0.00 O ATOM 152 CB ARG A 10 -4.265 2.860 -1.527 1.00 0.00 C ATOM 153 CG ARG A 10 -4.891 3.673 -0.392 1.00 0.00 C ATOM 154 CD ARG A 10 -5.920 2.799 0.311 1.00 0.00 C ATOM 155 NE ARG A 10 -5.770 3.109 1.760 1.00 0.00 N ATOM 156 CZ ARG A 10 -6.825 3.193 2.523 1.00 0.00 C ATOM 157 NH1 ARG A 10 -7.773 2.302 2.426 1.00 0.00 N ATOM 158 NH2 ARG A 10 -6.932 4.170 3.382 1.00 0.00 N ATOM 159 H ARG A 10 -3.935 0.679 -2.604 1.00 0.00 H ATOM 160 HA ARG A 10 -2.242 2.346 -1.090 1.00 0.00 H ATOM 161 HB2 ARG A 10 -3.809 3.536 -2.237 1.00 0.00 H ATOM 162 HB3 ARG A 10 -5.029 2.290 -2.022 1.00 0.00 H ATOM 163 HG2 ARG A 10 -4.123 3.969 0.310 1.00 0.00 H ATOM 164 HG3 ARG A 10 -5.376 4.548 -0.793 1.00 0.00 H ATOM 165 HD2 ARG A 10 -6.917 3.039 -0.031 1.00 0.00 H ATOM 166 HD3 ARG A 10 -5.693 1.760 0.127 1.00 0.00 H ATOM 167 HE ARG A 10 -4.877 3.248 2.141 1.00 0.00 H ATOM 168 HH11 ARG A 10 -7.691 1.554 1.767 1.00 0.00 H ATOM 169 HH12 ARG A 10 -8.582 2.367 3.011 1.00 0.00 H ATOM 170 HH21 ARG A 10 -6.206 4.852 3.456 1.00 0.00 H ATOM 171 HH22 ARG A 10 -7.741 4.235 3.967 1.00 0.00 H ATOM 172 N ALA A 11 -3.979 0.344 0.719 1.00 0.00 N ATOM 173 CA ALA A 11 -4.225 -0.089 2.119 1.00 0.00 C ATOM 174 C ALA A 11 -3.458 -1.374 2.412 1.00 0.00 C ATOM 175 O ALA A 11 -3.963 -2.281 3.044 1.00 0.00 O ATOM 176 CB ALA A 11 -5.732 -0.320 2.211 1.00 0.00 C ATOM 177 H ALA A 11 -4.228 -0.242 -0.014 1.00 0.00 H ATOM 178 HA ALA A 11 -3.926 0.679 2.795 1.00 0.00 H ATOM 179 HB1 ALA A 11 -5.925 -1.221 2.774 1.00 0.00 H ATOM 180 HB2 ALA A 11 -6.143 -0.422 1.217 1.00 0.00 H ATOM 181 HB3 ALA A 11 -6.196 0.520 2.707 1.00 0.00 H ATOM 182 N TYR A 12 -2.247 -1.462 1.942 1.00 0.00 N ATOM 183 CA TYR A 12 -1.445 -2.675 2.166 1.00 0.00 C ATOM 184 C TYR A 12 -0.205 -2.349 3.005 1.00 0.00 C ATOM 185 O TYR A 12 0.900 -2.729 2.669 1.00 0.00 O ATOM 186 CB TYR A 12 -1.058 -3.108 0.761 1.00 0.00 C ATOM 187 CG TYR A 12 -1.514 -4.525 0.530 1.00 0.00 C ATOM 188 CD1 TYR A 12 -2.853 -4.863 0.758 1.00 0.00 C ATOM 189 CD2 TYR A 12 -0.609 -5.497 0.090 1.00 0.00 C ATOM 190 CE1 TYR A 12 -3.289 -6.176 0.547 1.00 0.00 C ATOM 191 CE2 TYR A 12 -1.044 -6.811 -0.122 1.00 0.00 C ATOM 192 CZ TYR A 12 -2.384 -7.150 0.106 1.00 0.00 C ATOM 193 OH TYR A 12 -2.813 -8.445 -0.101 1.00 0.00 O ATOM 194 H TYR A 12 -1.866 -0.734 1.426 1.00 0.00 H ATOM 195 HA TYR A 12 -2.036 -3.431 2.636 1.00 0.00 H ATOM 196 HB2 TYR A 12 -1.534 -2.456 0.041 1.00 0.00 H ATOM 197 HB3 TYR A 12 0.003 -3.039 0.653 1.00 0.00 H ATOM 198 HD1 TYR A 12 -3.550 -4.106 1.099 1.00 0.00 H ATOM 199 HD2 TYR A 12 0.424 -5.235 -0.085 1.00 0.00 H ATOM 200 HE1 TYR A 12 -4.322 -6.437 0.723 1.00 0.00 H ATOM 201 HE2 TYR A 12 -0.346 -7.563 -0.461 1.00 0.00 H ATOM 202 HH TYR A 12 -2.700 -8.649 -1.034 1.00 0.00 H ATOM 203 N SER A 13 -0.381 -1.649 4.094 1.00 0.00 N ATOM 204 CA SER A 13 0.786 -1.298 4.955 1.00 0.00 C ATOM 205 C SER A 13 0.322 -1.024 6.389 1.00 0.00 C ATOM 206 O SER A 13 0.623 0.004 6.963 1.00 0.00 O ATOM 207 CB SER A 13 1.371 -0.033 4.329 1.00 0.00 C ATOM 208 OG SER A 13 0.414 1.015 4.404 1.00 0.00 O ATOM 209 H SER A 13 -1.281 -1.355 4.345 1.00 0.00 H ATOM 210 HA SER A 13 1.517 -2.090 4.940 1.00 0.00 H ATOM 211 HB2 SER A 13 2.259 0.258 4.867 1.00 0.00 H ATOM 212 HB3 SER A 13 1.627 -0.229 3.297 1.00 0.00 H ATOM 213 HG SER A 13 0.689 1.620 5.096 1.00 0.00 H ATOM 214 N PHE A 14 -0.408 -1.939 6.971 1.00 0.00 N ATOM 215 CA PHE A 14 -0.892 -1.736 8.366 1.00 0.00 C ATOM 216 C PHE A 14 0.146 -2.251 9.367 1.00 0.00 C ATOM 217 O PHE A 14 0.588 -1.532 10.242 1.00 0.00 O ATOM 218 CB PHE A 14 -2.175 -2.552 8.458 1.00 0.00 C ATOM 219 CG PHE A 14 -3.169 -1.837 9.343 1.00 0.00 C ATOM 220 CD1 PHE A 14 -2.820 -1.497 10.656 1.00 0.00 C ATOM 221 CD2 PHE A 14 -4.440 -1.516 8.851 1.00 0.00 C ATOM 222 CE1 PHE A 14 -3.742 -0.836 11.476 1.00 0.00 C ATOM 223 CE2 PHE A 14 -5.362 -0.854 9.672 1.00 0.00 C ATOM 224 CZ PHE A 14 -5.013 -0.514 10.984 1.00 0.00 C ATOM 225 H PHE A 14 -0.639 -2.761 6.489 1.00 0.00 H ATOM 226 HA PHE A 14 -1.107 -0.701 8.546 1.00 0.00 H ATOM 227 HB2 PHE A 14 -2.595 -2.679 7.471 1.00 0.00 H ATOM 228 HB3 PHE A 14 -1.950 -3.513 8.878 1.00 0.00 H ATOM 229 HD1 PHE A 14 -1.840 -1.745 11.035 1.00 0.00 H ATOM 230 HD2 PHE A 14 -4.710 -1.778 7.839 1.00 0.00 H ATOM 231 HE1 PHE A 14 -3.473 -0.573 12.489 1.00 0.00 H ATOM 232 HE2 PHE A 14 -6.342 -0.606 9.293 1.00 0.00 H ATOM 233 HZ PHE A 14 -5.724 -0.004 11.617 1.00 0.00 H ATOM 234 N ARG A 15 0.541 -3.491 9.240 1.00 0.00 N ATOM 235 CA ARG A 15 1.551 -4.062 10.168 1.00 0.00 C ATOM 236 C ARG A 15 1.915 -5.478 9.740 1.00 0.00 C ATOM 237 O ARG A 15 1.186 -6.423 9.970 1.00 0.00 O ATOM 238 CB ARG A 15 0.896 -4.077 11.542 1.00 0.00 C ATOM 239 CG ARG A 15 1.988 -3.926 12.594 1.00 0.00 C ATOM 240 CD ARG A 15 2.252 -5.277 13.257 1.00 0.00 C ATOM 241 NE ARG A 15 3.243 -4.993 14.332 1.00 0.00 N ATOM 242 CZ ARG A 15 2.894 -5.094 15.585 1.00 0.00 C ATOM 243 NH1 ARG A 15 2.177 -4.156 16.140 1.00 0.00 N ATOM 244 NH2 ARG A 15 3.262 -6.133 16.284 1.00 0.00 N ATOM 245 H ARG A 15 0.180 -4.048 8.528 1.00 0.00 H ATOM 246 HA ARG A 15 2.432 -3.442 10.192 1.00 0.00 H ATOM 247 HB2 ARG A 15 0.197 -3.256 11.621 1.00 0.00 H ATOM 248 HB3 ARG A 15 0.379 -5.012 11.689 1.00 0.00 H ATOM 249 HG2 ARG A 15 2.896 -3.575 12.119 1.00 0.00 H ATOM 250 HG3 ARG A 15 1.673 -3.215 13.334 1.00 0.00 H ATOM 251 HD2 ARG A 15 1.338 -5.675 13.678 1.00 0.00 H ATOM 252 HD3 ARG A 15 2.670 -5.967 12.541 1.00 0.00 H ATOM 253 HE ARG A 15 4.158 -4.729 14.098 1.00 0.00 H ATOM 254 HH11 ARG A 15 1.896 -3.359 15.605 1.00 0.00 H ATOM 255 HH12 ARG A 15 1.909 -4.233 17.101 1.00 0.00 H ATOM 256 HH21 ARG A 15 3.812 -6.852 15.859 1.00 0.00 H ATOM 257 HH22 ARG A 15 2.994 -6.210 17.245 1.00 0.00 H ATOM 258 N GLY A 16 3.043 -5.620 9.118 1.00 0.00 N ATOM 259 CA GLY A 16 3.489 -6.965 8.658 1.00 0.00 C ATOM 260 C GLY A 16 4.971 -6.917 8.297 1.00 0.00 C ATOM 261 O GLY A 16 5.818 -7.321 9.071 1.00 0.00 O ATOM 262 H GLY A 16 3.599 -4.833 8.954 1.00 0.00 H ATOM 263 HA2 GLY A 16 3.330 -7.689 9.445 1.00 0.00 H ATOM 264 HA3 GLY A 16 2.927 -7.255 7.778 1.00 0.00 H ATOM 265 N PRO A 17 5.229 -6.438 7.113 1.00 0.00 N ATOM 266 CA PRO A 17 6.594 -6.336 6.585 1.00 0.00 C ATOM 267 C PRO A 17 7.132 -4.911 6.749 1.00 0.00 C ATOM 268 O PRO A 17 7.742 -4.363 5.852 1.00 0.00 O ATOM 269 CB PRO A 17 6.375 -6.685 5.113 1.00 0.00 C ATOM 270 CG PRO A 17 4.925 -6.375 4.832 1.00 0.00 C ATOM 271 CD PRO A 17 4.288 -5.940 6.124 1.00 0.00 C ATOM 272 HA PRO A 17 7.247 -7.058 7.048 1.00 0.00 H ATOM 273 HB2 PRO A 17 7.017 -6.081 4.488 1.00 0.00 H ATOM 274 HB3 PRO A 17 6.561 -7.730 4.942 1.00 0.00 H ATOM 275 HG2 PRO A 17 4.854 -5.593 4.098 1.00 0.00 H ATOM 276 HG3 PRO A 17 4.422 -7.262 4.480 1.00 0.00 H ATOM 277 HD2 PRO A 17 4.210 -4.862 6.167 1.00 0.00 H ATOM 278 HD3 PRO A 17 3.324 -6.404 6.249 1.00 0.00 H ATOM 279 N GLY A 18 6.911 -4.310 7.887 1.00 0.00 N ATOM 280 CA GLY A 18 7.407 -2.922 8.111 1.00 0.00 C ATOM 281 C GLY A 18 8.068 -2.831 9.489 1.00 0.00 C ATOM 282 O GLY A 18 7.816 -3.651 10.350 1.00 0.00 O ATOM 283 H GLY A 18 6.417 -4.772 8.596 1.00 0.00 H ATOM 284 HA2 GLY A 18 8.128 -2.672 7.345 1.00 0.00 H ATOM 285 HA3 GLY A 18 6.579 -2.231 8.065 1.00 0.00 H ATOM 286 N PRO A 19 8.899 -1.832 9.656 1.00 0.00 N ATOM 287 CA PRO A 19 9.601 -1.631 10.932 1.00 0.00 C ATOM 288 C PRO A 19 8.771 -0.771 11.890 1.00 0.00 C ATOM 289 O PRO A 19 8.998 0.416 12.028 1.00 0.00 O ATOM 290 CB PRO A 19 10.879 -0.924 10.525 1.00 0.00 C ATOM 291 CG PRO A 19 10.587 -0.279 9.211 1.00 0.00 C ATOM 292 CD PRO A 19 9.267 -0.802 8.692 1.00 0.00 C ATOM 293 HA PRO A 19 9.848 -2.571 11.368 1.00 0.00 H ATOM 294 HB2 PRO A 19 11.141 -0.176 11.261 1.00 0.00 H ATOM 295 HB3 PRO A 19 11.681 -1.637 10.414 1.00 0.00 H ATOM 296 HG2 PRO A 19 10.546 0.795 9.322 1.00 0.00 H ATOM 297 HG3 PRO A 19 11.362 -0.551 8.528 1.00 0.00 H ATOM 298 HD2 PRO A 19 8.528 -0.012 8.675 1.00 0.00 H ATOM 299 HD3 PRO A 19 9.388 -1.234 7.712 1.00 0.00 H ATOM 300 N GLN A 20 7.812 -1.361 12.553 1.00 0.00 N ATOM 301 CA GLN A 20 6.966 -0.580 13.504 1.00 0.00 C ATOM 302 C GLN A 20 7.841 0.082 14.573 1.00 0.00 C ATOM 303 O GLN A 20 7.635 1.223 14.937 1.00 0.00 O ATOM 304 CB GLN A 20 6.028 -1.608 14.140 1.00 0.00 C ATOM 305 CG GLN A 20 4.728 -1.679 13.336 1.00 0.00 C ATOM 306 CD GLN A 20 3.967 -0.360 13.476 1.00 0.00 C ATOM 307 OE1 GLN A 20 3.703 0.309 12.497 1.00 0.00 O ATOM 308 NE2 GLN A 20 3.602 0.047 14.661 1.00 0.00 N ATOM 309 H GLN A 20 7.647 -2.318 12.426 1.00 0.00 H ATOM 310 HA GLN A 20 6.393 0.162 12.972 1.00 0.00 H ATOM 311 HB2 GLN A 20 6.507 -2.579 14.140 1.00 0.00 H ATOM 312 HB3 GLN A 20 5.805 -1.311 15.156 1.00 0.00 H ATOM 313 HG2 GLN A 20 4.958 -1.855 12.295 1.00 0.00 H ATOM 314 HG3 GLN A 20 4.117 -2.486 13.712 1.00 0.00 H ATOM 315 HE21 GLN A 20 3.815 -0.494 15.451 1.00 0.00 H ATOM 316 HE22 GLN A 20 3.114 0.890 14.762 1.00 0.00 H ATOM 317 N LEU A 21 8.814 -0.629 15.076 1.00 0.00 N ATOM 318 CA LEU A 21 9.706 -0.045 16.121 1.00 0.00 C ATOM 319 C LEU A 21 11.077 0.281 15.526 1.00 0.00 C ATOM 320 O LEU A 21 12.039 0.298 16.277 1.00 0.00 O ATOM 321 CB LEU A 21 9.828 -1.134 17.188 1.00 0.00 C ATOM 322 CG LEU A 21 10.491 -0.553 18.443 1.00 0.00 C ATOM 323 CD1 LEU A 21 9.502 -0.591 19.610 1.00 0.00 C ATOM 324 CD2 LEU A 21 11.727 -1.382 18.799 1.00 0.00 C ATOM 325 H LEU A 21 8.961 -1.547 14.766 1.00 0.00 H ATOM 326 HA LEU A 21 9.258 0.840 16.546 1.00 0.00 H ATOM 327 HB2 LEU A 21 8.844 -1.505 17.437 1.00 0.00 H ATOM 328 HB3 LEU A 21 10.432 -1.944 16.807 1.00 0.00 H ATOM 329 HG LEU A 21 10.784 0.471 18.255 1.00 0.00 H ATOM 330 HD11 LEU A 21 8.880 -1.470 19.525 1.00 0.00 H ATOM 331 HD12 LEU A 21 8.882 0.292 19.586 1.00 0.00 H ATOM 332 HD13 LEU A 21 10.047 -0.624 20.542 1.00 0.00 H ATOM 333 HD21 LEU A 21 12.328 -1.532 17.913 1.00 0.00 H ATOM 334 HD22 LEU A 21 11.418 -2.340 19.190 1.00 0.00 H ATOM 335 HD23 LEU A 21 12.309 -0.860 19.544 1.00 0.00 H HETATM 336 N NH2 A 22 11.194 0.527 14.251 1.00 0.00 N HETATM 337 HN1 NH2 A 22 10.398 0.511 13.671 1.00 0.00 H HETATM 338 HN2 NH2 A 22 12.077 0.735 13.869 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 4 ATOM 1 N SER A 1 -0.677 14.311 -4.133 1.00 0.00 N ATOM 2 CA SER A 1 -2.165 14.233 -4.142 1.00 0.00 C ATOM 3 C SER A 1 -2.648 13.445 -5.363 1.00 0.00 C ATOM 4 O SER A 1 -3.632 13.790 -5.986 1.00 0.00 O ATOM 5 CB SER A 1 -2.637 15.684 -4.220 1.00 0.00 C ATOM 6 OG SER A 1 -4.058 15.714 -4.269 1.00 0.00 O ATOM 7 H1 SER A 1 -0.282 13.378 -3.900 1.00 0.00 H ATOM 8 H2 SER A 1 -0.370 15.006 -3.421 1.00 0.00 H ATOM 9 H3 SER A 1 -0.339 14.604 -5.072 1.00 0.00 H ATOM 10 HA SER A 1 -2.525 13.778 -3.232 1.00 0.00 H ATOM 11 HB2 SER A 1 -2.301 16.222 -3.350 1.00 0.00 H ATOM 12 HB3 SER A 1 -2.227 16.147 -5.108 1.00 0.00 H ATOM 13 HG SER A 1 -4.318 16.223 -5.040 1.00 0.00 H ATOM 14 N SER A 2 -1.960 12.389 -5.708 1.00 0.00 N ATOM 15 CA SER A 2 -2.376 11.576 -6.888 1.00 0.00 C ATOM 16 C SER A 2 -3.010 10.261 -6.430 1.00 0.00 C ATOM 17 O SER A 2 -2.922 9.887 -5.277 1.00 0.00 O ATOM 18 CB SER A 2 -1.083 11.308 -7.658 1.00 0.00 C ATOM 19 OG SER A 2 -0.920 12.303 -8.660 1.00 0.00 O ATOM 20 H SER A 2 -1.169 12.130 -5.189 1.00 0.00 H ATOM 21 HA SER A 2 -3.063 12.134 -7.505 1.00 0.00 H ATOM 22 HB2 SER A 2 -0.246 11.344 -6.982 1.00 0.00 H ATOM 23 HB3 SER A 2 -1.134 10.328 -8.114 1.00 0.00 H ATOM 24 HG SER A 2 -0.918 11.865 -9.515 1.00 0.00 H ATOM 25 N MET A 3 -3.650 9.558 -7.326 1.00 0.00 N ATOM 26 CA MET A 3 -4.293 8.267 -6.945 1.00 0.00 C ATOM 27 C MET A 3 -3.461 7.089 -7.465 1.00 0.00 C ATOM 28 O MET A 3 -3.554 6.713 -8.617 1.00 0.00 O ATOM 29 CB MET A 3 -5.665 8.291 -7.620 1.00 0.00 C ATOM 30 CG MET A 3 -6.738 8.639 -6.585 1.00 0.00 C ATOM 31 SD MET A 3 -8.378 8.375 -7.304 1.00 0.00 S ATOM 32 CE MET A 3 -9.253 8.038 -5.756 1.00 0.00 C ATOM 33 H MET A 3 -3.709 9.879 -8.249 1.00 0.00 H ATOM 34 HA MET A 3 -4.408 8.203 -5.875 1.00 0.00 H ATOM 35 HB2 MET A 3 -5.667 9.035 -8.404 1.00 0.00 H ATOM 36 HB3 MET A 3 -5.878 7.321 -8.043 1.00 0.00 H ATOM 37 HG2 MET A 3 -6.619 8.007 -5.718 1.00 0.00 H ATOM 38 HG3 MET A 3 -6.635 9.674 -6.294 1.00 0.00 H ATOM 39 HE1 MET A 3 -9.262 8.931 -5.147 1.00 0.00 H ATOM 40 HE2 MET A 3 -8.751 7.239 -5.226 1.00 0.00 H ATOM 41 HE3 MET A 3 -10.267 7.741 -5.972 1.00 0.00 H ATOM 42 N LYS A 4 -2.651 6.507 -6.621 1.00 0.00 N ATOM 43 CA LYS A 4 -1.813 5.354 -7.062 1.00 0.00 C ATOM 44 C LYS A 4 -2.613 4.053 -6.961 1.00 0.00 C ATOM 45 O LYS A 4 -3.361 3.845 -6.025 1.00 0.00 O ATOM 46 CB LYS A 4 -0.626 5.331 -6.096 1.00 0.00 C ATOM 47 CG LYS A 4 0.647 5.758 -6.833 1.00 0.00 C ATOM 48 CD LYS A 4 1.839 4.953 -6.310 1.00 0.00 C ATOM 49 CE LYS A 4 2.197 3.854 -7.312 1.00 0.00 C ATOM 50 NZ LYS A 4 1.412 2.666 -6.877 1.00 0.00 N ATOM 51 H LYS A 4 -2.593 6.827 -5.698 1.00 0.00 H ATOM 52 HA LYS A 4 -1.465 5.504 -8.072 1.00 0.00 H ATOM 53 HB2 LYS A 4 -0.815 6.013 -5.279 1.00 0.00 H ATOM 54 HB3 LYS A 4 -0.496 4.332 -5.708 1.00 0.00 H ATOM 55 HG2 LYS A 4 0.526 5.578 -7.893 1.00 0.00 H ATOM 56 HG3 LYS A 4 0.824 6.810 -6.666 1.00 0.00 H ATOM 57 HD2 LYS A 4 2.687 5.611 -6.178 1.00 0.00 H ATOM 58 HD3 LYS A 4 1.583 4.504 -5.361 1.00 0.00 H ATOM 59 HE2 LYS A 4 1.912 4.151 -8.312 1.00 0.00 H ATOM 60 HE3 LYS A 4 3.253 3.635 -7.270 1.00 0.00 H ATOM 61 HZ1 LYS A 4 1.553 1.889 -7.554 1.00 0.00 H ATOM 62 HZ2 LYS A 4 0.403 2.911 -6.841 1.00 0.00 H ATOM 63 HZ3 LYS A 4 1.731 2.366 -5.933 1.00 0.00 H ATOM 64 N LEU A 5 -2.463 3.175 -7.917 1.00 0.00 N ATOM 65 CA LEU A 5 -3.217 1.885 -7.877 1.00 0.00 C ATOM 66 C LEU A 5 -2.903 1.129 -6.583 1.00 0.00 C ATOM 67 O LEU A 5 -2.104 1.565 -5.776 1.00 0.00 O ATOM 68 CB LEU A 5 -2.727 1.094 -9.095 1.00 0.00 C ATOM 69 CG LEU A 5 -3.898 0.843 -10.046 1.00 0.00 C ATOM 70 CD1 LEU A 5 -4.037 2.022 -11.010 1.00 0.00 C ATOM 71 CD2 LEU A 5 -3.639 -0.438 -10.844 1.00 0.00 C ATOM 72 H LEU A 5 -1.857 3.364 -8.662 1.00 0.00 H ATOM 73 HA LEU A 5 -4.274 2.069 -7.959 1.00 0.00 H ATOM 74 HB2 LEU A 5 -1.961 1.657 -9.608 1.00 0.00 H ATOM 75 HB3 LEU A 5 -2.321 0.147 -8.770 1.00 0.00 H ATOM 76 HG LEU A 5 -4.809 0.735 -9.476 1.00 0.00 H ATOM 77 HD11 LEU A 5 -3.057 2.336 -11.340 1.00 0.00 H ATOM 78 HD12 LEU A 5 -4.526 2.843 -10.506 1.00 0.00 H ATOM 79 HD13 LEU A 5 -4.626 1.723 -11.864 1.00 0.00 H ATOM 80 HD21 LEU A 5 -3.161 -0.189 -11.780 1.00 0.00 H ATOM 81 HD22 LEU A 5 -4.578 -0.935 -11.040 1.00 0.00 H ATOM 82 HD23 LEU A 5 -2.998 -1.093 -10.275 1.00 0.00 H ATOM 83 N SER A 6 -3.527 0.001 -6.376 1.00 0.00 N ATOM 84 CA SER A 6 -3.267 -0.783 -5.134 1.00 0.00 C ATOM 85 C SER A 6 -3.587 -2.263 -5.362 1.00 0.00 C ATOM 86 O SER A 6 -4.316 -2.873 -4.602 1.00 0.00 O ATOM 87 CB SER A 6 -4.206 -0.183 -4.087 1.00 0.00 C ATOM 88 OG SER A 6 -3.483 0.736 -3.279 1.00 0.00 O ATOM 89 H SER A 6 -4.168 -0.332 -7.040 1.00 0.00 H ATOM 90 HA SER A 6 -2.243 -0.662 -4.821 1.00 0.00 H ATOM 91 HB2 SER A 6 -5.013 0.334 -4.577 1.00 0.00 H ATOM 92 HB3 SER A 6 -4.611 -0.978 -3.473 1.00 0.00 H ATOM 93 HG SER A 6 -3.295 0.308 -2.440 1.00 0.00 H ATOM 94 N PHE A 7 -3.047 -2.846 -6.399 1.00 0.00 N ATOM 95 CA PHE A 7 -3.319 -4.289 -6.675 1.00 0.00 C ATOM 96 C PHE A 7 -2.927 -5.140 -5.463 1.00 0.00 C ATOM 97 O PHE A 7 -3.745 -5.827 -4.885 1.00 0.00 O ATOM 98 CB PHE A 7 -2.443 -4.638 -7.882 1.00 0.00 C ATOM 99 CG PHE A 7 -3.313 -4.842 -9.098 1.00 0.00 C ATOM 100 CD1 PHE A 7 -4.300 -5.835 -9.094 1.00 0.00 C ATOM 101 CD2 PHE A 7 -3.134 -4.039 -10.232 1.00 0.00 C ATOM 102 CE1 PHE A 7 -5.108 -6.025 -10.221 1.00 0.00 C ATOM 103 CE2 PHE A 7 -3.941 -4.230 -11.359 1.00 0.00 C ATOM 104 CZ PHE A 7 -4.928 -5.223 -11.354 1.00 0.00 C ATOM 105 H PHE A 7 -2.463 -2.335 -6.997 1.00 0.00 H ATOM 106 HA PHE A 7 -4.357 -4.434 -6.918 1.00 0.00 H ATOM 107 HB2 PHE A 7 -1.747 -3.832 -8.068 1.00 0.00 H ATOM 108 HB3 PHE A 7 -1.895 -5.546 -7.678 1.00 0.00 H ATOM 109 HD1 PHE A 7 -4.439 -6.454 -8.219 1.00 0.00 H ATOM 110 HD2 PHE A 7 -2.372 -3.273 -10.235 1.00 0.00 H ATOM 111 HE1 PHE A 7 -5.868 -6.791 -10.217 1.00 0.00 H ATOM 112 HE2 PHE A 7 -3.803 -3.610 -12.233 1.00 0.00 H ATOM 113 HZ PHE A 7 -5.550 -5.369 -12.224 1.00 0.00 H ATOM 114 N ARG A 8 -1.681 -5.093 -5.076 1.00 0.00 N ATOM 115 CA ARG A 8 -1.230 -5.894 -3.901 1.00 0.00 C ATOM 116 C ARG A 8 -1.111 -4.991 -2.671 1.00 0.00 C ATOM 117 O ARG A 8 -1.349 -5.405 -1.553 1.00 0.00 O ATOM 118 CB ARG A 8 0.138 -6.452 -4.309 1.00 0.00 C ATOM 119 CG ARG A 8 0.876 -6.980 -3.076 1.00 0.00 C ATOM 120 CD ARG A 8 2.195 -7.628 -3.504 1.00 0.00 C ATOM 121 NE ARG A 8 3.231 -6.584 -3.267 1.00 0.00 N ATOM 122 CZ ARG A 8 4.404 -6.690 -3.831 1.00 0.00 C ATOM 123 NH1 ARG A 8 5.033 -7.833 -3.817 1.00 0.00 N ATOM 124 NH2 ARG A 8 4.945 -5.653 -4.408 1.00 0.00 N ATOM 125 H ARG A 8 -1.040 -4.529 -5.557 1.00 0.00 H ATOM 126 HA ARG A 8 -1.915 -6.698 -3.710 1.00 0.00 H ATOM 127 HB2 ARG A 8 0.000 -7.256 -5.017 1.00 0.00 H ATOM 128 HB3 ARG A 8 0.723 -5.667 -4.766 1.00 0.00 H ATOM 129 HG2 ARG A 8 1.078 -6.158 -2.403 1.00 0.00 H ATOM 130 HG3 ARG A 8 0.262 -7.713 -2.575 1.00 0.00 H ATOM 131 HD2 ARG A 8 2.395 -8.504 -2.903 1.00 0.00 H ATOM 132 HD3 ARG A 8 2.163 -7.887 -4.552 1.00 0.00 H ATOM 133 HE ARG A 8 