HEADER TRANSCRIPTION REGULATOR 08-SEP-97 1BUZ TITLE SOLUTION STRUCTURE OF SPOIIAA, A PHOSPHORYLATABLE COMPONENT TITLE 2 OF THE SYSTEM THAT REGULATES TRANSCRIPTION FACTOR SIGMA-F TITLE 3 OF BACILLUS SUBTILIS NMR, MINIMIZED AVERAGE STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: SPOIIAA; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 OTHER_DETAILS: NON-PHOSPHORYLATED FORM SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; SOURCE 3 ORGANISM_TAXID: 1423; SOURCE 4 STRAIN: SG38; SOURCE 5 CELL_LINE: BL21; SOURCE 6 CELLULAR_LOCATION: CYTOPLASM; SOURCE 7 GENE: SPOIIAA; SOURCE 8 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 10 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 11 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM; SOURCE 12 EXPRESSION_SYSTEM_VECTOR_TYPE: BACTERIAL; SOURCE 13 EXPRESSION_SYSTEM_VECTOR: T7 RNA POLYMERASE EXPRESSION SOURCE 14 VECTOR; SOURCE 15 EXPRESSION_SYSTEM_PLASMID: PEAA; SOURCE 16 EXPRESSION_SYSTEM_GENE: SPOIIAA KEYWDS TRANSCRIPTION REGULATOR, KINASE SUBSTRATE, ANTI-ANTI SIGMA KEYWDS 2 FACTOR, NOVEL ALPHA/BETA FOLD, SPORULATION, PHOSPHORYLATION EXPDTA SOLUTION NMR AUTHOR H.KOVACS,D.COMFORT,M.LORD,I.D.CAMPBELL,M.D.YUDKIN REVDAT 2 24-FEB-09 1BUZ 1 VERSN REVDAT 1 01-JUL-98 1BUZ 0 JRNL AUTH H.KOVACS,D.COMFORT,M.LORD,I.D.CAMPBELL,M.D.YUDKIN JRNL TITL SOLUTION STRUCTURE OF SPOIIAA, A PHOSPHORYLATABLE JRNL TITL 2 COMPONENT OF THE SYSTEM THAT REGULATES JRNL TITL 3 TRANSCRIPTION FACTOR SIGMAF OF BACILLUS SUBTILIS. JRNL REF PROC.NATL.ACAD.SCI.USA V. 95 5067 1998 JRNL REFN ISSN 0027-8424 JRNL PMID 9560229 JRNL DOI 10.1073/PNAS.95.9.5067 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH L.DUNCAN,S.ALPER,F.ARIGONI,R.LOSICK,P.STRAGIER REMARK 1 TITL ACTIVATION OF CELL-SPECIFIC TRANSCRIPTION BY A REMARK 1 TITL 2 SERINE PHOSPHATASE AT THE SITE OF ASYMMETRIC REMARK 1 TITL 3 DIVISION REMARK 1 REF SCIENCE V. 270 641 1995 REMARK 1 REFN ISSN 0036-8075 REMARK 1 REFERENCE 2 REMARK 1 AUTH B.DIEDERICH,J.F.WILKINSON,T.MAGNIN,S.M.A.NAJAFI, REMARK 1 AUTH 2 J.ERRINGTON,M.D.YUDKIN REMARK 1 TITL ROLE OF INTERACTIONS BETWEEN SPOIIAA AND SPOIIAB REMARK 1 TITL 2 IN REGULATING CELL-SPECIFIC TRANSCRIPTION FACTOR REMARK 1 TITL 3 SIGMA F OF BACILLUS SUBTILIS REMARK 1 REF GENES DEV. V. 8 2653 1994 REMARK 1 REFN ISSN 0890-9369 REMARK 1 REFERENCE 3 REMARK 1 AUTH S.ALPER,L.DUNCAN,R.LOSICK REMARK 1 TITL AN ADENOSINE NUCLEOTIDE SWITCH CONTROLLING THE REMARK 1 TITL 2 ACTIVITY OF A CELL TYPE-SPECIFIC TRANSCRIPTION REMARK 1 TITL 3 FACTOR IN B. SUBTILIS REMARK 1 REF CELL(CAMBRIDGE,MASS.) V. 77 195 1994 REMARK 1 REFN ISSN 0092-8674 REMARK 1 REFERENCE 4 REMARK 1 AUTH K.T.MIN,C.M.HILDITCH,B.DIEDERICH,J.ERRINGTON, REMARK 1 AUTH 2 M.D.YUDKIN REMARK 1 TITL SIGMA F, THE FIRST COMPARTMENT-SPECIFIC REMARK 1 TITL 2 TRANSCRIPTION FACTOR OF B. SUBTILIS, IS REGULATED REMARK 1 TITL 3 BY AN ANTI-SIGMA FACTOR THAT IS ALSO A PROTEIN REMARK 1 TITL 4 KINASE REMARK 1 REF CELL(CAMBRIDGE,MASS.) V. 74 735 1993 REMARK 1 REFN ISSN 0092-8674 REMARK 1 REFERENCE 5 REMARK 1 AUTH I.J.CHALLONER-COURTNEY,M.D.YUDKIN REMARK 1 TITL MOLECULAR AND PHENOTYPIC CHARACTERIZATION OF REMARK 1 TITL 2 PROMOTER-PROXIMAL MUTATIONS IN THE SPOIIA LOCUS OF REMARK 1 TITL 3 BACILLUS SUBTILIS REMARK 1 REF J.BACTERIOL. V. 175 5636 1993 REMARK 1 REFN ISSN 0021-9193 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : DYANA REMARK 3 AUTHORS : GUNTERT,WUTHRICH REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REFINEMENT WITH TORSION ANGLE REMARK 3 DYNAMICS. THE TOTAL NUMBER OF STEPS WAS 6000; HIGH TEMP. STAGE REMARK 3 1/5TH OF TOTAL. 1000 STEPS OF CONJUGANT GRADIENT MINIMIZATION. REMARK 4 REMARK 4 1BUZ COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 6.4 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NOESY, TOCSY, HSQC, HMQC-J, REMARK 210 HNCA, CBCA(CO)NH, HBHA(CO)NH REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 750 MHZ REMARK 210 SPECTROMETER MODEL : HOMEBUILT REMARK 210 SPECTROMETER MANUFACTURER : HOMEBUILT SPECTROMETER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : DYANA 1.3 REMARK 210 METHOD USED : SIMULATED ANNEALING IN REMARK 210 TORSION ANGLE SPACE REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : TARGET FUNCTION AND LEAST REMARK 210 RESTRAINT VIOLATIONS REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: 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 CD1 LEU A 13 O HIS A 44 1.81 REMARK 500 O GLN A 103 N GLU A 105 2.03 REMARK 500 O SER A 104 N GLN A 107 2.14 REMARK 500 N GLY A 3 O THR A 18 2.18 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 ILE A 4 135.08 179.76 REMARK 500 GLU A 10 -27.83 64.50 REMARK 500 SER A 11 -5.47 162.48 REMARK 500 GLU A 38 74.58 -161.63 REMARK 500 ASP A 40 -91.02 167.34 REMARK 500 ASP A 41 -124.33 -79.69 REMARK 500 VAL A 46 82.73 -163.53 REMARK 500 ASN A 48 103.73 -176.61 REMARK 500 ASP A 51 67.70 -107.43 REMARK 500 SER A 53 -90.21 -124.50 REMARK 500 PHE A 54 -70.81 -61.86 REMARK 500 MET A 55 90.54 41.59 REMARK 500 ASP A 56 -156.95 -109.10 REMARK 500 ALA A 81 46.26 77.60 REMARK 500 VAL A 86 -36.04 -139.26 REMARK 500 ARG A 100 88.58 30.16 REMARK 500 GLU A 102 -145.55 -147.19 REMARK 500 SER A 104 -63.79 47.63 REMARK 500 GLU A 105 -31.85 -33.85 REMARK 500 GLN A 107 -31.64 -34.84 REMARK 500 THR A 111 -1.38 -54.87 REMARK 500 LEU A 112 14.18 101.74 REMARK 500 VAL A 114 82.45 -157.45 REMARK 500 ALA A 115 87.62 158.30 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: P REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: PHOSPHORYLATION SITE IN SPOIIAA IS SER 58. DBREF 1BUZ A 1 116 UNP P10727 SP2AA_BACSU 1 116 SEQRES 1 A 116 SER LEU GLY ILE ASP MET ASN VAL LYS GLU SER VAL LEU SEQRES 2 A 116 CYS ILE ARG LEU THR GLY GLU LEU ASP HIS HIS THR ALA SEQRES 3 A 116 GLU THR LEU LYS GLN LYS VAL THR GLN SER LEU GLU LYS SEQRES 4 A 116 ASP ASP ILE ARG HIS ILE VAL LEU ASN LEU GLU ASP LEU SEQRES 5 A 116 SER PHE MET ASP SER SER GLY LEU GLY VAL ILE LEU GLY SEQRES 6 A 116 ARG TYR LYS GLN ILE LYS GLN ILE GLY GLY GLU MET VAL SEQRES 7 A 116 VAL CYS ALA ILE SER PRO ALA VAL LYS ARG LEU PHE ASP SEQRES 8 A 116 MET SER GLY LEU PHE LYS ILE ILE ARG PHE GLU GLN SER SEQRES 9 A 116 GLU GLN GLN ALA LEU LEU THR LEU GLY VAL ALA SER HELIX 1 H1 THR A 25 LEU A 37 1 13 HELIX 2 H2 SER A 57 LYS A 71 1 15 HELIX 3 H3 LYS A 87 SER A 93 1 7 HELIX 4 H4 GLU A 105 THR A 111 1 7 SHEET 1 B 4 GLY A 3 LYS A 9 0 SHEET 2 B 4 VAL A 12 THR A 18 -1 SHEET 3 B 4 HIS A 44 ASN A 48 1 SHEET 4 B 4 GLU A 76 CYS A 80 1 SITE 1 P 1 SER A 57 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 ATOM 1 N SER A 1 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA SER A 1 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C SER A 1 1.648 1.187 -2.112 1.00 0.00 C ATOM 4 O SER A 1 0.695 1.892 -1.781 1.00 0.00 O ATOM 5 CB SER A 1 1.874 -1.311 -2.008 1.00 0.00 C ATOM 6 OG SER A 1 1.665 -2.413 -1.129 1.00 0.00 O ATOM 7 H SER A 1 1.884 0.000 0.829 1.00 0.00 H ATOM 8 HA SER A 1 3.119 0.095 -0.954 1.00 0.00 H ATOM 9 HB2 SER A 1 1.020 -1.215 -2.678 1.00 0.00 H ATOM 10 HB3 SER A 1 2.747 -1.505 -2.631 1.00 0.00 H ATOM 11 HG SER A 1 0.885 -2.230 -0.530 1.00 0.00 H ATOM 12 N LEU A 2 2.375 1.373 -3.204 1.00 0.00 N ATOM 13 CA LEU A 2 2.085 2.463 -4.119 1.00 0.00 C ATOM 14 C LEU A 2 2.479 2.049 -5.539 1.00 0.00 C ATOM 15 O LEU A 2 3.474 1.353 -5.733 1.00 0.00 O ATOM 16 CB LEU A 2 2.757 3.753 -3.646 1.00 0.00 C ATOM 17 CG LEU A 2 2.840 4.883 -4.675 1.00 0.00 C ATOM 18 CD1 LEU A 2 1.869 6.013 -4.327 1.00 0.00 C ATOM 19 CD2 LEU A 2 4.277 5.386 -4.822 1.00 0.00 C ATOM 20 H LEU A 2 3.148 0.795 -3.466 1.00 0.00 H ATOM 21 HA LEU A 2 1.009 2.633 -4.095 1.00 0.00 H ATOM 22 HB2 LEU A 2 2.218 4.122 -2.774 1.00 0.00 H ATOM 23 HB3 LEU A 2 3.769 3.513 -3.318 1.00 0.00 H ATOM 24 HG LEU A 2 2.537 4.486 -5.644 1.00 0.00 H ATOM 25 HD11 LEU A 2 1.372 5.788 -3.383 1.00 0.00 H ATOM 26 HD12 LEU A 2 2.420 6.949 -4.232 1.00 0.00 H ATOM 27 HD13 LEU A 2 1.124 6.108 -5.117 1.00 0.00 H ATOM 28 HD21 LEU A 2 4.871 5.043 -3.975 1.00 0.00 H ATOM 29 HD22 LEU A 2 4.705 4.999 -5.747 1.00 0.00 H ATOM 30 HD23 LEU A 2 4.279 6.476 -4.849 1.00 0.00 H ATOM 31 N GLY A 3 1.677 2.495 -6.495 1.00 0.00 N ATOM 32 CA GLY A 3 1.929 2.179 -7.890 1.00 0.00 C ATOM 33 C GLY A 3 2.593 3.356 -8.608 1.00 0.00 C ATOM 34 O GLY A 3 3.155 4.242 -7.965 1.00 0.00 O ATOM 35 H GLY A 3 0.869 3.061 -6.328 1.00 0.00 H ATOM 36 HA2 GLY A 3 2.568 1.299 -7.958 1.00 0.00 H ATOM 37 HA3 GLY A 3 0.990 1.930 -8.386 1.00 0.00 H ATOM 38 N ILE A 4 2.508 3.327 -9.929 1.00 0.00 N ATOM 39 CA ILE A 4 3.093 4.381 -10.741 1.00 0.00 C ATOM 40 C ILE A 4 2.844 4.078 -12.220 1.00 0.00 C ATOM 41 O ILE A 4 3.023 2.945 -12.664 1.00 0.00 O ATOM 42 CB ILE A 4 4.571 