3.034 -5.819 -2.687 1.00 0.00 H ATOM 134 HH11 ARG A 8 4.618 -8.628 -3.374 1.00 0.00 H ATOM 135 HH12 ARG A 8 5.932 -7.914 -4.248 1.00 0.00 H ATOM 136 HH21 ARG A 8 4.463 -4.777 -4.419 1.00 0.00 H ATOM 137 HH22 ARG A 8 5.844 -5.734 -4.840 1.00 0.00 H ATOM 138 N ALA A 9 -0.743 -3.761 -2.878 1.00 0.00 N ATOM 139 CA ALA A 9 -0.599 -2.812 -1.737 1.00 0.00 C ATOM 140 C ALA A 9 -1.947 -2.579 -1.046 1.00 0.00 C ATOM 141 O ALA A 9 -2.009 -2.030 0.036 1.00 0.00 O ATOM 142 CB ALA A 9 -0.092 -1.513 -2.362 1.00 0.00 C ATOM 143 H ALA A 9 -0.557 -3.465 -3.788 1.00 0.00 H ATOM 144 HA ALA A 9 0.123 -3.185 -1.034 1.00 0.00 H ATOM 145 HB1 ALA A 9 0.534 -0.994 -1.652 1.00 0.00 H ATOM 146 HB2 ALA A 9 -0.932 -0.890 -2.627 1.00 0.00 H ATOM 147 HB3 ALA A 9 0.481 -1.741 -3.248 1.00 0.00 H ATOM 148 N ARG A 10 -3.024 -2.993 -1.659 1.00 0.00 N ATOM 149 CA ARG A 10 -4.362 -2.795 -1.033 1.00 0.00 C ATOM 150 C ARG A 10 -4.442 -3.539 0.308 1.00 0.00 C ATOM 151 O ARG A 10 -5.337 -3.312 1.098 1.00 0.00 O ATOM 152 CB ARG A 10 -5.359 -3.329 -2.073 1.00 0.00 C ATOM 153 CG ARG A 10 -6.590 -3.931 -1.394 1.00 0.00 C ATOM 154 CD ARG A 10 -6.234 -5.328 -0.906 1.00 0.00 C ATOM 155 NE ARG A 10 -6.916 -5.467 0.410 1.00 0.00 N ATOM 156 CZ ARG A 10 -8.052 -6.105 0.493 1.00 0.00 C ATOM 157 NH1 ARG A 10 -9.008 -5.849 -0.358 1.00 0.00 N ATOM 158 NH2 ARG A 10 -8.231 -6.998 1.427 1.00 0.00 N ATOM 159 H ARG A 10 -2.955 -3.433 -2.528 1.00 0.00 H ATOM 160 HA ARG A 10 -4.542 -1.762 -0.879 1.00 0.00 H ATOM 161 HB2 ARG A 10 -5.668 -2.519 -2.717 1.00 0.00 H ATOM 162 HB3 ARG A 10 -4.872 -4.083 -2.664 1.00 0.00 H ATOM 163 HG2 ARG A 10 -6.881 -3.314 -0.556 1.00 0.00 H ATOM 164 HG3 ARG A 10 -7.403 -3.992 -2.101 1.00 0.00 H ATOM 165 HD2 ARG A 10 -6.590 -6.074 -1.604 1.00 0.00 H ATOM 166 HD3 ARG A 10 -5.164 -5.401 -0.781 1.00 0.00 H ATOM 167 HE ARG A 10 -6.513 -5.079 1.215 1.00 0.00 H ATOM 168 HH11 ARG A 10 -8.871 -5.165 -1.074 1.00 0.00 H ATOM 169 HH12 ARG A 10 -9.878 -6.338 -0.295 1.00 0.00 H ATOM 170 HH21 ARG A 10 -7.499 -7.194 2.080 1.00 0.00 H ATOM 171 HH22 ARG A 10 -9.102 -7.487 1.491 1.00 0.00 H ATOM 172 N ALA A 11 -3.514 -4.424 0.571 1.00 0.00 N ATOM 173 CA ALA A 11 -3.541 -5.172 1.856 1.00 0.00 C ATOM 174 C ALA A 11 -2.119 -5.400 2.368 1.00 0.00 C ATOM 175 O ALA A 11 -1.757 -6.493 2.757 1.00 0.00 O ATOM 176 CB ALA A 11 -4.220 -6.503 1.530 1.00 0.00 C ATOM 177 H ALA A 11 -2.803 -4.593 -0.070 1.00 0.00 H ATOM 178 HA ALA A 11 -4.113 -4.635 2.580 1.00 0.00 H ATOM 179 HB1 ALA A 11 -3.699 -7.305 2.031 1.00 0.00 H ATOM 180 HB2 ALA A 11 -4.196 -6.668 0.463 1.00 0.00 H ATOM 181 HB3 ALA A 11 -5.246 -6.475 1.867 1.00 0.00 H ATOM 182 N TYR A 12 -1.307 -4.379 2.360 1.00 0.00 N ATOM 183 CA TYR A 12 0.081 -4.528 2.827 1.00 0.00 C ATOM 184 C TYR A 12 0.332 -3.646 4.054 1.00 0.00 C ATOM 185 O TYR A 12 1.312 -2.930 4.125 1.00 0.00 O ATOM 186 CB TYR A 12 0.906 -4.061 1.639 1.00 0.00 C ATOM 187 CG TYR A 12 1.865 -5.149 1.232 1.00 0.00 C ATOM 188 CD1 TYR A 12 1.378 -6.436 0.974 1.00 0.00 C ATOM 189 CD2 TYR A 12 3.233 -4.879 1.111 1.00 0.00 C ATOM 190 CE1 TYR A 12 2.260 -7.455 0.595 1.00 0.00 C ATOM 191 CE2 TYR A 12 4.115 -5.898 0.732 1.00 0.00 C ATOM 192 CZ TYR A 12 3.629 -7.186 0.474 1.00 0.00 C ATOM 193 OH TYR A 12 4.498 -8.189 0.100 1.00 0.00 O ATOM 194 H TYR A 12 -1.602 -3.514 2.035 1.00 0.00 H ATOM 195 HA TYR A 12 0.295 -5.553 3.044 1.00 0.00 H ATOM 196 HB2 TYR A 12 0.248 -3.836 0.812 1.00 0.00 H ATOM 197 HB3 TYR A 12 1.443 -3.178 1.912 1.00 0.00 H ATOM 198 HD1 TYR A 12 0.318 -6.640 1.070 1.00 0.00 H ATOM 199 HD2 TYR A 12 3.607 -3.886 1.311 1.00 0.00 H ATOM 200 HE1 TYR A 12 1.884 -8.447 0.396 1.00 0.00 H ATOM 201 HE2 TYR A 12 5.171 -5.690 0.638 1.00 0.00 H ATOM 202 HH TYR A 12 5.164 -8.276 0.786 1.00 0.00 H ATOM 203 N SER A 13 -0.546 -3.692 5.019 1.00 0.00 N ATOM 204 CA SER A 13 -0.360 -2.856 6.241 1.00 0.00 C ATOM 205 C SER A 13 -0.824 -3.621 7.483 1.00 0.00 C ATOM 206 O SER A 13 -1.544 -3.098 8.312 1.00 0.00 O ATOM 207 CB SER A 13 -1.232 -1.623 6.013 1.00 0.00 C ATOM 208 OG SER A 13 -2.598 -1.975 6.190 1.00 0.00 O ATOM 209 H SER A 13 -1.329 -4.277 4.940 1.00 0.00 H ATOM 210 HA SER A 13 0.673 -2.563 6.344 1.00 0.00 H ATOM 211 HB2 SER A 13 -0.970 -0.855 6.722 1.00 0.00 H ATOM 212 HB3 SER A 13 -1.073 -1.252 5.008 1.00 0.00 H ATOM 213 HG SER A 13 -2.793 -2.713 5.607 1.00 0.00 H ATOM 214 N PHE A 14 -0.418 -4.855 7.617 1.00 0.00 N ATOM 215 CA PHE A 14 -0.832 -5.656 8.802 1.00 0.00 C ATOM 216 C PHE A 14 0.318 -5.749 9.809 1.00 0.00 C ATOM 217 O PHE A 14 0.412 -6.688 10.574 1.00 0.00 O ATOM 218 CB PHE A 14 -1.165 -7.032 8.241 1.00 0.00 C ATOM 219 CG PHE A 14 -2.342 -7.614 8.988 1.00 0.00 C ATOM 220 CD1 PHE A 14 -2.152 -8.204 10.244 1.00 0.00 C ATOM 221 CD2 PHE A 14 -3.622 -7.563 8.425 1.00 0.00 C ATOM 222 CE1 PHE A 14 -3.243 -8.744 10.935 1.00 0.00 C ATOM 223 CE2 PHE A 14 -4.713 -8.103 9.116 1.00 0.00 C ATOM 224 CZ PHE A 14 -4.524 -8.693 10.372 1.00 0.00 C ATOM 225 H PHE A 14 0.162 -5.256 6.937 1.00 0.00 H ATOM 226 HA PHE A 14 -1.702 -5.231 9.262 1.00 0.00 H ATOM 227 HB2 PHE A 14 -1.408 -6.946 7.193 1.00 0.00 H ATOM 228 HB3 PHE A 14 -0.313 -7.673 8.360 1.00 0.00 H ATOM 229 HD1 PHE A 14 -1.164 -8.243 10.678 1.00 0.00 H ATOM 230 HD2 PHE A 14 -3.768 -7.109 7.456 1.00 0.00 H ATOM 231 HE1 PHE A 14 -3.097 -9.198 11.904 1.00 0.00 H ATOM 232 HE2 PHE A 14 -5.701 -8.063 8.682 1.00 0.00 H ATOM 233 HZ PHE A 14 -5.366 -9.108 10.906 1.00 0.00 H ATOM 234 N ARG A 15 1.195 -4.780 9.813 1.00 0.00 N ATOM 235 CA ARG A 15 2.334 -4.801 10.757 1.00 0.00 C ATOM 236 C ARG A 15 2.366 -3.491 11.543 1.00 0.00 C ATOM 237 O ARG A 15 1.418 -3.128 12.212 1.00 0.00 O ATOM 238 CB ARG A 15 3.564 -4.969 9.854 1.00 0.00 C ATOM 239 CG ARG A 15 4.750 -5.459 10.688 1.00 0.00 C ATOM 240 CD ARG A 15 4.818 -6.987 10.631 1.00 0.00 C ATOM 241 NE ARG A 15 5.331 -7.299 9.268 1.00 0.00 N ATOM 242 CZ ARG A 15 4.731 -8.196 8.535 1.00 0.00 C ATOM 243 NH1 ARG A 15 4.458 -9.371 9.033 1.00 0.00 N ATOM 244 NH2 ARG A 15 4.404 -7.919 7.302 1.00 0.00 N ATOM 245 H ARG A 15 1.107 -4.032 9.190 1.00 0.00 H ATOM 246 HA ARG A 15 2.267 -5.623 11.429 1.00 0.00 H ATOM 247 HB2 ARG A 15 3.344 -5.693 9.083 1.00 0.00 H ATOM 248 HB3 ARG A 15 3.812 -4.023 9.397 1.00 0.00 H ATOM 249 HG2 ARG A 15 5.665 -5.042 10.293 1.00 0.00 H ATOM 250 HG3 ARG A 15 4.624 -5.145 11.713 1.00 0.00 H ATOM 251 HD2 ARG A 15 5.497 -7.361 11.386 1.00 0.00 H ATOM 252 HD3 ARG A 15 3.836 -7.413 10.763 1.00 0.00 H ATOM 253 HE ARG A 15 6.118 -6.829 8.922 1.00 0.00 H ATOM 254 HH11 ARG A 15 4.709 -9.584 9.978 1.00 0.00 H ATOM 255 HH12 ARG A 15 3.999 -10.059 8.471 1.00 0.00 H ATOM 256 HH21 ARG A 15 4.613 -7.018 6.920 1.00 0.00 H ATOM 257 HH22 ARG A 15 3.945 -8.606 6.739 1.00 0.00 H ATOM 258 N GLY A 16 3.444 -2.793 11.464 1.00 0.00 N ATOM 259 CA GLY A 16 3.571 -1.500 12.196 1.00 0.00 C ATOM 260 C GLY A 16 3.711 -0.356 11.194 1.00 0.00 C ATOM 261 O GLY A 16 2.760 0.343 10.906 1.00 0.00 O ATOM 262 H GLY A 16 4.171 -3.124 10.919 1.00 0.00 H ATOM 263 HA2 GLY A 16 2.694 -1.342 12.807 1.00 0.00 H ATOM 264 HA3 GLY A 16 4.455 -1.522 12.822 1.00 0.00 H ATOM 265 N PRO A 17 4.913 -0.195 10.714 1.00 0.00 N ATOM 266 CA PRO A 17 5.243 0.868 9.758 1.00 0.00 C ATOM 267 C PRO A 17 5.263 0.323 8.326 1.00 0.00 C ATOM 268 O PRO A 17 6.297 -0.055 7.811 1.00 0.00 O ATOM 269 CB PRO A 17 6.644 1.266 10.225 1.00 0.00 C ATOM 270 CG PRO A 17 7.187 0.065 10.961 1.00 0.00 C ATOM 271 CD PRO A 17 6.104 -0.977 11.005 1.00 0.00 C ATOM 272 HA PRO A 17 4.568 1.701 9.852 1.00 0.00 H ATOM 273 HB2 PRO A 17 7.268 1.499 9.373 1.00 0.00 H ATOM 274 HB3 PRO A 17 6.594 2.107 10.892 1.00 0.00 H ATOM 275 HG2 PRO A 17 8.052 -0.316 10.449 1.00 0.00 H ATOM 276 HG3 PRO A 17 7.443 0.340 11.972 1.00 0.00 H ATOM 277 HD2 PRO A 17 6.269 -1.732 10.247 1.00 0.00 H ATOM 278 HD3 PRO A 17 6.038 -1.420 11.984 1.00 0.00 H ATOM 279 N GLY A 18 4.127 0.280 7.682 1.00 0.00 N ATOM 280 CA GLY A 18 4.078 -0.239 6.286 1.00 0.00 C ATOM 281 C GLY A 18 4.248 0.922 5.301 1.00 0.00 C ATOM 282 O GLY A 18 4.439 2.051 5.705 1.00 0.00 O ATOM 283 H GLY A 18 3.307 0.591 8.118 1.00 0.00 H ATOM 284 HA2 GLY A 18 4.875 -0.955 6.140 1.00 0.00 H ATOM 285 HA3 GLY A 18 3.127 -0.718 6.112 1.00 0.00 H ATOM 286 N PRO A 19 4.170 0.605 4.033 1.00 0.00 N ATOM 287 CA PRO A 19 4.315 1.620 2.980 1.00 0.00 C ATOM 288 C PRO A 19 2.964 2.252 2.633 1.00 0.00 C ATOM 289 O PRO A 19 1.920 1.671 2.857 1.00 0.00 O ATOM 290 CB PRO A 19 4.874 0.836 1.809 1.00 0.00 C ATOM 291 CG PRO A 19 4.491 -0.588 2.050 1.00 0.00 C ATOM 292 CD PRO A 19 3.944 -0.714 3.454 1.00 0.00 C ATOM 293 HA PRO A 19 5.025 2.358 3.275 1.00 0.00 H ATOM 294 HB2 PRO A 19 4.441 1.190 0.883 1.00 0.00 H ATOM 295 HB3 PRO A 19 5.948 0.927 1.778 1.00 0.00 H ATOM 296 HG2 PRO A 19 3.750 -0.902 1.330 1.00 0.00 H ATOM 297 HG3 PRO A 19 5.370 -1.188 1.963 1.00 0.00 H ATOM 298 HD2 PRO A 19 2.888 -0.944 3.429 1.00 0.00 H ATOM 299 HD3 PRO A 19 4.487 -1.463 4.009 1.00 0.00 H ATOM 300 N GLN A 20 2.977 3.441 2.086 1.00 0.00 N ATOM 301 CA GLN A 20 1.695 4.121 1.720 1.00 0.00 C ATOM 302 C GLN A 20 0.740 4.146 2.918 1.00 0.00 C ATOM 303 O GLN A 20 -0.461 4.037 2.768 1.00 0.00 O ATOM 304 CB GLN A 20 1.107 3.283 0.583 1.00 0.00 C ATOM 305 CG GLN A 20 1.581 3.842 -0.760 1.00 0.00 C ATOM 306 CD GLN A 20 0.681 5.009 -1.174 1.00 0.00 C ATOM 307 OE1 GLN A 20 -0.468 5.072 -0.786 1.00 0.00 O ATOM 308 NE2 GLN A 20 1.159 5.942 -1.951 1.00 0.00 N ATOM 309 H GLN A 20 3.832 3.889 1.915 1.00 0.00 H ATOM 310 HA GLN A 20 1.889 5.123 1.373 1.00 0.00 H ATOM 311 HB2 GLN A 20 1.436 2.256 0.682 1.00 0.00 H ATOM 312 HB3 GLN A 20 0.026 3.324 0.626 1.00 0.00 H ATOM 313 HG2 GLN A 20 2.600 4.188 -0.667 1.00 0.00 H ATOM 314 HG3 GLN A 20 1.529 3.068 -1.511 1.00 0.00 H ATOM 315 HE21 GLN A 20 2.087 5.891 -2.264 1.00 0.00 H ATOM 316 HE22 GLN A 20 0.592 6.693 -2.221 1.00 0.00 H ATOM 317 N LEU A 21 1.267 4.289 4.107 1.00 0.00 N ATOM 318 CA LEU A 21 0.395 4.323 5.322 1.00 0.00 C ATOM 319 C LEU A 21 -0.527 3.099 5.351 1.00 0.00 C ATOM 320 O LEU A 21 -1.599 3.205 5.924 1.00 0.00 O ATOM 321 CB LEU A 21 -0.423 5.609 5.194 1.00 0.00 C ATOM 322 CG LEU A 21 -0.958 6.013 6.569 1.00 0.00 C ATOM 323 CD1 LEU A 21 0.156 6.682 7.376 1.00 0.00 C ATOM 324 CD2 LEU A 21 -2.119 6.995 6.394 1.00 0.00 C ATOM 325 H LEU A 21 2.240 4.375 4.202 1.00 0.00 H ATOM 326 HA LEU A 21 0.998 4.359 6.215 1.00 0.00 H ATOM 327 HB2 LEU A 21 0.206 6.398 4.806 1.00 0.00 H ATOM 328 HB3 LEU A 21 -1.252 5.445 4.522 1.00 0.00 H ATOM 329 HG LEU A 21 -1.304 5.134 7.093 1.00 0.00 H ATOM 330 HD11 LEU A 21 0.234 7.720 7.090 1.00 0.00 H ATOM 331 HD12 LEU A 21 1.093 6.183 7.178 1.00 0.00 H ATOM 332 HD13 LEU A 21 -0.072 6.614 8.429 1.00 0.00 H ATOM 333 HD21 LEU A 21 -1.744 8.007 6.437 1.00 0.00 H ATOM 334 HD22 LEU A 21 -2.840 6.844 7.185 1.00 0.00 H ATOM 335 HD23 LEU A 21 -2.593 6.826 5.438 1.00 0.00 H HETATM 336 N NH2 A 22 -0.161 1.988 4.775 1.00 0.00 N HETATM 337 HN1 NH2 A 22 0.711 1.935 4.321 1.00 0.00 H HETATM 338 HN2 NH2 A 22 -0.757 1.205 4.795 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 5 ATOM 1 N SER A 1 -2.962 2.622 -8.619 1.00 0.00 N ATOM 2 CA SER A 1 -1.820 3.566 -8.448 1.00 0.00 C ATOM 3 C SER A 1 -0.803 2.994 -7.458 1.00 0.00 C ATOM 4 O SER A 1 -1.050 1.998 -6.808 1.00 0.00 O ATOM 5 CB SER A 1 -2.444 4.846 -7.896 1.00 0.00 C ATOM 6 OG SER A 1 -3.014 5.591 -8.965 1.00 0.00 O ATOM 7 H1 SER A 1 -3.362 2.390 -7.688 1.00 0.00 H ATOM 8 H2 SER A 1 -2.626 1.752 -9.079 1.00 0.00 H ATOM 9 H3 SER A 1 -3.695 3.066 -9.207 1.00 0.00 H ATOM 10 HA SER A 1 -1.351 3.766 -9.399 1.00 0.00 H ATOM 11 HB2 SER A 1 -3.216 4.596 -7.187 1.00 0.00 H ATOM 12 HB3 SER A 1 -1.681 5.433 -7.401 1.00 0.00 H ATOM 13 HG SER A 1 -2.350 6.209 -9.282 1.00 0.00 H ATOM 14 N SER A 2 0.339 3.618 -7.340 1.00 0.00 N ATOM 15 CA SER A 2 1.374 3.111 -6.393 1.00 0.00 C ATOM 16 C SER A 2 1.634 4.138 -5.286 1.00 0.00 C ATOM 17 O SER A 2 2.040 3.794 -4.194 1.00 0.00 O ATOM 18 CB SER A 2 2.627 2.913 -7.246 1.00 0.00 C ATOM 19 OG SER A 2 2.553 1.654 -7.902 1.00 0.00 O ATOM 20 H SER A 2 0.515 4.419 -7.876 1.00 0.00 H ATOM 21 HA SER A 2 1.066 2.169 -5.968 1.00 0.00 H ATOM 22 HB2 SER A 2 2.689 3.695 -7.983 1.00 0.00 H ATOM 23 HB3 SER A 2 3.502 2.950 -6.611 1.00 0.00 H ATOM 24 HG SER A 2 1.718 1.614 -8.374 1.00 0.00 H ATOM 25 N MET A 3 1.405 5.395 -5.561 1.00 0.00 N ATOM 26 CA MET A 3 1.641 6.442 -4.524 1.00 0.00 C ATOM 27 C MET A 3 0.696 7.628 -4.739 1.00 0.00 C ATOM 28 O MET A 3 1.124 8.759 -4.871 1.00 0.00 O ATOM 29 CB MET A 3 3.100 6.869 -4.715 1.00 0.00 C ATOM 30 CG MET A 3 3.295 7.430 -6.127 1.00 0.00 C ATOM 31 SD MET A 3 4.975 7.070 -6.694 1.00 0.00 S ATOM 32 CE MET A 3 4.567 6.771 -8.433 1.00 0.00 C ATOM 33 H MET A 3 1.079 5.651 -6.449 1.00 0.00 H ATOM 34 HA MET A 3 1.507 6.029 -3.537 1.00 0.00 H ATOM 35 HB2 MET A 3 3.349 7.628 -3.989 1.00 0.00 H ATOM 36 HB3 MET A 3 3.744 6.013 -4.578 1.00 0.00 H ATOM 37 HG2 MET A 3 2.583 6.973 -6.799 1.00 0.00 H ATOM 38 HG3 MET A 3 3.141 8.498 -6.114 1.00 0.00 H ATOM 39 HE1 MET A 3 5.155 7.429 -9.058 1.00 0.00 H ATOM 40 HE2 MET A 3 3.514 6.958 -8.592 1.00 0.00 H ATOM 41 HE3 MET A 3 4.789 5.746 -8.685 1.00 0.00 H ATOM 42 N LYS A 4 -0.585 7.379 -4.776 1.00 0.00 N ATOM 43 CA LYS A 4 -1.560 8.491 -4.982 1.00 0.00 C ATOM 44 C LYS A 4 -2.983 8.006 -4.692 1.00 0.00 C ATOM 45 O LYS A 4 -3.611 8.434 -3.742 1.00 0.00 O ATOM 46 CB LYS A 4 -1.412 8.881 -6.454 1.00 0.00 C ATOM 47 CG LYS A 4 -1.657 10.383 -6.610 1.00 0.00 C ATOM 48 CD LYS A 4 -1.859 10.716 -8.090 1.00 0.00 C ATOM 49 CE LYS A 4 -0.498 10.792 -8.786 1.00 0.00 C ATOM 50 NZ LYS A 4 -0.346 9.481 -9.476 1.00 0.00 N ATOM 51 H LYS A 4 -0.909 6.460 -4.668 1.00 0.00 H ATOM 52 HA LYS A 4 -1.311 9.330 -4.352 1.00 0.00 H ATOM 53 HB2 LYS A 4 -0.415 8.641 -6.790 1.00 0.00 H ATOM 54 HB3 LYS A 4 -2.133 8.338 -7.046 1.00 0.00 H ATOM 55 HG2 LYS A 4 -2.539 10.664 -6.053 1.00 0.00 H ATOM 56 HG3 LYS A 4 -0.805 10.928 -6.233 1.00 0.00 H ATOM 57 HD2 LYS A 4 -2.458 9.946 -8.552 1.00 0.00 H ATOM 58 HD3 LYS A 4 -2.361 11.667 -8.179 1.00 0.00 H ATOM 59 HE2 LYS A 4 -0.489 11.602 -9.504 1.00 0.00 H ATOM 60 HE3 LYS A 4 0.291 10.923 -8.063 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -0.424 8.712 -8.782 1.00 0.00 H ATOM 62 HZ2 LYS A 4 0.586 9.437 -9.936 1.00 0.00 H ATOM 63 HZ3 LYS A 4 -1.093 9.379 -10.195 1.00 0.00 H ATOM 64 N LEU A 5 -3.497 7.119 -5.501 1.00 0.00 N ATOM 65 CA LEU A 5 -4.875 6.609 -5.275 1.00 0.00 C ATOM 66 C LEU A 5 -4.850 5.456 -4.266 1.00 0.00 C ATOM 67 O LEU A 5 -3.887 5.270 -3.548 1.00 0.00 O ATOM 68 CB LEU A 5 -5.350 6.121 -6.646 1.00 0.00 C ATOM 69 CG LEU A 5 -6.420 7.072 -7.187 1.00 0.00 C ATOM 70 CD1 LEU A 5 -6.212 7.277 -8.690 1.00 0.00 C ATOM 71 CD2 LEU A 5 -7.807 6.472 -6.945 1.00 0.00 C ATOM 72 H LEU A 5 -2.978 6.790 -6.258 1.00 0.00 H ATOM 73 HA LEU A 5 -5.509 7.401 -4.926 1.00 0.00 H ATOM 74 HB2 LEU A 5 -4.512 6.095 -7.328 1.00 0.00 H ATOM 75 HB3 LEU A 5 -5.768 5.129 -6.551 1.00 0.00 H ATOM 76 HG LEU A 5 -6.344 8.025 -6.682 1.00 0.00 H ATOM 77 HD11 LEU A 5 -7.143 7.578 -9.145 1.00 0.00 H ATOM 78 HD12 LEU A 5 -5.875 6.353 -9.135 1.00 0.00 H ATOM 79 HD13 LEU A 5 -5.468 8.044 -8.848 1.00 0.00 H ATOM 80 HD21 LEU A 5 -7.831 6.004 -5.973 1.00 0.00 H ATOM 81 HD22 LEU A 5 -8.018 5.734 -7.705 1.00 0.00 H ATOM 82 HD23 LEU A 5 -8.550 7.255 -6.986 1.00 0.00 H ATOM 83 N SER A 6 -5.902 4.683 -4.207 1.00 0.00 N ATOM 84 CA SER A 6 -5.938 3.545 -3.244 1.00 0.00 C ATOM 85 C SER A 6 -6.424 2.271 -3.943 1.00 0.00 C ATOM 86 O SER A 6 -6.984 1.390 -3.323 1.00 0.00 O ATOM 87 CB SER A 6 -6.929 3.973 -2.163 1.00 0.00 C ATOM 88 OG SER A 6 -6.478 3.502 -0.899 1.00 0.00 O ATOM 89 H SER A 6 -6.668 4.853 -4.795 1.00 0.00 H ATOM 90 HA SER A 6 -4.964 3.388 -2.809 1.00 0.00 H ATOM 91 HB2 SER A 6 -6.995 5.048 -2.137 1.00 0.00 H ATOM 92 HB3 SER A 6 -7.905 3.560 -2.386 1.00 0.00 H ATOM 93 HG SER A 6 -6.847 4.072 -0.221 1.00 0.00 H ATOM 94 N PHE A 7 -6.213 2.169 -5.228 1.00 0.00 N ATOM 95 CA PHE A 7 -6.662 0.953 -5.967 1.00 0.00 C ATOM 96 C PHE A 7 -6.007 -0.299 -5.378 1.00 0.00 C ATOM 97 O PHE A 7 -6.678 -1.231 -4.975 1.00 0.00 O ATOM 98 CB PHE A 7 -6.201 1.170 -7.409 1.00 0.00 C ATOM 99 CG PHE A 7 -7.364 1.647 -8.247 1.00 0.00 C ATOM 100 CD1 PHE A 7 -8.394 0.760 -8.583 1.00 0.00 C ATOM 101 CD2 PHE A 7 -7.413 2.975 -8.686 1.00 0.00 C ATOM 102 CE1 PHE A 7 -9.473 1.202 -9.360 1.00 0.00 C ATOM 103 CE2 PHE A 7 -8.491 3.416 -9.462 1.00 0.00 C ATOM 104 CZ PHE A 7 -9.520 2.530 -9.800 1.00 0.00 C ATOM 105 H PHE A 7 -5.759 2.892 -5.707 1.00 0.00 H ATOM 106 HA PHE A 7 -7.736 0.870 -5.931 1.00 0.00 H ATOM 107 HB2 PHE A 7 -5.416 1.912 -7.428 1.00 0.00 H ATOM 108 HB3 PHE A 7 -5.827 0.241 -7.811 1.00 0.00 H ATOM 109 HD1 PHE A 7 -8.357 -0.265 -8.244 1.00 0.00 H ATOM 110 HD2 PHE A 7 -6.618 3.659 -8.427 1.00 0.00 H ATOM 111 HE1 PHE A 7 -10.267 0.518 -9.619 1.00 0.00 H ATOM 112 HE2 PHE A 7 -8.528 4.441 -9.801 1.00 0.00 H ATOM 113 HZ PHE A 7 -10.353 2.871 -10.398 1.00 0.00 H ATOM 114 N ARG A 8 -4.703 -0.328 -5.325 1.00 0.00 N ATOM 115 CA ARG A 8 -4.000 -1.519 -4.763 1.00 0.00 C ATOM 116 C ARG A 8 -3.964 -1.436 -3.236 1.00 0.00 C