4.567 -10.392 1.00 0.00 C ATOM 43 CG1 ILE A 4 4.945 6.050 -10.360 1.00 0.00 C ATOM 44 CG2 ILE A 4 5.464 3.771 -11.346 1.00 0.00 C ATOM 45 CD1 ILE A 4 4.078 6.855 -11.330 1.00 0.00 C ATOM 46 H ILE A 4 2.050 2.603 -10.444 1.00 0.00 H ATOM 47 HA ILE A 4 2.583 5.310 -10.487 1.00 0.00 H ATOM 48 HB ILE A 4 4.738 4.171 -9.390 1.00 0.00 H ATOM 49 HG12 ILE A 4 4.821 6.438 -9.349 1.00 0.00 H ATOM 50 HG13 ILE A 4 5.996 6.170 -10.620 1.00 0.00 H ATOM 51 HG21 ILE A 4 4.857 3.055 -11.900 1.00 0.00 H ATOM 52 HG22 ILE A 4 5.948 4.454 -12.045 1.00 0.00 H ATOM 53 HG23 ILE A 4 6.224 3.238 -10.774 1.00 0.00 H ATOM 54 HD11 ILE A 4 3.094 6.393 -11.407 1.00 0.00 H ATOM 55 HD12 ILE A 4 3.973 7.875 -10.962 1.00 0.00 H ATOM 56 HD13 ILE A 4 4.550 6.869 -12.313 1.00 0.00 H ATOM 57 N ASP A 5 2.435 5.111 -12.941 1.00 0.00 N ATOM 58 CA ASP A 5 2.158 4.969 -14.361 1.00 0.00 C ATOM 59 C ASP A 5 2.571 6.251 -15.087 1.00 0.00 C ATOM 60 O ASP A 5 2.538 7.336 -14.507 1.00 0.00 O ATOM 61 CB ASP A 5 0.666 4.744 -14.611 1.00 0.00 C ATOM 62 CG ASP A 5 0.335 3.572 -15.537 1.00 0.00 C ATOM 63 OD1 ASP A 5 1.229 2.837 -15.981 1.00 0.00 O ATOM 64 OD2 ASP A 5 -0.919 3.426 -15.805 1.00 0.00 O ATOM 65 H ASP A 5 2.292 6.029 -12.572 1.00 0.00 H ATOM 66 HA ASP A 5 2.738 4.104 -14.681 1.00 0.00 H ATOM 67 HB2 ASP A 5 0.172 4.581 -13.653 1.00 0.00 H ATOM 68 HB3 ASP A 5 0.243 5.655 -15.036 1.00 0.00 H ATOM 69 HD2 ASP A 5 -1.246 4.201 -16.344 1.00 0.00 H ATOM 70 N MET A 6 2.951 6.085 -16.345 1.00 0.00 N ATOM 71 CA MET A 6 3.370 7.215 -17.156 1.00 0.00 C ATOM 72 C MET A 6 2.844 7.087 -18.587 1.00 0.00 C ATOM 73 O MET A 6 2.897 6.010 -19.178 1.00 0.00 O ATOM 74 CB MET A 6 4.898 7.289 -17.178 1.00 0.00 C ATOM 75 CG MET A 6 5.439 7.848 -15.861 1.00 0.00 C ATOM 76 SD MET A 6 7.216 7.685 -15.812 1.00 0.00 S ATOM 77 CE MET A 6 7.387 6.576 -14.423 1.00 0.00 C ATOM 78 H MET A 6 2.975 5.199 -16.809 1.00 0.00 H ATOM 79 HA MET A 6 2.937 8.094 -16.679 1.00 0.00 H ATOM 80 HB2 MET A 6 5.312 6.295 -17.353 1.00 0.00 H ATOM 81 HB3 MET A 6 5.224 7.919 -18.006 1.00 0.00 H ATOM 82 HG2 MET A 6 5.159 8.896 -15.759 1.00 0.00 H ATOM 83 HG3 MET A 6 4.993 7.316 -15.020 1.00 0.00 H ATOM 84 HE1 MET A 6 6.743 5.709 -14.569 1.00 0.00 H ATOM 85 HE2 MET A 6 8.424 6.250 -14.345 1.00 0.00 H ATOM 86 HE3 MET A 6 7.099 7.093 -13.508 1.00 0.00 H ATOM 87 N ASN A 7 2.350 8.203 -19.104 1.00 0.00 N ATOM 88 CA ASN A 7 1.816 8.230 -20.455 1.00 0.00 C ATOM 89 C ASN A 7 2.202 9.550 -21.125 1.00 0.00 C ATOM 90 O ASN A 7 2.526 10.523 -20.446 1.00 0.00 O ATOM 91 CB ASN A 7 0.289 8.132 -20.446 1.00 0.00 C ATOM 92 CG ASN A 7 -0.185 6.882 -21.190 1.00 0.00 C ATOM 93 OD1 ASN A 7 -0.408 5.832 -20.612 1.00 0.00 O ATOM 94 ND2 ASN A 7 -0.325 7.054 -22.501 1.00 0.00 N ATOM 95 H ASN A 7 2.311 9.075 -18.616 1.00 0.00 H ATOM 96 HA ASN A 7 2.255 7.366 -20.953 1.00 0.00 H ATOM 97 HB2 ASN A 7 -0.071 8.106 -19.417 1.00 0.00 H ATOM 98 HB3 ASN A 7 -0.138 9.021 -20.911 1.00 0.00 H ATOM 99 HD21 ASN A 7 -0.124 7.943 -22.913 1.00 0.00 H ATOM 100 HD22 ASN A 7 -0.631 6.295 -23.076 1.00 0.00 H ATOM 101 N VAL A 8 2.153 9.542 -22.449 1.00 0.00 N ATOM 102 CA VAL A 8 2.493 10.727 -23.218 1.00 0.00 C ATOM 103 C VAL A 8 1.362 11.033 -24.201 1.00 0.00 C ATOM 104 O VAL A 8 0.779 10.121 -24.786 1.00 0.00 O ATOM 105 CB VAL A 8 3.847 10.535 -23.904 1.00 0.00 C ATOM 106 CG1 VAL A 8 3.694 10.535 -25.427 1.00 0.00 C ATOM 107 CG2 VAL A 8 4.846 11.602 -23.454 1.00 0.00 C ATOM 108 H VAL A 8 1.889 8.746 -22.993 1.00 0.00 H ATOM 109 HA VAL A 8 2.584 11.558 -22.518 1.00 0.00 H ATOM 110 HB VAL A 8 4.238 9.562 -23.607 1.00 0.00 H ATOM 111 HG11 VAL A 8 2.928 9.814 -25.715 1.00 0.00 H ATOM 112 HG12 VAL A 8 3.401 11.530 -25.763 1.00 0.00 H ATOM 113 HG13 VAL A 8 4.643 10.260 -25.887 1.00 0.00 H ATOM 114 HG21 VAL A 8 4.922 11.592 -22.366 1.00 0.00 H ATOM 115 HG22 VAL A 8 5.824 11.390 -23.888 1.00 0.00 H ATOM 116 HG23 VAL A 8 4.506 12.582 -23.786 1.00 0.00 H ATOM 117 N LYS A 9 1.085 12.320 -24.353 1.00 0.00 N ATOM 118 CA LYS A 9 0.034 12.757 -25.256 1.00 0.00 C ATOM 119 C LYS A 9 0.414 14.112 -25.856 1.00 0.00 C ATOM 120 O LYS A 9 0.320 15.140 -25.188 1.00 0.00 O ATOM 121 CB LYS A 9 -1.319 12.759 -24.542 1.00 0.00 C ATOM 122 CG LYS A 9 -1.306 11.814 -23.339 1.00 0.00 C ATOM 123 CD LYS A 9 -1.832 10.430 -23.723 1.00 0.00 C ATOM 124 CE LYS A 9 -3.278 10.245 -23.260 1.00 0.00 C ATOM 125 NZ LYS A 9 -4.113 9.721 -24.365 1.00 0.00 N ATOM 126 H LYS A 9 1.563 13.055 -23.874 1.00 0.00 H ATOM 127 HA LYS A 9 -0.029 12.027 -26.063 1.00 0.00 H ATOM 128 HB2 LYS A 9 -1.560 13.770 -24.212 1.00 0.00 H ATOM 129 HB3 LYS A 9 -2.102 12.457 -25.237 1.00 0.00 H ATOM 130 HG2 LYS A 9 -0.291 11.727 -22.952 1.00 0.00 H ATOM 131 HG3 LYS A 9 -1.917 12.230 -22.538 1.00 0.00 H ATOM 132 HD2 LYS A 9 -1.772 10.301 -24.803 1.00 0.00 H ATOM 133 HD3 LYS A 9 -1.202 9.661 -23.275 1.00 0.00 H ATOM 134 HE2 LYS A 9 -3.311 9.558 -22.415 1.00 0.00 H ATOM 135 HE3 LYS A 9 -3.680 11.197 -22.914 1.00 0.00 H ATOM 136 HZ1 LYS A 9 -4.878 9.150 -24.025 1.00 0.00 H ATOM 137 HZ2 LYS A 9 -4.525 10.466 -24.916 1.00 0.00 H ATOM 138 N GLU A 10 0.836 14.069 -27.112 1.00 0.00 N ATOM 139 CA GLU A 10 1.232 15.281 -27.810 1.00 0.00 C ATOM 140 C GLU A 10 2.465 15.897 -27.146 1.00 0.00 C ATOM 141 O GLU A 10 3.254 16.575 -27.803 1.00 0.00 O ATOM 142 CB GLU A 10 0.079 16.285 -27.862 1.00 0.00 C ATOM 143 CG GLU A 10 0.589 17.689 -28.190 1.00 0.00 C ATOM 144 CD GLU A 10 -0.385 18.425 -29.113 1.00 0.00 C ATOM 145 OE1 GLU A 10 -1.605 18.235 -29.004 1.00 0.00 O ATOM 146 OE2 GLU A 10 0.167 19.220 -29.966 1.00 0.00 O ATOM 147 H GLU A 10 0.910 13.229 -27.649 1.00 0.00 H ATOM 148 HA GLU A 10 1.476 14.964 -28.824 1.00 0.00 H ATOM 149 HB2 GLU A 10 -0.646 15.973 -28.614 1.00 0.00 H ATOM 150 HB3 GLU A 10 -0.441 16.298 -26.904 1.00 0.00 H ATOM 151 HG2 GLU A 10 0.721 18.257 -27.269 1.00 0.00 H ATOM 152 HG3 GLU A 10 1.567 17.623 -28.667 1.00 0.00 H ATOM 153 HE2 GLU A 10 -0.535 19.729 -30.463 1.00 0.00 H ATOM 154 N SER A 11 2.593 15.639 -25.853 1.00 0.00 N ATOM 155 CA SER A 11 3.718 16.159 -25.094 1.00 0.00 C ATOM 156 C SER A 11 3.412 16.096 -23.596 1.00 0.00 C ATOM 157 O SER A 11 4.273 16.394 -22.770 1.00 0.00 O ATOM 158 CB SER A 11 4.045 17.595 -25.508 1.00 0.00 C ATOM 159 OG SER A 11 2.989 18.188 -26.259 1.00 0.00 O ATOM 160 H SER A 11 1.947 15.087 -25.326 1.00 0.00 H ATOM 161 HA SER A 11 4.558 15.509 -25.340 1.00 0.00 H ATOM 162 HB2 SER A 11 4.238 18.194 -24.618 1.00 0.00 H ATOM 163 HB3 SER A 11 4.960 17.601 -26.101 1.00 0.00 H ATOM 164 HG SER A 11 2.882 19.147 -25.999 1.00 0.00 H ATOM 165 N VAL A 12 2.183 15.705 -23.291 1.00 0.00 N ATOM 166 CA VAL A 12 1.753 15.598 -21.908 1.00 0.00 C ATOM 167 C VAL A 12 1.977 14.167 -21.417 1.00 0.00 C ATOM 168 O VAL A 12 1.424 13.221 -21.976 1.00 0.00 O ATOM 169 CB VAL A 12 0.298 16.054 -21.775 1.00 0.00 C ATOM 170 CG1 VAL A 12 -0.653 15.052 -22.431 1.00 0.00 C ATOM 171 CG2 VAL A 12 -0.073 16.284 -20.309 1.00 0.00 C ATOM 172 H VAL A 12 1.489 15.463 -23.969 1.00 0.00 H ATOM 173 HA VAL A 12 2.373 16.273 -21.318 1.00 0.00 H ATOM 174 HB VAL A 12 0.196 17.005 -22.299 1.00 0.00 H ATOM 175 HG11 VAL A 12 -0.119 14.496 -23.202 1.00 0.00 H ATOM 176 HG12 VAL A 12 -1.027 14.359 -21.677 1.00 0.00 H ATOM 177 HG13 VAL A 12 -1.489 15.586 -22.882 1.00 0.00 H ATOM 178 HG21 VAL A 12 0.501 15.605 -19.678 1.00 0.00 H ATOM 179 HG22 VAL A 12 0.154 17.314 -20.033 1.00 0.00 H ATOM 180 HG23 VAL A 12 -1.138 16.096 -20.170 1.00 0.00 H ATOM 181 N LEU A 13 2.790 14.052 -20.377 1.00 0.00 N ATOM 182 CA LEU A 13 3.095 12.752 -19.804 1.00 0.00 C ATOM 183 C LEU A 13 2.187 12.505 -18.598 1.00 0.00 C ATOM 184 O LEU A 13 2.424 13.044 -17.518 1.00 0.00 O ATOM 185 CB LEU A 13 4.587 12.644 -19.484 1.00 0.00 C ATOM 186 CG LEU A 13 5.406 13.924 -19.664 1.00 0.00 C ATOM 187 CD1 LEU A 13 4.592 15.156 -19.264 1.00 0.00 C ATOM 188 CD2 LEU A 13 6.730 13.839 -18.901 1.00 0.00 C ATOM 189 H LEU A 13 3.236 14.826 -19.927 1.00 0.00 H ATOM 190 HA LEU A 13 2.873 12.001 -20.563 1.00 0.00 H ATOM 191 HB2 LEU A 13 4.693 12.310 -18.452 1.00 0.00 H ATOM 192 HB3 LEU A 13 5.019 11.868 -20.116 1.00 0.00 H ATOM 193 HG LEU A 13 5.649 14.028 -20.721 1.00 0.00 H ATOM 194 HD11 LEU A 13 3.533 14.962 -19.431 1.00 0.00 H ATOM 195 HD12 LEU A 13 4.759 15.375 -18.209 1.00 0.00 H ATOM 196 HD13 LEU A 13 4.905 16.009 -19.866 1.00 0.00 H ATOM 197 HD21 LEU A 13 7.202 12.877 -19.100 1.00 0.00 H ATOM 198 HD22 LEU A 13 7.390 14.642 -19.229 1.00 0.00 H ATOM 199 HD23 LEU A 13 6.541 13.937 -17.832 1.00 0.00 H ATOM 200 N CYS A 14 1.167 11.689 -18.822 1.00 0.00 N ATOM 201 CA CYS A 14 0.222 11.365 -17.767 1.00 0.00 C ATOM 202 C CYS A 14 0.924 10.456 -16.756 1.00 0.00 C ATOM 203 O CYS A 14 1.610 9.509 -17.139 1.00 0.00 O ATOM 204 CB CYS A 14 -1.050 10.724 -18.324 1.00 0.00 C ATOM 205 SG CYS A 14 -1.334 11.287 -20.042 1.00 0.00 S ATOM 206 H CYS A 14 0.982 11.255 -19.703 1.00 0.00 H ATOM 207 HA CYS A 14 -0.066 12.309 -17.304 1.00 0.00 H ATOM 208 HB2 CYS A 14 -0.961 9.638 -18.299 1.00 0.00 H ATOM 209 HB3 CYS A 14 -1.904 10.988 -17.700 1.00 0.00 H ATOM 210 HG CYS A 14 -2.640 11.037 -20.056 1.00 0.00 H ATOM 211 N ILE A 15 0.729 10.776 -15.485 1.00 0.00 N ATOM 212 CA ILE A 15 1.335 10.001 -14.416 1.00 0.00 C ATOM 213 C ILE A 15 0.235 9.434 -13.517 1.00 0.00 C ATOM 214 O ILE A 15 -0.318 10.148 -12.681 1.00 0.00 O ATOM 215 CB ILE A 15 2.371 10.840 -13.666 1.00 0.00 C ATOM 216 CG1 ILE A 15 3.736 10.768 -14.354 1.00 0.00 C ATOM 217 CG2 ILE A 15 2.449 10.428 -12.195 1.00 0.00 C ATOM 218 CD1 ILE A 15 3.615 11.083 -15.847 1.00 0.00 C ATOM 219 H ILE A 15 0.170 11.548 -15.182 1.00 0.00 H ATOM 220 HA ILE A 15 1.867 9.168 -14.878 1.00 0.00 H ATOM 221 HB ILE A 15 2.052 11.881 -13.693 1.00 0.00 H ATOM 222 HG12 ILE A 15 4.421 11.474 -13.885 1.00 0.00 H ATOM 223 HG13 ILE A 15 4.163 9.774 -14.222 1.00 0.00 H ATOM 224 HG21 ILE A 15 1.951 9.468 -12.059 1.00 0.00 H ATOM 225 HG22 ILE A 15 3.494 10.341 -11.897 1.00 0.00 H ATOM 226 HG23 ILE A 15 1.958 11.182 -11.580 1.00 0.00 H ATOM 227 HD11 ILE A 15 2.567 11.246 -16.100 1.00 0.00 H ATOM 228 HD12 ILE A 15 4.189 11.980 -16.077 1.00 0.00 H ATOM 229 HD13 ILE A 15 4.002 10.245 -16.427 1.00 0.00 H ATOM 230 N ARG A 16 -0.051 8.156 -13.718 1.00 0.00 N ATOM 231 CA ARG A 16 -1.074 7.485 -12.935 1.00 0.00 C ATOM 232 C ARG A 16 -0.466 6.891 -11.663 1.00 0.00 C ATOM 233 O ARG A 16 0.206 5.862 -11.715 1.00 0.00 O ATOM 234 CB ARG A 16 -1.743 6.370 -13.742 1.00 0.00 C ATOM 235 CG ARG A 16 -3.241 6.632 -13.903 1.00 0.00 C ATOM 236 CD ARG A 16 -3.662 6.524 -15.370 1.00 0.00 C ATOM 237 NE ARG A 16 -5.134 6.396 -15.466 1.00 0.00 N ATOM 238 CZ ARG A 16 -5.772 5.726 -16.449 1.00 0.00 C ATOM 239 NH1 ARG A 16 -5.072 5.116 -17.430 1.00 0.00 N ATOM 240 NH2 ARG A 16 -7.091 5.675 -16.437 1.00 0.00 N ATOM 241 H ARG A 16 0.403 7.582 -14.400 1.00 0.00 H ATOM 242 HA ARG A 16 -1.798 8.265 -12.696 1.00 0.00 H ATOM 243 HB2 ARG A 16 -1.275 6.296 -14.724 1.00 0.00 H ATOM 244 HB3 ARG A 16 -1.589 5.413 -13.243 1.00 0.00 H ATOM 245 HG2 ARG A 16 -3.806 5.917 -13.305 1.00 0.00 H ATOM 246 HG3 ARG A 16 -3.483 7.625 -13.524 1.00 0.00 H ATOM 247 HD2 ARG A 16 -3.329 7.405 -15.919 1.00 0.00 H ATOM 248 HD3 ARG A 16 -3.183 5.661 -15.832 1.00 0.00 H ATOM 249 HE ARG A 16 -5.689 6.833 -14.759 1.00 0.00 H ATOM 250 HH11 ARG A 16 -4.073 5.159 -17.432 1.00 0.00 H ATOM 251 HH12 ARG A 16 -5.553 4.622 -18.154 1.00 0.00 H ATOM 252 HH21 ARG A 16 -7.639 5.201 -17.126 1.00 0.00 H ATOM 253 N LEU A 17 -0.724 7.564 -10.552 1.00 0.00 N ATOM 254 CA LEU A 17 -0.210 7.115 -9.269 1.00 0.00 C ATOM 255 C LEU A 17 -1.320 6.393 -8.504 1.00 0.00 C ATOM 256 O LEU A 17 -2.419 6.923 -8.350 1.00 0.00 O ATOM 257 CB LEU A 17 0.406 8.286 -8.500 1.00 0.00 C ATOM 258 CG LEU A 17 1.820 8.063 -7.958 1.00 0.00 C ATOM 259 CD1 LEU A 17 1.835 8.105 -6.429 1.00 0.00 C ATOM 260 CD2 LEU A 17 2.416 6.762 -8.501 1.00 0.00 C ATOM 261 H LEU A 17 -1.271 8.400 -10.518 1.00 0.00 H ATOM 262 HA LEU A 17 0.591 6.404 -9.469 1.00 0.00 H ATOM 263 HB2 LEU A 17 0.423 9.157 -9.154 1.00 0.00 H ATOM 264 HB3 LEU A 17 -0.248 8.529 -7.662 1.00 0.00 H ATOM 265 HG LEU A 17 2.453 8.878 -8.309 1.00 0.00 H ATOM 266 HD11 LEU A 17 0.811 8.136 -6.057 1.00 0.00 H ATOM 267 HD12 LEU A 17 2.334 7.216 -6.045 1.00 0.00 H ATOM 268 HD13 LEU A 17 2.370 8.995 -6.095 1.00 0.00 H ATOM 269 HD21 LEU A 17 1.659 5.979 -8.480 1.00 0.00 H ATOM 270 HD22 LEU A 17 2.751 6.916 -9.527 1.00 0.00 H ATOM 271 HD23 LEU A 17 3.263 6.465 -7.883 1.00 0.00 H ATOM 272 N THR A 18 -0.995 5.194 -8.044 1.00 0.00 N ATOM 273 CA THR A 18 -1.951 4.394 -7.297 1.00 0.00 C ATOM 274 C THR A 18 -1.305 3.839 -6.027 1.00 0.00 C ATOM 275 O THR A 18 -0.400 3.009 -6.098 1.00 0.00 O ATOM 276 CB THR A 18 -2.489 3.307 -8.231 1.00 0.00 C ATOM 277 OG1 THR A 18 -1.384 2.998 -9.076 1.00 0.00 O ATOM 278 CG2 THR A 18 -3.556 3.835 -9.191 1.00 0.00 C ATOM 279 H THR A 18 -0.099 4.769 -8.174 1.00 0.00 H ATOM 280 HA THR A 18 -2.770 5.041 -6.983 1.00 0.00 H ATOM 281 HB THR A 18 -2.863 2.456 -7.662 1.00 0.00 H ATOM 282 HG1 THR A 18 -1.671 2.368 -9.797 1.00 0.00 H ATOM 283 HG21 THR A 18 -3.330 4.869 -9.453 1.00 0.00 H ATOM 284 HG22 THR A 18 -3.566 3.226 -10.094 1.00 0.00 H ATOM 285 HG23 THR A 18 -4.533 3.788 -8.710 1.00 0.00 H ATOM 286 N GLY A 19 -1.795 4.319 -4.893 1.00 0.00 N ATOM 287 CA GLY A 19 -1.277 3.880 -3.609 1.00 0.00 C ATOM 288 C GLY A 19 -1.552 4.922 -2.522 1.00 0.00 C ATOM 289 O GLY A 19 -2.707 5.238 -2.238 1.00 0.00 O ATOM 290 H GLY A 19 -2.531 4.994 -4.844 1.00 0.00 H ATOM 291 HA2 GLY A 19 -1.736 2.931 -3.332 1.00 0.00 H ATOM 292 HA3 GLY A 19 -0.204 3.705 -3.686 1.00 0.00 H ATOM 293 N GLU A 20 -0.473 5.426 -1.943 1.00 0.00 N ATOM 294 CA GLU A 20 -0.583 6.425 -0.894 1.00 0.00 C ATOM 295 C GLU A 20 0.192 7.687 -1.278 1.00 0.00 C ATOM 296 O GLU A 20 1.076 7.641 -2.133 1.00 0.00 O ATOM 297 CB GLU A 20 -0.097 5.869 0.446 1.00 0.00 C ATOM 298 CG GLU A 20 -1.277 5.530 1.359 1.00 0.00 C ATOM 299 CD GLU A 20 -1.302 4.036 1.690 1.00 0.00 C ATOM 300 OE1 GLU A 20 -1.015 3.203 0.818 1.00 0.00 O ATOM 301 OE2 GLU A 20 -1.634 3.752 2.904 1.00 0.00 O ATOM 302 H GLU A 20 0.463 5.164 -2.180 1.00 0.00 H ATOM 303 HA GLU A 20 -1.647 6.653 -0.822 1.00 0.00 H ATOM 304 HB2 GLU A 20 0.505 4.976 0.276 1.00 0.00 H ATOM 305 HB3 GLU A 20 0.547 6.600 0.935 1.00 0.00 H ATOM 306 HG2 GLU A 20 -1.206 6.109 2.280 1.00 0.00 H ATOM 307 HG3 GLU A 20 -2.210 5.814 0.874 1.00 0.00 H ATOM 308 HE2 GLU A 20 -1.721 4.592 3.440 1.00 0.00 H ATOM 309 N LEU A 21 -0.166 8.784 -0.628 1.00 0.00 N ATOM 310 CA LEU A 21 0.486 10.056 -0.890 1.00 0.00 C ATOM 311 C LEU A 21 1.181 10.541 0.383 1.00 0.00 C ATOM 312 O LEU A 21 0.597 11.285 1.169 1.00 0.00 O ATOM 313 CB LEU A 21 -0.514 11.062 -1.465 1.00 0.00 C ATOM 314 CG LEU A 21 -0.213 11.576 -2.875 1.00 0.00 C ATOM 315 CD1 LEU A 21 1.295 11.637 -3.126 1.00 0.00 C ATOM 316 CD2 LEU A 21 -0.937 10.737 -3.930 1.00 0.00 C ATOM 317 H LEU A 21 -0.885 8.813 0.066 1.00 0.00 H ATOM 318 HA LEU A 21 1.244 9.883 -1.654 1.00 0.00 H ATOM 319 HB2 LEU A 21 -1.501 10.599 -1.472 1.00 0.00 H ATOM 320 HB3 LEU A 21 -0.567 11.917 -0.792 1.00 0.00 H ATOM 321 HG LEU A 21 -0.595 12.594 -2.955 1.00 0.00 H ATOM 322 HD11 LEU A 21 1.798 10.909 -2.490 1.00 0.00 H ATOM 323 HD12 LEU A 21 1.498 11.408 -4.172 1.00 0.00 H ATOM 324 HD13 LEU A 21 1.661 12.637 -2.895 1.00 0.00 H ATOM 325 HD21 LEU A 21 -1.981 10.612 -3.642 1.00 0.00 H ATOM 326 HD22 LEU A 21 -0.884 11.242 -4.895 1.00 0.00 H ATOM 327 HD23 LEU A 21 -0.461 9.759 -4.006 1.00 0.00 H ATOM 328 N ASP A 22 2.419 10.098 0.548 1.00 0.00 N ATOM 329 CA ASP A 22 3.201 10.477 1.712 1.00 0.00 C ATOM 330 C ASP A 22 4.653 10.712 1.292 1.00 0.00 C ATOM 331 O ASP A 22 5.039 10.388 0.170 1.00 0.00 O ATOM 332 CB ASP A 22 3.188 9.371 2.769 1.00 0.00 C ATOM 333 CG ASP A 22 2.636 8.027 2.291 1.00 0.00 C ATOM 334 OD1 ASP A 22 3.328 7.260 1.604 1.00 0.00 O ATOM 335 OD2 ASP A 22 1.425 7.773 2.656 1.00 0.00 O ATOM 336 H ASP A 22 2.887 9.492 -0.096 1.00 0.00 H ATOM 337 HA ASP A 22 2.726 11.381 2.094 1.00 0.00 H ATOM 338 HB2 ASP A 22 4.205 9.222 3.130 1.00 0.00 H ATOM 339 HB3 ASP A 22 2.595 9.708 3.619 1.00 0.00 H ATOM 340 HD2 ASP A 22 1.288 6.785 2.723 1.00 0.00 H ATOM 341 N HIS A 23 5.420 11.275 2.215 1.00 0.00 N ATOM 342 CA HIS A 23 6.821 11.557 1.954 1.00 0.00 C ATOM 343 C HIS A 23 7.481 10.332 1.318 1.00 0.00 C ATOM 344 O HIS A 23 8.523 10.449 0.674 1.00 0.00 O ATOM 345 CB HIS A 23 7.529 12.017 3.230 1.00 0.00 C ATOM 346 CG HIS A 23 8.146 10.894 4.029 1.00 0.00 C ATOM 347 ND1 HIS A 23 9.492 10.578 3.962 1.00 0.00 N ATOM 348 CD2 HIS A 23 7.588 10.017 4.912 1.00 0.00 C ATOM 349 CE1 HIS A 23 9.722 9.555 4.772 1.00 0.00 C ATOM 350 NE2 HIS A 23 8.540 9.208 5.359 1.00 0.00 N ATOM 351 H HIS A 23 5.098 11.535 3.125 1.00 0.00 H ATOM 352 HA HIS A 23 6.846 12.383 1.244 1.00 0.00 H ATOM 353 HB2 HIS A 23 8.309 12.730 2.963 1.00 0.00 H ATOM 354 HB3 HIS A 23 6.814 12.547 3.859 1.00 0.00 H ATOM 355 HD1 HIS A 23 10.175 11.043 3.399 1.00 0.00 H ATOM 356 HD2 HIS A 23 6.537 9.985 5.200 1.00 0.00 H ATOM 357 HE1 HIS A 23 10.686 9.075 4.940 1.00 0.00 H ATOM 358 N HIS A 24 6.848 9.186 1.521 1.00 0.00 N ATOM 359 CA HIS A 24 7.361 7.941 0.975 1.00 0.00 C ATOM 360 C HIS A 24 6.976 7.831 -0.502 1.00 0.00 C ATOM 361 O HIS A 24 7.832 7.599 -1.355 1.00 0.00 O ATOM 362 CB HIS A 24 6.883 6.747 1.803 1.00 0.00 C ATOM 363 CG HIS A 24 7.617 6.574 3.111 1.00 0.00 C ATOM 364 ND1 HIS A 24 8.672 5.691 3.268 1.00 0.00 N ATOM 365 CD2 HIS A 24 7.439 7.179 4.320 1.00 0.00 C ATOM 366 