ATOM 117 O ARG A 8 -4.112 -2.424 -2.543 1.00 0.00 O ATOM 118 CB ARG A 8 -2.585 -1.451 -5.348 1.00 0.00 C ATOM 119 CG ARG A 8 -1.684 -2.476 -4.653 1.00 0.00 C ATOM 120 CD ARG A 8 -0.325 -2.522 -5.356 1.00 0.00 C ATOM 121 NE ARG A 8 0.497 -1.481 -4.678 1.00 0.00 N ATOM 122 CZ ARG A 8 1.777 -1.401 -4.923 1.00 0.00 C ATOM 123 NH1 ARG A 8 2.218 -1.525 -6.145 1.00 0.00 N ATOM 124 NH2 ARG A 8 2.616 -1.194 -3.944 1.00 0.00 N ATOM 125 H ARG A 8 -4.184 0.435 -5.655 1.00 0.00 H ATOM 126 HA ARG A 8 -4.486 -2.422 -5.076 1.00 0.00 H ATOM 127 HB2 ARG A 8 -2.625 -1.666 -6.406 1.00 0.00 H ATOM 128 HB3 ARG A 8 -2.181 -0.461 -5.198 1.00 0.00 H ATOM 129 HG2 ARG A 8 -1.548 -2.188 -3.620 1.00 0.00 H ATOM 130 HG3 ARG A 8 -2.146 -3.450 -4.698 1.00 0.00 H ATOM 131 HD2 ARG A 8 0.124 -3.498 -5.236 1.00 0.00 H ATOM 132 HD3 ARG A 8 -0.435 -2.283 -6.402 1.00 0.00 H ATOM 133 HE ARG A 8 0.078 -0.856 -4.050 1.00 0.00 H ATOM 134 HH11 ARG A 8 1.575 -1.682 -6.895 1.00 0.00 H ATOM 135 HH12 ARG A 8 3.199 -1.463 -6.332 1.00 0.00 H ATOM 136 HH21 ARG A 8 2.279 -1.098 -3.008 1.00 0.00 H ATOM 137 HH22 ARG A 8 3.597 -1.132 -4.132 1.00 0.00 H ATOM 138 N ALA A 9 -3.765 -0.262 -2.715 1.00 0.00 N ATOM 139 CA ALA A 9 -3.711 -0.090 -1.235 1.00 0.00 C ATOM 140 C ALA A 9 -5.090 -0.318 -0.607 1.00 0.00 C ATOM 141 O ALA A 9 -5.225 -0.382 0.601 1.00 0.00 O ATOM 142 CB ALA A 9 -3.262 1.354 -1.020 1.00 0.00 C ATOM 143 H ALA A 9 -3.645 0.507 -3.301 1.00 0.00 H ATOM 144 HA ALA A 9 -2.988 -0.763 -0.811 1.00 0.00 H ATOM 145 HB1 ALA A 9 -3.629 1.968 -1.829 1.00 0.00 H ATOM 146 HB2 ALA A 9 -2.183 1.396 -0.997 1.00 0.00 H ATOM 147 HB3 ALA A 9 -3.658 1.717 -0.083 1.00 0.00 H ATOM 148 N ARG A 10 -6.116 -0.446 -1.408 1.00 0.00 N ATOM 149 CA ARG A 10 -7.477 -0.672 -0.848 1.00 0.00 C ATOM 150 C ARG A 10 -7.549 -2.046 -0.164 1.00 0.00 C ATOM 151 O ARG A 10 -8.506 -2.355 0.518 1.00 0.00 O ATOM 152 CB ARG A 10 -8.415 -0.558 -2.057 1.00 0.00 C ATOM 153 CG ARG A 10 -9.666 -1.415 -1.862 1.00 0.00 C ATOM 154 CD ARG A 10 -9.315 -2.857 -2.199 1.00 0.00 C ATOM 155 NE ARG A 10 -10.048 -3.680 -1.198 1.00 0.00 N ATOM 156 CZ ARG A 10 -11.185 -4.235 -1.516 1.00 0.00 C ATOM 157 NH1 ARG A 10 -12.102 -3.537 -2.128 1.00 0.00 N ATOM 158 NH2 ARG A 10 -11.406 -5.486 -1.219 1.00 0.00 N ATOM 159 H ARG A 10 -5.993 -0.396 -2.375 1.00 0.00 H ATOM 160 HA ARG A 10 -7.713 0.088 -0.151 1.00 0.00 H ATOM 161 HB2 ARG A 10 -8.707 0.474 -2.184 1.00 0.00 H ATOM 162 HB3 ARG A 10 -7.890 -0.887 -2.935 1.00 0.00 H ATOM 163 HG2 ARG A 10 -9.994 -1.350 -0.834 1.00 0.00 H ATOM 164 HG3 ARG A 10 -10.450 -1.070 -2.518 1.00 0.00 H ATOM 165 HD2 ARG A 10 -9.637 -3.099 -3.204 1.00 0.00 H ATOM 166 HD3 ARG A 10 -8.250 -3.000 -2.094 1.00 0.00 H ATOM 167 HE ARG A 10 -9.675 -3.805 -0.300 1.00 0.00 H ATOM 168 HH11 ARG A 10 -11.933 -2.578 -2.355 1.00 0.00 H ATOM 169 HH12 ARG A 10 -12.974 -3.962 -2.371 1.00 0.00 H ATOM 170 HH21 ARG A 10 -10.703 -6.021 -0.750 1.00 0.00 H ATOM 171 HH22 ARG A 10 -12.278 -5.912 -1.463 1.00 0.00 H ATOM 172 N ALA A 11 -6.545 -2.868 -0.337 1.00 0.00 N ATOM 173 CA ALA A 11 -6.559 -4.208 0.305 1.00 0.00 C ATOM 174 C ALA A 11 -5.153 -4.593 0.762 1.00 0.00 C ATOM 175 O ALA A 11 -4.691 -5.690 0.521 1.00 0.00 O ATOM 176 CB ALA A 11 -7.056 -5.167 -0.778 1.00 0.00 C ATOM 177 H ALA A 11 -5.786 -2.605 -0.884 1.00 0.00 H ATOM 178 HA ALA A 11 -7.231 -4.210 1.135 1.00 0.00 H ATOM 179 HB1 ALA A 11 -8.075 -4.920 -1.038 1.00 0.00 H ATOM 180 HB2 ALA A 11 -7.014 -6.181 -0.408 1.00 0.00 H ATOM 181 HB3 ALA A 11 -6.430 -5.077 -1.653 1.00 0.00 H ATOM 182 N TYR A 12 -4.465 -3.692 1.410 1.00 0.00 N ATOM 183 CA TYR A 12 -3.099 -3.988 1.869 1.00 0.00 C ATOM 184 C TYR A 12 -3.022 -3.924 3.398 1.00 0.00 C ATOM 185 O TYR A 12 -2.135 -3.310 3.958 1.00 0.00 O ATOM 186 CB TYR A 12 -2.265 -2.888 1.232 1.00 0.00 C ATOM 187 CG TYR A 12 -1.165 -3.505 0.408 1.00 0.00 C ATOM 188 CD1 TYR A 12 -1.485 -4.458 -0.566 1.00 0.00 C ATOM 189 CD2 TYR A 12 0.168 -3.131 0.612 1.00 0.00 C ATOM 190 CE1 TYR A 12 -0.472 -5.037 -1.338 1.00 0.00 C ATOM 191 CE2 TYR A 12 1.182 -3.710 -0.160 1.00 0.00 C ATOM 192 CZ TYR A 12 0.863 -4.663 -1.135 1.00 0.00 C ATOM 193 OH TYR A 12 1.863 -5.234 -1.895 1.00 0.00 O ATOM 194 H TYR A 12 -4.839 -2.815 1.585 1.00 0.00 H ATOM 195 HA TYR A 12 -2.784 -4.944 1.511 1.00 0.00 H ATOM 196 HB2 TYR A 12 -2.896 -2.284 0.594 1.00 0.00 H ATOM 197 HB3 TYR A 12 -1.850 -2.275 2.001 1.00 0.00 H ATOM 198 HD1 TYR A 12 -2.519 -4.745 -0.720 1.00 0.00 H ATOM 199 HD2 TYR A 12 0.413 -2.395 1.364 1.00 0.00 H ATOM 200 HE1 TYR A 12 -0.719 -5.772 -2.091 1.00 0.00 H ATOM 201 HE2 TYR A 12 2.211 -3.421 -0.003 1.00 0.00 H ATOM 202 HH TYR A 12 1.567 -5.251 -2.809 1.00 0.00 H ATOM 203 N SER A 13 -3.945 -4.553 4.074 1.00 0.00 N ATOM 204 CA SER A 13 -3.929 -4.530 5.566 1.00 0.00 C ATOM 205 C SER A 13 -3.340 -5.834 6.109 1.00 0.00 C ATOM 206 O SER A 13 -3.923 -6.485 6.955 1.00 0.00 O ATOM 207 CB SER A 13 -5.394 -4.391 5.975 1.00 0.00 C ATOM 208 OG SER A 13 -6.096 -5.573 5.613 1.00 0.00 O ATOM 209 H SER A 13 -4.651 -5.042 3.600 1.00 0.00 H ATOM 210 HA SER A 13 -3.364 -3.683 5.924 1.00 0.00 H ATOM 211 HB2 SER A 13 -5.461 -4.251 7.041 1.00 0.00 H ATOM 212 HB3 SER A 13 -5.827 -3.536 5.474 1.00 0.00 H ATOM 213 HG SER A 13 -7.033 -5.416 5.751 1.00 0.00 H ATOM 214 N PHE A 14 -2.187 -6.221 5.631 1.00 0.00 N ATOM 215 CA PHE A 14 -1.559 -7.482 6.117 1.00 0.00 C ATOM 216 C PHE A 14 -0.617 -7.193 7.291 1.00 0.00 C ATOM 217 O PHE A 14 -0.277 -8.075 8.053 1.00 0.00 O ATOM 218 CB PHE A 14 -0.778 -8.013 4.921 1.00 0.00 C ATOM 219 CG PHE A 14 -0.863 -9.520 4.891 1.00 0.00 C ATOM 220 CD1 PHE A 14 -0.092 -10.282 5.776 1.00 0.00 C ATOM 221 CD2 PHE A 14 -1.715 -10.154 3.979 1.00 0.00 C ATOM 222 CE1 PHE A 14 -0.172 -11.681 5.748 1.00 0.00 C ATOM 223 CE2 PHE A 14 -1.795 -11.552 3.952 1.00 0.00 C ATOM 224 CZ PHE A 14 -1.024 -12.315 4.836 1.00 0.00 C ATOM 225 H PHE A 14 -1.734 -5.681 4.950 1.00 0.00 H ATOM 226 HA PHE A 14 -2.309 -8.192 6.404 1.00 0.00 H ATOM 227 HB2 PHE A 14 -1.193 -7.608 4.010 1.00 0.00 H ATOM 228 HB3 PHE A 14 0.248 -7.714 5.013 1.00 0.00 H ATOM 229 HD1 PHE A 14 0.566 -9.794 6.480 1.00 0.00 H ATOM 230 HD2 PHE A 14 -2.310 -9.565 3.296 1.00 0.00 H ATOM 231 HE1 PHE A 14 0.423 -12.269 6.431 1.00 0.00 H ATOM 232 HE2 PHE A 14 -2.452 -12.042 3.248 1.00 0.00 H ATOM 233 HZ PHE A 14 -1.086 -13.393 4.816 1.00 0.00 H ATOM 234 N ARG A 15 -0.188 -5.964 7.436 1.00 0.00 N ATOM 235 CA ARG A 15 0.737 -5.607 8.550 1.00 0.00 C ATOM 236 C ARG A 15 2.066 -6.334 8.384 1.00 0.00 C ATOM 237 O ARG A 15 2.198 -7.505 8.683 1.00 0.00 O ATOM 238 CB ARG A 15 0.045 -6.038 9.842 1.00 0.00 C ATOM 239 CG ARG A 15 0.699 -5.304 11.013 1.00 0.00 C ATOM 240 CD ARG A 15 1.774 -6.195 11.637 1.00 0.00 C ATOM 241 NE ARG A 15 2.112 -5.540 12.931 1.00 0.00 N ATOM 242 CZ ARG A 15 3.221 -4.862 13.049 1.00 0.00 C ATOM 243 NH1 ARG A 15 3.580 -4.032 12.108 1.00 0.00 N ATOM 244 NH2 ARG A 15 3.969 -5.014 14.107 1.00 0.00 N ATOM 245 H ARG A 15 -0.465 -5.272 6.805 1.00 0.00 H ATOM 246 HA ARG A 15 0.903 -4.542 8.567 1.00 0.00 H ATOM 247 HB2 ARG A 15 -1.005 -5.785 9.792 1.00 0.00 H ATOM 248 HB3 ARG A 15 0.157 -7.103 9.978 1.00 0.00 H ATOM 249 HG2 ARG A 15 1.154 -4.391 10.651 1.00 0.00 H ATOM 250 HG3 ARG A 15 -0.047 -5.067 11.753 1.00 0.00 H ATOM 251 HD2 ARG A 15 1.384 -7.190 11.804 1.00 0.00 H ATOM 252 HD3 ARG A 15 2.644 -6.231 11.000 1.00 0.00 H ATOM 253 HE ARG A 15 1.503 -5.620 13.694 1.00 0.00 H ATOM 254 HH11 ARG A 15 3.007 -3.915 11.298 1.00 0.00 H ATOM 255 HH12 ARG A 15 4.429 -3.511 12.198 1.00 0.00 H ATOM 256 HH21 ARG A 15 3.693 -5.650 14.827 1.00 0.00 H ATOM 257 HH22 ARG A 15 4.819 -4.494 14.196 1.00 0.00 H ATOM 258 N GLY A 16 3.048 -5.633 7.905 1.00 0.00 N ATOM 259 CA GLY A 16 4.391 -6.250 7.705 1.00 0.00 C ATOM 260 C GLY A 16 5.476 -5.244 8.079 1.00 0.00 C ATOM 261 O GLY A 16 6.038 -5.299 9.155 1.00 0.00 O ATOM 262 H GLY A 16 2.898 -4.691 7.677 1.00 0.00 H ATOM 263 HA2 GLY A 16 4.482 -7.130 8.324 1.00 0.00 H ATOM 264 HA3 GLY A 16 4.514 -6.522 6.662 1.00 0.00 H ATOM 265 N PRO A 17 5.746 -4.364 7.154 1.00 0.00 N ATOM 266 CA PRO A 17 6.776 -3.333 7.325 1.00 0.00 C ATOM 267 C PRO A 17 6.142 -2.000 7.733 1.00 0.00 C ATOM 268 O PRO A 17 4.969 -1.768 7.516 1.00 0.00 O ATOM 269 CB PRO A 17 7.369 -3.264 5.918 1.00 0.00 C ATOM 270 CG PRO A 17 6.292 -3.781 4.994 1.00 0.00 C ATOM 271 CD PRO A 17 5.133 -4.228 5.843 1.00 0.00 C ATOM 272 HA PRO A 17 7.527 -3.644 8.032 1.00 0.00 H ATOM 273 HB2 PRO A 17 7.618 -2.241 5.668 1.00 0.00 H ATOM 274 HB3 PRO A 17 8.240 -3.889 5.844 1.00 0.00 H ATOM 275 HG2 PRO A 17 5.985 -3.003 4.319 1.00 0.00 H ATOM 276 HG3 PRO A 17 6.662 -4.631 4.441 1.00 0.00 H ATOM 277 HD2 PRO A 17 4.356 -3.474 5.853 1.00 0.00 H ATOM 278 HD3 PRO A 17 4.751 -5.174 5.501 1.00 0.00 H ATOM 279 N GLY A 18 6.909 -1.122 8.324 1.00 0.00 N ATOM 280 CA GLY A 18 6.351 0.194 8.746 1.00 0.00 C ATOM 281 C GLY A 18 6.204 1.105 7.522 1.00 0.00 C ATOM 282 O GLY A 18 7.000 1.035 6.606 1.00 0.00 O ATOM 283 H GLY A 18 7.851 -1.330 8.490 1.00 0.00 H ATOM 284 HA2 GLY A 18 5.385 0.042 9.205 1.00 0.00 H ATOM 285 HA3 GLY A 18 7.018 0.657 9.457 1.00 0.00 H ATOM 286 N PRO A 19 5.190 1.937 7.542 1.00 0.00 N ATOM 287 CA PRO A 19 4.945 2.863 6.427 1.00 0.00 C ATOM 288 C PRO A 19 5.710 4.175 6.619 1.00 0.00 C ATOM 289 O PRO A 19 5.125 5.237 6.710 1.00 0.00 O ATOM 290 CB PRO A 19 3.446 3.087 6.473 1.00 0.00 C ATOM 291 CG PRO A 19 3.030 2.773 7.872 1.00 0.00 C ATOM 292 CD PRO A 19 4.183 2.102 8.585 1.00 0.00 C ATOM 293 HA PRO A 19 5.197 2.398 5.502 1.00 0.00 H ATOM 294 HB2 PRO A 19 3.217 4.117 6.237 1.00 0.00 H ATOM 295 HB3 PRO A 19 2.948 2.425 5.784 1.00 0.00 H ATOM 296 HG2 PRO A 19 2.745 3.676 8.390 1.00 0.00 H ATOM 297 HG3 PRO A 19 2.207 2.095 7.829 1.00 0.00 H ATOM 298 HD2 PRO A 19 4.555 2.734 9.381 1.00 0.00 H ATOM 299 HD3 PRO A 19 3.881 1.141 8.970 1.00 0.00 H ATOM 300 N GLN A 20 7.014 4.110 6.682 1.00 0.00 N ATOM 301 CA GLN A 20 7.820 5.353 6.870 1.00 0.00 C ATOM 302 C GLN A 20 7.522 6.354 5.748 1.00 0.00 C ATOM 303 O GLN A 20 6.818 7.325 5.944 1.00 0.00 O ATOM 304 CB GLN A 20 9.278 4.894 6.809 1.00 0.00 C ATOM 305 CG GLN A 20 9.806 4.673 8.229 1.00 0.00 C ATOM 306 CD GLN A 20 10.668 5.866 8.649 1.00 0.00 C ATOM 307 OE1 GLN A 20 11.866 5.738 8.809 1.00 0.00 O ATOM 308 NE2 GLN A 20 10.106 7.029 8.833 1.00 0.00 N ATOM 309 H GLN A 20 7.463 3.243 6.608 1.00 0.00 H ATOM 310 HA GLN A 20 7.611 5.791 7.832 1.00 0.00 H ATOM 311 HB2 GLN A 20 9.341 3.967 6.254 1.00 0.00 H ATOM 312 HB3 GLN A 20 9.874 5.653 6.319 1.00 0.00 H ATOM 313 HG2 GLN A 20 8.974 4.572 8.912 1.00 0.00 H ATOM 314 HG3 GLN A 20 10.404 3.775 8.255 1.00 0.00 H ATOM 315 HE21 GLN A 20 9.141 7.133 8.704 1.00 0.00 H ATOM 316 HE22 GLN A 20 10.651 7.799 9.101 1.00 0.00 H ATOM 317 N LEU A 21 8.053 6.122 4.575 1.00 0.00 N ATOM 318 CA LEU A 21 7.804 7.057 3.433 1.00 0.00 C ATOM 319 C LEU A 21 8.118 8.500 3.842 1.00 0.00 C ATOM 320 O LEU A 21 9.000 8.684 4.664 1.00 0.00 O ATOM 321 CB LEU A 21 6.316 6.902 3.107 1.00 0.00 C ATOM 322 CG LEU A 21 6.058 5.501 2.556 1.00 0.00 C ATOM 323 CD1 LEU A 21 4.556 5.210 2.580 1.00 0.00 C ATOM 324 CD2 LEU A 21 6.569 5.418 1.115 1.00 0.00 C ATOM 325 H LEU A 21 8.616 5.331 4.442 1.00 0.00 H ATOM 326 HA LEU A 21 8.397 6.772 2.580 1.00 0.00 H ATOM 327 HB2 LEU A 21 5.735 7.050 4.006 1.00 0.00 H ATOM 328 HB3 LEU A 21 6.032 7.636 2.369 1.00 0.00 H ATOM 329 HG LEU A 21 6.575 4.772 3.165 1.00 0.00 H ATOM 330 HD11 LEU A 21 4.363 4.266 2.094 1.00 0.00 H ATOM 331 HD12 LEU A 21 4.030 5.997 2.060 1.00 0.00 H ATOM 332 HD13 LEU A 21 4.215 5.165 3.604 1.00 0.00 H ATOM 333 HD21 LEU A 21 7.389 6.108 0.984 1.00 0.00 H ATOM 334 HD22 LEU A 21 5.771 5.676 0.435 1.00 0.00 H ATOM 335 HD23 LEU A 21 6.907 4.413 0.910 1.00 0.00 H HETATM 336 N NH2 A 22 7.451 9.489 3.315 1.00 0.00 N HETATM 337 HN1 NH2 A 22 6.745 9.305 2.654 1.00 0.00 H HETATM 338 HN2 NH2 A 22 7.655 10.415 3.579 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 6 ATOM 1 N SER A 1 -12.185 12.745 -13.026 1.00 0.00 N ATOM 2 CA SER A 1 -11.187 12.704 -11.918 1.00 0.00 C ATOM 3 C SER A 1 -10.053 11.735 -12.263 1.00 0.00 C ATOM 4 O SER A 1 -10.032 11.142 -13.325 1.00 0.00 O ATOM 5 CB SER A 1 -11.965 12.207 -10.701 1.00 0.00 C ATOM 6 OG SER A 1 -13.040 13.099 -10.435 1.00 0.00 O ATOM 7 H1 SER A 1 -11.696 12.914 -13.928 1.00 0.00 H ATOM 8 H2 SER A 1 -12.866 13.511 -12.850 1.00 0.00 H ATOM 9 H3 SER A 1 -12.688 11.836 -13.072 1.00 0.00 H ATOM 10 HA SER A 1 -10.796 13.691 -11.727 1.00 0.00 H ATOM 11 HB2 SER A 1 -12.362 11.226 -10.901 1.00 0.00 H ATOM 12 HB3 SER A 1 -11.304 12.159 -9.846 1.00 0.00 H ATOM 13 HG SER A 1 -13.415 12.866 -9.582 1.00 0.00 H ATOM 14 N SER A 2 -9.109 11.571 -11.375 1.00 0.00 N ATOM 15 CA SER A 2 -7.975 10.640 -11.652 1.00 0.00 C ATOM 16 C SER A 2 -7.634 9.834 -10.396 1.00 0.00 C ATOM 17 O SER A 2 -6.482 9.690 -10.034 1.00 0.00 O ATOM 18 CB SER A 2 -6.807 11.545 -12.040 1.00 0.00 C ATOM 19 OG SER A 2 -7.258 12.518 -12.974 1.00 0.00 O ATOM 20 H SER A 2 -9.145 12.059 -10.526 1.00 0.00 H ATOM 21 HA SER A 2 -8.219 9.980 -12.469 1.00 0.00 H ATOM 22 HB2 SER A 2 -6.428 12.043 -11.165 1.00 0.00 H ATOM 23 HB3 SER A 2 -6.020 10.947 -12.481 1.00 0.00 H ATOM 24 HG SER A 2 -7.517 13.302 -12.484 1.00 0.00 H ATOM 25 N MET A 3 -8.626 9.309 -9.728 1.00 0.00 N ATOM 26 CA MET A 3 -8.361 8.512 -8.495 1.00 0.00 C ATOM 27 C MET A 3 -8.017 7.066 -8.866 1.00 0.00 C ATOM 28 O MET A 3 -8.862 6.192 -8.842 1.00 0.00 O ATOM 29 CB MET A 3 -9.666 8.564 -7.697 1.00 0.00 C ATOM 30 CG MET A 3 -10.005 10.021 -7.363 1.00 0.00 C ATOM 31 SD MET A 3 -10.608 10.130 -5.660 1.00 0.00 S ATOM 32 CE MET A 3 -10.179 11.865 -5.379 1.00 0.00 C ATOM 33 H MET A 3 -9.548 9.438 -10.039 1.00 0.00 H ATOM 34 HA MET A 3 -7.561 8.955 -7.925 1.00 0.00 H ATOM 35 HB2 MET A 3 -10.463 8.134 -8.285 1.00 0.00 H ATOM 36 HB3 MET A 3 -9.549 8.003 -6.783 1.00 0.00 H ATOM 37 HG2 MET A 3 -9.120 10.630 -7.470 1.00 0.00 H ATOM 38 HG3 MET A 3 -10.770 10.375 -8.038 1.00 0.00 H ATOM 39 HE1 MET A 3 -9.869 11.997 -4.350 1.00 0.00 H ATOM 40 HE2 MET A 3 -11.041 12.485 -5.584 1.00 0.00 H ATOM 41 HE3 MET A 3 -9.372 12.147 -6.034 1.00 0.00 H ATOM 42 N LYS A 4 -6.783 6.810 -9.207 1.00 0.00 N ATOM 43 CA LYS A 4 -6.381 5.422 -9.580 1.00 0.00 C ATOM 44 C LYS A 4 -6.334 4.532 -8.335 1.00 0.00 C ATOM 45 O LYS A 4 -5.961 4.968 -7.263 1.00 0.00 O ATOM 46 CB LYS A 4 -4.985 5.562 -10.190 1.00 0.00 C ATOM 47 CG LYS A 4 -4.735 4.412 -11.171 1.00 0.00 C ATOM 48 CD LYS A 4 -4.667 4.958 -12.599 1.00 0.00 C ATOM 49 CE LYS A 4 -6.085 5.190 -13.128 1.00 0.00 C ATOM 50 NZ LYS A 4 -6.286 6.664 -13.061 1.00 0.00 N ATOM 51 H LYS A 4 -6.119 7.532 -9.218 1.00 0.00 H ATOM 52 HA LYS A 4 -7.063 5.015 -10.309 1.00 0.00 H ATOM 53 HB2 LYS A 4 -4.915 6.506 -10.713 1.00 0.00 H ATOM 54 HB3 LYS A 4 -4.245 5.530 -9.405 1.00 0.00 H ATOM 55 HG2 LYS A 4 -3.799 3.929 -10.926 1.00 0.00 H ATOM 56 HG3 LYS A 4 -5.538 3.695 -11.100 1.00 0.00 H ATOM 57 HD2 LYS A 4 -4.124 5.893 -12.600 1.00 0.00 H ATOM 58 HD3 LYS A 4 -4.160 4.247 -13.233 1.00 0.00 H ATOM 59 HE2 LYS A 4 -6.165 4.842 -14.148 1.00 0.00 H ATOM 60 HE3 LYS A 4 -6.808 4.690 -12.501 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -7.142 6.921 -13.591 1.00 0.00 H ATOM 62 HZ2 LYS A 4 -5.465 7.146 -13.480 1.00 0.00 H ATOM 63 HZ3 LYS A 4 -6.391 6.955 -12.068 1.00 0.00 H ATOM 64 N LEU A 5 -6.709 3.287 -8.469 1.00 0.00 N ATOM 65 CA LEU A 5 -6.687 2.365 -7.296 1.00 0.00 C ATOM 66 C LEU A 5 -5.278 2.303 -6.698 1.00 0.00 C ATOM 67 O LEU A 5 -4.322 2.763 -7.290 1.00 0.00 O ATOM 68 CB LEU A 5 -7.094 1.000 -7.853 1.00 0.00 C ATOM 69 CG LEU A 5 -8.562 0.718 -7.512 1.00 0.00 C ATOM 70 CD1 LEU A 5 -9.350 0.470 -8.800 1.00 0.00 C ATOM 71 CD2 LEU A 5 -8.650 -0.523 -6.618 1.00 0.00 C ATOM 72 H LEU A 5 -7.006 2.959 -9.342 1.00 0.00 H ATOM 73 HA LEU A 5 -7.398 2.687 -6.553 1.00 0.00 H ATOM 74 HB2 LEU A 5 -6.965 0.999 -8.927 1.00 0.00 H ATOM 75 HB3 LEU A 5 -6.470 0.233 -7.417 1.00 0.00 H ATOM 76 HG LEU A 5 -8.982 1.567 -6.993 1.00 0.00 H ATOM 77 HD11 LEU A 5 -8.932 1.065 -9.598 1.00 0.00 H ATOM 78 HD12 LEU A 5 -10.383 0.746 -8.648 1.00 0.00 H ATOM 79 HD13 LEU A 5 -9.292 -0.576 -9.062 1.00 0.00 H ATOM 80 HD21 LEU A 5 -9.637 -0.952 -6.695 1.00 0.00 H ATOM 81 HD22 LEU A 5 -8.457 -0.242 -5.593 1.00 0.00 H ATOM 82 HD23 LEU A 5 -7.916 -1.248 -6.936 1.00 0.00 H ATOM 83 N SER A 6 -5.144 1.735 -5.529 1.00 0.00 N ATOM 84 CA SER A 6 -3.797 1.643 -4.894 1.00 0.00 C ATOM 85 C SER A 6 -3.574 0.241 -4.316 1.00 0.00 C ATOM 86 O SER A 6 -2.776 0.051 -3.420 1.00 0.00 O ATOM 87 CB SER A 6 -3.814 2.686 -3.777 1.00 0.00 C ATOM 88 OG SER A 6 -2.545 3.324 -3.710 1.00 0.00 O ATOM 89 H SER A 6 -5.928 1.371 -5.068 1.00 0.00 H ATOM 90 HA SER A 6 -3.026 1.883 -5.608 1.00 0.00 H ATOM 91 HB2 SER A 6 -4.572 3.424 -3.983 1.00 0.00 H ATOM 92 HB3 SER A 6 -4.036 2.200 -2.835 1.00 0.00 H ATOM 93 HG SER A 6 -1.880 2.645 -3.574 1.00 0.00 H ATOM 94 N PHE A 7 -4.274 -0.740 -4.823 1.00 0.00 N ATOM 95 CA PHE A 7 -4.101 -2.129 -4.303 1.00 0.00 C ATOM 96 C PHE A 7 -2.647 -2.578 -4.468 1.00 0.00 C ATOM 97 O PHE A 7 -2.121 -3.321 -3.663 1.00 0.00 