CE1 HIS A 24 9.100 5.770 4.519 1.00 0.00 C ATOM 367 NE2 HIS A 24 8.335 6.692 5.170 1.00 0.00 N ATOM 368 H HIS A 24 6.002 9.100 2.046 1.00 0.00 H ATOM 369 HA HIS A 24 8.447 7.988 1.055 1.00 0.00 H ATOM 370 HB2 HIS A 24 5.819 6.863 2.008 1.00 0.00 H ATOM 371 HB3 HIS A 24 6.997 5.839 1.211 1.00 0.00 H ATOM 372 HD1 HIS A 24 9.047 5.095 2.558 1.00 0.00 H ATOM 373 HD2 HIS A 24 6.688 7.935 4.550 1.00 0.00 H ATOM 374 HE1 HIS A 24 9.921 5.197 4.953 1.00 0.00 H ATOM 375 N THR A 25 5.687 8.002 -0.758 1.00 0.00 N ATOM 376 CA THR A 25 5.178 7.923 -2.117 1.00 0.00 C ATOM 377 C THR A 25 5.466 9.223 -2.871 1.00 0.00 C ATOM 378 O THR A 25 5.602 9.219 -4.093 1.00 0.00 O ATOM 379 CB THR A 25 3.689 7.580 -2.045 1.00 0.00 C ATOM 380 OG1 THR A 25 3.052 8.839 -1.842 1.00 0.00 O ATOM 381 CG2 THR A 25 3.333 6.777 -0.792 1.00 0.00 C ATOM 382 H THR A 25 4.998 8.191 -0.059 1.00 0.00 H ATOM 383 HA THR A 25 5.710 7.127 -2.638 1.00 0.00 H ATOM 384 HB THR A 25 3.365 7.059 -2.946 1.00 0.00 H ATOM 385 HG1 THR A 25 3.022 9.349 -2.702 1.00 0.00 H ATOM 386 HG21 THR A 25 4.161 6.823 -0.084 1.00 0.00 H ATOM 387 HG22 THR A 25 2.439 7.198 -0.332 1.00 0.00 H ATOM 388 HG23 THR A 25 3.147 5.739 -1.066 1.00 0.00 H ATOM 389 N ALA A 26 5.550 10.305 -2.110 1.00 0.00 N ATOM 390 CA ALA A 26 5.819 11.609 -2.690 1.00 0.00 C ATOM 391 C ALA A 26 7.247 11.633 -3.240 1.00 0.00 C ATOM 392 O ALA A 26 7.565 12.436 -4.115 1.00 0.00 O ATOM 393 CB ALA A 26 5.581 12.695 -1.639 1.00 0.00 C ATOM 394 H ALA A 26 5.438 10.299 -1.116 1.00 0.00 H ATOM 395 HA ALA A 26 5.120 11.757 -3.513 1.00 0.00 H ATOM 396 HB1 ALA A 26 5.485 12.234 -0.656 1.00 0.00 H ATOM 397 HB2 ALA A 26 6.423 13.388 -1.635 1.00 0.00 H ATOM 398 HB3 ALA A 26 4.666 13.237 -1.877 1.00 0.00 H ATOM 399 N GLU A 27 8.069 10.743 -2.703 1.00 0.00 N ATOM 400 CA GLU A 27 9.455 10.651 -3.130 1.00 0.00 C ATOM 401 C GLU A 27 9.531 10.270 -4.610 1.00 0.00 C ATOM 402 O GLU A 27 10.257 10.898 -5.379 1.00 0.00 O ATOM 403 CB GLU A 27 10.229 9.653 -2.267 1.00 0.00 C ATOM 404 CG GLU A 27 11.457 10.312 -1.636 1.00 0.00 C ATOM 405 CD GLU A 27 11.309 10.407 -0.116 1.00 0.00 C ATOM 406 OE1 GLU A 27 10.759 9.489 0.512 1.00 0.00 O ATOM 407 OE2 GLU A 27 11.789 11.481 0.413 1.00 0.00 O ATOM 408 H GLU A 27 7.802 10.093 -1.991 1.00 0.00 H ATOM 409 HA GLU A 27 9.869 11.648 -2.983 1.00 0.00 H ATOM 410 HB2 GLU A 27 9.579 9.263 -1.484 1.00 0.00 H ATOM 411 HB3 GLU A 27 10.540 8.804 -2.876 1.00 0.00 H ATOM 412 HG2 GLU A 27 12.350 9.737 -1.882 1.00 0.00 H ATOM 413 HG3 GLU A 27 11.595 11.309 -2.054 1.00 0.00 H ATOM 414 HE2 GLU A 27 11.917 11.350 1.397 1.00 0.00 H ATOM 415 N THR A 28 8.770 9.245 -4.964 1.00 0.00 N ATOM 416 CA THR A 28 8.743 8.772 -6.338 1.00 0.00 C ATOM 417 C THR A 28 8.654 9.954 -7.306 1.00 0.00 C ATOM 418 O THR A 28 9.380 10.004 -8.298 1.00 0.00 O ATOM 419 CB THR A 28 7.582 7.785 -6.475 1.00 0.00 C ATOM 420 OG1 THR A 28 8.218 6.533 -6.715 1.00 0.00 O ATOM 421 CG2 THR A 28 6.752 8.029 -7.737 1.00 0.00 C ATOM 422 H THR A 28 8.182 8.740 -4.332 1.00 0.00 H ATOM 423 HA THR A 28 9.683 8.260 -6.544 1.00 0.00 H ATOM 424 HB THR A 28 6.952 7.799 -5.586 1.00 0.00 H ATOM 425 HG1 THR A 28 8.887 6.345 -5.996 1.00 0.00 H ATOM 426 HG21 THR A 28 6.397 9.060 -7.745 1.00 0.00 H ATOM 427 HG22 THR A 28 7.369 7.851 -8.618 1.00 0.00 H ATOM 428 HG23 THR A 28 5.899 7.351 -7.748 1.00 0.00 H ATOM 429 N LEU A 29 7.758 10.875 -6.984 1.00 0.00 N ATOM 430 CA LEU A 29 7.564 12.052 -7.813 1.00 0.00 C ATOM 431 C LEU A 29 8.778 12.973 -7.674 1.00 0.00 C ATOM 432 O LEU A 29 9.107 13.716 -8.598 1.00 0.00 O ATOM 433 CB LEU A 29 6.235 12.731 -7.478 1.00 0.00 C ATOM 434 CG LEU A 29 5.564 13.494 -8.622 1.00 0.00 C ATOM 435 CD1 LEU A 29 6.286 13.242 -9.947 1.00 0.00 C ATOM 436 CD2 LEU A 29 4.074 13.156 -8.707 1.00 0.00 C ATOM 437 H LEU A 29 7.171 10.826 -6.176 1.00 0.00 H ATOM 438 HA LEU A 29 7.502 11.716 -8.849 1.00 0.00 H ATOM 439 HB2 LEU A 29 5.542 11.971 -7.118 1.00 0.00 H ATOM 440 HB3 LEU A 29 6.402 13.425 -6.654 1.00 0.00 H ATOM 441 HG LEU A 29 5.640 14.561 -8.412 1.00 0.00 H ATOM 442 HD11 LEU A 29 6.643 12.213 -9.976 1.00 0.00 H ATOM 443 HD12 LEU A 29 5.596 13.411 -10.774 1.00 0.00 H ATOM 444 HD13 LEU A 29 7.133 13.923 -10.034 1.00 0.00 H ATOM 445 HD21 LEU A 29 3.803 12.499 -7.880 1.00 0.00 H ATOM 446 HD22 LEU A 29 3.489 14.073 -8.650 1.00 0.00 H ATOM 447 HD23 LEU A 29 3.870 12.653 -9.652 1.00 0.00 H ATOM 448 N LYS A 30 9.410 12.896 -6.513 1.00 0.00 N ATOM 449 CA LYS A 30 10.580 13.713 -6.241 1.00 0.00 C ATOM 450 C LYS A 30 11.624 13.482 -7.336 1.00 0.00 C ATOM 451 O LYS A 30 12.222 14.431 -7.838 1.00 0.00 O ATOM 452 CB LYS A 30 11.103 13.448 -4.828 1.00 0.00 C ATOM 453 CG LYS A 30 11.828 14.675 -4.272 1.00 0.00 C ATOM 454 CD LYS A 30 13.318 14.633 -4.617 1.00 0.00 C ATOM 455 CE LYS A 30 13.550 14.986 -6.088 1.00 0.00 C ATOM 456 NZ LYS A 30 14.876 15.621 -6.265 1.00 0.00 N ATOM 457 H LYS A 30 9.135 12.289 -5.766 1.00 0.00 H ATOM 458 HA LYS A 30 10.266 14.756 -6.278 1.00 0.00 H ATOM 459 HB2 LYS A 30 10.272 13.184 -4.172 1.00 0.00 H ATOM 460 HB3 LYS A 30 11.781 12.594 -4.841 1.00 0.00 H ATOM 461 HG2 LYS A 30 11.382 15.581 -4.680 1.00 0.00 H ATOM 462 HG3 LYS A 30 11.703 14.717 -3.190 1.00 0.00 H ATOM 463 HD2 LYS A 30 13.862 15.332 -3.981 1.00 0.00 H ATOM 464 HD3 LYS A 30 13.716 13.639 -4.411 1.00 0.00 H ATOM 465 HE2 LYS A 30 13.487 14.086 -6.698 1.00 0.00 H ATOM 466 HE3 LYS A 30 12.768 15.662 -6.433 1.00 0.00 H ATOM 467 HZ1 LYS A 30 15.615 15.086 -5.823 1.00 0.00 H ATOM 468 HZ2 LYS A 30 15.125 15.713 -7.244 1.00 0.00 H ATOM 469 N GLN A 31 11.810 12.214 -7.673 1.00 0.00 N ATOM 470 CA GLN A 31 12.770 11.846 -8.699 1.00 0.00 C ATOM 471 C GLN A 31 12.249 12.243 -10.082 1.00 0.00 C ATOM 472 O GLN A 31 13.031 12.560 -10.977 1.00 0.00 O ATOM 473 CB GLN A 31 13.088 10.350 -8.642 1.00 0.00 C ATOM 474 CG GLN A 31 11.887 9.517 -9.096 1.00 0.00 C ATOM 475 CD GLN A 31 12.060 8.048 -8.705 1.00 0.00 C ATOM 476 OE1 GLN A 31 12.429 7.205 -9.506 1.00 0.00 O ATOM 477 NE2 GLN A 31 11.774 7.790 -7.432 1.00 0.00 N ATOM 478 H GLN A 31 11.319 11.447 -7.259 1.00 0.00 H ATOM 479 HA GLN A 31 13.673 12.411 -8.467 1.00 0.00 H ATOM 480 HB2 GLN A 31 13.947 10.133 -9.277 1.00 0.00 H ATOM 481 HB3 GLN A 31 13.364 10.072 -7.625 1.00 0.00 H ATOM 482 HG2 GLN A 31 10.976 9.912 -8.648 1.00 0.00 H ATOM 483 HG3 GLN A 31 11.772 9.598 -10.177 1.00 0.00 H ATOM 484 HE21 GLN A 31 11.476 8.529 -6.827 1.00 0.00 H ATOM 485 HE22 GLN A 31 11.856 6.858 -7.080 1.00 0.00 H ATOM 486 N LYS A 32 10.931 12.214 -10.213 1.00 0.00 N ATOM 487 CA LYS A 32 10.296 12.566 -11.471 1.00 0.00 C ATOM 488 C LYS A 32 10.508 14.057 -11.745 1.00 0.00 C ATOM 489 O LYS A 32 10.250 14.532 -12.850 1.00 0.00 O ATOM 490 CB LYS A 32 8.825 12.146 -11.465 1.00 0.00 C ATOM 491 CG LYS A 32 8.101 12.665 -12.710 1.00 0.00 C ATOM 492 CD LYS A 32 8.635 11.991 -13.975 1.00 0.00 C ATOM 493 CE LYS A 32 7.822 12.408 -15.203 1.00 0.00 C ATOM 494 NZ LYS A 32 8.616 12.222 -16.438 1.00 0.00 N ATOM 495 H LYS A 32 10.302 11.956 -9.480 1.00 0.00 H ATOM 496 HA LYS A 32 10.791 11.997 -12.258 1.00 0.00 H ATOM 497 HB2 LYS A 32 8.753 11.059 -11.425 1.00 0.00 H ATOM 498 HB3 LYS A 32 8.337 12.530 -10.570 1.00 0.00 H ATOM 499 HG2 LYS A 32 7.031 12.478 -12.617 1.00 0.00 H ATOM 500 HG3 LYS A 32 8.231 13.744 -12.786 1.00 0.00 H ATOM 501 HD2 LYS A 32 9.682 12.257 -14.120 1.00 0.00 H ATOM 502 HD3 LYS A 32 8.595 10.908 -13.859 1.00 0.00 H ATOM 503 HE2 LYS A 32 6.908 11.817 -15.259 1.00 0.00 H ATOM 504 HE3 LYS A 32 7.522 13.452 -15.110 1.00 0.00 H ATOM 505 HZ1 LYS A 32 9.613 12.246 -16.255 1.00 0.00 H ATOM 506 HZ2 LYS A 32 8.421 11.332 -16.884 1.00 0.00 H ATOM 507 N VAL A 33 10.977 14.753 -10.720 1.00 0.00 N ATOM 508 CA VAL A 33 11.227 16.180 -10.836 1.00 0.00 C ATOM 509 C VAL A 33 12.520 16.404 -11.624 1.00 0.00 C ATOM 510 O VAL A 33 12.518 17.094 -12.642 1.00 0.00 O ATOM 511 CB VAL A 33 11.255 16.821 -9.447 1.00 0.00 C ATOM 512 CG1 VAL A 33 11.304 18.347 -9.548 1.00 0.00 C ATOM 513 CG2 VAL A 33 10.059 16.365 -8.609 1.00 0.00 C ATOM 514 H VAL A 33 11.185 14.359 -9.824 1.00 0.00 H ATOM 515 HA VAL A 33 10.397 16.615 -11.392 1.00 0.00 H ATOM 516 HB VAL A 33 12.163 16.489 -8.943 1.00 0.00 H ATOM 517 HG11 VAL A 33 11.943 18.635 -10.383 1.00 0.00 H ATOM 518 HG12 VAL A 33 10.298 18.733 -9.711 1.00 0.00 H ATOM 519 HG13 VAL A 33 11.707 18.760 -8.623 1.00 0.00 H ATOM 520 HG21 VAL A 33 9.196 16.216 -9.258 1.00 0.00 H ATOM 521 HG22 VAL A 33 10.303 15.429 -8.107 1.00 0.00 H ATOM 522 HG23 VAL A 33 9.826 17.127 -7.864 1.00 0.00 H ATOM 523 N THR A 34 13.592 15.808 -11.123 1.00 0.00 N ATOM 524 CA THR A 34 14.888 15.933 -11.768 1.00 0.00 C ATOM 525 C THR A 34 14.784 15.563 -13.249 1.00 0.00 C ATOM 526 O THR A 34 15.355 16.240 -14.102 