O ATOM 98 CB PHE A 7 -5.033 -2.997 -5.154 1.00 0.00 C ATOM 99 CG PHE A 7 -6.174 -3.499 -4.302 1.00 0.00 C ATOM 100 CD1 PHE A 7 -5.909 -4.174 -3.105 1.00 0.00 C ATOM 101 CD2 PHE A 7 -7.498 -3.290 -4.709 1.00 0.00 C ATOM 102 CE1 PHE A 7 -6.966 -4.640 -2.313 1.00 0.00 C ATOM 103 CE2 PHE A 7 -8.555 -3.755 -3.918 1.00 0.00 C ATOM 104 CZ PHE A 7 -8.288 -4.431 -2.720 1.00 0.00 C ATOM 105 H PHE A 7 -4.912 -0.565 -5.545 1.00 0.00 H ATOM 106 HA PHE A 7 -4.395 -2.179 -3.268 1.00 0.00 H ATOM 107 HB2 PHE A 7 -5.425 -2.412 -5.972 1.00 0.00 H ATOM 108 HB3 PHE A 7 -4.482 -3.838 -5.544 1.00 0.00 H ATOM 109 HD1 PHE A 7 -4.888 -4.335 -2.792 1.00 0.00 H ATOM 110 HD2 PHE A 7 -7.702 -2.768 -5.632 1.00 0.00 H ATOM 111 HE1 PHE A 7 -6.760 -5.161 -1.390 1.00 0.00 H ATOM 112 HE2 PHE A 7 -9.576 -3.593 -4.231 1.00 0.00 H ATOM 113 HZ PHE A 7 -9.104 -4.790 -2.111 1.00 0.00 H ATOM 114 N ARG A 8 -1.994 -2.129 -5.506 1.00 0.00 N ATOM 115 CA ARG A 8 -0.572 -2.524 -5.726 1.00 0.00 C ATOM 116 C ARG A 8 0.313 -1.918 -4.635 1.00 0.00 C ATOM 117 O ARG A 8 1.319 -2.481 -4.248 1.00 0.00 O ATOM 118 CB ARG A 8 -0.215 -1.956 -7.106 1.00 0.00 C ATOM 119 CG ARG A 8 1.305 -1.922 -7.282 1.00 0.00 C ATOM 120 CD ARG A 8 1.646 -1.431 -8.691 1.00 0.00 C ATOM 121 NE ARG A 8 1.617 0.057 -8.600 1.00 0.00 N ATOM 122 CZ ARG A 8 2.038 0.779 -9.602 1.00 0.00 C ATOM 123 NH1 ARG A 8 1.282 0.937 -10.655 1.00 0.00 N ATOM 124 NH2 ARG A 8 3.213 1.344 -9.552 1.00 0.00 N ATOM 125 H ARG A 8 -2.440 -1.530 -6.140 1.00 0.00 H ATOM 126 HA ARG A 8 -0.477 -3.594 -5.732 1.00 0.00 H ATOM 127 HB2 ARG A 8 -0.651 -2.579 -7.873 1.00 0.00 H ATOM 128 HB3 ARG A 8 -0.608 -0.954 -7.193 1.00 0.00 H ATOM 129 HG2 ARG A 8 1.734 -1.251 -6.551 1.00 0.00 H ATOM 130 HG3 ARG A 8 1.707 -2.913 -7.141 1.00 0.00 H ATOM 131 HD2 ARG A 8 2.632 -1.772 -8.978 1.00 0.00 H ATOM 132 HD3 ARG A 8 0.907 -1.773 -9.398 1.00 0.00 H ATOM 133 HE ARG A 8 1.280 0.492 -7.790 1.00 0.00 H ATOM 134 HH11 ARG A 8 0.382 0.505 -10.693 1.00 0.00 H ATOM 135 HH12 ARG A 8 1.604 1.491 -11.423 1.00 0.00 H ATOM 136 HH21 ARG A 8 3.791 1.224 -8.745 1.00 0.00 H ATOM 137 HH22 ARG A 8 3.536 1.898 -10.319 1.00 0.00 H ATOM 138 N ALA A 9 -0.059 -0.772 -4.144 1.00 0.00 N ATOM 139 CA ALA A 9 0.747 -0.109 -3.081 1.00 0.00 C ATOM 140 C ALA A 9 0.438 -0.708 -1.703 1.00 0.00 C ATOM 141 O ALA A 9 0.874 -0.197 -0.689 1.00 0.00 O ATOM 142 CB ALA A 9 0.328 1.359 -3.126 1.00 0.00 C ATOM 143 H ALA A 9 -0.865 -0.346 -4.479 1.00 0.00 H ATOM 144 HA ALA A 9 1.793 -0.195 -3.303 1.00 0.00 H ATOM 145 HB1 ALA A 9 -0.503 1.518 -2.454 1.00 0.00 H ATOM 146 HB2 ALA A 9 0.032 1.618 -4.132 1.00 0.00 H ATOM 147 HB3 ALA A 9 1.158 1.980 -2.824 1.00 0.00 H ATOM 148 N ARG A 10 -0.303 -1.785 -1.650 1.00 0.00 N ATOM 149 CA ARG A 10 -0.624 -2.404 -0.335 1.00 0.00 C ATOM 150 C ARG A 10 0.664 -2.877 0.357 1.00 0.00 C ATOM 151 O ARG A 10 0.673 -3.155 1.540 1.00 0.00 O ATOM 152 CB ARG A 10 -1.580 -3.558 -0.672 1.00 0.00 C ATOM 153 CG ARG A 10 -1.412 -4.714 0.315 1.00 0.00 C ATOM 154 CD ARG A 10 -0.193 -5.525 -0.100 1.00 0.00 C ATOM 155 NE ARG A 10 0.457 -5.933 1.174 1.00 0.00 N ATOM 156 CZ ARG A 10 0.850 -7.166 1.341 1.00 0.00 C ATOM 157 NH1 ARG A 10 1.474 -7.787 0.378 1.00 0.00 N ATOM 158 NH2 ARG A 10 0.620 -7.779 2.469 1.00 0.00 N ATOM 159 H ARG A 10 -0.645 -2.187 -2.471 1.00 0.00 H ATOM 160 HA ARG A 10 -1.125 -1.706 0.283 1.00 0.00 H ATOM 161 HB2 ARG A 10 -2.597 -3.200 -0.631 1.00 0.00 H ATOM 162 HB3 ARG A 10 -1.367 -3.905 -1.665 1.00 0.00 H ATOM 163 HG2 ARG A 10 -1.268 -4.322 1.312 1.00 0.00 H ATOM 164 HG3 ARG A 10 -2.289 -5.343 0.293 1.00 0.00 H ATOM 165 HD2 ARG A 10 -0.494 -6.392 -0.674 1.00 0.00 H ATOM 166 HD3 ARG A 10 0.473 -4.899 -0.675 1.00 0.00 H ATOM 167 HE ARG A 10 0.589 -5.276 1.889 1.00 0.00 H ATOM 168 HH11 ARG A 10 1.650 -7.318 -0.489 1.00 0.00 H ATOM 169 HH12 ARG A 10 1.776 -8.732 0.504 1.00 0.00 H ATOM 170 HH21 ARG A 10 0.141 -7.303 3.207 1.00 0.00 H ATOM 171 HH22 ARG A 10 0.922 -8.723 2.596 1.00 0.00 H ATOM 172 N ALA A 11 1.748 -2.965 -0.370 1.00 0.00 N ATOM 173 CA ALA A 11 3.024 -3.413 0.244 1.00 0.00 C ATOM 174 C ALA A 11 4.160 -2.470 -0.147 1.00 0.00 C ATOM 175 O ALA A 11 5.232 -2.899 -0.528 1.00 0.00 O ATOM 176 CB ALA A 11 3.269 -4.816 -0.311 1.00 0.00 C ATOM 177 H ALA A 11 1.724 -2.737 -1.316 1.00 0.00 H ATOM 178 HA ALA A 11 2.925 -3.450 1.306 1.00 0.00 H ATOM 179 HB1 ALA A 11 2.396 -5.428 -0.141 1.00 0.00 H ATOM 180 HB2 ALA A 11 4.120 -5.257 0.186 1.00 0.00 H ATOM 181 HB3 ALA A 11 3.465 -4.754 -1.372 1.00 0.00 H ATOM 182 N TYR A 12 3.930 -1.188 -0.066 1.00 0.00 N ATOM 183 CA TYR A 12 4.973 -0.218 -0.438 1.00 0.00 C ATOM 184 C TYR A 12 5.400 0.600 0.786 1.00 0.00 C ATOM 185 O TYR A 12 5.237 1.803 0.829 1.00 0.00 O ATOM 186 CB TYR A 12 4.288 0.658 -1.476 1.00 0.00 C ATOM 187 CG TYR A 12 5.089 0.645 -2.753 1.00 0.00 C ATOM 188 CD1 TYR A 12 5.450 -0.579 -3.327 1.00 0.00 C ATOM 189 CD2 TYR A 12 5.469 1.846 -3.362 1.00 0.00 C ATOM 190 CE1 TYR A 12 6.195 -0.603 -4.513 1.00 0.00 C ATOM 191 CE2 TYR A 12 6.213 1.824 -4.548 1.00 0.00 C ATOM 192 CZ TYR A 12 6.575 0.599 -5.124 1.00 0.00 C ATOM 193 OH TYR A 12 7.309 0.576 -6.292 1.00 0.00 O ATOM 194 H TYR A 12 3.066 -0.859 0.227 1.00 0.00 H ATOM 195 HA TYR A 12 5.810 -0.719 -0.872 1.00 0.00 H ATOM 196 HB2 TYR A 12 3.296 0.274 -1.672 1.00 0.00 H ATOM 197 HB3 TYR A 12 4.212 1.654 -1.099 1.00 0.00 H ATOM 198 HD1 TYR A 12 5.155 -1.507 -2.851 1.00 0.00 H ATOM 199 HD2 TYR A 12 5.188 2.790 -2.917 1.00 0.00 H ATOM 200 HE1 TYR A 12 6.474 -1.547 -4.957 1.00 0.00 H ATOM 201 HE2 TYR A 12 6.507 2.749 -5.019 1.00 0.00 H ATOM 202 HH TYR A 12 8.042 1.189 -6.193 1.00 0.00 H ATOM 203 N SER A 13 5.944 -0.049 1.784 1.00 0.00 N ATOM 204 CA SER A 13 6.384 0.682 3.013 1.00 0.00 C ATOM 205 C SER A 13 5.239 1.542 3.560 1.00 0.00 C ATOM 206 O SER A 13 5.269 2.755 3.482 1.00 0.00 O ATOM 207 CB SER A 13 7.551 1.561 2.561 1.00 0.00 C ATOM 208 OG SER A 13 7.778 2.576 3.530 1.00 0.00 O ATOM 209 H SER A 13 6.063 -1.020 1.727 1.00 0.00 H ATOM 210 HA SER A 13 6.720 -0.016 3.764 1.00 0.00 H ATOM 211 HB2 SER A 13 8.439 0.960 2.463 1.00 0.00 H ATOM 212 HB3 SER A 13 7.314 2.008 1.604 1.00 0.00 H ATOM 213 HG SER A 13 8.655 2.445 3.897 1.00 0.00 H ATOM 214 N PHE A 14 4.230 0.921 4.111 1.00 0.00 N ATOM 215 CA PHE A 14 3.082 1.696 4.660 1.00 0.00 C ATOM 216 C PHE A 14 3.324 2.036 6.133 1.00 0.00 C ATOM 217 O PHE A 14 3.396 3.189 6.508 1.00 0.00 O ATOM 218 CB PHE A 14 1.881 0.770 4.514 1.00 0.00 C ATOM 219 CG PHE A 14 0.656 1.579 4.160 1.00 0.00 C ATOM 220 CD1 PHE A 14 0.250 2.632 4.988 1.00 0.00 C ATOM 221 CD2 PHE A 14 -0.072 1.275 3.004 1.00 0.00 C ATOM 222 CE1 PHE A 14 -0.886 3.382 4.660 1.00 0.00 C ATOM 223 CE2 PHE A 14 -1.208 2.024 2.676 1.00 0.00 C ATOM 224 CZ PHE A 14 -1.615 3.078 3.504 1.00 0.00 C ATOM 225 H PHE A 14 4.225 -0.057 4.161 1.00 0.00 H ATOM 226 HA PHE A 14 2.921 2.590 4.090 1.00 0.00 H ATOM 227 HB2 PHE A 14 2.076 0.047 3.735 1.00 0.00 H ATOM 228 HB3 PHE A 14 1.718 0.261 5.444 1.00 0.00 H ATOM 229 HD1 PHE A 14 0.812 2.867 5.879 1.00 0.00 H ATOM 230 HD2 PHE A 14 0.242 0.463 2.365 1.00 0.00 H ATOM 231 HE1 PHE A 14 -1.200 4.195 5.298 1.00 0.00 H ATOM 232 HE2 PHE A 14 -1.770 1.791 1.784 1.00 0.00 H ATOM 233 HZ PHE A 14 -2.491 3.656 3.250 1.00 0.00 H ATOM 234 N ARG A 15 3.443 1.037 6.971 1.00 0.00 N ATOM 235 CA ARG A 15 3.673 1.282 8.424 1.00 0.00 C ATOM 236 C ARG A 15 2.467 1.984 9.037 1.00 0.00 C ATOM 237 O ARG A 15 2.278 3.176 8.889 1.00 0.00 O ATOM 238 CB ARG A 15 4.919 2.161 8.522 1.00 0.00 C ATOM 239 CG ARG A 15 5.459 2.086 9.948 1.00 0.00 C ATOM 240 CD ARG A 15 4.919 3.265 10.760 1.00 0.00 C ATOM 241 NE ARG A 15 5.563 3.139 12.097 1.00 0.00 N ATOM 242 CZ ARG A 15 6.170 4.165 12.627 1.00 0.00 C ATOM 243 NH1 ARG A 15 7.218 4.677 12.043 1.00 0.00 N ATOM 244 NH2 ARG A 15 5.727 4.680 13.742 1.00 0.00 N ATOM 245 H ARG A 15 3.371 0.117 6.646 1.00 0.00 H ATOM 246 HA ARG A 15 3.850 0.349 8.932 1.00 0.00 H ATOM 247 HB2 ARG A 15 5.668 1.806 7.829 1.00 0.00 H ATOM 248 HB3 ARG A 15 4.663 3.183 8.288 1.00 0.00 H ATOM 249 HG2 ARG A 15 5.137 1.159 10.405 1.00 0.00 H ATOM 250 HG3 ARG A 15 6.535 2.126 9.931 1.00 0.00 H ATOM 251 HD2 ARG A 15 5.194 4.199 10.291 1.00 0.00 H ATOM 252 HD3 ARG A 15 3.847 3.191 10.856 1.00 0.00 H ATOM 253 HE ARG A 15 5.530 2.286 12.577 1.00 0.00 H ATOM 254 HH11 ARG A 15 7.558 4.282 11.190 1.00 0.00 H ATOM 255 HH12 ARG A 15 7.683 5.463 12.451 1.00 0.00 H ATOM 256 HH21 ARG A 15 4.923 4.288 14.189 1.00 0.00 H ATOM 257 HH22 ARG A 15 6.192 5.466 14.148 1.00 0.00 H ATOM 258 N GLY A 16 1.655 1.241 9.724 1.00 0.00 N ATOM 259 CA GLY A 16 0.446 1.832 10.363 1.00 0.00 C ATOM 260 C GLY A 16 0.474 1.566 11.867 1.00 0.00 C ATOM 261 O GLY A 16 0.822 2.429 12.649 1.00 0.00 O ATOM 262 H GLY A 16 1.845 0.284 9.818 1.00 0.00 H ATOM 263 HA2 GLY A 16 0.424 2.898 10.184 1.00 0.00 H ATOM 264 HA3 GLY A 16 -0.445 1.375 9.948 1.00 0.00 H ATOM 265 N PRO A 17 0.079 0.374 12.217 1.00 0.00 N ATOM 266 CA PRO A 17 0.013 -0.053 13.619 1.00 0.00 C ATOM 267 C PRO A 17 1.254 -0.869 13.999 1.00 0.00 C ATOM 268 O PRO A 17 2.091 -0.420 14.761 1.00 0.00 O ATOM 269 CB PRO A 17 -1.249 -0.918 13.610 1.00 0.00 C ATOM 270 CG PRO A 17 -1.429 -1.366 12.180 1.00 0.00 C ATOM 271 CD PRO A 17 -0.357 -0.711 11.353 1.00 0.00 C ATOM 272 HA PRO A 17 -0.118 0.789 14.276 1.00 0.00 H ATOM 273 HB2 PRO A 17 -1.118 -1.774 14.259 1.00 0.00 H ATOM 274 HB3 PRO A 17 -2.102 -0.343 13.919 1.00 0.00 H ATOM 275 HG2 PRO A 17 -1.346 -2.437 12.119 1.00 0.00 H ATOM 276 HG3 PRO A 17 -2.392 -1.046 11.815 1.00 0.00 H ATOM 277 HD2 PRO A 17 0.452 -1.403 11.160 1.00 0.00 H ATOM 278 HD3 PRO A 17 -0.765 -0.326 10.435 1.00 0.00 H ATOM 279 N GLY A 18 1.381 -2.060 13.478 1.00 0.00 N ATOM 280 CA GLY A 18 2.568 -2.900 13.810 1.00 0.00 C ATOM 281 C GLY A 18 3.171 -3.469 12.522 1.00 0.00 C ATOM 282 O GLY A 18 2.492 -3.580 11.521 1.00 0.00 O ATOM 283 H GLY A 18 0.697 -2.402 12.866 1.00 0.00 H ATOM 284 HA2 GLY A 18 3.304 -2.294 14.319 1.00 0.00 H ATOM 285 HA3 GLY A 18 2.265 -3.713 14.452 1.00 0.00 H ATOM 286 N PRO A 19 4.433 -3.813 12.588 1.00 0.00 N ATOM 287 CA PRO A 19 5.131 -4.374 11.421 1.00 0.00 C ATOM 288 C PRO A 19 4.973 -5.895 11.361 1.00 0.00 C ATOM 289 O PRO A 19 5.790 -6.634 11.875 1.00 0.00 O ATOM 290 CB PRO A 19 6.577 -3.980 11.650 1.00 0.00 C ATOM 291 CG PRO A 19 6.709 -3.750 13.119 1.00 0.00 C ATOM 292 CD PRO A 19 5.328 -3.720 13.735 1.00 0.00 C ATOM 293 HA PRO A 19 4.784 -3.910 10.526 1.00 0.00 H ATOM 294 HB2 PRO A 19 7.234 -4.779 11.334 1.00 0.00 H ATOM 295 HB3 PRO A 19 6.807 -3.073 11.115 1.00 0.00 H ATOM 296 HG2 PRO A 19 7.304 -4.531 13.569 1.00 0.00 H ATOM 297 HG3 PRO A 19 7.175 -2.800 13.265 1.00 0.00 H ATOM 298 HD2 PRO A 19 5.191 -4.565 14.396 1.00 0.00 H ATOM 299 HD3 PRO A 19 5.166 -2.793 14.261 1.00 0.00 H ATOM 300 N GLN A 20 3.925 -6.367 10.738 1.00 0.00 N ATOM 301 CA GLN A 20 3.709 -7.841 10.644 1.00 0.00 C ATOM 302 C GLN A 20 4.904 -8.511 9.958 1.00 0.00 C ATOM 303 O GLN A 20 5.861 -7.860 9.586 1.00 0.00 O ATOM 304 CB GLN A 20 2.444 -8.005 9.798 1.00 0.00 C ATOM 305 CG GLN A 20 1.232 -8.179 10.717 1.00 0.00 C ATOM 306 CD GLN A 20 0.866 -9.662 10.807 1.00 0.00 C ATOM 307 OE1 GLN A 20 1.701 -10.488 11.112 1.00 0.00 O ATOM 308 NE2 GLN A 20 -0.359 -10.034 10.553 1.00 0.00 N ATOM 309 H GLN A 20 3.280 -5.753 10.333 1.00 0.00 H ATOM 310 HA GLN A 20 3.554 -8.260 11.624 1.00 0.00 H ATOM 311 HB2 GLN A 20 2.307 -7.124 9.183 1.00 0.00 H ATOM 312 HB3 GLN A 20 2.545 -8.879 9.166 1.00 0.00 H ATOM 313 HG2 GLN A 20 1.470 -7.805 11.702 1.00 0.00 H ATOM 314 HG3 GLN A 20 0.396 -7.627 10.316 1.00 0.00 H ATOM 315 HE21 GLN A 20 -1.034 -9.367 10.307 1.00 0.00 H ATOM 316 HE22 GLN A 20 -0.604 -10.982 10.608 1.00 0.00 H ATOM 317 N LEU A 21 4.853 -9.807 9.790 1.00 0.00 N ATOM 318 CA LEU A 21 5.984 -10.529 9.127 1.00 0.00 C ATOM 319 C LEU A 21 7.315 -10.172 9.798 1.00 0.00 C ATOM 320 O LEU A 21 8.346 -10.503 9.235 1.00 0.00 O ATOM 321 CB LEU A 21 5.969 -10.049 7.674 1.00 0.00 C ATOM 322 CG LEU A 21 4.697 -10.548 6.980 1.00 0.00 C ATOM 323 CD1 LEU A 21 4.046 -9.397 6.211 1.00 0.00 C ATOM 324 CD2 LEU A 21 5.055 -11.672 6.004 1.00 0.00 C ATOM 325 H LEU A 21 4.071 -10.308 10.098 1.00 0.00 H ATOM 326 HA LEU A 21 5.819 -11.594 9.162 1.00 0.00 H ATOM 327 HB2 LEU A 21 5.992 -8.968 7.653 1.00 0.00 H ATOM 328 HB3 LEU A 21 6.835 -10.435 7.158 1.00 0.00 H ATOM 329 HG LEU A 21 4.004 -10.920 7.722 1.00 0.00 H ATOM 330 HD11 LEU A 21 2.976 -9.538 6.189 1.00 0.00 H ATOM 331 HD12 LEU A 21 4.427 -9.378 5.200 1.00 0.00 H ATOM 332 HD13 LEU A 21 4.276 -8.461 6.700 1.00 0.00 H ATOM 333 HD21 LEU A 21 5.464 -11.246 5.100 1.00 0.00 H ATOM 334 HD22 LEU A 21 4.166 -12.238 5.766 1.00 0.00 H ATOM 335 HD23 LEU A 21 5.787 -12.324 6.458 1.00 0.00 H HETATM 336 N NH2 A 22 7.321 -9.534 10.935 1.00 0.00 N HETATM 337 HN1 NH2 A 22 6.475 -9.282 11.364 1.00 0.00 H HETATM 338 HN2 NH2 A 22 8.180 -9.306 11.364 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 7 ATOM 1 N SER A 1 -5.719 5.497 -2.500 1.00 0.00 N ATOM 2 CA SER A 1 -7.158 5.868 -2.637 1.00 0.00 C ATOM 3 C SER A 1 -7.288 7.335 -3.057 1.00 0.00 C ATOM 4 O SER A 1 -8.207 8.025 -2.657 1.00 0.00 O ATOM 5 CB SER A 1 -7.756 5.654 -1.247 1.00 0.00 C ATOM 6 OG SER A 1 -7.310 6.687 -0.379 1.00 0.00 O ATOM 7 H1 SER A 1 -5.222 6.229 -1.953 1.00 0.00 H ATOM 8 H2 SER A 1 -5.290 5.420 -3.445 1.00 0.00 H ATOM 9 H3 SER A 1 -5.641 4.586 -2.006 1.00 0.00 H ATOM 10 HA SER A 1 -7.646 5.226 -3.351 1.00 0.00 H ATOM 11 HB2 SER A 1 -8.831 5.680 -1.308 1.00 0.00 H ATOM 12 HB3 SER A 1 -7.443 4.690 -0.867 1.00 0.00 H ATOM 13 HG SER A 1 -7.257 6.327 0.509 1.00 0.00 H ATOM 14 N SER A 2 -6.377 7.815 -3.859 1.00 0.00 N ATOM 15 CA SER A 2 -6.447 9.237 -4.306 1.00 0.00 C ATOM 16 C SER A 2 -5.705 9.410 -5.635 1.00 0.00 C ATOM 17 O SER A 2 -4.682 10.063 -5.705 1.00 0.00 O ATOM 18 CB SER A 2 -5.760 10.033 -3.197 1.00 0.00 C ATOM 19 OG SER A 2 -6.289 9.639 -1.939 1.00 0.00 O ATOM 20 H SER A 2 -5.645 7.241 -4.168 1.00 0.00 H ATOM 21 HA SER A 2 -7.473 9.551 -4.403 1.00 0.00 H ATOM 22 HB2 SER A 2 -4.701 9.838 -3.214 1.00 0.00 H ATOM 23 HB3 SER A 2 -5.930 11.091 -3.356 1.00 0.00 H ATOM 24 HG SER A 2 -6.416 10.429 -1.409 1.00 0.00 H ATOM 25 N MET A 3 -6.214 8.829 -6.690 1.00 0.00 N ATOM 26 CA MET A 3 -5.545 8.954 -8.022 1.00 0.00 C ATOM 27 C MET A 3 -4.067 8.562 -7.916 1.00 0.00 C ATOM 28 O MET A 3 -3.189 9.403 -7.934 1.00 0.00 O ATOM 29 CB MET A 3 -5.684 10.430 -8.404 1.00 0.00 C ATOM 30 CG MET A 3 -7.166 10.794 -8.506 1.00 0.00 C ATOM 31 SD MET A 3 -7.396 12.047 -9.793 1.00 0.00 S ATOM 32 CE MET A 3 -8.758 11.232 -10.662 1.00 0.00 C ATOM 33 H MET A 3 -7.040 8.308 -6.608 1.00 0.00 H ATOM 34 HA MET A 3 -6.044 8.338 -8.752 1.00 0.00 H ATOM 35 HB2 MET A 3 -5.213 11.043 -7.650 1.00 0.00 H ATOM 36 HB3 MET A 3 -5.206 10.601 -9.358 1.00 0.00 H ATOM 37 HG2 MET A 3 -7.737 9.912 -8.758 1.00 0.00 H ATOM 38 HG3 MET A 3 -7.507 11.184 -7.559 1.00 0.00 H ATOM 39 HE1 MET A 3 -9.108 11.872 -11.461 1.00 0.00 H ATOM 40 HE2 MET A 3 -9.565 11.042 -9.968 1.00 0.00 H ATOM 41 HE3 MET A 3 -8.415 10.298 -11.077 1.00 0.00 H ATOM 42 N LYS A 4 -3.789 7.290 -7.805 1.00 0.00 N ATOM 43 CA LYS A 4 -2.370 6.840 -7.697 1.00 0.00 C ATOM 44 C LYS A 4 -2.259 5.353 -8.045 1.00 0.00 C ATOM 45 O LYS A 4 -3.243 4.696 -8.324 1.00 0.00 O ATOM 46 CB LYS A 4 -1.985 7.082 -6.235 1.00 0.00 C ATOM 47 CG LYS A 4 -2.940 6.315 -5.315 1.00 0.00 C ATOM 48 CD LYS A 4 -2.635 6.663 -3.855 1.00 0.00 C ATOM 49 CE LYS A 4 -1.860 5.515 -3.204 1.00 0.00 C ATOM 50 NZ LYS A 4 -0.427 5.822 -3.464 1.00 0.00 N ATOM 51 H LYS A 4 -4.514 6.631 -7.792 1.00 0.00 H ATOM 52 HA LYS A 4 -1.739 7.426 -8.345 1.00 0.00 H ATOM 53 HB2 LYS A 4 -0.973 6.741 -6.069 1.00 0.00 H ATOM 54 HB3 LYS A 4 -2.047 8.137 -6.017 1.00 0.00 H ATOM 55 HG2 LYS A 4 -3.959 6.591 -5.546 1.00 0.00 H ATOM 56 HG3 LYS A 4 -2.810 5.255 -5.465 1.00 0.00 H ATOM 57 HD2 LYS A 4 -2.044 7.566 -3.814 1.00 0.00 H ATOM 58 HD3 LYS A 4 -3.562 6.816 -3.321 1.00 0.00 H ATOM 59 HE2 LYS A 4 -2.055 5.487 -2.140 1.00 0.00 H ATOM 60 HE3 LYS A 4 -2.126 4.574 -3.662 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -0.218 6.792 -3.150 1.00 0.00 H ATOM 62 HZ2 LYS A 4 -0.233 5.741 -4.481 1.00 0.00 H ATOM 63 HZ3 LYS A 4 0.172 5.151 -2.940 1.00 0.00 H ATOM 64 N LEU A 5 -1.066 4.818 -8.029 1.00 0.00 N ATOM 65 CA LEU A 5 -0.887 3.373 -8.359 1.00 0.00 C ATOM 66 C LEU A 5 -1.728 2.507 -7.416 1.00 0.00 C ATOM 67 O LEU A 5 -1.916 2.834 -6.260 1.00 0.00 O ATOM 68 CB LEU A 5 0.605 3.095 -8.156 1.00 0.00 C ATOM 69 CG LEU A 5 1.246 2.726 -9.497 1.00 0.00 C ATOM 70 CD1 LEU A 5 2.761 2.608 -9.324 1.00 0.00 C ATOM 71 CD2 LEU A 5 0.683 1.387 -9.977 1.00 0.00 C ATOM 72 H LEU A 5 -0.289 5.368 -7.803 1.00 0.00 H ATOM 73 HA LEU A 5 -1.161 3.187 -9.384 1.00 0.00 H ATOM 74 HB2 LEU A 5 1.087 3.977 -7.759 1.00 0.00 H ATOM 75 HB3 LEU A 5 0.729 2.275 -7.465 1.00 0.00 H ATOM 76 HG LEU A 5 1.025 3.494 -10.223 1.00 0.00 H ATOM 77 HD11 LEU A 5 3.162 3.559 -9.006 1.00 0.00 H ATOM 78 HD12 LEU A 5 3.210 2.325 -10.264 1.00 0.00 H ATOM 79 HD13 LEU A 5 2.981 1.858 -8.578 1.00 0.00 H ATOM 80 HD21 LEU A 5 1.286 1.014 -10.791 1.00 0.00 H ATOM 81 HD22 LEU A 5 -0.334 1.524 -10.316 1.00 0.00 H ATOM 82 HD23 LEU A 5 0.698 0.677 -9.163 1.00 0.00 H ATOM 83 N SER A 6 -2.235 1.406 -7.902 1.00 0.00 N ATOM 84 CA SER A 6 -3.066 0.518 -7.036 1.00 0.00 C ATOM 85 C SER A 6 -2.395 -0.851 -6.868 1.00 0.00 C ATOM 86 O SER A 6 -2.808 -1.655 -6.057 1.00 0.00 O ATOM 87 CB SER A 6 -4.394 0.376 -7.776 1.00 0.00 C ATOM 88 OG SER A 6 -5.080 1.621 -7.755 1.00 0.00 O ATOM 89 H SER A 6 -2.072 1.163 -8.837 1.00 0.00 H ATOM 90 HA SER A 6 -3.228 0.977 -6.074 1.00 0.00 H ATOM 91 HB2 SER A 6 -4.210 0.090 -8.798 1.00 0.00 H ATOM 92 HB3 SER A 6 -4.994 -0.385 -7.294 1.00 0.00 H ATOM 93 HG SER A 6 -5.758 1.598 -8.433 1.00 0.00 H ATOM 94 N PHE A 7 -1.364 -1.121 -7.627 1.00 0.00 N ATOM 95 CA PHE A 7 -0.671 -2.441 -7.510 1.00 0.00 C ATOM 96 C PHE A 7 -0.239 -2.690 -6.060 1.00 0.00 C ATOM 97 O PHE A 7 -0.409 -3.771 -5.530 1.00 0.00 O ATOM 98 CB PHE A 7 0.554 -2.332 -8.422 1.00 0.00 C ATOM 99 CG PHE A 7 0.371 -3.225 -9.626 1.00 0.00 C ATOM 100 CD1 PHE A 7 0.564 -4.607 -9.506 1.00 0.00 C ATOM 101 CD2 PHE A 7 0.010 -2.673 -10.861 1.00 0.00 C ATOM 102 CE1 PHE A 7 0.395 -5.437 -10.622 1.00 0.00 C ATOM 103 CE2 PHE A 7 -0.158 -3.502 -11.975 1.00 0.00 C ATOM 104 CZ PHE A 7 0.034 -4.884 -11.856 1.00 0.00 C ATOM 105 H PHE A 7 -1.047 -0.460 -8.275 1.00 0.00 H ATOM 106 HA PHE A 7 -1.315 -3.234 -7.852 1.00 0.00 H ATOM 107 HB2 PHE A 7 0.671 -1.308 -8.748 1.00 0.00 H ATOM 108 HB3 PHE A 7 1.434 -2.638 -7.879 1.00 0.00 H ATOM 109 HD1 PHE A 7 0.843 -5.033 -8.554 1.00 0.00 H ATOM 110 HD2 PHE A 7 -0.139 -1.607 -10.952 1.00 0.00 H ATOM 111 HE1 PHE A 7 0.544 -6.502 -10.529 1.00 0.00 H ATOM 112 HE2 PHE A 7 -0.438 -3.077 -12.928 1.00 0.00 H ATOM 113 HZ PHE A 7 -0.097 -5.524 -12.716 1.00 0.00 H ATOM 114 N ARG A 8 0.319 -1.700 -5.419 1.00 0.00 N ATOM 115 CA ARG A 8 0.765 -1.877 -4.006 1.00 0.00 C ATOM 116 C ARG A 8 -0.405 -1.640 -3.050 1.00 0.00 C ATOM 117 O ARG A 8 -0.580 -2.343 -2.075 1.00 0.00 O ATOM 118 CB ARG A 8 1.858 -0.823 -3.805 1.00 0.00 C ATOM 119 CG ARG A 8 2.266 -0.774 -2.331 1.00 0.00 C ATOM 120 CD ARG A 8 3.329 0.309 -2.131 1.00 0.00 C ATOM 121 NE ARG A 8 2.561 1.556 -1.859 1.00 0.00 N ATOM 122 CZ ARG A 8 2.990 2.405 -0.964 1.00 0.00 C ATOM 123 NH1 ARG A 8 4.200 2.885 -1.048 1.00 0.00 N ATOM 124 NH2 ARG A 8 2.207 2.773 0.013 1.00 0.00 N ATOM 125 H ARG A 8 0.446 -0.837 -5.867 1.00 0.00 H ATOM 126 HA ARG A 8 1.169 -2.859 -3.863 1.00 0.00 H ATOM 127 HB2 ARG A 8 2.716 -1.079 -4.407 1.00 0.00 H ATOM 128 HB3 ARG A 8 1.483 0.144 -4.105 1.00 0.00 H ATOM 129 HG2 ARG A 8 1.399 -0.544 -1.728 1.00 0.00 H ATOM 130 HG3 ARG A 8 2.669 -1.730 -2.035 1.00 0.00 H ATOM 131 HD2 ARG A 8 3.962 0.062 -1.290 1.00 0.00 H ATOM 132 HD3 ARG A 8 3.919 0.427 -3.026 1.00 0.00 H ATOM 133 HE ARG A 8 1.733 1.739 -2.350 1.00 0.00 H ATOM 134 HH11 ARG A 8 4.800 2.603 -1.797 1.00 0.00 H ATOM 135 HH12 ARG A 8 4.528 3.535 -0.363 1.00 0.00 H ATOM 136 HH21 ARG A 8 1.279 2.405 0.077 1.00 0.00 H ATOM 137 HH22 ARG A 8 2.535 3.424 0.698 1.00 0.00 H ATOM 138 N ALA A 9 -1.197 -0.647 -3.325 1.00 0.00 N ATOM 139 CA ALA A 9 -2.357 -0.339 -2.442 1.00 0.00 C ATOM 140 C ALA A 9 -3.525 -1.296 -2.711 1.00 0.00 C ATOM 141 O ALA A 9 -4.581 -1.173 -2.120 1.00 0.00 O ATOM 142 CB ALA A 9 -2.754 1.092 -2.795 1.00 0.00 C ATOM 143 H ALA A 9 -1.025 -0.100 -4.110 1.00 0.00 H ATOM 144 HA ALA A 9 -2.060 -0.390 -1.412 1.00 0.00 H ATOM 145 HB1 ALA A 9 -2.261 1.777 -2.123 1.00 0.00 H ATOM 146 HB2 ALA A 9 -3.824 1.201 -2.701 1.00 0.00 H ATOM 147 HB3 ALA A 9 -2.459 1.307 -3.811 1.00 0.00 H ATOM 148 N ARG A 10 -3.351 -2.250 -3.589 1.00 0.00 N ATOM 149 CA ARG A 10 -4.453 -3.205 -3.879 1.00 0.00 C ATOM 150 C ARG A 10 -4.657 -4.154 -2.688 1.00 0.00 C ATOM 151 O ARG A 10 -5.607 -4.909 -2.643 1.00 0.00 O ATOM 152 CB ARG A 10 -4.005 -3.930 -5.153 1.00 0.00 C ATOM 153 CG ARG A 10 -4.628 -5.322 -5.237 1.00 0.00 C ATOM 154 CD ARG A 10 -3.797 -6.266 -4.383 1.00 0.00 C ATOM 155 NE ARG A 10 -4.778 -7.201 -3.768 1.00 0.00 N ATOM 156 CZ ARG A 10 -4.612 -8.491 -3.886 1.00 0.00 C ATOM 157 NH1 ARG A 10 -5.028 -9.106 -4.959 1.00 0.00 N ATOM 158 NH2 ARG A 10 -4.031 -9.164 -2.931 1.00 0.00 N ATOM 159 H ARG A 10 -2.499 -2.343 -4.054 1.00 0.00 H ATOM 160 HA ARG A 10 -5.349 -2.677 -4.075 1.00 0.00 H ATOM 161 HB2 ARG A 10 -4.305 -3.353 -6.015 1.00 0.00 H ATOM 162 HB3 ARG A 10 -2.935 -4.018 -5.141 1.00 0.00 H ATOM 163 HG2 ARG A 10 -5.643 -5.290 -4.866 1.00 0.00 H ATOM 164 HG3 ARG A 10 -4.624 -5.662 -6.262 1.00 0.00 H ATOM 165 HD2 ARG A 10 -3.086 -6.803 -4.997 1.00 0.00 H ATOM 166 HD3 ARG A 10 -3.290 -5.698 -3.618 1.00 0.00 H ATOM 167 HE ARG A 10 -5.549 -6.850 -3.277 1.00 0.00 H ATOM 168 HH11 ARG A 10 -5.474 -8.591 -5.690 1.00 0.00 H ATOM 169 HH12 ARG A 10 -4.901 -10.094 -5.049 1.00 0.00 H ATOM 170 HH21 ARG A 10 -3.712 -8.693 -2.109 1.00 0.00 H ATOM 171 HH22 ARG A 10 -3.904 -10.152 -3.022 1.00 0.00 H ATOM 172 N ALA A 11 -3.775 -4.113 -1.718 1.00 0.00 N ATOM 173 CA ALA A 11 -3.919 -5.002 -0.529 1.00 0.00 C ATOM 174 C ALA A 11 -2.808 -4.715 0.481 1.00 0.00 C ATOM 175 O ALA A 11 -2.156 -5.617 0.972 1.00 0.00 O ATOM 176 CB ALA A 11 -3.799 -6.430 -1.065 1.00 0.00 C ATOM 177 H ALA A 11 -3.021 -3.493 -1.771 1.00 0.00 H ATOM 178 HA ALA A 11 -4.879 -4.859 -0.072 1.00 0.00 H ATOM 179 HB1 ALA A 11 -4.746 -6.740 -1.478 1.00 0.00 H ATOM 180 HB2 ALA A 11 -3.522 -7.095 -0.259 1.00 0.00 H ATOM 181 HB3 ALA A 11 -3.042 -6.464 -1.834 1.00 0.00 H ATOM 182 N TYR A 12 -2.577 -3.466 0.784 1.00 0.00 N ATOM 183 CA TYR A 12 -1.511 -3.117 1.736 1.00 0.00 C ATOM 184 C TYR A 12 -2.111 -2.578 3.040 1.00 0.00 C ATOM 185 O TYR A 12 -1.702 -1.550 3.544 1.00 0.00 O ATOM 186 CB TYR A 12 -0.725 -2.038 1.006 1.00 0.00 C ATOM 187 CG TYR A 12 0.709 -2.476 0.852 1.00 0.00 C ATOM 188 CD1 TYR A 12 0.991 -3.727 0.292 1.00 0.00 C ATOM 189 CD2 TYR A 12 1.752 -1.639 1.264 1.00 0.00 C ATOM 190 CE1 TYR A 12 2.320 -4.144 0.143 1.00 0.00 C ATOM 191 CE2 TYR A 12 3.081 -2.056 1.116 1.00 0.00 C ATOM 192 CZ TYR A 12 3.365 -3.309 0.556 1.00 0.00 C ATOM 193 OH TYR A 12 4.675 -3.718 0.410 1.00 0.00 O ATOM 194 H TYR A 12 -3.092 -2.754 0.374 1.00 0.00 H ATOM 195 HA TYR A 12 -0.885 -3.963 1.926 1.00 0.00 H ATOM 196 HB2 TYR A 12 -1.158 -1.879 0.028 1.00 0.00 H ATOM 197 HB3 TYR A 12 -0.776 -1.128 1.565 1.00 0.00 H ATOM 198 HD1 TYR A 12 0.180 -4.372 -0.025 1.00 0.00 H ATOM 199 HD2 TYR A 12 1.533 -0.674 1.696 1.00 0.00 H ATOM 200 HE1 TYR A 12 2.538 -5.109 -0.289 1.00 0.00 H ATOM 201 HE2 TYR A 12 3.887 -1.411 1.434 1.00 0.00 H ATOM 202 HH TYR A 12 4.750 -4.176 -0.431 1.00 0.00 H ATOM 203 N SER A 13 -3.079 -3.265 3.587 1.00 0.00 N ATOM 204 CA SER A 13 -3.706 -2.794 4.857 1.00 0.00 C ATOM 205 C SER A 13 -3.905 -3.971 5.816 1.00 0.00 C ATOM 206 O SER A 13 -5.015 -4.298 6.190 1.00 0.00 O ATOM 207 CB SER A 13 -5.053 -2.206 4.439 1.00 0.00 C ATOM 208 OG SER A 13 -5.468 -1.250 5.405 1.00 0.00 O ATOM 209 H SER A 13 -3.392 -4.091 3.163 1.00 0.00 H ATOM 210 HA SER A 13 -3.097 -2.031 5.318 1.00 0.00 H ATOM 211 HB2 SER A 13 -4.955 -1.723 3.481 1.00 0.00 H ATOM 212 HB3 SER A 13 -5.784 -3.001 4.366 1.00 0.00 H ATOM 213 HG SER A 13 -6.400 -1.395 5.584 1.00 0.00 H ATOM 214 N PHE A 14 -2.838 -4.609 6.217 1.00 0.00 N ATOM 215 CA PHE A 14 -2.961 -5.763 7.151 1.00 0.00 C ATOM 216 C PHE A 14 -2.809 -5.292 8.599 1.00 0.00 C ATOM 217 O PHE A 14 -3.410 -5.839 9.505 1.00 0.00 O ATOM 218 CB PHE A 14 -1.820 -6.698 6.769 1.00 0.00 C ATOM 219 CG PHE A 14 -2.271 -8.132 6.909 1.00 0.00 C ATOM 220 CD1 PHE A 14 -2.315 -8.732 8.173 1.00 0.00 C ATOM 221 CD2 PHE A 14 -2.643 -8.863 5.775 1.00 0.00 C ATOM 222 CE1 PHE A 14 -2.733 -10.062 8.304 1.00 0.00 C ATOM 223 CE2 PHE A 14 -3.061 -10.193 5.905 1.00 0.00 C ATOM 224 CZ PHE A 14 -3.106 -10.793 7.169 1.00 0.00 C ATOM 225 H PHE A 14 -1.953 -4.328 5.903 1.00 0.00 H ATOM 226 HA PHE A 14 -3.900 -6.263 7.014 1.00 0.00 H ATOM 227 HB2 PHE A 14 -1.525 -6.510 5.747 1.00 0.00 H ATOM 228 HB3 PHE A 14 -0.988 -6.518 7.422 1.00 0.00 H ATOM 229 HD1 PHE A 14 -2.027 -8.168 9.049 1.00 0.00 H ATOM 230 HD2 PHE A 14 -2.609 -8.401 4.799 1.00 0.00 H ATOM 231 HE1 PHE A 14 -2.766 -10.525 9.279 1.00 0.00 H ATOM 232 HE2 PHE A 14 -3.348 -10.758 5.030 1.00 0.00 H ATOM 233 HZ PHE A 14 -3.427 -11.819 7.269 1.00 0.00 H ATOM 234 N ARG A 15 -2.011 -4.283 8.824 1.00 0.00 N ATOM 235 CA ARG A 15 -1.813 -3.771 10.200 1.00 0.00 C ATOM 236 C ARG A 15 -2.146 -2.281 10.238 1.00 0.00 C ATOM 237 O ARG A 15 -3.241 -1.866 9.910 1.00 0.00 O ATOM 238 CB ARG A 15 -0.332 -4.047 10.492 1.00 0.00 C ATOM 239 CG ARG A 15 -0.086 -3.996 12.004 1.00 0.00 C ATOM 240 CD ARG A 15 0.162 -5.410 12.533 1.00 0.00 C ATOM 241 NE ARG A 15 1.508 -5.782 12.016 1.00 0.00 N ATOM 242 CZ ARG A 15 1.669 -6.900 11.360 1.00 0.00 C ATOM 243 NH1 ARG A 15 1.461 -8.041 11.955 1.00 0.00 N ATOM 244 NH2 ARG A 15 2.038 -6.873 10.109 1.00 0.00 N ATOM 245 H ARG A 15 -1.536 -3.855 8.085 1.00 0.00 H ATOM 246 HA ARG A 15 -2.422 -4.295 10.899 1.00 0.00 H ATOM 247 HB2 ARG A 15 -0.071 -5.027 10.118 1.00 0.00 H ATOM 248 HB3 ARG A 15 0.278 -3.304 10.002 1.00 0.00 H ATOM 249 HG2 ARG A 15 0.778 -3.379 12.206 1.00 0.00 H ATOM 250 HG3 ARG A 15 -0.950 -3.576 12.496 1.00 0.00 H ATOM 251 HD2 ARG A 15 0.156 -5.413 13.614 1.00 0.00 H ATOM 252 HD3 ARG A 15 -0.582 -6.091 12.150 1.00 0.00 H ATOM 253 HE ARG A 15 2.272 -5.189 12.168 1.00 0.00 H ATOM 254 HH11 ARG A 15 1.177 -8.061 12.914 1.00 0.00 H ATOM 255 HH12 ARG A 15 1.584 -8.897 11.453 1.00 0.00 H ATOM 256 HH21 ARG A 15 2.198 -5.998 9.653 1.00 0.00 H ATOM 257 HH22 ARG A 15 2.161 -7.729 9.606 1.00 0.00 H ATOM 258 N GLY A 16 -1.213 -1.489 10.634 1.00 0.00 N ATOM 259 CA GLY A 16 -1.441 -0.018 10.707 1.00 0.00 C ATOM 260 C GLY A 16 -0.309 0.713 9.990 1.00 0.00 C ATOM 261 O GLY A 16 -0.453 1.138 8.860 1.00 0.00 O ATOM 262 H GLY A 16 -0.359 -1.868 10.885 1.00 0.00 H ATOM 263 HA2 GLY A 16 -2.384 0.227 10.239 1.00 0.00 H ATOM 264 HA3 GLY A 16 -1.456 0.298 11.744 1.00 0.00 H ATOM 265 N PRO A 17 0.781 0.851 10.691 1.00 0.00 N ATOM 266 CA PRO A 17 1.966 1.547 10.178 1.00 0.00 C ATOM 267 C PRO A 17 3.002 0.543 9.662 1.00 0.00 C ATOM 268 O PRO A 17 3.351 -0.404 10.338 1.00 0.00 O ATOM 269 CB PRO A 17 2.460 2.267 11.434 1.00 0.00 C ATOM 270 CG PRO A 17 1.907 1.480 12.598 1.00 0.00 C ATOM 271 CD PRO A 17 1.040 0.384 12.044 1.00 0.00 C ATOM 272 HA PRO A 17 1.700 2.263 9.418 1.00 0.00 H ATOM 273 HB2 PRO A 17 3.541 2.269 11.461 1.00 0.00 H ATOM 274 HB3 PRO A 17 2.084 3.272 11.465 1.00 0.00 H ATOM 275 HG2 PRO A 17 2.714 1.065 13.174 1.00 0.00 H ATOM 276 HG3 PRO A 17 1.299 2.122 13.217 1.00 0.00 H ATOM 277 HD2 PRO A 17 1.574 -0.558 12.035 1.00 0.00 H ATOM 278 HD3 PRO A 17 0.122 0.303 12.600 1.00 0.00 H ATOM 279 N GLY A 18 3.496 0.746 8.471 1.00 0.00 N ATOM 280 CA GLY A 18 4.510 -0.193 7.911 1.00 0.00 C ATOM 281 C GLY A 18 5.872 0.079 8.555 1.00 0.00 C ATOM 282 O GLY A 18 5.993 0.943 9.401 1.00 0.00 O ATOM 283 H GLY A 18 3.200 1.517 7.943 1.00 0.00 H ATOM 284 HA2 GLY A 18 4.208 -1.211 8.117 1.00 0.00 H ATOM 285 HA3 GLY A 18 4.585 -0.049 6.844 1.00 0.00 H ATOM 286 N PRO A 19 6.858 -0.670 8.132 1.00 0.00 N ATOM 287 CA PRO A 19 8.220 -0.514 8.666 1.00 0.00 C ATOM 288 C PRO A 19 9.011 0.526 7.868 1.00 0.00 C ATOM 289 O PRO A 19 8.970 0.550 6.653 1.00 0.00 O ATOM 290 CB PRO A 19 8.818 -1.899 8.513 1.00 0.00 C ATOM 291 CG PRO A 19 8.028 -2.569 7.438 1.00 0.00 C ATOM 292 CD PRO A 19 6.812 -1.725 7.128 1.00 0.00 C ATOM 293 HA PRO A 19 8.182 -0.264 9.701 1.00 0.00 H ATOM 294 HB2 PRO A 19 9.857 -1.824 8.224 1.00 0.00 H ATOM 295 HB3 PRO A 19 8.725 -2.449 9.437 1.00 0.00 H ATOM 296 HG2 PRO A 19 8.631 -2.696 6.553 1.00 0.00 H ATOM 297 HG3 PRO A 19 7.706 -3.519 7.806 1.00 0.00 H ATOM 298 HD2 PRO A 19 6.885 -1.309 6.131 1.00 0.00 H ATOM 299 HD3 PRO A 19 5.908 -2.303 7.236 1.00 0.00 H ATOM 300 N GLN A 20 9.727 1.385 8.542 1.00 0.00 N ATOM 301 CA GLN A 20 10.522 2.425 7.824 1.00 0.00 C ATOM 302 C GLN A 20 11.496 1.768 6.841 1.00 0.00 C ATOM 303 O GLN A 20 12.341 0.982 7.221 1.00 0.00 O ATOM 304 CB GLN A 20 11.288 3.173 8.922 1.00 0.00 C ATOM 305 CG GLN A 20 12.165 2.190 9.706 1.00 0.00 C ATOM 306 CD GLN A 20 13.638 2.439 9.377 1.00 0.00 C ATOM 307 OE1 GLN A 20 14.009 2.522 8.223 1.00 0.00 O ATOM 308 NE2 GLN A 20 14.499 2.563 10.349 1.00 0.00 N ATOM 309 H GLN A 20 9.743 1.346 9.520 1.00 0.00 H ATOM 310 HA GLN A 20 9.867 3.105 7.307 1.00 0.00 H ATOM 311 HB2 GLN A 20 11.913 3.933 8.470 1.00 0.00 H ATOM 312 HB3 GLN A 20 10.581 3.639 9.597 1.00 0.00 H ATOM 313 HG2 GLN A 20 12.004 2.331 10.765 1.00 0.00 H ATOM 314 HG3 GLN A 20 11.903 1.177 9.435 1.00 0.00 H ATOM 315 HE21 GLN A 20 14.200 2.496 11.280 1.00 0.00 H ATOM 316 HE22 GLN A 20 15.445 2.721 10.148 1.00 0.00 H ATOM 317 N LEU A 21 11.383 2.087 5.576 1.00 0.00 N ATOM 318 CA LEU A 21 12.299 1.485 4.559 1.00 0.00 C ATOM 319 C LEU A 21 12.286 -0.044 4.663 1.00 0.00 C ATOM 320 O LEU A 21 13.076 -0.573 5.430 1.00 0.00 O ATOM 321 CB LEU A 21 13.687 2.036 4.896 1.00 0.00 C ATOM 322 CG LEU A 21 14.632 1.794 3.718 1.00 0.00 C ATOM 323 CD1 LEU A 21 14.595 2.999 2.776 1.00 0.00 C ATOM 324 CD2 LEU A 21 16.058 1.603 4.242 1.00 0.00 C ATOM 325 H LEU A 21 10.693 2.723 5.295 1.00 0.00 H ATOM 326 HA LEU A 21 12.012 1.795 3.567 1.00 0.00 H ATOM 327 HB2 LEU A 21 13.615 3.096 5.089 1.00 0.00 H ATOM 328 HB3 LEU A 21 14.071 1.536 5.772 1.00 0.00 H ATOM 329 HG LEU A 21 14.321 0.909 3.183 1.00 0.00 H ATOM 330 HD11 LEU A 21 13.624 3.470 2.833 1.00 0.00 H ATOM 331 HD12 LEU A 21 14.776 2.670 1.764 1.00 0.00 H ATOM 332 HD13 LEU A 21 15.357 3.707 3.067 1.00 0.00 H ATOM 333 HD21 LEU A 21 16.216 0.562 4.482 1.00 0.00 H ATOM 334 HD22 LEU A 21 16.198 2.203 5.128 1.00 0.00 H ATOM 335 HD23 LEU A 21 16.764 1.909 3.484 1.00 0.00 H HETATM 336 N NH2 A 22 11.451 -0.741 3.946 1.00 0.00 N HETATM 337 HN1 NH2 A 22 10.829 -0.285 3.338 1.00 0.00 H HETATM 338 HN2 NH2 A 22 11.445 -1.723 4.017 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 8 ATOM 1 N SER A 1 -6.045 13.845 -9.175 1.00 0.00 N ATOM 2 CA SER A 1 -7.268 14.278 -8.439 1.00 0.00 C ATOM 3 C SER A 1 -8.403 13.276 -8.665 1.00 0.00 C ATOM 4 O SER A 1 -9.554 13.646 -8.788 1.00 0.00 O ATOM 5 CB SER A 1 -7.627 15.639 -9.034 1.00 0.00 C ATOM 6 OG SER A 1 -6.506 16.507 -8.934 1.00 0.00 O ATOM 7 H1 SER A 1 -5.626 13.022 -8.698 1.00 0.00 H ATOM 8 H2 SER A 1 -5.355 14.625 -9.193 1.00 0.00 H ATOM 9 H3 SER A 1 -6.299 13.585 -10.149 1.00 0.00 H ATOM 10 HA SER A 1 -7.057 14.379 -7.387 1.00 0.00 H ATOM 11 HB2 SER A 1 -7.894 15.522 -10.072 1.00 0.00 H ATOM 12 HB3 SER A 1 -8.468 16.056 -8.494 1.00 0.00 H ATOM 13 HG SER A 1 -6.798 17.323 -8.524 1.00 0.00 H ATOM 14 N SER A 2 -8.087 12.010 -8.717 1.00 0.00 N ATOM 15 CA SER A 2 -9.145 10.981 -8.934 1.00 0.00 C ATOM 16 C SER A 2 -8.764 9.673 -8.236 1.00 0.00 C ATOM 17 O SER A 2 -7.903 9.645 -7.379 1.00 0.00 O ATOM 18 CB SER A 2 -9.203 10.785 -10.448 1.00 0.00 C ATOM 19 OG SER A 2 -9.325 12.052 -11.082 1.00 0.00 O ATOM 20 H SER A 2 -7.151 11.734 -8.614 1.00 0.00 H ATOM 21 HA SER A 2 -10.097 11.337 -8.572 1.00 0.00 H ATOM 22 HB2 SER A 2 -8.298 10.305 -10.785 1.00 0.00 H ATOM 23 HB3 SER A 2 -10.052 10.162 -10.698 1.00 0.00 H ATOM 24 HG SER A 2 -10.197 12.101 -11.481 1.00 0.00 H ATOM 25 N MET A 3 -9.397 8.591 -8.600 1.00 0.00 N ATOM 26 CA MET A 3 -9.073 7.283 -7.959 1.00 0.00 C ATOM 27 C MET A 3 -8.281 6.401 -8.929 1.00 0.00 C ATOM 28 O MET A 3 -8.845 5.703 -9.748 1.00 0.00 O ATOM 29 CB MET A 3 -10.428 6.650 -7.643 1.00 0.00 C ATOM 30 CG MET A 3 -11.079 7.397 -6.476 1.00 0.00 C ATOM 31 SD MET A 3 -12.068 8.770 -7.117 1.00 0.00 S ATOM 32 CE MET A 3 -12.886 9.205 -5.563 1.00 0.00 C ATOM 33 H MET A 3 -10.088 8.637 -9.294 1.00 0.00 H ATOM 34 HA MET A 3 -8.516 7.436 -7.048 1.00 0.00 H ATOM 35 HB2 MET A 3 -11.066 6.713 -8.512 1.00 0.00 H ATOM 36 HB3 MET A 3 -10.288 5.615 -7.372 1.00 0.00 H ATOM 37 HG2 MET A 3 -11.716 6.721 -5.928 1.00 0.00 H ATOM 38 HG3 MET A 3 -10.311 7.781 -5.822 1.00 0.00 H ATOM 39 HE1 MET A 3 -12.173 9.676 -4.901 1.00 0.00 H ATOM 40 HE2 MET A 3 -13.277 8.309 -5.100 1.00 0.00 H ATOM 41 HE3 MET A 3 -13.697 9.887 -5.759 1.00 0.00 H ATOM 42 N LYS A 4 -6.978 6.430 -8.841 1.00 0.00 N ATOM 43 CA LYS A 4 -6.148 5.594 -9.758 1.00 0.00 C ATOM 44 C LYS A 4 -6.130 4.140 -9.275 1.00 0.00 C ATOM 45 O LYS A 4 -6.427 3.853 -8.132 1.00 0.00 O ATOM 46 CB LYS A 4 -4.743 6.201 -9.687 1.00 0.00 C ATOM 47 CG LYS A 4 -4.266 6.558 -11.097 1.00 0.00 C ATOM 48 CD LYS A 4 -3.429 7.837 -11.045 1.00 0.00 C ATOM 49 CE LYS A 4 -4.314 9.045 -11.367 1.00 0.00 C ATOM 50 NZ LYS A 4 -4.563 9.701 -10.054 1.00 0.00 N ATOM 51 H LYS A 4 -6.546 7.001 -8.173 1.00 0.00 H ATOM 52 HA LYS A 4 -6.525 5.652 -10.766 1.00 0.00 H ATOM 53 HB2 LYS A 4 -4.768 7.094 -9.078 1.00 0.00 H ATOM 54 HB3 LYS A 4 -4.063 5.487 -9.250 1.00 0.00 H ATOM 55 HG2 LYS A 4 -3.666 5.748 -11.488 1.00 0.00 H ATOM 56 HG3 LYS A 4 -5.121 6.715 -11.737 1.00 0.00 H ATOM 57 HD2 LYS A 4 -3.007 7.952 -10.057 1.00 0.00 H ATOM 58 HD3 LYS A 4 -2.631 7.775 -11.770 1.00 0.00 H ATOM 59 HE2 LYS A 4 -3.798 9.719 -12.037 1.00 0.00 H ATOM 60 HE3 LYS A 4 -5.247 8.722 -11.802 