1.00 0.00 O ATOM 527 CB THR A 34 15.886 15.069 -10.994 1.00 0.00 C ATOM 528 OG1 THR A 34 16.924 14.810 -11.936 1.00 0.00 O ATOM 529 CG2 THR A 34 15.328 13.683 -10.663 1.00 0.00 C ATOM 530 H THR A 34 13.584 15.249 -10.294 1.00 0.00 H ATOM 531 HA THR A 34 15.196 16.977 -11.720 1.00 0.00 H ATOM 532 HB THR A 34 16.224 15.579 -10.092 1.00 0.00 H ATOM 533 HG1 THR A 34 17.813 15.023 -11.532 1.00 0.00 H ATOM 534 HG21 THR A 34 14.368 13.549 -11.162 1.00 0.00 H ATOM 535 HG22 THR A 34 16.026 12.920 -11.007 1.00 0.00 H ATOM 536 HG23 THR A 34 15.194 13.594 -9.585 1.00 0.00 H ATOM 537 N GLN A 35 14.051 14.490 -13.508 1.00 0.00 N ATOM 538 CA GLN A 35 13.866 14.022 -14.871 1.00 0.00 C ATOM 539 C GLN A 35 13.104 15.065 -15.691 1.00 0.00 C ATOM 540 O GLN A 35 13.451 15.330 -16.841 1.00 0.00 O ATOM 541 CB GLN A 35 13.145 12.673 -14.894 1.00 0.00 C ATOM 542 CG GLN A 35 13.766 11.702 -13.887 1.00 0.00 C ATOM 543 CD GLN A 35 12.891 10.459 -13.713 1.00 0.00 C ATOM 544 OE1 GLN A 35 12.794 9.609 -14.582 1.00 0.00 O ATOM 545 NE2 GLN A 35 12.260 10.401 -12.543 1.00 0.00 N ATOM 546 H GLN A 35 13.590 13.945 -12.808 1.00 0.00 H ATOM 547 HA GLN A 35 14.871 13.897 -15.274 1.00 0.00 H ATOM 548 HB2 GLN A 35 12.090 12.816 -14.663 1.00 0.00 H ATOM 549 HB3 GLN A 35 13.197 12.246 -15.896 1.00 0.00 H ATOM 550 HG2 GLN A 35 14.759 11.407 -14.226 1.00 0.00 H ATOM 551 HG3 GLN A 35 13.891 12.201 -12.926 1.00 0.00 H ATOM 552 HE21 GLN A 35 12.382 11.133 -11.873 1.00 0.00 H ATOM 553 HE22 GLN A 35 11.663 9.626 -12.335 1.00 0.00 H ATOM 554 N SER A 36 12.079 15.628 -15.068 1.00 0.00 N ATOM 555 CA SER A 36 11.265 16.635 -15.726 1.00 0.00 C ATOM 556 C SER A 36 12.006 17.974 -15.748 1.00 0.00 C ATOM 557 O SER A 36 11.722 18.831 -16.583 1.00 0.00 O ATOM 558 CB SER A 36 9.911 16.790 -15.030 1.00 0.00 C ATOM 559 OG SER A 36 8.848 16.963 -15.963 1.00 0.00 O ATOM 560 H SER A 36 11.803 15.406 -14.133 1.00 0.00 H ATOM 561 HA SER A 36 11.112 16.266 -16.740 1.00 0.00 H ATOM 562 HB2 SER A 36 9.716 15.910 -14.417 1.00 0.00 H ATOM 563 HB3 SER A 36 9.945 17.646 -14.356 1.00 0.00 H ATOM 564 HG SER A 36 9.213 17.252 -16.848 1.00 0.00 H ATOM 565 N LEU A 37 12.942 18.111 -14.820 1.00 0.00 N ATOM 566 CA LEU A 37 13.726 19.331 -14.723 1.00 0.00 C ATOM 567 C LEU A 37 14.259 19.701 -16.108 1.00 0.00 C ATOM 568 O LEU A 37 14.366 20.880 -16.442 1.00 0.00 O ATOM 569 CB LEU A 37 14.819 19.182 -13.663 1.00 0.00 C ATOM 570 CG LEU A 37 14.737 20.144 -12.476 1.00 0.00 C ATOM 571 CD1 LEU A 37 15.062 21.576 -12.907 1.00 0.00 C ATOM 572 CD2 LEU A 37 13.375 20.049 -11.785 1.00 0.00 C ATOM 573 H LEU A 37 13.167 17.409 -14.145 1.00 0.00 H ATOM 574 HA LEU A 37 13.057 20.123 -14.387 1.00 0.00 H ATOM 575 HB2 LEU A 37 14.790 18.162 -13.280 1.00 0.00 H ATOM 576 HB3 LEU A 37 15.787 19.314 -14.146 1.00 0.00 H ATOM 577 HG LEU A 37 15.490 19.849 -11.745 1.00 0.00 H ATOM 578 HD11 LEU A 37 14.466 21.836 -13.782 1.00 0.00 H ATOM 579 HD12 LEU A 37 14.831 22.262 -12.092 1.00 0.00 H ATOM 580 HD13 LEU A 37 16.121 21.649 -13.154 1.00 0.00 H ATOM 581 HD21 LEU A 37 12.789 19.254 -12.246 1.00 0.00 H ATOM 582 HD22 LEU A 37 13.519 19.828 -10.728 1.00 0.00 H ATOM 583 HD23 LEU A 37 12.847 20.997 -11.890 1.00 0.00 H ATOM 584 N GLU A 38 14.581 18.671 -16.878 1.00 0.00 N ATOM 585 CA GLU A 38 15.100 18.873 -18.220 1.00 0.00 C ATOM 586 C GLU A 38 14.962 17.590 -19.041 1.00 0.00 C ATOM 587 O GLU A 38 15.948 16.896 -19.285 1.00 0.00 O ATOM 588 CB GLU A 38 16.555 19.345 -18.180 1.00 0.00 C ATOM 589 CG GLU A 38 16.637 20.842 -17.874 1.00 0.00 C ATOM 590 CD GLU A 38 18.016 21.400 -18.233 1.00 0.00 C ATOM 591 OE1 GLU A 38 19.005 20.651 -18.240 1.00 0.00 O ATOM 592 OE2 GLU A 38 18.039 22.659 -18.511 1.00 0.00 O ATOM 593 H GLU A 38 14.492 17.715 -16.599 1.00 0.00 H ATOM 594 HA GLU A 38 14.481 19.659 -18.655 1.00 0.00 H ATOM 595 HB2 GLU A 38 17.102 18.785 -17.422 1.00 0.00 H ATOM 596 HB3 GLU A 38 17.034 19.139 -19.137 1.00 0.00 H ATOM 597 HG2 GLU A 38 15.869 21.375 -18.435 1.00 0.00 H ATOM 598 HG3 GLU A 38 16.436 21.013 -16.817 1.00 0.00 H ATOM 599 HE2 GLU A 38 17.639 23.183 -17.760 1.00 0.00 H ATOM 600 N LYS A 39 13.731 17.313 -19.445 1.00 0.00 N ATOM 601 CA LYS A 39 13.452 16.125 -20.234 1.00 0.00 C ATOM 602 C LYS A 39 14.043 16.297 -21.635 1.00 0.00 C ATOM 603 O LYS A 39 14.710 15.399 -22.146 1.00 0.00 O ATOM 604 CB LYS A 39 11.953 15.821 -20.233 1.00 0.00 C ATOM 605 CG LYS A 39 11.646 14.570 -21.059 1.00 0.00 C ATOM 606 CD LYS A 39 10.903 13.528 -20.221 1.00 0.00 C ATOM 607 CE LYS A 39 11.351 12.111 -20.585 1.00 0.00 C ATOM 608 NZ LYS A 39 10.387 11.114 -20.070 1.00 0.00 N ATOM 609 H LYS A 39 12.935 17.883 -19.243 1.00 0.00 H ATOM 610 HA LYS A 39 13.951 15.286 -19.749 1.00 0.00 H ATOM 611 HB2 LYS A 39 11.607 15.678 -19.209 1.00 0.00 H ATOM 612 HB3 LYS A 39 11.405 16.672 -20.637 1.00 0.00 H ATOM 613 HG2 LYS A 39 11.043 14.842 -21.926 1.00 0.00 H ATOM 614 HG3 LYS A 39 12.574 14.144 -21.438 1.00 0.00 H ATOM 615 HD2 LYS A 39 11.086 13.710 -19.162 1.00 0.00 H ATOM 616 HD3 LYS A 39 9.829 13.626 -20.381 1.00 0.00 H ATOM 617 HE2 LYS A 39 11.437 12.017 -21.668 1.00 0.00 H ATOM 618 HE3 LYS A 39 12.340 11.918 -20.170 1.00 0.00 H ATOM 619 HZ1 LYS A 39 10.269 10.334 -20.708 1.00 0.00 H ATOM 620 HZ2 LYS A 39 10.681 10.724 -19.181 1.00 0.00 H ATOM 621 N ASP A 40 13.777 17.458 -22.216 1.00 0.00 N ATOM 622 CA ASP A 40 14.274 17.760 -23.547 1.00 0.00 C ATOM 623 C ASP A 40 13.565 19.006 -24.082 1.00 0.00 C ATOM 624 O ASP A 40 14.021 20.126 -23.862 1.00 0.00 O ATOM 625 CB ASP A 40 13.996 16.606 -24.513 1.00 0.00 C ATOM 626 CG ASP A 40 15.127 15.585 -24.644 1.00 0.00 C ATOM 627 OD1 ASP A 40 16.179 15.710 -23.999 1.00 0.00 O ATOM 628 OD2 ASP A 40 14.894 14.614 -25.461 1.00 0.00 O ATOM 629 H ASP A 40 13.234 18.184 -21.793 1.00 0.00 H ATOM 630 HA ASP A 40 15.347 17.910 -23.426 1.00 0.00 H ATOM 631 HB2 ASP A 40 13.094 16.088 -24.186 1.00 0.00 H ATOM 632 HB3 ASP A 40 13.785 17.021 -25.499 1.00 0.00 H ATOM 633 HD2 ASP A 40 14.218 14.896 -26.143 1.00 0.00 H ATOM 634 N ASP A 41 12.460 18.768 -24.773 1.00 0.00 N ATOM 635 CA ASP A 41 11.683 19.857 -25.341 1.00 0.00 C ATOM 636 C ASP A 41 10.817 20.485 -24.248 1.00 0.00 C ATOM 637 O ASP A 41 11.330 20.912 -23.214 1.00 0.00 O ATOM 638 CB ASP A 41 10.755 19.352 -26.448 1.00 0.00 C ATOM 639 CG ASP A 41 10.089 20.448 -27.283 1.00 0.00 C ATOM 640 OD1 ASP A 41 10.260 21.647 -27.016 1.00 0.00 O ATOM 641 OD2 ASP A 41 9.359 20.023 -28.257 1.00 0.00 O ATOM 642 H ASP A 41 12.095 17.853 -24.946 1.00 0.00 H ATOM 643 HA ASP A 41 12.419 20.554 -25.743 1.00 0.00 H ATOM 644 HB2 ASP A 41 11.326 18.705 -27.114 1.00 0.00 H ATOM 645 HB3 ASP A 41 9.977 18.737 -25.997 1.00 0.00 H ATOM 646 HD2 ASP A 41 8.416 19.897 -27.948 1.00 0.00 H ATOM 647 N ILE A 42 9.520 20.521 -24.513 1.00 0.00 N ATOM 648 CA ILE A 42 8.578 21.090 -23.564 1.00 0.00 C ATOM 649 C ILE A 42 7.311 20.231 -23.532 1.00 0.00 C ATOM 650 O ILE A 42 6.362 20.491 -24.270 1.00 0.00 O ATOM 651 CB ILE A 42 8.315 22.562 -23.887 1.00 0.00 C ATOM 652 CG1 ILE A 42 9.350 23.464 -23.212 1.00 0.00 C ATOM 653 CG2 ILE A 42 6.883 22.957 -23.519 1.00 0.00 C ATOM 654 CD1 ILE A 42 9.558 23.064 -21.750 1.00 0.00 C ATOM 655 H ILE A 42 9.111 20.171 -25.356 1.00 0.00 H ATOM 656 HA ILE A 42 9.044 21.054 -22.579 1.00 0.00 H ATOM 657 HB ILE A 42 8.420 22.699 -24.963 1.00 0.00 H ATOM 658 HG12 ILE A 42 10.297 23.401 -23.748 1.00 0.00 H ATOM 659 HG13 ILE A 42 9.022 24.503 -23.266 1.00 0.00 H ATOM 660 HG21 ILE A 42 6.198 22.166 -23.825 1.00 0.00 H ATOM 661 HG22 ILE A 42 6.812 23.102 -22.441 1.00 0.00 H ATOM 662 HG23 ILE A 42 6.620 23.884 -24.028 1.00 0.00 H ATOM 663 HD11 ILE A 42 8.590 22.987 -21.254 1.00 0.00 H ATOM 664 HD12 ILE A 42 10.065 22.100 -21.706 1.00 0.00 H ATOM 665 HD13 ILE A 42 10.165 23.818 -21.250 1.00 0.00 H ATOM 666 N ARG A 43 7.338 19.226 -22.669 1.00 0.00 N ATOM 667 CA ARG A 43 6.203 18.329 -22.530 1.00 0.00 C ATOM 668 C ARG A 43 5.147 18.948 -21.611 1.00 0.00 C ATOM 669 O ARG A 43 5.226 20.129 -21.276 1.00 0.00 O ATOM 670 CB ARG A 43 6.636 16.977 -21.961 1.00 0.00 C ATOM 671 CG ARG A 43 6.923 15.976 -23.082 1.00 0.00 C ATOM 672 CD ARG A 43 7.300 16.698 -24.377 1.00 0.00 C ATOM 673 NE ARG A 43 8.448 16.019 -25.019 1.00 0.00 N ATOM 674 CZ ARG A 43 8.649 15.969 -26.353 1.00 0.00 C ATOM 675 NH1 ARG A 43 7.778 16.558 -27.199 1.00 0.00 N ATOM 676 NH2 ARG A 43 9.709 15.335 -26.817 1.00 0.00 N ATOM 677 H ARG A 43 8.114 19.021 -22.073 1.00 0.00 H ATOM 678 HA ARG A 43 5.818 18.207 -23.543 1.00 0.00 H ATOM 679 HB2 ARG A 43 7.527 17.106 -21.346 1.00 0.00 H ATOM 680 HB3 ARG A 43 5.854 16.585 -21.310 1.00 0.00 H ATOM 681 HG2 ARG A 43 7.733 15.312 -22.782 1.00 0.00 H ATOM 682 HG3 ARG A 43 6.045 15.353 -23.251 1.00 0.00 H ATOM 683 HD2 