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -5.068 9.044 -9.427 1.00 0.00 H ATOM 62 HZ2 LYS A 4 -5.139 10.554 -10.197 1.00 0.00 H ATOM 63 HZ3 LYS A 4 -3.654 9.965 -9.621 1.00 0.00 H ATOM 64 N LEU A 5 -5.783 3.223 -10.140 1.00 0.00 N ATOM 65 CA LEU A 5 -5.745 1.786 -9.735 1.00 0.00 C ATOM 66 C LEU A 5 -4.802 1.599 -8.542 1.00 0.00 C ATOM 67 O LEU A 5 -4.316 2.554 -7.968 1.00 0.00 O ATOM 68 CB LEU A 5 -5.217 1.036 -10.962 1.00 0.00 C ATOM 69 CG LEU A 5 -6.249 0.000 -11.414 1.00 0.00 C ATOM 70 CD1 LEU A 5 -7.174 0.624 -12.461 1.00 0.00 C ATOM 71 CD2 LEU A 5 -5.528 -1.204 -12.024 1.00 0.00 C ATOM 72 H LEU A 5 -5.550 3.480 -11.056 1.00 0.00 H ATOM 73 HA LEU A 5 -6.736 1.442 -9.490 1.00 0.00 H ATOM 74 HB2 LEU A 5 -5.035 1.737 -11.764 1.00 0.00 H ATOM 75 HB3 LEU A 5 -4.296 0.533 -10.708 1.00 0.00 H ATOM 76 HG LEU A 5 -6.834 -0.319 -10.563 1.00 0.00 H ATOM 77 HD11 LEU A 5 -7.535 -0.147 -13.127 1.00 0.00 H ATOM 78 HD12 LEU A 5 -6.628 1.363 -13.028 1.00 0.00 H ATOM 79 HD13 LEU A 5 -8.011 1.095 -11.968 1.00 0.00 H ATOM 80 HD21 LEU A 5 -5.371 -1.034 -13.078 1.00 0.00 H ATOM 81 HD22 LEU A 5 -6.130 -2.090 -11.888 1.00 0.00 H ATOM 82 HD23 LEU A 5 -4.575 -1.338 -11.535 1.00 0.00 H ATOM 83 N SER A 6 -4.541 0.376 -8.166 1.00 0.00 N ATOM 84 CA SER A 6 -3.631 0.129 -7.009 1.00 0.00 C ATOM 85 C SER A 6 -2.710 -1.058 -7.303 1.00 0.00 C ATOM 86 O SER A 6 -2.842 -2.118 -6.723 1.00 0.00 O ATOM 87 CB SER A 6 -4.559 -0.188 -5.838 1.00 0.00 C ATOM 88 OG SER A 6 -4.708 0.972 -5.030 1.00 0.00 O ATOM 89 H SER A 6 -4.944 -0.380 -8.642 1.00 0.00 H ATOM 90 HA SER A 6 -3.052 1.012 -6.792 1.00 0.00 H ATOM 91 HB2 SER A 6 -5.524 -0.487 -6.211 1.00 0.00 H ATOM 92 HB3 SER A 6 -4.136 -0.994 -5.253 1.00 0.00 H ATOM 93 HG SER A 6 -5.027 1.685 -5.589 1.00 0.00 H ATOM 94 N PHE A 7 -1.774 -0.886 -8.199 1.00 0.00 N ATOM 95 CA PHE A 7 -0.841 -2.002 -8.532 1.00 0.00 C ATOM 96 C PHE A 7 -0.079 -2.446 -7.280 1.00 0.00 C ATOM 97 O PHE A 7 -0.039 -3.616 -6.947 1.00 0.00 O ATOM 98 CB PHE A 7 0.124 -1.417 -9.566 1.00 0.00 C ATOM 99 CG PHE A 7 -0.315 -1.822 -10.953 1.00 0.00 C ATOM 100 CD1 PHE A 7 -0.457 -3.176 -11.274 1.00 0.00 C ATOM 101 CD2 PHE A 7 -0.579 -0.842 -11.917 1.00 0.00 C ATOM 102 CE1 PHE A 7 -0.865 -3.552 -12.560 1.00 0.00 C ATOM 103 CE2 PHE A 7 -0.986 -1.217 -13.203 1.00 0.00 C ATOM 104 CZ PHE A 7 -1.128 -2.572 -13.524 1.00 0.00 C ATOM 105 H PHE A 7 -1.686 -0.024 -8.654 1.00 0.00 H ATOM 106 HA PHE A 7 -1.383 -2.829 -8.959 1.00 0.00 H ATOM 107 HB2 PHE A 7 0.126 -0.340 -9.488 1.00 0.00 H ATOM 108 HB3 PHE A 7 1.119 -1.793 -9.381 1.00 0.00 H ATOM 109 HD1 PHE A 7 -0.253 -3.931 -10.529 1.00 0.00 H ATOM 110 HD2 PHE A 7 -0.470 0.204 -11.669 1.00 0.00 H ATOM 111 HE1 PHE A 7 -0.974 -4.597 -12.807 1.00 0.00 H ATOM 112 HE2 PHE A 7 -1.190 -0.461 -13.946 1.00 0.00 H ATOM 113 HZ PHE A 7 -1.443 -2.862 -14.516 1.00 0.00 H ATOM 114 N ARG A 8 0.527 -1.520 -6.587 1.00 0.00 N ATOM 115 CA ARG A 8 1.290 -1.880 -5.356 1.00 0.00 C ATOM 116 C ARG A 8 0.484 -1.509 -4.109 1.00 0.00 C ATOM 117 O ARG A 8 0.486 -2.214 -3.119 1.00 0.00 O ATOM 118 CB ARG A 8 2.577 -1.053 -5.445 1.00 0.00 C ATOM 119 CG ARG A 8 3.340 -1.126 -4.120 1.00 0.00 C ATOM 120 CD ARG A 8 4.580 -0.233 -4.197 1.00 0.00 C ATOM 121 NE ARG A 8 4.066 1.157 -4.045 1.00 0.00 N ATOM 122 CZ ARG A 8 4.901 2.158 -3.991 1.00 0.00 C ATOM 123 NH1 ARG A 8 5.843 2.271 -4.887 1.00 0.00 N ATOM 124 NH2 ARG A 8 4.792 3.049 -3.044 1.00 0.00 N ATOM 125 H ARG A 8 0.480 -0.586 -6.878 1.00 0.00 H ATOM 126 HA ARG A 8 1.523 -2.926 -5.352 1.00 0.00 H ATOM 127 HB2 ARG A 8 3.199 -1.442 -6.239 1.00 0.00 H ATOM 128 HB3 ARG A 8 2.328 -0.024 -5.657 1.00 0.00 H ATOM 129 HG2 ARG A 8 2.699 -0.786 -3.319 1.00 0.00 H ATOM 130 HG3 ARG A 8 3.642 -2.145 -3.933 1.00 0.00 H ATOM 131 HD2 ARG A 8 5.265 -0.474 -3.394 1.00 0.00 H ATOM 132 HD3 ARG A 8 5.066 -0.345 -5.153 1.00 0.00 H ATOM 133 HE ARG A 8 3.101 1.320 -3.986 1.00 0.00 H ATOM 134 HH11 ARG A 8 5.925 1.589 -5.615 1.00 0.00 H ATOM 135 HH12 ARG A 8 6.483 3.039 -4.845 1.00 0.00 H ATOM 136 HH21 ARG A 8 4.070 2.963 -2.358 1.00 0.00 H ATOM 137 HH22 ARG A 8 5.431 3.816 -3.002 1.00 0.00 H ATOM 138 N ALA A 9 -0.196 -0.403 -4.157 1.00 0.00 N ATOM 139 CA ALA A 9 -1.006 0.040 -2.985 1.00 0.00 C ATOM 140 C ALA A 9 -2.110 -0.972 -2.666 1.00 0.00 C ATOM 141 O ALA A 9 -2.706 -0.937 -1.607 1.00 0.00 O ATOM 142 CB ALA A 9 -1.617 1.375 -3.406 1.00 0.00 C ATOM 143 H ALA A 9 -0.169 0.140 -4.967 1.00 0.00 H ATOM 144 HA ALA A 9 -0.372 0.184 -2.130 1.00 0.00 H ATOM 145 HB1 ALA A 9 -1.644 2.042 -2.557 1.00 0.00 H ATOM 146 HB2 ALA A 9 -2.621 1.213 -3.769 1.00 0.00 H ATOM 147 HB3 ALA A 9 -1.018 1.814 -4.189 1.00 0.00 H ATOM 148 N ARG A 10 -2.389 -1.875 -3.569 1.00 0.00 N ATOM 149 CA ARG A 10 -3.453 -2.886 -3.311 1.00 0.00 C ATOM 150 C ARG A 10 -3.091 -3.740 -2.087 1.00 0.00 C ATOM 151 O ARG A 10 -3.923 -4.440 -1.543 1.00 0.00 O ATOM 152 CB ARG A 10 -3.534 -3.704 -4.607 1.00 0.00 C ATOM 153 CG ARG A 10 -3.925 -5.154 -4.315 1.00 0.00 C ATOM 154 CD ARG A 10 -2.687 -5.897 -3.831 1.00 0.00 C ATOM 155 NE ARG A 10 -3.169 -6.791 -2.743 1.00 0.00 N ATOM 156 CZ ARG A 10 -3.493 -8.027 -3.008 1.00 0.00 C ATOM 157 NH1 ARG A 10 -4.194 -8.304 -4.074 1.00 0.00 N ATOM 158 NH2 ARG A 10 -3.118 -8.987 -2.206 1.00 0.00 N ATOM 159 H ARG A 10 -1.900 -1.889 -4.415 1.00 0.00 H ATOM 160 HA ARG A 10 -4.381 -2.401 -3.147 1.00 0.00 H ATOM 161 HB2 ARG A 10 -4.272 -3.263 -5.261 1.00 0.00 H ATOM 162 HB3 ARG A 10 -2.576 -3.683 -5.091 1.00 0.00 H ATOM 163 HG2 ARG A 10 -4.688 -5.179 -3.549 1.00 0.00 H ATOM 164 HG3 ARG A 10 -4.296 -5.621 -5.215 1.00 0.00 H ATOM 165 HD2 ARG A 10 -2.253 -6.473 -4.637 1.00 0.00 H ATOM 166 HD3 ARG A 10 -1.974 -5.187 -3.442 1.00 0.00 H ATOM 167 HE ARG A 10 -3.245 -6.451 -1.826 1.00 0.00 H ATOM 168 HH11 ARG A 10 -4.482 -7.569 -4.687 1.00 0.00 H ATOM 169 HH12 ARG A 10 -4.442 -9.252 -4.276 1.00 0.00 H ATOM 170 HH21 ARG A 10 -2.583 -8.774 -1.389 1.00 0.00 H ATOM 171 HH22 ARG A 10 -3.366 -9.934 -2.410 1.00 0.00 H ATOM 172 N ALA A 11 -1.859 -3.688 -1.651 1.00 0.00 N ATOM 173 CA ALA A 11 -1.451 -4.492 -0.470 1.00 0.00 C ATOM 174 C ALA A 11 -0.492 -3.693 0.410 1.00 0.00 C ATOM 175 O ALA A 11 0.533 -4.189 0.837 1.00 0.00 O ATOM 176 CB ALA A 11 -0.761 -5.729 -1.045 1.00 0.00 C ATOM 177 H ALA A 11 -1.206 -3.122 -2.096 1.00 0.00 H ATOM 178 HA ALA A 11 -2.313 -4.779 0.091 1.00 0.00 H ATOM 179 HB1 ALA A 11 0.126 -5.948 -0.469 1.00 0.00 H ATOM 180 HB2 ALA A 11 -0.484 -5.542 -2.072 1.00 0.00 H ATOM 181 HB3 ALA A 11 -1.435 -6.571 -1.001 1.00 0.00 H ATOM 182 N TYR A 12 -0.812 -2.456 0.675 1.00 0.00 N ATOM 183 CA TYR A 12 0.069 -1.621 1.507 1.00 0.00 C ATOM 184 C TYR A 12 -0.583 -1.343 2.864 1.00 0.00 C ATOM 185 O TYR A 12 -0.610 -0.222 3.334 1.00 0.00 O ATOM 186 CB TYR A 12 0.216 -0.344 0.695 1.00 0.00 C ATOM 187 CG TYR A 12 1.674 -0.098 0.402 1.00 0.00 C ATOM 188 CD1 TYR A 12 2.440 -1.116 -0.178 1.00 0.00 C ATOM 189 CD2 TYR A 12 2.260 1.135 0.707 1.00 0.00 C ATOM 190 CE1 TYR A 12 3.794 -0.901 -0.454 1.00 0.00 C ATOM 191 CE2 TYR A 12 3.615 1.351 0.431 1.00 0.00 C ATOM 192 CZ TYR A 12 4.383 0.333 -0.150 1.00 0.00 C ATOM 193 OH TYR A 12 5.719 0.547 -0.422 1.00 0.00 O ATOM 194 H TYR A 12 -1.627 -2.068 0.319 1.00 0.00 H ATOM 195 HA TYR A 12 1.021 -2.091 1.631 1.00 0.00 H ATOM 196 HB2 TYR A 12 -0.324 -0.446 -0.237 1.00 0.00 H ATOM 197 HB3 TYR A 12 -0.191 0.474 1.251 1.00 0.00 H ATOM 198 HD1 TYR A 12 1.980 -2.070 -0.412 1.00 0.00 H ATOM 199 HD2 TYR A 12 1.667 1.919 1.154 1.00 0.00 H ATOM 200 HE1 TYR A 12 4.386 -1.686 -0.903 1.00 0.00 H ATOM 201 HE2 TYR A 12 4.069 2.303 0.666 1.00 0.00 H ATOM 202 HH TYR A 12 6.147 0.820 0.392 1.00 0.00 H ATOM 203 N SER A 13 -1.108 -2.358 3.497 1.00 0.00 N ATOM 204 CA SER A 13 -1.760 -2.160 4.824 1.00 0.00 C ATOM 205 C SER A 13 -1.408 -3.316 5.764 1.00 0.00 C ATOM 206 O SER A 13 -2.263 -4.074 6.179 1.00 0.00 O ATOM 207 CB SER A 13 -3.259 -2.143 4.530 1.00 0.00 C ATOM 208 OG SER A 13 -3.573 -3.200 3.632 1.00 0.00 O ATOM 209 H SER A 13 -1.074 -3.253 3.098 1.00 0.00 H ATOM 210 HA SER A 13 -1.458 -1.219 5.255 1.00 0.00 H ATOM 211 HB2 SER A 13 -3.810 -2.279 5.445 1.00 0.00 H ATOM 212 HB3 SER A 13 -3.527 -1.191 4.089 1.00 0.00 H ATOM 213 HG SER A 13 -3.379 -4.031 4.073 1.00 0.00 H ATOM 214 N PHE A 14 -0.153 -3.457 6.101 1.00 0.00 N ATOM 215 CA PHE A 14 0.259 -4.562 7.012 1.00 0.00 C ATOM 216 C PHE A 14 0.031 -4.159 8.471 1.00 0.00 C ATOM 217 O PHE A 14 -0.742 -4.773 9.182 1.00 0.00 O ATOM 218 CB PHE A 14 1.743 -4.763 6.738 1.00 0.00 C ATOM 219 CG PHE A 14 2.085 -6.230 6.844 1.00 0.00 C ATOM 220 CD1 PHE A 14 1.979 -6.886 8.076 1.00 0.00 C ATOM 221 CD2 PHE A 14 2.507 -6.934 5.709 1.00 0.00 C ATOM 222 CE1 PHE A 14 2.296 -8.246 8.173 1.00 0.00 C ATOM 223 CE2 PHE A 14 2.824 -8.294 5.807 1.00 0.00 C ATOM 224 CZ PHE A 14 2.718 -8.950 7.039 1.00 0.00 C ATOM 225 H PHE A 14 0.519 -2.834 5.754 1.00 0.00 H ATOM 226 HA PHE A 14 -0.278 -5.462 6.783 1.00 0.00 H ATOM 227 HB2 PHE A 14 1.979 -4.406 5.745 1.00 0.00 H ATOM 228 HB3 PHE A 14 2.311 -4.211 7.462 1.00 0.00 H ATOM 229 HD1 PHE A 14 1.654 -6.343 8.950 1.00 0.00 H ATOM 230 HD2 PHE A 14 2.588 -6.428 4.758 1.00 0.00 H ATOM 231 HE1 PHE A 14 2.215 -8.752 9.125 1.00 0.00 H ATOM 232 HE2 PHE A 14 3.150 -8.838 4.933 1.00 0.00 H ATOM 233 HZ PHE A 14 2.962 -10.000 7.115 1.00 0.00 H ATOM 234 N ARG A 15 0.699 -3.130 8.923 1.00 0.00 N ATOM 235 CA ARG A 15 0.530 -2.681 10.324 1.00 0.00 C ATOM 236 C ARG A 15 0.190 -1.192 10.343 1.00 0.00 C ATOM 237 O ARG A 15 -0.789 -0.757 9.769 1.00 0.00 O ATOM 238 CB ARG A 15 1.885 -2.980 10.980 1.00 0.00 C ATOM 239 CG ARG A 15 1.729 -2.982 12.502 1.00 0.00 C ATOM 240 CD ARG A 15 1.076 -4.293 12.947 1.00 0.00 C ATOM 241 NE ARG A 15 1.555 -4.506 14.341 1.00 0.00 N ATOM 242 CZ ARG A 15 2.776 -4.910 14.558 1.00 0.00 C ATOM 243 NH1 ARG A 15 3.252 -5.932 13.901 1.00 0.00 N ATOM 244 NH2 ARG A 15 3.523 -4.291 15.431 1.00 0.00 N ATOM 245 H ARG A 15 1.317 -2.647 8.340 1.00 0.00 H ATOM 246 HA ARG A 15 -0.235 -3.231 10.818 1.00 0.00 H ATOM 247 HB2 ARG A 15 2.234 -3.948 10.653 1.00 0.00 H ATOM 248 HB3 ARG A 15 2.602 -2.226 10.693 1.00 0.00 H ATOM 249 HG2 ARG A 15 2.701 -2.888 12.965 1.00 0.00 H ATOM 250 HG3 ARG A 15 1.105 -2.153 12.802 1.00 0.00 H ATOM 251 HD2 ARG A 15 -0.001 -4.202 12.925 1.00 0.00 H ATOM 252 HD3 ARG A 15 1.400 -5.107 12.317 1.00 0.00 H ATOM 253 HE ARG A 15 0.952 -4.341 15.096 1.00 0.00 H ATOM 254 HH11 ARG A 15 2.680 -6.407 13.232 1.00 0.00 H ATOM 255 HH12 ARG A 15 4.188 -6.242 14.068 1.00 0.00 H ATOM 256 HH21 ARG A 15 3.158 -3.507 15.934 1.00 0.00 H ATOM 257 HH22 ARG A 15 4.459 -4.600 15.598 1.00 0.00 H ATOM 258 N GLY A 16 0.988 -0.422 10.995 1.00 0.00 N ATOM 259 CA GLY A 16 0.739 1.045 11.071 1.00 0.00 C ATOM 260 C GLY A 16 2.059 1.780 11.294 1.00 0.00 C ATOM 261 O GLY A 16 2.639 2.319 10.373 1.00 0.00 O ATOM 262 H GLY A 16 1.754 -0.815 11.436 1.00 0.00 H ATOM 263 HA2 GLY A 16 0.286 1.385 10.151 1.00 0.00 H ATOM 264 HA3 GLY A 16 0.079 1.260 11.903 1.00 0.00 H ATOM 265 N PRO A 17 2.474 1.793 12.530 1.00 0.00 N ATOM 266 CA PRO A 17 3.708 2.473 12.938 1.00 0.00 C ATOM 267 C PRO A 17 4.863 1.474 13.067 1.00 0.00 C ATOM 268 O PRO A 17 5.159 0.989 14.142 1.00 0.00 O ATOM 269 CB PRO A 17 3.304 3.038 14.301 1.00 0.00 C ATOM 270 CG PRO A 17 2.165 2.171 14.780 1.00 0.00 C ATOM 271 CD PRO A 17 1.846 1.183 13.691 1.00 0.00 C ATOM 272 HA PRO A 17 3.956 3.273 12.262 1.00 0.00 H ATOM 273 HB2 PRO A 17 4.135 2.981 14.989 1.00 0.00 H ATOM 274 HB3 PRO A 17 2.968 4.054 14.203 1.00 0.00 H ATOM 275 HG2 PRO A 17 2.451 1.657 15.680 1.00 0.00 H ATOM 276 HG3 PRO A 17 1.292 2.780 14.961 1.00 0.00 H ATOM 277 HD2 PRO A 17 2.285 0.219 13.911 1.00 0.00 H ATOM 278 HD3 PRO A 17 0.782 1.101 13.548 1.00 0.00 H ATOM 279 N GLY A 18 5.517 1.166 11.979 1.00 0.00 N ATOM 280 CA GLY A 18 6.652 0.200 12.037 1.00 0.00 C ATOM 281 C GLY A 18 6.317 -1.039 11.200 1.00 0.00 C ATOM 282 O GLY A 18 5.812 -2.015 11.719 1.00 0.00 O ATOM 283 H GLY A 18 5.260 1.570 11.124 1.00 0.00 H ATOM 284 HA2 GLY A 18 7.543 0.670 11.644 1.00 0.00 H ATOM 285 HA3 GLY A 18 6.821 -0.095 13.060 1.00 0.00 H ATOM 286 N PRO A 19 6.610 -0.960 9.927 1.00 0.00 N ATOM 287 CA PRO A 19 6.342 -2.079 9.010 1.00 0.00 C ATOM 288 C PRO A 19 7.522 -3.054 8.968 1.00 0.00 C ATOM 289 O PRO A 19 8.531 -2.794 8.343 1.00 0.00 O ATOM 290 CB PRO A 19 6.140 -1.399 7.671 1.00 0.00 C ATOM 291 CG PRO A 19 6.837 -0.081 7.773 1.00 0.00 C ATOM 292 CD PRO A 19 7.213 0.161 9.217 1.00 0.00 C ATOM 293 HA PRO A 19 5.440 -2.572 9.288 1.00 0.00 H ATOM 294 HB2 PRO A 19 6.578 -1.994 6.881 1.00 0.00 H ATOM 295 HB3 PRO A 19 5.089 -1.244 7.485 1.00 0.00 H ATOM 296 HG2 PRO A 19 7.719 -0.076 7.149 1.00 0.00 H ATOM 297 HG3 PRO A 19 6.158 0.679 7.458 1.00 0.00 H ATOM 298 HD2 PRO A 19 8.288 0.155 9.334 1.00 0.00 H ATOM 299 HD3 PRO A 19 6.797 1.092 9.567 1.00 0.00 H ATOM 300 N GLN A 20 7.401 -4.176 9.630 1.00 0.00 N ATOM 301 CA GLN A 20 8.513 -5.177 9.634 1.00 0.00 C ATOM 302 C GLN A 20 9.831 -4.510 10.042 1.00 0.00 C ATOM 303 O GLN A 20 10.835 -4.633 9.369 1.00 0.00 O ATOM 304 CB GLN A 20 8.592 -5.693 8.193 1.00 0.00 C ATOM 305 CG GLN A 20 8.629 -7.224 8.198 1.00 0.00 C ATOM 306 CD GLN A 20 10.082 -7.701 8.119 1.00 0.00 C ATOM 307 OE1 GLN A 20 10.983 -7.017 8.559 1.00 0.00 O ATOM 308 NE2 GLN A 20 10.346 -8.856 7.572 1.00 0.00 N ATOM 309 H GLN A 20 6.577 -4.363 10.126 1.00 0.00 H ATOM 310 HA GLN A 20 8.281 -5.991 10.304 1.00 0.00 H ATOM 311 HB2 GLN A 20 7.723 -5.356 7.643 1.00 0.00 H ATOM 312 HB3 GLN A 20 9.490 -5.315 7.722 1.00 0.00 H ATOM 313 HG2 GLN A 20 8.178 -7.592 9.108 1.00 0.00 H ATOM 314 HG3 GLN A 20 8.083 -7.600 7.346 1.00 0.00 H ATOM 315 HE21 GLN A 20 9.619 -9.409 7.217 1.00 0.00 H ATOM 316 HE22 GLN A 20 11.273 -9.171 7.517 1.00 0.00 H ATOM 317 N LEU A 21 9.833 -3.805 11.142 1.00 0.00 N ATOM 318 CA LEU A 21 11.083 -3.129 11.596 1.00 0.00 C ATOM 319 C LEU A 21 12.012 -4.138 12.275 1.00 0.00 C ATOM 320 O LEU A 21 12.721 -3.743 13.187 1.00 0.00 O ATOM 321 CB LEU A 21 10.619 -2.065 12.596 1.00 0.00 C ATOM 322 CG LEU A 21 11.237 -0.714 12.233 1.00 0.00 C ATOM 323 CD1 LEU A 21 10.265 0.074 11.354 1.00 0.00 C ATOM 324 CD2 LEU A 21 11.520 0.077 13.513 1.00 0.00 C ATOM 325 H LEU A 21 9.011 -3.720 11.668 1.00 0.00 H ATOM 326 HA LEU A 21 11.581 -2.659 10.762 1.00 0.00 H ATOM 327 HB2 LEU A 21 9.541 -1.989 12.566 1.00 0.00 H ATOM 328 HB3 LEU A 21 10.930 -2.346 13.591 1.00 0.00 H ATOM 329 HG LEU A 21 12.161 -0.874 11.695 1.00 0.00 H ATOM 330 HD11 LEU A 21 9.662 -0.613 10.778 1.00 0.00 H ATOM 331 HD12 LEU A 21 10.822 0.713 10.684 1.00 0.00 H ATOM 332 HD13 LEU A 21 9.624 0.678 11.978 1.00 0.00 H ATOM 333 HD21 LEU A 21 10.595 0.485 13.895 1.00 0.00 H ATOM 334 HD22 LEU A 21 12.205 0.882 13.294 1.00 0.00 H ATOM 335 HD23 LEU A 21 11.958 -0.578 14.252 1.00 0.00 H HETATM 336 N NH2 A 22 12.033 -5.379 11.877 1.00 0.00 N HETATM 337 HN1 NH2 A 22 11.449 -5.667 11.137 1.00 0.00 H HETATM 338 HN2 NH2 A 22 12.631 -6.026 12.316 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 9 ATOM 1 N SER A 1 -7.202 11.067 -16.305 1.00 0.00 N ATOM 2 CA SER A 1 -8.669 11.223 -16.084 1.00 0.00 C ATOM 3 C SER A 1 -9.113 10.395 -14.875 1.00 0.00 C ATOM 4 O SER A 1 -9.232 9.188 -14.949 1.00 0.00 O ATOM 5 CB SER A 1 -9.320 10.697 -17.362 1.00 0.00 C ATOM 6 OG SER A 1 -9.661 11.794 -18.200 1.00 0.00 O ATOM 7 H1 SER A 1 -6.885 11.747 -17.024 1.00 0.00 H ATOM 8 H2 SER A 1 -7.003 10.098 -16.630 1.00 0.00 H ATOM 9 H3 SER A 1 -6.696 11.246 -15.415 1.00 0.00 H ATOM 10 HA SER A 1 -8.920 12.262 -15.942 1.00 0.00 H ATOM 11 HB2 SER A 1 -8.629 10.055 -17.883 1.00 0.00 H ATOM 12 HB3 SER A 1 -10.209 10.135 -17.107 1.00 0.00 H ATOM 13 HG SER A 1 -8.884 12.028 -18.713 1.00 0.00 H ATOM 14 N SER A 2 -9.360 11.036 -13.762 1.00 0.00 N ATOM 15 CA SER A 2 -9.797 10.292 -12.540 1.00 0.00 C ATOM 16 C SER A 2 -8.828 9.145 -12.234 1.00 0.00 C ATOM 17 O SER A 2 -9.205 7.990 -12.210 1.00 0.00 O ATOM 18 CB SER A 2 -11.186 9.746 -12.881 1.00 0.00 C ATOM 19 OG SER A 2 -12.063 10.830 -13.156 1.00 0.00 O ATOM 20 H SER A 2 -9.256 12.010 -13.728 1.00 0.00 H ATOM 21 HA SER A 2 -9.865 10.962 -11.698 1.00 0.00 H ATOM 22 HB2 SER A 2 -11.121 9.113 -13.750 1.00 0.00 H ATOM 23 HB3 SER A 2 -11.559 9.169 -12.045 1.00 0.00 H ATOM 24 HG SER A 2 -12.550 11.028 -12.352 1.00 0.00 H ATOM 25 N MET A 3 -7.582 9.458 -11.998 1.00 0.00 N ATOM 26 CA MET A 3 -6.587 8.389 -11.692 1.00 0.00 C ATOM 27 C MET A 3 -6.370 8.286 -10.180 1.00 0.00 C ATOM 28 O MET A 3 -6.330 9.280 -9.480 1.00 0.00 O ATOM 29 CB MET A 3 -5.300 8.834 -12.389 1.00 0.00 C ATOM 30 CG MET A 3 -5.169 8.111 -13.732 1.00 0.00 C ATOM 31 SD MET A 3 -3.418 7.865 -14.119 1.00 0.00 S ATOM 32 CE MET A 3 -2.998 9.603 -14.392 1.00 0.00 C ATOM 33 H MET A 3 -7.300 10.396 -12.022 1.00 0.00 H ATOM 34 HA MET A 3 -6.915 7.443 -12.092 1.00 0.00 H ATOM 35 HB2 MET A 3 -5.331 9.901 -12.555 1.00 0.00 H ATOM 36 HB3 MET A 3 -4.451 8.591 -11.767 1.00 0.00 H ATOM 37 HG2 MET A 3 -5.664 7.152 -13.673 1.00 0.00 H ATOM 38 HG3 MET A 3 -5.629 8.706 -14.507 1.00 0.00 H ATOM 39 HE1 MET A 3 -3.614 10.225 -13.757 1.00 0.00 H ATOM 40 HE2 MET A 3 -3.171 9.855 -15.430 