ARG A 43 6.448 16.710 -25.057 1.00 0.00 H ATOM 684 HD3 ARG A 43 7.553 17.736 -24.164 1.00 0.00 H ATOM 685 HE ARG A 43 9.117 15.570 -24.427 1.00 0.00 H ATOM 686 HH11 ARG A 43 6.977 17.036 -26.839 1.00 0.00 H ATOM 687 HH12 ARG A 43 7.933 16.516 -28.186 1.00 0.00 H ATOM 688 HH21 ARG A 43 9.930 15.252 -27.789 1.00 0.00 H ATOM 689 N HIS A 44 4.184 18.122 -21.230 1.00 0.00 N ATOM 690 CA HIS A 44 3.114 18.573 -20.357 1.00 0.00 C ATOM 691 C HIS A 44 2.896 17.549 -19.241 1.00 0.00 C ATOM 692 O HIS A 44 3.273 16.386 -19.378 1.00 0.00 O ATOM 693 CB HIS A 44 1.842 18.856 -21.158 1.00 0.00 C ATOM 694 CG HIS A 44 1.964 20.019 -22.113 1.00 0.00 C ATOM 695 ND1 HIS A 44 2.554 21.220 -21.761 1.00 0.00 N ATOM 696 CD2 HIS A 44 1.566 20.151 -23.411 1.00 0.00 C ATOM 697 CE1 HIS A 44 2.507 22.032 -22.807 1.00 0.00 C ATOM 698 NE2 HIS A 44 1.895 21.367 -23.829 1.00 0.00 N ATOM 699 H HIS A 44 4.127 17.163 -21.507 1.00 0.00 H ATOM 700 HA HIS A 44 3.445 19.513 -19.916 1.00 0.00 H ATOM 701 HB2 HIS A 44 1.573 17.962 -21.721 1.00 0.00 H ATOM 702 HB3 HIS A 44 1.024 19.053 -20.464 1.00 0.00 H ATOM 703 HD1 HIS A 44 2.948 21.438 -20.868 1.00 0.00 H ATOM 704 HD2 HIS A 44 1.064 19.387 -24.005 1.00 0.00 H ATOM 705 HE1 HIS A 44 2.892 23.051 -22.845 1.00 0.00 H ATOM 706 N ILE A 45 2.289 18.018 -18.161 1.00 0.00 N ATOM 707 CA ILE A 45 2.018 17.158 -17.022 1.00 0.00 C ATOM 708 C ILE A 45 0.540 16.759 -17.030 1.00 0.00 C ATOM 709 O ILE A 45 -0.290 17.451 -17.616 1.00 0.00 O ATOM 710 CB ILE A 45 2.465 17.831 -15.723 1.00 0.00 C ATOM 711 CG1 ILE A 45 1.558 19.014 -15.377 1.00 0.00 C ATOM 712 CG2 ILE A 45 3.938 18.241 -15.797 1.00 0.00 C ATOM 713 CD1 ILE A 45 0.512 19.240 -16.470 1.00 0.00 C ATOM 714 H ILE A 45 1.985 18.965 -18.057 1.00 0.00 H ATOM 715 HA ILE A 45 2.619 16.257 -17.142 1.00 0.00 H ATOM 716 HB ILE A 45 2.373 17.107 -14.913 1.00 0.00 H ATOM 717 HG12 ILE A 45 1.061 18.829 -14.425 1.00 0.00 H ATOM 718 HG13 ILE A 45 2.160 19.914 -15.253 1.00 0.00 H ATOM 719 HG21 ILE A 45 4.509 17.457 -16.294 1.00 0.00 H ATOM 720 HG22 ILE A 45 4.028 19.169 -16.361 1.00 0.00 H ATOM 721 HG23 ILE A 45 4.325 18.389 -14.789 1.00 0.00 H ATOM 722 HD11 ILE A 45 -0.032 18.312 -16.650 1.00 0.00 H ATOM 723 HD12 ILE A 45 -0.186 20.014 -16.151 1.00 0.00 H ATOM 724 HD13 ILE A 45 1.008 19.554 -17.389 1.00 0.00 H ATOM 725 N VAL A 46 0.258 15.644 -16.372 1.00 0.00 N ATOM 726 CA VAL A 46 -1.104 15.145 -16.295 1.00 0.00 C ATOM 727 C VAL A 46 -1.203 14.115 -15.169 1.00 0.00 C ATOM 728 O VAL A 46 -1.131 12.912 -15.415 1.00 0.00 O ATOM 729 CB VAL A 46 -1.535 14.588 -17.654 1.00 0.00 C ATOM 730 CG1 VAL A 46 -2.350 13.304 -17.487 1.00 0.00 C ATOM 731 CG2 VAL A 46 -2.317 15.634 -18.452 1.00 0.00 C ATOM 732 H VAL A 46 0.940 15.086 -15.899 1.00 0.00 H ATOM 733 HA VAL A 46 -1.751 15.989 -16.056 1.00 0.00 H ATOM 734 HB VAL A 46 -0.635 14.343 -18.216 1.00 0.00 H ATOM 735 HG11 VAL A 46 -2.928 13.358 -16.564 1.00 0.00 H ATOM 736 HG12 VAL A 46 -3.027 13.191 -18.334 1.00 0.00 H ATOM 737 HG13 VAL A 46 -1.676 12.449 -17.444 1.00 0.00 H ATOM 738 HG21 VAL A 46 -3.138 16.015 -17.845 1.00 0.00 H ATOM 739 HG22 VAL A 46 -1.653 16.455 -18.722 1.00 0.00 H ATOM 740 HG23 VAL A 46 -2.716 15.176 -19.357 1.00 0.00 H ATOM 741 N LEU A 47 -1.366 14.624 -13.957 1.00 0.00 N ATOM 742 CA LEU A 47 -1.475 13.763 -12.791 1.00 0.00 C ATOM 743 C LEU A 47 -2.920 13.279 -12.654 1.00 0.00 C ATOM 744 O LEU A 47 -3.846 13.932 -13.133 1.00 0.00 O ATOM 745 CB LEU A 47 -0.945 14.477 -11.546 1.00 0.00 C ATOM 746 CG LEU A 47 0.566 14.712 -11.500 1.00 0.00 C ATOM 747 CD1 LEU A 47 1.327 13.491 -12.022 1.00 0.00 C ATOM 748 CD2 LEU A 47 0.946 15.989 -12.252 1.00 0.00 C ATOM 749 H LEU A 47 -1.424 15.604 -13.765 1.00 0.00 H ATOM 750 HA LEU A 47 -0.835 12.898 -12.964 1.00 0.00 H ATOM 751 HB2 LEU A 47 -1.445 15.442 -11.464 1.00 0.00 H ATOM 752 HB3 LEU A 47 -1.230 13.895 -10.669 1.00 0.00 H ATOM 753 HG LEU A 47 0.858 14.852 -10.459 1.00 0.00 H ATOM 754 HD11 LEU A 47 0.775 13.046 -12.850 1.00 0.00 H ATOM 755 HD12 LEU A 47 2.314 13.798 -12.366 1.00 0.00 H ATOM 756 HD13 LEU A 47 1.433 12.759 -11.221 1.00 0.00 H ATOM 757 HD21 LEU A 47 0.389 16.038 -13.188 1.00 0.00 H ATOM 758 HD22 LEU A 47 0.705 16.857 -11.639 1.00 0.00 H ATOM 759 HD23 LEU A 47 2.015 15.980 -12.466 1.00 0.00 H ATOM 760 N ASN A 48 -3.068 12.137 -11.998 1.00 0.00 N ATOM 761 CA ASN A 48 -4.384 11.558 -11.792 1.00 0.00 C ATOM 762 C ASN A 48 -4.253 10.295 -10.937 1.00 0.00 C ATOM 763 O ASN A 48 -3.835 9.249 -11.429 1.00 0.00 O ATOM 764 CB ASN A 48 -5.027 11.162 -13.123 1.00 0.00 C ATOM 765 CG ASN A 48 -4.314 9.956 -13.739 1.00 0.00 C ATOM 766 OD1 ASN A 48 -3.697 9.153 -13.059 1.00 0.00 O ATOM 767 ND2 ASN A 48 -4.434 9.875 -15.061 1.00 0.00 N ATOM 768 H ASN A 48 -2.310 11.612 -11.612 1.00 0.00 H ATOM 769 HA ASN A 48 -4.966 12.336 -11.299 1.00 0.00 H ATOM 770 HB2 ASN A 48 -6.079 10.926 -12.967 1.00 0.00 H ATOM 771 HB3 ASN A 48 -4.988 12.004 -13.814 1.00 0.00 H ATOM 772 HD21 ASN A 48 -4.955 10.567 -15.559 1.00 0.00 H ATOM 773 HD22 ASN A 48 -4.003 9.120 -15.556 1.00 0.00 H ATOM 774 N LEU A 49 -4.618 10.436 -9.671 1.00 0.00 N ATOM 775 CA LEU A 49 -4.546 9.320 -8.743 1.00 0.00 C ATOM 776 C LEU A 49 -5.954 8.770 -8.504 1.00 0.00 C ATOM 777 O LEU A 49 -6.848 9.504 -8.087 1.00 0.00 O ATOM 778 CB LEU A 49 -3.823 9.735 -7.460 1.00 0.00 C ATOM 779 CG LEU A 49 -3.551 8.617 -6.452 1.00 0.00 C ATOM 780 CD1 LEU A 49 -2.186 8.801 -5.785 1.00 0.00 C ATOM 781 CD2 LEU A 49 -4.682 8.518 -5.426 1.00 0.00 C ATOM 782 H LEU A 49 -4.957 11.291 -9.278 1.00 0.00 H ATOM 783 HA LEU A 49 -3.946 8.542 -9.214 1.00 0.00 H ATOM 784 HB2 LEU A 49 -2.871 10.190 -7.735 1.00 0.00 H ATOM 785 HB3 LEU A 49 -4.414 10.507 -6.967 1.00 0.00 H ATOM 786 HG LEU A 49 -3.521 7.671 -6.991 1.00 0.00 H ATOM 787 HD11 LEU A 49 -1.673 9.651 -6.234 1.00 0.00 H ATOM 788 HD12 LEU A 49 -2.324 8.982 -4.719 1.00 0.00 H ATOM 789 HD13 LEU A 49 -1.589 7.900 -5.926 1.00 0.00 H ATOM 790 HD21 LEU A 49 -5.387 9.334 -5.582 1.00 0.00 H ATOM 791 HD22 LEU A 49 -5.198 7.565 -5.545 1.00 0.00 H ATOM 792 HD23 LEU A 49 -4.267 8.583 -4.420 1.00 0.00 H ATOM 793 N GLU A 50 -6.106 7.483 -8.780 1.00 0.00 N ATOM 794 CA GLU A 50 -7.390 6.826 -8.601 1.00 0.00 C ATOM 795 C GLU A 50 -7.426 6.089 -7.260 1.00 0.00 C ATOM 796 O GLU A 50 -8.499 5.761 -6.757 1.00 0.00 O ATOM 797 CB GLU A 50 -7.684 5.871 -9.760 1.00 0.00 C ATOM 798 CG GLU A 50 -9.009 6.224 -10.437 1.00 0.00 C ATOM 799 CD GLU A 50 -10.073 5.164 -10.145 1.00 0.00 C ATOM 800 OE1 GLU A 50 -9.951 4.417 -9.163 1.00 0.00 O ATOM 801 OE2 GLU A 50 -11.056 5.132 -10.981 1.00 0.00 O ATOM 802 H GLU A 50 -5.373 6.893 -9.120 1.00 0.00 H ATOM 803 HA GLU A 50 -8.128 7.628 -8.602 1.00 0.00 H ATOM 804 HB2 GLU A 50 -6.875 5.918 -10.489 1.00 0.00 H ATOM 805 HB3 GLU A 50 -7.721 4.846 -9.391 1.00 0.00 H ATOM 806 HG2 GLU A 50 -9.354 7.196 -10.086 1.00 0.00 H ATOM 807 HG3 GLU A 50 -8.860 6.308 -11.514 1.00 0.00 H ATOM 808 HE2 GLU A 50 -11.467 4.221 -10.991 1.00 0.00 H ATOM 809 N ASP A 51 -6.240 5.850 -6.720 1.00 0.00 N ATOM 810 CA ASP A 51 -6.122 5.157 -5.449 1.00 0.00 C ATOM 811 C ASP A 51 -5.709 6.155 -4.365 1.00 0.00 C ATOM 812 O ASP A 51 -4.599 6.083 -3.839 1.00 0.00 O ATOM 813 CB ASP A 51 -5.055 4.063 -5.514 1.00 0.00 C ATOM 814 CG ASP A 51 -4.792 3.337 -4.194 1.00 0.00 C ATOM 815 OD1 ASP A 51 -4.063 3.837 -3.324 1.00 0.00 O ATOM 816 OD2 ASP A 51 -5.378 2.194 -4.073 1.00 0.00 O ATOM 817 H ASP A 51 -5.371 6.121 -7.136 1.00 0.00 H ATOM 818 HA ASP A 51 -7.106 4.726 -5.265 1.00 0.00 H ATOM 819 HB2 ASP A 51 -5.356 3.328 -6.262 1.00 0.00 H ATOM 820 HB3 ASP A 51 -4.122 4.506 -5.861 1.00 0.00 H ATOM 821 HD2 ASP A 51 -6.323 2.324 -3.774 1.00 0.00 H ATOM 822 N LEU A 52 -6.624 7.065 -4.064 1.00 0.00 N ATOM 823 CA LEU A 52 -6.369 8.077 -3.052 1.00 0.00 C ATOM 824 C LEU A 52 -6.852 7.566 -1.693 1.00 0.00 C ATOM 825 O LEU A 52 -8.043 7.322 -1.506 1.00 0.00 O ATOM 826 CB LEU A 52 -6.989 9.413 -3.463 1.00 0.00 C ATOM 827 CG LEU A 52 -6.625 10.618 -2.592 1.00 0.00 C ATOM 828 CD1 LEU A 52 -6.767 10.282 -1.106 1.00 0.00 C ATOM 829 CD2 LEU A 52 -5.227 11.138 -2.931 1.00 0.00 C ATOM 830 H LEU A 52 -7.524 7.117 -4.496 1.00 0.00 H ATOM 831 HA LEU A 52 -5.290 8.224 -3.002 1.00 0.00 H ATOM 832 HB2 LEU A 52 -6.691 9.629 -4.489 1.00 0.00 H ATOM 833 HB3 LEU A 52 -8.074 9.304 -3.462 1.00 0.00 H ATOM 834 HG LEU A 52 -7.329 11.421 -2.809 1.00 0.00 H ATOM 835 HD11 LEU A 52 -7.608 9.603 -0.965 1.00 0.00 H ATOM 836 HD12 LEU A 52 -5.853 9.805 -0.752 1.00 0.00 H ATOM 837 HD13 LEU A 52 -6.941 11.198 -0.541 1.00 0.00 H ATOM 838 HD21 LEU A 52 -4.524 10.305 -2.946 1.00 0.00 H ATOM 839 HD22 LEU A 52 -5.245 11.616 -3.911 1.00 0.00 H ATOM 840 HD23 LEU A 52 -4.917 11.862 -2.179 1.00 0.00 H ATOM 841 N SER A 53 -5.903 7.421 -0.780 1.00 0.00 N ATOM 842 CA SER A 53 -6.217 6.943 0.556 1.00 0.00 C ATOM 843 C SER A 53 -5.718 7.944 1.600 1.00 0.00 C ATOM 844 O SER A 53 -6.444 8.859 1.985 1.00 0.00 O ATOM 845 CB SER A 53 -5.603 5.564 0.806 1.00 0.00 C ATOM 846 OG SER A 53 -5.564 5.241 2.194 1.00 0.00 O ATOM 847 H SER A 53 -4.937 7.622 -0.941 1.00 0.00 H ATOM 848 HA SER A 53 -7.304 6.868 0.587 1.00 0.00 H ATOM 849 HB2 SER A 53 -6.181 4.808 0.274 1.00 0.00 H ATOM 850 HB3 SER A 53 -4.593 5.538 0.399 1.00 0.00 H ATOM 851 HG SER A 53 -5.421 4.259 2.312 1.00 0.00 H ATOM 852 N PHE A 54 -4.481 7.736 2.029 1.00 0.00 N ATOM 853 CA PHE A 54 -3.876 8.608 3.020 1.00 0.00 C ATOM 854 C PHE A 54 -3.769 10.042 2.497 1.00 0.00 C ATOM 855 O PHE A 54 -4.485 10.930 2.957 1.00 0.00 O ATOM 856 CB PHE A 54 -2.470 8.070 3.291 1.00 0.00 C ATOM 857 CG PHE A 54 -1.649 8.932 4.253 1.00 0.00 C ATOM 858 CD1 PHE A 54 -2.090 9.143 5.522 1.00 0.00 C ATOM 859 CD2 PHE A 54 -0.478 9.486 3.838 1.00 0.00 C ATOM 860 CE1 PHE A 54 -1.327 9.943 6.414 1.00 0.00 C ATOM 861 CE2 PHE A 54 0.284 10.285 4.731 1.00 0.00 C ATOM 862 CZ PHE A 54 -0.157 10.497 6.000 1.00 0.00 C ATOM 863 H PHE A 54 -3.898 6.989 1.711 1.00 0.00 H ATOM 864 HA PHE A 54 -4.519 8.592 3.901 1.00 0.00 H ATOM 865 HB2 PHE A 54 -2.550 7.063 3.700 1.00 0.00 H ATOM 866 HB3 PHE A 54 -1.935 7.989 2.345 1.00 0.00 H ATOM 867 HD1 PHE A 54 -3.028 8.699 5.854 1.00 0.00 H ATOM 868 HD2 PHE A 54 -0.125 9.316 2.821 1.00 0.00 H ATOM 869 HE1 PHE A 54 -1.681 10.112 7.431 1.00 0.00 H ATOM 870 HE2 PHE A 54 1.223 10.729 4.398 1.00 0.00 H ATOM 871 HZ PHE A 54 0.428 11.111 6.685 1.00 0.00 H ATOM 872 N MET A 55 -2.869 10.223 1.542 1.00 0.00 N ATOM 873 CA MET A 55 -2.657 11.534 0.952 1.00 0.00 C ATOM 874 C MET A 55 -2.672 12.626 2.023 1.00 0.00 C ATOM 875 O MET A 55 -3.726 13.177 2.338 1.00 0.00 O ATOM 876 CB MET A 55 -3.754 11.813 -0.078 1.00 0.00 C ATOM 877 CG MET A 55 -3.997 13.317 -0.226 1.00 0.00 C ATOM 878 SD MET A 55 -5.544 13.764 0.544 1.00 0.00 S ATOM 879 CE MET A 55 -5.854 12.287 1.497 1.00 0.00 C ATOM 880 H MET A 55 -2.291 9.495 1.173 1.00 0.00 H ATOM 881 HA MET A 55 -1.674 11.489 0.482 1.00 0.00 H ATOM 882 HB2 MET A 55 -3.469 11.391 -1.042 1.00 0.00 H ATOM 883 HB3 MET A 55 -4.677 11.320 0.226 1.00 0.00 H ATOM 884 HG2 MET A 55 -3.179 13.872 0.232 1.00 0.00 H ATOM 885 HG3 MET A 55 -4.015 13.588 -1.282 1.00 0.00 H ATOM 886 HE1 MET A 55 -5.657 11.409 0.882 1.00 0.00 H ATOM 887 HE2 MET A 55 -5.200 12.274 2.369 1.00 0.00 H ATOM 888 HE3 MET A 55 -6.894 12.276 1.823 1.00 0.00 H ATOM 889 N ASP A 56 -1.491 12.907 2.552 1.00 0.00 N ATOM 890 CA ASP A 56 -1.355 13.924 3.581 1.00 0.00 C ATOM 891 C ASP A 56 -0.637 15.142 2.997 1.00 0.00 C ATOM 892 O ASP A 56 -0.646 15.350 1.785 1.00 0.00 O ATOM 893 CB ASP A 56 -0.527 13.408 4.760 1.00 0.00 C ATOM 894 CG ASP A 56 -0.828 14.076 6.103 1.00 0.00 C ATOM 895 OD1 ASP A 56 -1.353 15.198 6.155 1.00 0.00 O ATOM 896 OD2 ASP A 56 -0.496 13.386 7.142 1.00 0.00 O ATOM 897 H ASP A 56 -0.639 12.455 2.290 1.00 0.00 H ATOM 898 HA ASP A 56 -2.373 14.152 3.896 1.00 0.00 H ATOM 899 HB2 ASP A 56 -0.694 12.335 4.859 1.00 0.00 H ATOM 900 HB3 ASP A 56 0.529 13.547 4.531 1.00 0.00 H ATOM 901 HD2 ASP A 56 -0.656 12.413 6.972 1.00 0.00 H ATOM 902 N SER A 57 -0.032 15.916 3.887 1.00 0.00 N ATOM 903 CA SER A 57 0.689 17.108 3.474 1.00 0.00 C ATOM 904 C SER A 57 2.165 16.775 3.247 1.00 0.00 C ATOM 905 O SER A 57 3.011 17.668 3.231 1.00 0.00 O ATOM 906 CB SER A 57 0.550 18.223 4.513 1.00 0.00 C ATOM 907 OG SER A 57 1.579 18.166 5.498 1.00 0.00 O ATOM 908 H SER A 57 -0.029 15.739 4.871 1.00 0.00 H ATOM 909 HA SER A 57 0.220 17.421 2.542 1.00 0.00 H ATOM 910 HB2 SER A 57 0.580 19.191 4.013 1.00 0.00 H ATOM 911 HB3 SER A 57 -0.422 18.146 5.000 1.00 0.00 H ATOM 912 HG SER A 57 1.188 17.930 6.387 1.00 0.00 H ATOM 913 N SER A 58 2.429 15.488 3.078 1.00 0.00 N ATOM 914 CA SER A 58 3.788 15.026 2.853 1.00 0.00 C ATOM 915 C SER A 58 4.208 15.318 1.411 1.00 0.00 C ATOM 916 O SER A 58 5.295 15.841 1.171 1.00 0.00 O ATOM 917 CB SER A 58 3.918 13.530 3.150 1.00 0.00 C ATOM 918 OG SER A 58 2.923 13.080 4.066 1.00 0.00 O ATOM 919 H SER A 58 1.735 14.768 3.094 1.00 0.00 H ATOM 920 HA SER A 58 4.404 15.590 3.553 1.00 0.00 H ATOM 921 HB2 SER A 58 3.837 12.967 2.221 1.00 0.00 H ATOM 922 HB3 SER A 58 4.907 13.327 3.561 1.00 0.00 H ATOM 923 HG SER A 58 3.351 12.804 4.927 1.00 0.00 H ATOM 924 N GLY A 59 3.324 14.968 0.488 1.00 0.00 N ATOM 925 CA GLY A 59 3.589 15.187 -0.923 1.00 0.00 C ATOM 926 C GLY A 59 2.971 16.503 -1.400 1.00 0.00 C ATOM 927 O GLY A 59 3.232 16.947 -2.516 1.00 0.00 O ATOM 928 H GLY A 59 2.442 14.543 0.692 1.00 0.00 H ATOM 929 HA2 GLY A 59 4.665 15.203 -1.097 1.00 0.00 H ATOM 930 HA3 GLY A 59 3.184 14.359 -1.506 1.00 0.00 H ATOM 931 N LEU A 60 2.163 17.090 -0.528 1.00 0.00 N ATOM 932 CA LEU A 60 1.506 18.346 -0.846 1.00 0.00 C ATOM 933 C LEU A 60 2.540 19.336 -1.386 1.00 0.00 C ATOM 934 O LEU A 60 2.300 20.004 -2.390 1.00 0.00 O ATOM 935 CB LEU A 60 0.731 18.867 0.367 1.00 0.00 C ATOM 936 CG LEU A 60 -0.666 19.421 0.082 1.00 0.00 C ATOM 937 CD1 LEU A 60 -0.607 20.914 -0.250 1.00 0.00 C ATOM 938 CD2 LEU A 60 -1.362 18.617 -1.018 1.00 0.00 C ATOM 939 H LEU A 60 1.956 16.722 0.378 1.00 0.00 H ATOM 940 HA LEU A 60 0.778 18.144 -1.631 1.00 0.00 H ATOM 941 HB2 LEU A 60 0.639 18.056 1.089 1.00 0.00 H ATOM 942 HB3 LEU A 60 1.322 19.651 0.841 1.00 0.00 H ATOM 943 HG LEU A 60 -1.266 19.316 0.986 1.00 0.00 H ATOM 944 HD11 LEU A 60 0.242 21.366 0.262 1.00 0.00 H ATOM 945 HD12 LEU A 60 -0.492 21.042 -1.326 1.00 0.00 H ATOM 946 HD13 LEU A 60 -1.528 21.395 0.077 1.00 0.00 H ATOM 947 HD21 LEU A 60 -0.824 17.682 -1.179 1.00 0.00 H ATOM 948 HD22 LEU A 60 -2.386 18.399 -0.716 1.00 0.00 H ATOM 949 HD23 LEU A 60 -1.370 19.195 -1.941 1.00 0.00 H ATOM 950 N GLY A 61 3.669 19.398 -0.695 1.00 0.00 N ATOM 951 CA GLY A 61 4.741 20.294 -1.094 1.00 0.00 C ATOM 952 C GLY A 61 5.499 19.740 -2.302 1.00 0.00 C ATOM 953 O GLY A 61 5.969 20.500 -3.147 1.00 0.00 O ATOM 954 H GLY A 61 3.857 18.852 0.121 1.00 0.00 H ATOM 955 HA2 GLY A 61 4.330 21.274 -1.337 1.00 0.00 H ATOM 956 HA3 GLY A 61 5.430 20.436 -0.261 1.00 0.00 H ATOM 957 N VAL A 62 5.595 18.419 -2.344 1.00 0.00 N ATOM 958 CA VAL A 62 6.287 17.753 -3.435 1.00 0.00 C ATOM 959 C VAL A 62 5.566 18.055 -4.750 1.00 0.00 C ATOM 960 O VAL A 62 6.168 17.992 -5.821 1.00 0.00 O ATOM 961 CB VAL A 62 6.402 16.255 -3.145 1.00 0.00 C ATOM 962 CG1 VAL A 62 5.490 15.447 -4.071 1.00 0.00 C ATOM 963 CG2 VAL A 62 7.853 15.784 -3.256 1.00 0.00 C ATOM 964 H VAL A 62 5.211 17.808 -1.652 1.00 0.00 H ATOM 965 HA VAL A 62 7.295 18.165 -3.485 1.00 0.00 H ATOM 966 HB VAL A 62 6.072 16.086 -2.120 1.00 0.00 H ATOM 967 HG11 VAL A 62 4.655 16.069 -4.392 1.00 0.00 H ATOM 968 HG12 VAL A 62 6.057 15.120 -4.943 1.00 0.00 H ATOM 969 HG13 VAL A 62 5.111 14.576 -3.537 1.00 0.00 H ATOM 970 HG21 VAL A 62 8.271 16.117 -4.207 1.00 0.00 H ATOM 971 HG22 VAL A 62 8.435 16.205 -2.437 1.00 0.00 H ATOM 972 HG23 VAL A 62 7.887 14.696 -3.205 1.00 0.00 H ATOM 973 N ILE A 63 4.287 18.376 -4.626 1.00 0.00 N ATOM 974 CA ILE A 63 3.477 18.685 -5.792 1.00 0.00 C ATOM 975 C ILE A 63 3.488 20.197 -6.028 1.00 0.00 C ATOM 976 O ILE A 63 3.513 20.650 -7.171 1.00 0.00 O ATOM 977 CB ILE A 63 2.073 18.097 -5.641 1.00 0.00 C ATOM 978 CG1 ILE A 63 2.044 16.629 -6.072 1.00 0.00 C ATOM 979 CG2 ILE A 63 1.041 18.937 -6.397 1.00 0.00 C ATOM 980 CD1 ILE A 63 1.577 15.730 -4.925 1.00 0.00 C ATOM 981 H ILE A 63 3.805 18.425 -3.751 1.00 0.00 H ATOM 982 HA ILE A 63 3.940 18.198 -6.650 1.00 0.00 H ATOM 983 HB ILE A 63 1.801 18.128 -4.585 1.00 0.00 H ATOM 984 HG12 ILE A 63 1.377 16.510 -6.926 1.00 0.00 H ATOM 985 HG13 ILE A 63 3.038 16.323 -6.398 1.00 0.00 H ATOM 986 HG21 ILE A 63 1.055 19.958 -6.017 1.00 0.00 H ATOM 987 HG22 ILE A 63 1.285 18.941 -7.459 1.00 0.00 H ATOM 988 HG23 ILE A 63 0.049 18.509 -6.254 1.00 0.00 H ATOM 989 HD11 ILE A 63 1.942 16.129 -3.979 1.00 0.00 H ATOM 990 HD12 ILE A 63 0.488 15.696 -4.910 1.00 0.00 H ATOM 991 HD13 ILE A 63 1.970 14.723 -5.070 1.00 0.00 H ATOM 992 N LEU A 64 3.468 20.936 -4.928 1.00 0.00 N ATOM 993 CA LEU A 64 3.476 22.387 -5.001 1.00 0.00 C ATOM 994 C LEU A 64 4.852 22.862 -5.473 1.00 0.00 C ATOM 995 O LEU A 64 4.950 23.780 -6.285 1.00 0.00 O ATOM 996 CB LEU A 64 3.040 22.993 -3.666 1.00 0.00 C ATOM 997 CG LEU A 64 2.169 24.248 -3.751 1.00 0.00 C ATOM 998 CD1 LEU A 64 0.688 23.881 -3.860 1.00 0.00 C ATOM 999 CD2 LEU A 64 2.442 25.186 -2.573 1.00 0.00 C ATOM 1000 H LEU A 64 3.447 20.559 -4.002 1.00 0.00 H ATOM 1001 HA LEU A 64 2.735 22.680 -5.745 1.00 0.00 H ATOM 1002 HB2 LEU A 64 2.495 22.233 -3.106 1.00 0.00 H ATOM 1003 HB3 LEU A 64 3.934 23.233 -3.090 1.00 0.00 H