1.00 0.00 H ATOM 41 HE3 MET A 3 -1.959 9.766 -14.153 1.00 0.00 H ATOM 42 N LYS A 4 -6.231 7.091 -9.672 1.00 0.00 N ATOM 43 CA LYS A 4 -6.017 6.920 -8.204 1.00 0.00 C ATOM 44 C LYS A 4 -5.015 5.793 -7.942 1.00 0.00 C ATOM 45 O LYS A 4 -5.319 4.627 -8.103 1.00 0.00 O ATOM 46 CB LYS A 4 -7.395 6.562 -7.637 1.00 0.00 C ATOM 47 CG LYS A 4 -7.950 5.326 -8.354 1.00 0.00 C ATOM 48 CD LYS A 4 -9.294 5.668 -9.002 1.00 0.00 C ATOM 49 CE LYS A 4 -10.373 5.768 -7.921 1.00 0.00 C ATOM 50 NZ LYS A 4 -11.038 4.436 -7.916 1.00 0.00 N ATOM 51 H LYS A 4 -6.267 6.304 -10.256 1.00 0.00 H ATOM 52 HA LYS A 4 -5.669 7.843 -7.766 1.00 0.00 H ATOM 53 HB2 LYS A 4 -7.303 6.354 -6.580 1.00 0.00 H ATOM 54 HB3 LYS A 4 -8.069 7.393 -7.782 1.00 0.00 H ATOM 55 HG2 LYS A 4 -7.254 5.008 -9.117 1.00 0.00 H ATOM 56 HG3 LYS A 4 -8.090 4.529 -7.639 1.00 0.00 H ATOM 57 HD2 LYS A 4 -9.214 6.612 -9.521 1.00 0.00 H ATOM 58 HD3 LYS A 4 -9.563 4.893 -9.704 1.00 0.00 H ATOM 59 HE2 LYS A 4 -9.921 5.970 -6.959 1.00 0.00 H ATOM 60 HE3 LYS A 4 -11.087 6.537 -8.171 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -10.346 3.703 -7.665 1.00 0.00 H ATOM 62 HZ2 LYS A 4 -11.424 4.238 -8.860 1.00 0.00 H ATOM 63 HZ3 LYS A 4 -11.810 4.438 -7.219 1.00 0.00 H ATOM 64 N LEU A 5 -3.819 6.133 -7.541 1.00 0.00 N ATOM 65 CA LEU A 5 -2.790 5.085 -7.269 1.00 0.00 C ATOM 66 C LEU A 5 -3.308 4.087 -6.228 1.00 0.00 C ATOM 67 O LEU A 5 -4.422 4.192 -5.755 1.00 0.00 O ATOM 68 CB LEU A 5 -1.578 5.846 -6.725 1.00 0.00 C ATOM 69 CG LEU A 5 -0.488 5.910 -7.797 1.00 0.00 C ATOM 70 CD1 LEU A 5 0.247 7.248 -7.700 1.00 0.00 C ATOM 71 CD2 LEU A 5 0.507 4.767 -7.582 1.00 0.00 C ATOM 72 H LEU A 5 -3.595 7.079 -7.421 1.00 0.00 H ATOM 73 HA LEU A 5 -2.525 4.575 -8.181 1.00 0.00 H ATOM 74 HB2 LEU A 5 -1.875 6.849 -6.453 1.00 0.00 H ATOM 75 HB3 LEU A 5 -1.193 5.337 -5.854 1.00 0.00 H ATOM 76 HG LEU A 5 -0.940 5.818 -8.775 1.00 0.00 H ATOM 77 HD11 LEU A 5 -0.340 8.017 -8.181 1.00 0.00 H ATOM 78 HD12 LEU A 5 1.206 7.168 -8.189 1.00 0.00 H ATOM 79 HD13 LEU A 5 0.393 7.504 -6.661 1.00 0.00 H ATOM 80 HD21 LEU A 5 1.364 4.910 -8.223 1.00 0.00 H ATOM 81 HD22 LEU A 5 0.031 3.827 -7.821 1.00 0.00 H ATOM 82 HD23 LEU A 5 0.826 4.757 -6.550 1.00 0.00 H ATOM 83 N SER A 6 -2.503 3.119 -5.870 1.00 0.00 N ATOM 84 CA SER A 6 -2.939 2.107 -4.860 1.00 0.00 C ATOM 85 C SER A 6 -4.283 1.491 -5.261 1.00 0.00 C ATOM 86 O SER A 6 -5.150 1.279 -4.435 1.00 0.00 O ATOM 87 CB SER A 6 -3.073 2.881 -3.548 1.00 0.00 C ATOM 88 OG SER A 6 -1.907 2.680 -2.761 1.00 0.00 O ATOM 89 H SER A 6 -1.609 3.057 -6.267 1.00 0.00 H ATOM 90 HA SER A 6 -2.191 1.337 -4.754 1.00 0.00 H ATOM 91 HB2 SER A 6 -3.183 3.933 -3.756 1.00 0.00 H ATOM 92 HB3 SER A 6 -3.946 2.531 -3.012 1.00 0.00 H ATOM 93 HG SER A 6 -2.047 1.905 -2.214 1.00 0.00 H ATOM 94 N PHE A 7 -4.462 1.203 -6.523 1.00 0.00 N ATOM 95 CA PHE A 7 -5.750 0.600 -6.979 1.00 0.00 C ATOM 96 C PHE A 7 -6.001 -0.725 -6.253 1.00 0.00 C ATOM 97 O PHE A 7 -7.075 -0.969 -5.739 1.00 0.00 O ATOM 98 CB PHE A 7 -5.574 0.364 -8.482 1.00 0.00 C ATOM 99 CG PHE A 7 -6.406 1.360 -9.254 1.00 0.00 C ATOM 100 CD1 PHE A 7 -7.802 1.327 -9.160 1.00 0.00 C ATOM 101 CD2 PHE A 7 -5.783 2.315 -10.066 1.00 0.00 C ATOM 102 CE1 PHE A 7 -8.575 2.249 -9.877 1.00 0.00 C ATOM 103 CE2 PHE A 7 -6.555 3.238 -10.782 1.00 0.00 C ATOM 104 CZ PHE A 7 -7.951 3.204 -10.687 1.00 0.00 C ATOM 105 H PHE A 7 -3.752 1.383 -7.170 1.00 0.00 H ATOM 106 HA PHE A 7 -6.564 1.284 -6.806 1.00 0.00 H ATOM 107 HB2 PHE A 7 -4.532 0.485 -8.745 1.00 0.00 H ATOM 108 HB3 PHE A 7 -5.892 -0.637 -8.729 1.00 0.00 H ATOM 109 HD1 PHE A 7 -8.284 0.591 -8.534 1.00 0.00 H ATOM 110 HD2 PHE A 7 -4.704 2.341 -10.139 1.00 0.00 H ATOM 111 HE1 PHE A 7 -9.652 2.224 -9.803 1.00 0.00 H ATOM 112 HE2 PHE A 7 -6.073 3.975 -11.408 1.00 0.00 H ATOM 113 HZ PHE A 7 -8.547 3.916 -11.240 1.00 0.00 H ATOM 114 N ARG A 8 -5.017 -1.582 -6.209 1.00 0.00 N ATOM 115 CA ARG A 8 -5.191 -2.893 -5.518 1.00 0.00 C ATOM 116 C ARG A 8 -4.409 -2.901 -4.202 1.00 0.00 C ATOM 117 O ARG A 8 -4.784 -3.552 -3.247 1.00 0.00 O ATOM 118 CB ARG A 8 -4.632 -3.929 -6.502 1.00 0.00 C ATOM 119 CG ARG A 8 -4.339 -5.242 -5.773 1.00 0.00 C ATOM 120 CD ARG A 8 -3.894 -6.300 -6.786 1.00 0.00 C ATOM 121 NE ARG A 8 -2.432 -6.076 -6.957 1.00 0.00 N ATOM 122 CZ ARG A 8 -1.937 -5.881 -8.149 1.00 0.00 C ATOM 123 NH1 ARG A 8 -2.258 -6.681 -9.129 1.00 0.00 N ATOM 124 NH2 ARG A 8 -1.119 -4.887 -8.361 1.00 0.00 N ATOM 125 H ARG A 8 -4.160 -1.363 -6.631 1.00 0.00 H ATOM 126 HA ARG A 8 -6.232 -3.083 -5.335 1.00 0.00 H ATOM 127 HB2 ARG A 8 -5.356 -4.106 -7.283 1.00 0.00 H ATOM 128 HB3 ARG A 8 -3.719 -3.552 -6.939 1.00 0.00 H ATOM 129 HG2 ARG A 8 -3.553 -5.081 -5.049 1.00 0.00 H ATOM 130 HG3 ARG A 8 -5.231 -5.582 -5.269 1.00 0.00 H ATOM 131 HD2 ARG A 8 -4.083 -7.292 -6.400 1.00 0.00 H ATOM 132 HD3 ARG A 8 -4.403 -6.157 -7.727 1.00 0.00 H ATOM 133 HE ARG A 8 -1.842 -6.076 -6.175 1.00 0.00 H ATOM 134 HH11 ARG A 8 -2.886 -7.443 -8.968 1.00 0.00 H ATOM 135 HH12 ARG A 8 -1.879 -6.531 -10.042 1.00 0.00 H ATOM 136 HH21 ARG A 8 -0.872 -4.273 -7.610 1.00 0.00 H ATOM 137 HH22 ARG A 8 -0.739 -4.737 -9.274 1.00 0.00 H ATOM 138 N ALA A 9 -3.325 -2.183 -4.155 1.00 0.00 N ATOM 139 CA ALA A 9 -2.501 -2.138 -2.915 1.00 0.00 C ATOM 140 C ALA A 9 -3.119 -1.191 -1.876 1.00 0.00 C ATOM 141 O ALA A 9 -2.545 -0.955 -0.830 1.00 0.00 O ATOM 142 CB ALA A 9 -1.138 -1.616 -3.365 1.00 0.00 C ATOM 143 H ALA A 9 -3.050 -1.678 -4.940 1.00 0.00 H ATOM 144 HA ALA A 9 -2.395 -3.126 -2.507 1.00 0.00 H ATOM 145 HB1 ALA A 9 -1.253 -0.632 -3.795 1.00 0.00 H ATOM 146 HB2 ALA A 9 -0.722 -2.284 -4.104 1.00 0.00 H ATOM 147 HB3 ALA A 9 -0.475 -1.561 -2.514 1.00 0.00 H ATOM 148 N ARG A 10 -4.279 -0.650 -2.146 1.00 0.00 N ATOM 149 CA ARG A 10 -4.917 0.273 -1.165 1.00 0.00 C ATOM 150 C ARG A 10 -5.206 -0.465 0.152 1.00 0.00 C ATOM 151 O ARG A 10 -5.475 0.148 1.167 1.00 0.00 O ATOM 152 CB ARG A 10 -6.191 0.768 -1.865 1.00 0.00 C ATOM 153 CG ARG A 10 -7.307 1.030 -0.854 1.00 0.00 C ATOM 154 CD ARG A 10 -7.942 -0.302 -0.482 1.00 0.00 C ATOM 155 NE ARG A 10 -8.238 -0.199 0.973 1.00 0.00 N ATOM 156 CZ ARG A 10 -9.402 -0.574 1.430 1.00 0.00 C ATOM 157 NH1 ARG A 10 -9.894 -1.734 1.088 1.00 0.00 N ATOM 158 NH2 ARG A 10 -10.074 0.210 2.229 1.00 0.00 N ATOM 159 H ARG A 10 -4.731 -0.849 -2.988 1.00 0.00 H ATOM 160 HA ARG A 10 -4.280 1.098 -0.978 1.00 0.00 H ATOM 161 HB2 ARG A 10 -5.971 1.683 -2.396 1.00 0.00 H ATOM 162 HB3 ARG A 10 -6.513 0.022 -2.567 1.00 0.00 H ATOM 163 HG2 ARG A 10 -6.895 1.499 0.029 1.00 0.00 H ATOM 164 HG3 ARG A 10 -8.053 1.675 -1.294 1.00 0.00 H ATOM 165 HD2 ARG A 10 -8.849 -0.460 -1.048 1.00 0.00 H ATOM 166 HD3 ARG A 10 -7.234 -1.097 -0.662 1.00 0.00 H ATOM 167 HE ARG A 10 -7.561 0.150 1.589 1.00 0.00 H ATOM 168 HH11 ARG A 10 -9.379 -2.334 0.477 1.00 0.00 H ATOM 169 HH12 ARG A 10 -10.785 -2.021 1.437 1.00 0.00 H ATOM 170 HH21 ARG A 10 -9.696 1.098 2.492 1.00 0.00 H ATOM 171 HH22 ARG A 10 -10.965 -0.079 2.579 1.00 0.00 H ATOM 172 N ALA A 11 -5.146 -1.772 0.145 1.00 0.00 N ATOM 173 CA ALA A 11 -5.408 -2.540 1.390 1.00 0.00 C ATOM 174 C ALA A 11 -4.575 -3.822 1.399 1.00 0.00 C ATOM 175 O ALA A 11 -5.096 -4.914 1.512 1.00 0.00 O ATOM 176 CB ALA A 11 -6.902 -2.864 1.359 1.00 0.00 C ATOM 177 H ALA A 11 -4.923 -2.248 -0.675 1.00 0.00 H ATOM 178 HA ALA A 11 -5.176 -1.942 2.245 1.00 0.00 H ATOM 179 HB1 ALA A 11 -7.436 -2.157 1.978 1.00 0.00 H ATOM 180 HB2 ALA A 11 -7.062 -3.864 1.736 1.00 0.00 H ATOM 181 HB3 ALA A 11 -7.264 -2.799 0.345 1.00 0.00 H ATOM 182 N TYR A 12 -3.282 -3.694 1.268 1.00 0.00 N ATOM 183 CA TYR A 12 -2.410 -4.879 1.250 1.00 0.00 C ATOM 184 C TYR A 12 -1.649 -5.008 2.576 1.00 0.00 C ATOM 185 O TYR A 12 -0.446 -5.170 2.597 1.00 0.00 O ATOM 186 CB TYR A 12 -1.457 -4.597 0.097 1.00 0.00 C ATOM 187 CG TYR A 12 -1.576 -5.690 -0.933 1.00 0.00 C ATOM 188 CD1 TYR A 12 -2.837 -6.032 -1.432 1.00 0.00 C ATOM 189 CD2 TYR A 12 -0.435 -6.358 -1.389 1.00 0.00 C ATOM 190 CE1 TYR A 12 -2.959 -7.046 -2.390 1.00 0.00 C ATOM 191 CE2 TYR A 12 -0.555 -7.372 -2.347 1.00 0.00 C ATOM 192 CZ TYR A 12 -1.818 -7.715 -2.847 1.00 0.00 C ATOM 193 OH TYR A 12 -1.937 -8.715 -3.791 1.00 0.00 O ATOM 194 H TYR A 12 -2.882 -2.815 1.164 1.00 0.00 H ATOM 195 HA TYR A 12 -2.980 -5.761 1.050 1.00 0.00 H ATOM 196 HB2 TYR A 12 -1.713 -3.649 -0.356 1.00 0.00 H ATOM 197 HB3 TYR A 12 -0.457 -4.550 0.471 1.00 0.00 H ATOM 198 HD1 TYR A 12 -3.718 -5.511 -1.075 1.00 0.00 H ATOM 199 HD2 TYR A 12 0.539 -6.093 -1.003 1.00 0.00 H ATOM 200 HE1 TYR A 12 -3.932 -7.310 -2.774 1.00 0.00 H ATOM 201 HE2 TYR A 12 0.325 -7.889 -2.701 1.00 0.00 H ATOM 202 HH TYR A 12 -1.237 -8.596 -4.438 1.00 0.00 H ATOM 203 N SER A 13 -2.346 -4.940 3.681 1.00 0.00 N ATOM 204 CA SER A 13 -1.671 -5.058 5.010 1.00 0.00 C ATOM 205 C SER A 13 -0.498 -4.077 5.106 1.00 0.00 C ATOM 206 O SER A 13 0.649 -4.452 4.953 1.00 0.00 O ATOM 207 CB SER A 13 -1.172 -6.502 5.077 1.00 0.00 C ATOM 208 OG SER A 13 -0.404 -6.678 6.261 1.00 0.00 O ATOM 209 H SER A 13 -3.317 -4.810 3.638 1.00 0.00 H ATOM 210 HA SER A 13 -2.377 -4.878 5.806 1.00 0.00 H ATOM 211 HB2 SER A 13 -2.013 -7.175 5.097 1.00 0.00 H ATOM 212 HB3 SER A 13 -0.565 -6.712 4.207 1.00 0.00 H ATOM 213 HG SER A 13 0.447 -7.044 6.009 1.00 0.00 H ATOM 214 N PHE A 14 -0.777 -2.825 5.354 1.00 0.00 N ATOM 215 CA PHE A 14 0.318 -1.819 5.458 1.00 0.00 C ATOM 216 C PHE A 14 0.646 -1.520 6.925 1.00 0.00 C ATOM 217 O PHE A 14 1.379 -0.598 7.226 1.00 0.00 O ATOM 218 CB PHE A 14 -0.230 -0.576 4.770 1.00 0.00 C ATOM 219 CG PHE A 14 0.883 0.130 4.033 1.00 0.00 C ATOM 220 CD1 PHE A 14 1.770 0.958 4.731 1.00 0.00 C ATOM 221 CD2 PHE A 14 1.027 -0.045 2.651 1.00 0.00 C ATOM 222 CE1 PHE A 14 2.802 1.611 4.047 1.00 0.00 C ATOM 223 CE2 PHE A 14 2.060 0.609 1.968 1.00 0.00 C ATOM 224 CZ PHE A 14 2.948 1.437 2.666 1.00 0.00 C ATOM 225 H PHE A 14 -1.708 -2.545 5.472 1.00 0.00 H ATOM 226 HA PHE A 14 1.193 -2.160 4.940 1.00 0.00 H ATOM 227 HB2 PHE A 14 -1.004 -0.860 4.072 1.00 0.00 H ATOM 228 HB3 PHE A 14 -0.640 0.081 5.514 1.00 0.00 H ATOM 229 HD1 PHE A 14 1.658 1.093 5.796 1.00 0.00 H ATOM 230 HD2 PHE A 14 0.343 -0.684 2.113 1.00 0.00 H ATOM 231 HE1 PHE A 14 3.486 2.250 4.585 1.00 0.00 H ATOM 232 HE2 PHE A 14 2.172 0.474 0.903 1.00 0.00 H ATOM 233 HZ PHE A 14 3.744 1.941 2.139 1.00 0.00 H ATOM 234 N ARG A 15 0.114 -2.289 7.841 1.00 0.00 N ATOM 235 CA ARG A 15 0.407 -2.037 9.286 1.00 0.00 C ATOM 236 C ARG A 15 0.863 -3.324 9.964 1.00 0.00 C ATOM 237 O ARG A 15 0.674 -3.523 11.148 1.00 0.00 O ATOM 238 CB ARG A 15 -0.904 -1.547 9.902 1.00 0.00 C ATOM 239 CG ARG A 15 -2.058 -2.405 9.391 1.00 0.00 C ATOM 240 CD ARG A 15 -2.651 -1.745 8.149 1.00 0.00 C ATOM 241 NE ARG A 15 -3.127 -2.872 7.301 1.00 0.00 N ATOM 242 CZ ARG A 15 -4.082 -2.678 6.433 1.00 0.00 C ATOM 243 NH1 ARG A 15 -4.030 -1.656 5.623 1.00 0.00 N ATOM 244 NH2 ARG A 15 -5.089 -3.506 6.376 1.00 0.00 N ATOM 245 H ARG A 15 -0.472 -3.029 7.582 1.00 0.00 H ATOM 246 HA ARG A 15 1.162 -1.284 9.375 1.00 0.00 H ATOM 247 HB2 ARG A 15 -0.845 -1.622 10.978 1.00 0.00 H ATOM 248 HB3 ARG A 15 -1.070 -0.517 9.622 1.00 0.00 H ATOM 249 HG2 ARG A 15 -1.686 -3.389 9.137 1.00 0.00 H ATOM 250 HG3 ARG A 15 -2.815 -2.488 10.154 1.00 0.00 H ATOM 251 HD2 ARG A 15 -3.476 -1.101 8.424 1.00 0.00 H ATOM 252 HD3 ARG A 15 -1.888 -1.183 7.629 1.00 0.00 H ATOM 253 HE ARG A 15 -2.723 -3.760 7.396 1.00 0.00 H ATOM 254 HH11 ARG A 15 -3.259 -1.021 5.667 1.00 0.00 H ATOM 255 HH12 ARG A 15 -4.762 -1.508 4.958 1.00 0.00 H ATOM 256 HH21 ARG A 15 -5.128 -4.289 6.997 1.00 0.00 H ATOM 257 HH22 ARG A 15 -5.821 -3.357 5.710 1.00 0.00 H ATOM 258 N GLY A 16 1.468 -4.193 9.214 1.00 0.00 N ATOM 259 CA GLY A 16 1.955 -5.479 9.790 1.00 0.00 C ATOM 260 C GLY A 16 3.242 -5.230 10.572 1.00 0.00 C ATOM 261 O GLY A 16 3.232 -5.143 11.784 1.00 0.00 O ATOM 262 H GLY A 16 1.604 -3.993 8.268 1.00 0.00 H ATOM 263 HA2 GLY A 16 1.202 -5.891 10.447 1.00 0.00 H ATOM 264 HA3 GLY A 16 2.165 -6.180 8.990 1.00 0.00 H ATOM 265 N PRO A 17 4.316 -5.141 9.838 1.00 0.00 N ATOM 266 CA PRO A 17 5.647 -4.924 10.416 1.00 0.00 C ATOM 267 C PRO A 17 6.042 -3.447 10.317 1.00 0.00 C ATOM 268 O PRO A 17 5.592 -2.733 9.441 1.00 0.00 O ATOM 269 CB PRO A 17 6.515 -5.797 9.508 1.00 0.00 C ATOM 270 CG PRO A 17 5.743 -5.936 8.217 1.00 0.00 C ATOM 271 CD PRO A 17 4.422 -5.240 8.392 1.00 0.00 C ATOM 272 HA PRO A 17 5.696 -5.277 11.432 1.00 0.00 H ATOM 273 HB2 PRO A 17 7.467 -5.317 9.327 1.00 0.00 H ATOM 274 HB3 PRO A 17 6.662 -6.766 9.947 1.00 0.00 H ATOM 275 HG2 PRO A 17 6.298 -5.490 7.411 1.00 0.00 H ATOM 276 HG3 PRO A 17 5.560 -6.979 8.011 1.00 0.00 H ATOM 277 HD2 PRO A 17 4.444 -4.258 7.936 1.00 0.00 H ATOM 278 HD3 PRO A 17 3.620 -5.835 7.992 1.00 0.00 H ATOM 279 N GLY A 18 6.876 -2.984 11.209 1.00 0.00 N ATOM 280 CA GLY A 18 7.297 -1.554 11.167 1.00 0.00 C ATOM 281 C GLY A 18 8.815 -1.471 10.983 1.00 0.00 C ATOM 282 O GLY A 18 9.419 -2.366 10.426 1.00 0.00 O ATOM 283 H GLY A 18 7.224 -3.578 11.907 1.00 0.00 H ATOM 284 HA2 GLY A 18 6.805 -1.058 10.343 1.00 0.00 H ATOM 285 HA3 GLY A 18 7.024 -1.071 12.093 1.00 0.00 H ATOM 286 N PRO A 19 9.386 -0.394 11.459 1.00 0.00 N ATOM 287 CA PRO A 19 10.838 -0.185 11.350 1.00 0.00 C ATOM 288 C PRO A 19 11.575 -0.803 12.540 1.00 0.00 C ATOM 289 O PRO A 19 11.024 -0.953 13.613 1.00 0.00 O ATOM 290 CB PRO A 19 10.979 1.324 11.335 1.00 0.00 C ATOM 291 CG PRO A 19 9.745 1.856 11.983 1.00 0.00 C ATOM 292 CD PRO A 19 8.750 0.728 12.140 1.00 0.00 C ATOM 293 HA PRO A 19 11.196 -0.577 10.426 1.00 0.00 H ATOM 294 HB2 PRO A 19 11.856 1.621 11.894 1.00 0.00 H ATOM 295 HB3 PRO A 19 11.043 1.683 10.319 1.00 0.00 H ATOM 296 HG2 PRO A 19 9.982 2.281 12.948 1.00 0.00 H ATOM 297 HG3 PRO A 19 9.327 2.601 11.343 1.00 0.00 H ATOM 298 HD2 PRO A 19 8.595 0.502 13.187 1.00 0.00 H ATOM 299 HD3 PRO A 19 7.816 0.974 11.660 1.00 0.00 H ATOM 300 N GLN A 20 12.818 -1.165 12.357 1.00 0.00 N ATOM 301 CA GLN A 20 13.594 -1.777 13.476 1.00 0.00 C ATOM 302 C GLN A 20 13.649 -0.823 14.673 1.00 0.00 C ATOM 303 O GLN A 20 13.172 -1.134 15.747 1.00 0.00 O ATOM 304 CB GLN A 20 14.996 -2.005 12.908 1.00 0.00 C ATOM 305 CG GLN A 20 15.541 -3.339 13.419 1.00 0.00 C ATOM 306 CD GLN A 20 14.863 -4.489 12.670 1.00 0.00 C ATOM 307 OE1 GLN A 20 14.292 -5.372 13.277 1.00 0.00 O ATOM 308 NE2 GLN A 20 14.902 -4.514 11.366 1.00 0.00 N ATOM 309 H GLN A 20 13.239 -1.036 11.483 1.00 0.00 H ATOM 310 HA GLN A 20 13.156 -2.718 13.763 1.00 0.00 H ATOM 311 HB2 GLN A 20 14.947 -2.024 11.827 1.00 0.00 H ATOM 312 HB3 GLN A 20 15.649 -1.205 13.229 1.00 0.00 H ATOM 313 HG2 GLN A 20 16.608 -3.380 13.252 1.00 0.00 H ATOM 314 HG3 GLN A 20 15.338 -3.431 14.475 1.00 0.00 H ATOM 315 HE21 GLN A 20 15.362 -3.801 10.875 1.00 0.00 H ATOM 316 HE22 GLN A 20 14.470 -5.246 10.877 1.00 0.00 H ATOM 317 N LEU A 21 14.227 0.336 14.495 1.00 0.00 N ATOM 318 CA LEU A 21 14.320 1.317 15.622 1.00 0.00 C ATOM 319 C LEU A 21 14.986 0.669 16.841 1.00 0.00 C ATOM 320 O LEU A 21 16.192 0.801 16.972 1.00 0.00 O ATOM 321 CB LEU A 21 12.872 1.705 15.940 1.00 0.00 C ATOM 322 CG LEU A 21 12.767 3.223 16.138 1.00 0.00 C ATOM 323 CD1 LEU A 21 13.719 3.666 17.253 1.00 0.00 C ATOM 324 CD2 LEU A 21 13.138 3.937 14.834 1.00 0.00 C ATOM 325 H LEU A 21 14.605 0.563 13.620 1.00 0.00 H ATOM 326 HA LEU A 21 14.875 2.189 15.313 1.00 0.00 H ATOM 327 HB2 LEU A 21 12.233 1.406 15.122 1.00 0.00 H ATOM 328 HB3 LEU A 21 12.555 1.206 16.844 1.00 0.00 H ATOM 329 HG LEU A 21 11.754 3.478 16.412 1.00 0.00 H ATOM 330 HD11 LEU A 21 13.441 4.653 17.592 1.00 0.00 H ATOM 331 HD12 LEU A 21 14.731 3.687 16.876 1.00 0.00 H ATOM 332 HD13 LEU A 21 13.656 2.971 18.077 1.00 0.00 H ATOM 333 HD21 LEU A 21 12.239 4.288 14.349 1.00 0.00 H ATOM 334 HD22 LEU A 21 13.655 3.252 14.180 1.00 0.00 H ATOM 335 HD23 LEU A 21 13.779 4.779 15.053 1.00 0.00 H HETATM 336 N NH2 A 22 14.269 0.001 17.701 1.00 0.00 N HETATM 337 HN1 NH2 A 22 13.297 -0.088 17.567 1.00 0.00 H HETATM 338 HN2 NH2 A 22 14.700 -0.415 18.483 1.00 0.00 H TER 339 NH2 A 22 ENDMDL MODEL 10 ATOM 1 N SER A 1 -4.842 14.001 -10.573 1.00 0.00 N ATOM 2 CA SER A 1 -4.427 12.690 -9.997 1.00 0.00 C ATOM 3 C SER A 1 -5.637 11.969 -9.395 1.00 0.00 C ATOM 4 O SER A 1 -5.862 12.004 -8.201 1.00 0.00 O ATOM 5 CB SER A 1 -3.415 13.040 -8.908 1.00 0.00 C ATOM 6 OG SER A 1 -4.074 13.750 -7.867 1.00 0.00 O ATOM 7 H1 SER A 1 -5.592 13.849 -11.277 1.00 0.00 H ATOM 8 H2 SER A 1 -4.024 14.453 -11.030 1.00 0.00 H ATOM 9 H3 SER A 1 -5.201 14.615 -9.816 1.00 0.00 H ATOM 10 HA SER A 1 -3.960 12.077 -10.751 1.00 0.00 H ATOM 11 HB2 SER A 1 -2.989 12.136 -8.505 1.00 0.00 H ATOM 12 HB3 SER A 1 -2.628 13.650 -9.332 1.00 0.00 H ATOM 13 HG SER A 1 -3.667 13.501 -7.034 1.00 0.00 H ATOM 14 N SER A 2 -6.418 11.317 -10.215 1.00 0.00 N ATOM 15 CA SER A 2 -7.615 10.594 -9.693 1.00 0.00 C ATOM 16 C SER A 2 -7.188 9.502 -8.708 1.00 0.00 C ATOM 17 O SER A 2 -7.773 9.341 -7.654 1.00 0.00 O ATOM 18 CB SER A 2 -8.275 9.974 -10.924 1.00 0.00 C ATOM 19 OG SER A 2 -7.463 8.912 -11.407 1.00 0.00 O ATOM 20 H SER A 2 -6.217 11.302 -11.174 1.00 0.00 H ATOM 21 HA SER A 2 -8.295 11.283 -9.219 1.00 0.00 H ATOM 22 HB2 SER A 2 -9.244 9.587 -10.658 1.00 0.00 H ATOM 23 HB3 SER A 2 -8.388 10.731 -11.689 1.00 0.00 H ATOM 24 HG SER A 2 -6.946 9.245 -12.143 1.00 0.00 H ATOM 25 N MET A 3 -6.173 8.751 -9.042 1.00 0.00 N ATOM 26 CA MET A 3 -5.708 7.668 -8.126 1.00 0.00 C ATOM 27 C MET A 3 -4.275 7.254 -8.475 1.00 0.00 C ATOM 28 O MET A 3 -4.009 6.755 -9.551 1.00 0.00 O ATOM 29 CB MET A 3 -6.679 6.506 -8.356 1.00 0.00 C ATOM 30 CG MET A 3 -6.645 6.082 -9.827 1.00 0.00 C ATOM 31 SD MET A 3 -8.180 5.216 -10.240 1.00 0.00 S ATOM 32 CE MET A 3 -7.448 3.961 -11.319 1.00 0.00 C ATOM 33 H MET A 3 -5.717 8.898 -9.897 1.00 0.00 H ATOM 34 HA MET A 3 -5.765 7.996 -7.100 1.00 0.00 H ATOM 35 HB2 MET A 3 -6.389 5.670 -7.735 1.00 0.00 H ATOM 36 HB3 MET A 3 -7.680 6.817 -8.096 1.00 0.00 H ATOM 37 HG2 MET A 3 -6.548 6.958 -10.453 1.00 0.00 H ATOM 38 HG3 MET A 3 -5.804 5.425 -9.994 1.00 0.00 H ATOM 39 HE1 MET A 3 -8.206 3.243 -11.600 1.00 0.00 H ATOM 40 HE2 MET A 3 -6.646 3.460 -10.795 1.00 0.00 H ATOM 41 HE3 MET A 3 -7.056 4.432 -12.206 1.00 0.00 H ATOM 42 N LYS A 4 -3.353 7.458 -7.572 1.00 0.00 N ATOM 43 CA LYS A 4 -1.936 7.078 -7.849 1.00 0.00 C ATOM 44 C LYS A 4 -1.431 6.109 -6.775 1.00 0.00 C ATOM 45 O LYS A 4 -1.046 6.511 -5.695 1.00 0.00 O ATOM 46 CB LYS A 4 -1.155 8.391 -7.797 1.00 0.00 C ATOM 47 CG LYS A 4 0.265 8.164 -8.319 1.00 0.00 C ATOM 48 CD LYS A 4 1.080 9.449 -8.159 1.00 0.00 C ATOM 49 CE LYS A 4 0.907 10.325 -9.403 1.00 0.00 C ATOM 50 NZ LYS A 4 2.151 10.115 -10.197 1.00 0.00 N ATOM 51 H LYS A 4 -3.592 7.862 -6.712 1.00 0.00 H ATOM 52 HA LYS A 4 -1.849 6.635 -8.828 1.00 0.00 H ATOM 53 HB2 LYS A 4 -1.652 9.129 -8.411 1.00 0.00 H ATOM 54 HB3 LYS A 4 -1.110 8.744 -6.777 1.00 0.00 H ATOM 55 HG2 LYS A 4 0.732 7.368 -7.757 1.00 0.00 H ATOM 56 HG3 LYS A 4 0.226 7.892 -9.364 1.00 0.00 H ATOM 57 HD2 LYS A 4 0.734 9.988 -7.289 1.00 0.00 H ATOM 58 HD3 LYS A 4 2.123 9.200 -8.038 1.00 0.00 H ATOM 59 HE2 LYS A 4 0.040 10.009 -9.968 1.00 0.00 H ATOM 60 HE3 LYS A 4 0.818 11.363 -9.124 1.00 0.00 H ATOM 61 HZ1 LYS A 4 2.976 10.377 -9.623 1.00 0.00 H ATOM 62 HZ2 LYS A 4 2.121 10.708 -11.049 1.00 0.00 H ATOM 63 HZ3 LYS A 4 2.221 9.114 -10.471 1.00 0.00 H ATOM 64 N LEU A 5 -1.428 4.834 -7.069 1.00 0.00 N ATOM 65 CA LEU A 5 -0.947 3.834 -6.075 1.00 0.00 C ATOM 66 C LEU A 5 -0.877 2.446 -6.718 1.00 0.00 C ATOM 67 O LEU A 5 -0.861 2.312 -7.925 1.00 0.00 O ATOM 68 CB LEU A 5 -1.983 3.851 -4.948 1.00 0.00 C ATOM 69 CG LEU A 5 -1.275 3.698 -3.600 1.00 0.00 C ATOM 70 CD1 LEU A 5 -0.999 5.081 -3.008 1.00 0.00 C ATOM 71 CD2 LEU A 5 -2.167 2.904 -2.644 1.00 0.00 C ATOM 72 H LEU A 5 -1.739 4.536 -7.945 1.00 0.00 H ATOM 73 HA LEU A 5 0.017 4.121 -5.694 1.00 0.00 H ATOM 74 HB2 LEU A 5 -2.521 4.788 -4.969 1.00 0.00 H ATOM 75 HB3 LEU A 5 -2.675 3.035 -5.083 1.00 0.00 H ATOM 76 HG LEU A 5 -0.341 3.175 -3.743 1.00 0.00 H ATOM 77 HD11 LEU A 5 -0.470 4.973 -2.072 1.00 0.00 H ATOM 78 HD12 LEU A 5 -1.935 5.592 -2.836 1.00 0.00 H ATOM 79 HD13 LEU A 5 -0.397 5.655 -3.697 1.00 0.00 H ATOM 80 HD21 LEU A 5 -1.568 2.512 -1.835 1.00 0.00 H ATOM 81 HD22 LEU A 5 -2.630 2.087 -3.178 1.00 0.00 H ATOM 82 HD23 LEU A 5 -2.933 3.553 -2.243 1.00 0.00 H ATOM 83 N SER A 6 -0.833 1.414 -5.918 1.00 0.00 N ATOM 84 CA SER A 6 -0.762 0.034 -6.482 1.00 0.00 C ATOM 85 C SER A 6 -2.016 -0.760 -6.105 1.00 0.00 C ATOM 86 O SER A 6 -2.570 -0.592 -5.036 1.00 0.00 O ATOM 87 CB SER A 6 0.479 -0.590 -5.846 1.00 0.00 C ATOM 88 OG SER A 6 1.542 -0.589 -6.791 1.00 0.00 O ATOM 89 H SER A 6 -0.846 1.546 -4.948 1.00 0.00 H ATOM 90 HA SER A 6 -0.648 0.071 -7.554 1.00 0.00 H ATOM 91 HB2 SER A 6 0.772 -0.017 -4.983 1.00 0.00 H ATOM 92 HB3 SER A 6 0.255 -1.605 -5.543 1.00 0.00 H ATOM 93 HG SER A 6 2.362 -0.450 -6.313 1.00 0.00 H ATOM 94 N PHE A 7 -2.463 -1.625 -6.975 1.00 0.00 N ATOM 95 CA PHE A 7 -3.679 -2.436 -6.673 1.00 0.00 C ATOM 96 C PHE A 7 -3.468 -3.249 -5.391 1.00 0.00 C ATOM 97 O PHE A 7 -4.332 -3.321 -4.540 1.00 0.00 O ATOM 98 CB PHE A 7 -3.845 -3.368 -7.876 1.00 0.00 C ATOM 99 CG PHE A 7 -4.963 -2.863 -8.756 1.00 0.00 C ATOM 100 CD1 PHE A 7 -6.238 -2.663 -8.215 1.00 0.00 C ATOM 101 CD2 PHE A 7 -4.725 -2.594 -10.108 1.00 0.00 C ATOM 102 CE1 PHE A 7 -7.277 -2.195 -9.028 1.00 0.00 C ATOM 103 CE2 PHE A 7 -5.764 -2.125 -10.921 1.00 0.00 C ATOM 104 CZ PHE A 7 -7.040 -1.926 -10.381 1.00 0.00 C ATOM 105 H PHE A 7 -1.998 -1.744 -7.829 1.00 0.00 H ATOM 106 HA PHE A 7 -4.542 -1.799 -6.578 1.00 0.00 H ATOM 107 HB2 PHE A 7 -2.926 -3.393 -8.442 1.00 0.00 H ATOM 108 HB3 PHE A 7 -4.082 -4.364 -7.531 1.00 0.00 H ATOM 109 HD1 PHE A 7 -6.419 -2.872 -7.171 1.00 0.00 H ATOM 110 HD2 PHE A 7 -3.741 -2.748 -10.525 1.00 0.00 H ATOM 111 HE1 PHE A 7 -8.261 -2.042 -8.611 1.00 0.00 H ATOM 112 HE2 PHE A 7 -5.580 -1.917 -11.965 1.00 0.00 H ATOM 113 HZ PHE A 7 -7.841 -1.563 -11.008 1.00 0.00 H ATOM 114 N ARG A 8 -2.322 -3.857 -5.252 1.00 0.00 N ATOM 115 CA ARG A 8 -2.042 -4.666 -4.029 1.00 0.00 C ATOM 116 C ARG A 8 -1.737 -3.745 -2.847 1.00 0.00 C ATOM 117 O ARG A 8 -2.252 -3.917 -1.758 1.00 0.00 O ATOM 118 CB ARG A 8 -0.816 -5.511 -4.386 1.00 0.00 C ATOM 119 CG ARG A 8 -0.372 -6.322 -3.167 1.00 0.00 C ATOM 120 CD ARG A 8 0.993 -6.956 -3.445 1.00 0.00 C ATOM 121 NE ARG A 8 1.985 -5.965 -2.945 1.00 0.00 N ATOM 122 CZ ARG A 8 3.191 -5.938 -3.443 1.00 0.00 C ATOM 123 NH1 ARG A 8 4.051 -6.863 -3.116 1.00 0.00 N ATOM 124 NH2 ARG A 8 3.535 -4.987 -4.268 1.00 0.00 N ATOM 125 H ARG A 8 -1.642 -3.782 -5.954 1.00 0.00 H ATOM 126 HA ARG A 8 -2.874 -5.301 -3.801 1.00 0.00 H ATOM 127 HB2 ARG A 8 -1.068 -6.183 -5.195 1.00 0.00 H ATOM 128 HB3 ARG A 8 -0.012 -4.862 -4.697 1.00 0.00 H ATOM 129 HG2 ARG A 8 -0.299 -5.670 -2.309 1.00 0.00 H ATOM 130 HG3 ARG A 8 -1.094 -7.100 -2.969 1.00 0.00 H ATOM 131 HD2 ARG A 8 1.088 -7.890 -2.909 1.00 0.00 H ATOM 132 HD3 ARG A 8 1.128 -7.112 -4.504 1.00 0.00 H ATOM 133 HE ARG A 8 1.732 -5.332 -2.240 1.00 0.00 H ATOM 134 HH11 ARG A 8 3.787 -7.592 -2.484 1.00 0.00 H ATOM 135 HH12 ARG A 8 4.976 -6.843 -3.499 1.00 0.00 H ATOM 136 HH21 ARG A 8 2.877 -4.279 -4.518 1.00 0.00 H ATOM 137 HH22 ARG A 8 4.459 -4.968 -4.650 1.00 0.00 H ATOM 138 N ALA A 9 -0.901 -2.774 -3.060 1.00 0.00 N ATOM 139 CA ALA A 9 -0.541 -1.828 -1.962 1.00 0.00 C ATOM 140 C ALA A 9 -1.796 -1.172 -1.380 1.00 0.00 C ATOM 141 O ALA A 9 -1.793 -0.683 -0.267 1.00 0.00 O ATOM 142 CB ALA A 9 0.353 -0.777 -2.618 1.00 0.00 C ATOM 143 H ALA A 9 -0.505 -2.670 -3.947 1.00 0.00 H ATOM 144 HA ALA A 9 0.002 -2.342 -1.191 1.00 0.00 H ATOM 145 HB1 ALA A 9 -0.260 -0.058 -3.141 1.00 0.00 H ATOM 146 HB2 ALA A 9 1.020 -1.259 -3.318 1.00 0.00 H ATOM 147 HB3 ALA A 9 0.931 -0.273 -1.859 1.00 0.00 H ATOM 148 N ARG A 10 -2.868 -1.165 -2.121 1.00 0.00 N ATOM 149 CA ARG A 10 -4.124 -0.548 -1.614 1.00 0.00 C ATOM 150 C ARG A 10 -4.644 -1.327 -0.397 1.00 0.00 C ATOM 151 O ARG A 10 -5.518 -0.871 0.313 1.00 0.00 O ATOM 152 CB ARG A 10 -5.089 -0.595 -2.807 1.00 0.00 C ATOM 153 CG ARG A 10 -6.538 -0.727 -2.333 1.00 0.00 C ATOM 154 CD ARG A 10 -6.795 -2.184 -1.977 1.00 0.00 C ATOM 155 NE ARG A 10 -7.635 -2.141 -0.747 1.00 0.00 N ATOM 156 CZ ARG A 10 -8.880 -2.527 -0.794 1.00 0.00 C ATOM 157 NH1 ARG A 10 -9.788 -1.739 -1.302 1.00 0.00 N ATOM 158 NH2 ARG A 10 -9.218 -3.700 -0.332 1.00 0.00 N ATOM 159 H ARG A 10 -2.848 -1.567 -3.011 1.00 0.00 H ATOM 160 HA ARG A 10 -3.951 0.461 -1.347 1.00 0.00 H ATOM 161 HB2 ARG A 10 -4.985 0.311 -3.385 1.00 0.00 H ATOM 162 HB3 ARG A 10 -4.837 -1.437 -3.424 1.00 0.00 H ATOM 163 HG2 ARG A 10 -6.694 -0.105 -1.463 1.00 0.00 H ATOM 164 HG3 ARG A 10 -7.209 -0.425 -3.123 1.00 0.00 H ATOM 165 HD2 ARG A 10 -7.318 -2.684 -2.782 1.00 0.00 H ATOM 166 HD3 ARG A 10 -5.856 -2.673 -1.769 1.00 0.00 H ATOM 167 HE ARG A 10 -7.252 -1.823 0.097 1.00 0.00 H ATOM 168 HH11 ARG A 10 -9.530 -0.841 -1.655 1.00 0.00 H ATOM 169 HH12 ARG A 10 -10.744 -2.034 -1.337 1.00 0.00 H ATOM 170 HH21 ARG A 10 -8.522 -4.304 0.058 1.00 0.00 H ATOM 171 HH22 ARG A 10 -10.173 -3.995 -0.367 1.00 0.00 H ATOM 172 N ALA A 11 -4.112 -2.497 -0.150 1.00 0.00 N ATOM 173 CA ALA A 11 -4.572 -3.296 1.015 1.00 0.00 C ATOM 174 C ALA A 11 -3.400 -4.048 1.640 1.00 0.00 C ATOM 175 O ALA A 11 -3.444 -5.250 1.817 1.00 0.00 O ATOM 176 CB ALA A 11 -5.603 -4.273 0.449 1.00 0.00 C ATOM 177 H ALA A 11 -3.410 -2.848 -0.726 1.00 0.00 H ATOM 178 HA ALA A 11 -5.029 -2.657 1.738 1.00 0.00 H ATOM 179 HB1 ALA A 11 -5.432 -4.403 -0.609 1.00 0.00 H ATOM 180 HB2 ALA A 11 -6.597 -3.880 0.607 1.00 0.00 H ATOM 181 HB3 ALA A 11 -5.509 -5.225 0.949 1.00 0.00 H ATOM 182 N TYR A 12 -2.346 -3.352 1.969 1.00 0.00 N ATOM 183 CA TYR A 12 -1.174 -4.010 2.566 1.00 0.00 C ATOM 184 C TYR A 12 -1.038 -3.626 4.042 1.00 0.00 C ATOM 185 O TYR A 12 0.018 -3.227 4.496 1.00 0.00 O ATOM 186 CB TYR A 12 -0.010 -3.474 1.746 1.00 0.00 C ATOM 187 CG TYR A 12 0.730 -4.627 1.117 1.00 0.00 C ATOM 188 CD1 TYR A 12 0.023 -5.564 0.355 1.00 0.00 C ATOM 189 CD2 TYR A 12 2.112 -4.761 1.291 1.00 0.00 C ATOM 190 CE1 TYR A 12 0.698 -6.638 -0.234 1.00 0.00 C ATOM 191 CE2 TYR A 12 2.788 -5.836 0.702 1.00 0.00 C ATOM 192 CZ TYR A 12 2.081 -6.776 -0.061 1.00 0.00 C ATOM 193 OH TYR A 12 2.748 -7.835 -0.641 1.00 0.00 O ATOM 194 H TYR A 12 -2.317 -2.394 1.812 1.00 0.00 H ATOM 195 HA TYR A 12 -1.245 -5.072 2.454 1.00 0.00 H ATOM 196 HB2 TYR A 12 -0.386 -2.822 0.970 1.00 0.00 H ATOM 197 HB3 TYR A 12 0.645 -2.922 2.386 1.00 0.00 H ATOM 198 HD1 TYR A 12 -1.048 -5.454 0.225 1.00 0.00 H ATOM 199 HD2 TYR A 12 2.656 -4.037 1.879 1.00 0.00 H ATOM 200 HE1 TYR A 12 0.153 -7.363 -0.822 1.00 0.00 H ATOM 201 HE2 TYR A 12 3.855 -5.942 0.835 1.00 0.00 H ATOM 202 HH TYR A 12 2.187 -8.611 -0.575 1.00 0.00 H ATOM 203 N SER A 13 -2.100 -3.743 4.794 1.00 0.00 N ATOM 204 CA SER A 13 -2.036 -3.385 6.240 1.00 0.00 C ATOM 205 C SER A 13 -1.867 -4.648 7.089 1.00 0.00 C ATOM 206 O SER A 13 -2.666 -4.935 7.958 1.00 0.00 O ATOM 207 CB SER A 13 -3.375 -2.712 6.539 1.00 0.00 C ATOM 208 OG SER A 13 -3.398 -2.299 7.900 1.00 0.00 O ATOM 209 H SER A 13 -2.939 -4.067 4.406 1.00 0.00 H ATOM 210 HA SER A 13 -1.228 -2.696 6.423 1.00 0.00 H ATOM 211 HB2 SER A 13 -3.497 -1.850 5.905 1.00 0.00 H ATOM 212 HB3 SER A 13 -4.179 -3.412 6.352 1.00 0.00 H ATOM 213 HG SER A 13 -3.778 -3.011 8.420 1.00 0.00 H ATOM 214 N PHE A 14 -0.831 -5.408 6.837 1.00 0.00 N ATOM 215 CA PHE A 14 -0.604 -6.662 7.622 1.00 0.00 C ATOM 216 C PHE A 14 -0.711 -6.384 9.125 1.00 0.00 C ATOM 217 O PHE A 14 -1.001 -7.267 9.909 1.00 0.00 O ATOM 218 CB PHE A 14 0.805 -7.177 7.284 1.00 0.00 C ATOM 219 CG PHE A 14 1.731 -6.050 6.907 1.00 0.00 C ATOM 220 CD1 PHE A 14 1.718 -5.577 5.600 1.00 0.00 C ATOM 221 CD2 PHE A 14 2.605 -5.495 7.849 1.00 0.00 C ATOM 222 CE1 PHE A 14 2.576 -4.540 5.218 1.00 0.00 C ATOM 223 CE2 PHE A 14 3.464 -4.456 7.474 1.00 0.00 C ATOM 224 CZ PHE A 14 3.451 -3.978 6.156 1.00 0.00 C ATOM 225 H PHE A 14 -0.215 -5.158 6.128 1.00 0.00 H ATOM 226 HA PHE A 14 -1.325 -7.399 7.325 1.00 0.00 H ATOM 227 HB2 PHE A 14 1.210 -7.696 8.140 1.00 0.00 H ATOM 228 HB3 PHE A 14 0.733 -7.863 6.455 1.00 0.00 H ATOM 229 HD1 PHE A 14 1.029 -6.014 4.889 1.00 0.00 H ATOM 230 HD2 PHE A 14 2.613 -5.866 8.863 1.00 0.00 H ATOM 231 HE1 PHE A 14 2.564 -4.173 4.202 1.00 0.00 H ATOM 232 HE2 PHE A 14 4.138 -4.023 8.199 1.00 0.00 H ATOM 233 HZ PHE A 14 4.114 -3.177 5.864 1.00 0.00 H ATOM 234 N ARG A 15 -0.466 -5.163 9.529 1.00 0.00 N ATOM 235 CA ARG A 15 -0.538 -4.805 10.977 1.00 0.00 C ATOM 236 C ARG A 15 0.580 -5.498 11.745 1.00 0.00 C ATOM 237 O ARG A 15 0.515 -6.672 12.051 1.00 0.00 O ATOM 238 CB ARG A 15 -1.907 -5.268 11.473 1.00 0.00 C ATOM 239 CG ARG A 15 -2.262 -4.480 12.733 1.00 0.00 C ATOM 240 CD ARG A 15 -1.926 -5.317 13.969 1.00 0.00 C ATOM 241 NE ARG A 15 -2.475 -4.544 15.117 1.00 0.00 N ATOM 242 CZ ARG A 15 -1.879 -3.452 15.514 1.00 0.00 C ATOM 243 NH1 ARG A 15 -0.583 -3.435 15.668 1.00 0.00 N ATOM 244 NH2 ARG A 15 -2.579 -2.377 15.755 1.00 0.00 N ATOM 245 H ARG A 15 -0.221 -4.475 8.877 1.00 0.00 H ATOM 246 HA ARG A 15 -0.454 -3.736 11.095 1.00 0.00 H ATOM 247 HB2 ARG A 15 -2.650 -5.088 10.708 1.00 0.00 H ATOM 248 HB3 ARG A 15 -1.872 -6.322 11.705 1.00 0.00 H ATOM 249 HG2 ARG A 15 -1.690 -3.562 12.754 1.00 0.00 H ATOM 250 HG3 ARG A 15 -3.315 -4.250 12.731 1.00 0.00 H ATOM 251 HD2 ARG A 15 -2.397 -6.288 13.904 1.00 0.00 H ATOM 252 HD3 ARG A 15 -0.857 -5.421 14.069 1.00 0.00 H ATOM 253 HE ARG A 15 -3.283 -4.855 15.576 1.00 0.00 H ATOM 254 HH11 ARG A 15 -0.047 -4.258 15.483 1.00 0.00 H ATOM 255 HH12 ARG A 15 -0.127 -2.599 15.972 1.00 0.00 H ATOM 256 HH21 ARG A 15 -3.572 -2.390 15.636 1.00 0.00 H ATOM 257 HH22 ARG A 15 -2.123 -1.540 16.058 1.00 0.00 H ATOM 258 N GLY A 16 1.607 -4.764 12.054 1.00 0.00 N ATOM 259 CA GLY A 16 2.755 -5.345 12.804 1.00 0.00 C ATOM 260 C GLY A 16 3.718 -4.230 13.206 1.00 0.00 C ATOM 261 O GLY A 16 3.736 -3.797 14.342 1.00 0.00 O ATOM 262 H GLY A 16 1.619 -3.822 11.787 1.00 0.00 H ATOM 263 HA2 GLY A 16 2.394 -5.851 13.687 1.00 0.00 H ATOM 264 HA3 GLY A 16 3.285 -6.048 12.171 1.00 0.00 H ATOM 265 N PRO A 17 4.503 -3.818 12.250 1.00 0.00 N ATOM 266 CA PRO A 17 5.508 -2.770 12.452 1.00 0.00 C ATOM 267 C PRO A 17 4.988 -1.419 11.949 1.00 0.00 C ATOM 268 O PRO A 17 3.802 -1.231 11.765 1.00 0.00 O ATOM 269 CB PRO A 17 6.658 -3.285 11.585 1.00 0.00 C ATOM 270 CG PRO A 17 6.021 -4.195 10.561 1.00 0.00 C ATOM 271 CD PRO A 17 4.552 -4.281 10.873 1.00 0.00 C ATOM 272 HA PRO A 17 5.814 -2.714 13.483 1.00 0.00 H ATOM 273 HB2 PRO A 17 7.155 -2.459 11.095 1.00 0.00 H ATOM 274 HB3 PRO A 17 7.358 -3.842 12.178 1.00 0.00 H ATOM 275 HG2 PRO A 17 6.171 -3.796 9.574 1.00 0.00 H ATOM 276 HG3 PRO A 17 6.449 -5.182 10.633 1.00 0.00 H ATOM 277 HD2 PRO A 17 3.984 -3.630 10.222 1.00 0.00 H ATOM 278 HD3 PRO A 17 4.205 -5.298 10.802 1.00 0.00 H ATOM 279 N GLY A 18 5.869 -0.479 11.728 1.00 0.00 N ATOM 280 CA GLY A 18 5.427 0.858 11.238 1.00 0.00 C ATOM 281 C GLY A 18 4.974 0.746 9.779 1.00 0.00 C ATOM 282 O GLY A 18 5.171 -0.274 9.148 1.00 0.00 O ATOM 283 H GLY A 18 6.820 -0.653 11.884 1.00 0.00 H ATOM 284 HA2 GLY A 18 4.606 1.211 11.846 1.00 0.00 H ATOM 285 HA3 GLY A 18 6.249 1.555 11.302 1.00 0.00 H ATOM 286 N PRO A 19 4.377 1.803 9.289 1.00 0.00 N ATOM 287 CA PRO A 19 3.891 1.831 7.902 1.00 0.00 C ATOM 288 C PRO A 19 4.981 2.326 6.946 1.00 0.00 C ATOM 289 O PRO A 19 5.093 3.505 6.675 1.00 0.00 O ATOM 290 CB PRO A 19 2.725 2.800 7.957 1.00 0.00 C ATOM 291 CG PRO A 19 2.964 3.658 9.157 1.00 0.00 C ATOM 292 CD PRO A 19 4.097 3.064 9.962 1.00 0.00 C ATOM 293 HA PRO A 19 3.532 0.870 7.618 1.00 0.00 H ATOM 294 HB2 PRO A 19 2.701 3.405 7.061 1.00 0.00 H ATOM 295 HB3 PRO A 19 1.798 2.261 8.070 1.00 0.00 H ATOM 296 HG2 PRO A 19 3.208 4.665 8.853 1.00 0.00 H ATOM 297 HG3 PRO A 19 2.075 3.654 9.749 1.00 0.00 H ATOM 298 HD2 PRO A 19 4.962 3.713 9.935 1.00 0.00 H ATOM 299 HD3 PRO A 19 3.787 2.883 10.979 1.00 0.00 H ATOM 300 N GLN A 20 5.784 1.430 6.435 1.00 0.00 N ATOM 301 CA GLN A 20 6.869 1.846 5.498 1.00 0.00 C ATOM 302 C GLN A 20 6.276 2.557 4.279 1.00 0.00 C ATOM 303 O GLN A 20 5.090 2.820 4.219 1.00 0.00 O ATOM 304 CB GLN A 20 7.559 0.543 5.079 1.00 0.00 C ATOM 305 CG GLN A 20 9.070 0.674 5.287 1.00 0.00 C ATOM 306 CD GLN A 20 9.393 0.530 6.776 1.00 0.00 C ATOM 307 OE1 GLN A 20 9.961 1.423 7.375 1.00 0.00 O ATOM 308 NE2 GLN A 20 9.053 -0.563 7.402 1.00 0.00 N ATOM 309 H GLN A 20 5.676 0.487 6.670 1.00 0.00 H ATOM 310 HA GLN A 20 7.573 2.488 6.003 1.00 0.00 H ATOM 311 HB2 GLN A 20 7.182 -0.275 5.679 1.00 0.00 H ATOM 312 HB3 GLN A 20 7.358 0.349 4.033 1.00 0.00 H ATOM 313 HG2 GLN A 20 9.578 -0.101 4.731 1.00 0.00 H ATOM 314 HG3 GLN A 20 9.398 1.642 4.941 1.00 0.00 H ATOM 315 HE21 GLN A 20 8.596 -1.282 6.920 1.00 0.00 H ATOM 316 HE22 GLN A 20 9.257 -0.664 8.356 1.00 0.00 H ATOM 317 N LEU A 21 7.091 2.870 3.308 1.00 0.00 N ATOM 318 CA LEU A 21 6.576 3.564 2.092 1.00 0.00 C ATOM 319 C LEU A 21 7.518 3.328 0.908 1.00 0.00 C ATOM 320 O LEU A 21 8.571 3.944 0.882 1.00 0.00 O ATOM 321 CB LEU A 21 6.547 5.047 2.467 1.00 0.00 C ATOM 322 CG LEU A 21 5.415 5.744 1.709 1.00 0.00 C ATOM 323 CD1 LEU A 21 4.158 5.767 2.579 1.00 0.00 C ATOM 324 CD2 LEU A 21 5.832 7.180 1.379 1.00 0.00 C ATOM 325 H LEU A 21 8.043 2.648 3.378 1.00 0.00 H ATOM 326 HA LEU A 21 5.581 3.224 1.856 1.00 0.00 H ATOM 327 HB2 LEU A 21 6.384 5.146 3.529 1.00 0.00 H ATOM 328 HB3 LEU A 21 7.489 5.503 2.202 1.00 0.00 H ATOM 329 HG LEU A 21 5.211 5.206 0.794 1.00 0.00 H ATOM 330 HD11 LEU A 21 3.640 4.824 2.488 1.00 0.00 H ATOM 331 HD12 LEU A 21 3.508 6.567 2.252 1.00 0.00 H ATOM 332 HD13 LEU A 21 4.435 5.928 3.610 1.00 0.00 H ATOM 333 HD21 LEU A 21 5.166 7.584 0.632 1.00 0.00 H ATOM 334 HD22 LEU A 21 6.843 7.182 0.999 1.00 0.00 H ATOM 335 HD23 LEU A 21 5.781 7.783 2.273 1.00 0.00 H HETATM 336 N NH2 A 22 7.190 2.489 -0.035 1.00 0.00 N HETATM 337 HN1 NH2 A 22 6.332 2.008 0.013 1.00 0.00 H HETATM 338 HN2 NH2 A 22 7.799 2.339 -0.794 1.00 0.00 H TER 339 NH2 A 22 ENDMDL CONECT 336 337 338 CONECT 337 336 CONECT 338 336 MASTER 206 0 1 1 0 0 0 6 166 1 3 2 END