ATOM 1004 HG LEU A 64 2.435 24.787 -4.660 1.00 0.00 H ATOM 1005 HD11 LEU A 64 0.590 22.904 -4.333 1.00 0.00 H ATOM 1006 HD12 LEU A 64 0.248 23.848 -2.864 1.00 0.00 H ATOM 1007 HD13 LEU A 64 0.172 24.629 -4.461 1.00 0.00 H ATOM 1008 HD21 LEU A 64 3.198 24.743 -1.924 1.00 0.00 H ATOM 1009 HD22 LEU A 64 2.801 26.144 -2.948 1.00 0.00 H ATOM 1010 HD23 LEU A 64 1.522 25.337 -2.009 1.00 0.00 H ATOM 1011 N GLY A 65 5.879 22.215 -4.943 1.00 0.00 N ATOM 1012 CA GLY A 65 7.245 22.561 -5.298 1.00 0.00 C ATOM 1013 C GLY A 65 7.521 22.263 -6.773 1.00 0.00 C ATOM 1014 O GLY A 65 8.462 22.802 -7.354 1.00 0.00 O ATOM 1015 H GLY A 65 5.790 21.469 -4.283 1.00 0.00 H ATOM 1016 HA2 GLY A 65 7.420 23.619 -5.098 1.00 0.00 H ATOM 1017 HA3 GLY A 65 7.940 22.000 -4.673 1.00 0.00 H ATOM 1018 N ARG A 66 6.683 21.405 -7.336 1.00 0.00 N ATOM 1019 CA ARG A 66 6.824 21.029 -8.733 1.00 0.00 C ATOM 1020 C ARG A 66 6.091 22.029 -9.629 1.00 0.00 C ATOM 1021 O ARG A 66 6.568 22.363 -10.712 1.00 0.00 O ATOM 1022 CB ARG A 66 6.268 19.626 -8.984 1.00 0.00 C ATOM 1023 CG ARG A 66 7.373 18.672 -9.442 1.00 0.00 C ATOM 1024 CD ARG A 66 6.805 17.287 -9.760 1.00 0.00 C ATOM 1025 NE ARG A 66 5.594 17.417 -10.600 1.00 0.00 N ATOM 1026 CZ ARG A 66 5.250 16.545 -11.571 1.00 0.00 C ATOM 1027 NH1 ARG A 66 6.023 15.470 -11.833 1.00 0.00 N ATOM 1028 NH2 ARG A 66 4.145 16.760 -12.262 1.00 0.00 N ATOM 1029 H ARG A 66 5.920 20.971 -6.857 1.00 0.00 H ATOM 1030 HA ARG A 66 7.898 21.049 -8.919 1.00 0.00 H ATOM 1031 HB2 ARG A 66 5.808 19.244 -8.072 1.00 0.00 H ATOM 1032 HB3 ARG A 66 5.485 19.671 -9.741 1.00 0.00 H ATOM 1033 HG2 ARG A 66 7.866 19.078 -10.325 1.00 0.00 H ATOM 1034 HG3 ARG A 66 8.132 18.588 -8.663 1.00 0.00 H ATOM 1035 HD2 ARG A 66 7.554 16.688 -10.277 1.00 0.00 H ATOM 1036 HD3 ARG A 66 6.561 16.764 -8.835 1.00 0.00 H ATOM 1037 HE ARG A 66 4.994 18.201 -10.439 1.00 0.00 H ATOM 1038 HH11 ARG A 66 6.858 15.315 -11.305 1.00 0.00 H ATOM 1039 HH12 ARG A 66 5.760 14.829 -12.554 1.00 0.00 H ATOM 1040 HH21 ARG A 66 3.820 16.163 -12.995 1.00 0.00 H ATOM 1041 N TYR A 67 4.942 22.477 -9.144 1.00 0.00 N ATOM 1042 CA TYR A 67 4.138 23.432 -9.888 1.00 0.00 C ATOM 1043 C TYR A 67 5.002 24.572 -10.431 1.00 0.00 C ATOM 1044 O TYR A 67 4.854 24.973 -11.584 1.00 0.00 O ATOM 1045 CB TYR A 67 3.130 24.003 -8.889 1.00 0.00 C ATOM 1046 CG TYR A 67 1.773 24.352 -9.504 1.00 0.00 C ATOM 1047 CD1 TYR A 67 0.778 23.398 -9.566 1.00 0.00 C ATOM 1048 CD2 TYR A 67 1.545 25.620 -9.998 1.00 0.00 C ATOM 1049 CE1 TYR A 67 -0.499 23.727 -10.146 1.00 0.00 C ATOM 1050 CE2 TYR A 67 0.268 25.949 -10.577 1.00 0.00 C ATOM 1051 CZ TYR A 67 -0.691 24.986 -10.622 1.00 0.00 C ATOM 1052 OH TYR A 67 -1.897 25.296 -11.170 1.00 0.00 O ATOM 1053 H TYR A 67 4.561 22.200 -8.262 1.00 0.00 H ATOM 1054 HA TYR A 67 3.678 22.905 -10.724 1.00 0.00 H ATOM 1055 HB2 TYR A 67 2.978 23.280 -8.088 1.00 0.00 H ATOM 1056 HB3 TYR A 67 3.552 24.899 -8.434 1.00 0.00 H ATOM 1057 HD1 TYR A 67 0.958 22.396 -9.177 1.00 0.00 H ATOM 1058 HD2 TYR A 67 2.331 26.374 -9.949 1.00 0.00 H ATOM 1059 HE1 TYR A 67 -1.294 22.983 -10.201 1.00 0.00 H ATOM 1060 HE2 TYR A 67 0.075 26.947 -10.970 1.00 0.00 H ATOM 1061 HH TYR A 67 -1.914 25.028 -12.133 1.00 0.00 H ATOM 1062 N LYS A 68 5.886 25.062 -9.573 1.00 0.00 N ATOM 1063 CA LYS A 68 6.773 26.148 -9.952 1.00 0.00 C ATOM 1064 C LYS A 68 7.999 25.574 -10.666 1.00 0.00 C ATOM 1065 O LYS A 68 8.746 26.308 -11.311 1.00 0.00 O ATOM 1066 CB LYS A 68 7.117 27.008 -8.734 1.00 0.00 C ATOM 1067 CG LYS A 68 5.914 27.139 -7.798 1.00 0.00 C ATOM 1068 CD LYS A 68 5.296 28.536 -7.892 1.00 0.00 C ATOM 1069 CE LYS A 68 6.221 29.587 -7.276 1.00 0.00 C ATOM 1070 NZ LYS A 68 5.692 30.948 -7.517 1.00 0.00 N ATOM 1071 H LYS A 68 6.000 24.729 -8.637 1.00 0.00 H ATOM 1072 HA LYS A 68 6.231 26.783 -10.653 1.00 0.00 H ATOM 1073 HB2 LYS A 68 7.955 26.565 -8.196 1.00 0.00 H ATOM 1074 HB3 LYS A 68 7.437 27.997 -9.062 1.00 0.00 H ATOM 1075 HG2 LYS A 68 5.166 26.389 -8.054 1.00 0.00 H ATOM 1076 HG3 LYS A 68 6.224 26.943 -6.772 1.00 0.00 H ATOM 1077 HD2 LYS A 68 5.103 28.783 -8.936 1.00 0.00 H ATOM 1078 HD3 LYS A 68 4.334 28.547 -7.379 1.00 0.00 H ATOM 1079 HE2 LYS A 68 6.318 29.412 -6.205 1.00 0.00 H ATOM 1080 HE3 LYS A 68 7.219 29.498 -7.705 1.00 0.00 H ATOM 1081 HZ1 LYS A 68 4.796 31.093 -7.064 1.00 0.00 H ATOM 1082 HZ2 LYS A 68 6.317 31.666 -7.167 1.00 0.00 H ATOM 1083 N GLN A 69 8.168 24.267 -10.525 1.00 0.00 N ATOM 1084 CA GLN A 69 9.290 23.587 -11.149 1.00 0.00 C ATOM 1085 C GLN A 69 8.910 23.118 -12.555 1.00 0.00 C ATOM 1086 O GLN A 69 9.746 23.110 -13.458 1.00 0.00 O ATOM 1087 CB GLN A 69 9.766 22.414 -10.290 1.00 0.00 C ATOM 1088 CG GLN A 69 11.293 22.376 -10.212 1.00 0.00 C ATOM 1089 CD GLN A 69 11.788 22.951 -8.883 1.00 0.00 C ATOM 1090 OE1 GLN A 69 11.156 23.793 -8.267 1.00 0.00 O ATOM 1091 NE2 GLN A 69 12.951 22.449 -8.476 1.00 0.00 N ATOM 1092 H GLN A 69 7.556 23.678 -9.998 1.00 0.00 H ATOM 1093 HA GLN A 69 10.083 24.331 -11.209 1.00 0.00 H ATOM 1094 HB2 GLN A 69 9.349 22.500 -9.287 1.00 0.00 H ATOM 1095 HB3 GLN A 69 9.396 21.478 -10.709 1.00 0.00 H ATOM 1096 HG2 GLN A 69 11.641 21.349 -10.320 1.00 0.00 H ATOM 1097 HG3 GLN A 69 11.718 22.945 -11.039 1.00 0.00 H ATOM 1098 HE21 GLN A 69 13.419 21.759 -9.029 1.00 0.00 H ATOM 1099 HE22 GLN A 69 13.358 22.762 -7.618 1.00 0.00 H ATOM 1100 N ILE A 70 7.649 22.738 -12.698 1.00 0.00 N ATOM 1101 CA ILE A 70 7.149 22.268 -13.979 1.00 0.00 C ATOM 1102 C ILE A 70 7.027 23.453 -14.939 1.00 0.00 C ATOM 1103 O ILE A 70 7.271 23.313 -16.137 1.00 0.00 O ATOM 1104 CB ILE A 70 5.845 21.491 -13.792 1.00 0.00 C ATOM 1105 CG1 ILE A 70 5.448 20.767 -15.081 1.00 0.00 C ATOM 1106 CG2 ILE A 70 4.729 22.405 -13.282 1.00 0.00 C ATOM 1107 CD1 ILE A 70 6.491 19.715 -15.462 1.00 0.00 C ATOM 1108 H ILE A 70 6.975 22.748 -11.959 1.00 0.00 H ATOM 1109 HA ILE A 70 7.885 21.571 -14.381 1.00 0.00 H ATOM 1110 HB ILE A 70 6.008 20.727 -13.032 1.00 0.00 H ATOM 1111 HG12 ILE A 70 4.477 20.291 -14.951 1.00 0.00 H ATOM 1112 HG13 ILE A 70 5.343 21.490 -15.890 1.00 0.00 H ATOM 1113 HG21 ILE A 70 4.832 23.391 -13.735 1.00 0.00 H ATOM 1114 HG22 ILE A 70 3.761 21.982 -13.549 1.00 0.00 H ATOM 1115 HG23 ILE A 70 4.800 22.494 -12.198 1.00 0.00 H ATOM 1116 HD11 ILE A 70 7.409 19.893 -14.901 1.00 0.00 H ATOM 1117 HD12 ILE A 70 6.108 18.722 -15.228 1.00 0.00 H ATOM 1118 HD13 ILE A 70 6.700 19.781 -16.530 1.00 0.00 H ATOM 1119 N LYS A 71 6.649 24.592 -14.378 1.00 0.00 N ATOM 1120 CA LYS A 71 6.492 25.800 -15.170 1.00 0.00 C ATOM 1121 C LYS A 71 7.873 26.374 -15.496 1.00 0.00 C ATOM 1122 O LYS A 71 8.016 27.163 -16.428 1.00 0.00 O ATOM 1123 CB LYS A 71 5.567 26.790 -14.460 1.00 0.00 C ATOM 1124 CG LYS A 71 4.253 26.959 -15.225 1.00 0.00 C ATOM 1125 CD LYS A 71 3.678 28.362 -15.024 1.00 0.00 C ATOM 1126 CE LYS A 71 3.442 29.056 -16.367 1.00 0.00 C ATOM 1127 NZ LYS A 71 3.544 30.525 -16.218 1.00 0.00 N ATOM 1128 H LYS A 71 6.452 24.697 -13.404 1.00 0.00 H ATOM 1129 HA LYS A 71 6.006 25.518 -16.104 1.00 0.00 H ATOM 1130 HB2 LYS A 71 5.360 26.439 -13.449 1.00 0.00 H ATOM 1131 HB3 LYS A 71 6.065 27.755 -14.366 1.00 0.00 H ATOM 1132 HG2 LYS A 71 4.422 26.780 -16.287 1.00 0.00 H ATOM 1133 HG3 LYS A 71 3.533 26.215 -14.887 1.00 0.00 H ATOM 1134 HD2 LYS A 71 2.740 28.299 -14.473 1.00 0.00 H ATOM 1135 HD3 LYS A 71 4.363 28.957 -14.420 1.00 0.00 H ATOM 1136 HE2 LYS A 71 4.172 28.707 -17.097 1.00 0.00 H ATOM 1137 HE3 LYS A 71 2.456 28.791 -16.751 1.00 0.00 H ATOM 1138 HZ1 LYS A 71 3.496 30.812 -15.246 1.00 0.00 H ATOM 1139 HZ2 LYS A 71 4.417 30.884 -16.587 1.00 0.00 H ATOM 1140 N GLN A 72 8.853 25.954 -14.710 1.00 0.00 N ATOM 1141 CA GLN A 72 10.217 26.416 -14.904 1.00 0.00 C ATOM 1142 C GLN A 72 10.788 25.853 -16.208 1.00 0.00 C ATOM 1143 O GLN A 72 11.780 26.362 -16.727 1.00 0.00 O ATOM 1144 CB GLN A 72 11.099 26.038 -13.712 1.00 0.00 C ATOM 1145 CG GLN A 72 12.336 25.263 -14.169 1.00 0.00 C ATOM 1146 CD GLN A 72 13.398 25.227 -13.068 1.00 0.00 C ATOM 1147 OE1 GLN A 72 13.147 25.544 -11.917 1.00 0.00 O ATOM 1148 NE2 GLN A 72 14.595 24.823 -13.484 1.00 0.00 N ATOM 1149 H GLN A 72 8.728 25.313 -13.953 1.00 0.00 H ATOM 1150 HA GLN A 72 10.150 27.502 -14.969 1.00 0.00 H ATOM 1151 HB2 GLN A 72 11.405 26.940 -13.182 1.00 0.00 H ATOM 1152 HB3 GLN A 72 10.526 25.434 -13.009 1.00 0.00 H ATOM 1153 HG2 GLN A 72 12.053 24.246 -14.440 1.00 0.00 H ATOM 1154 HG3 GLN A 72 12.751 25.727 -15.064 1.00 0.00 H ATOM 1155 HE21 GLN A 72 14.734 24.576 -14.443 1.00 0.00 H ATOM 1156 HE22 GLN A 72 15.356 24.766 -12.837 1.00 0.00 H ATOM 1157 N ILE A 73 10.136 24.810 -16.700 1.00 0.00 N ATOM 1158 CA ILE A 73 10.566 24.172 -17.932 1.00 0.00 C ATOM 1159 C ILE A 73 9.942 24.902 -19.124 1.00 0.00 C ATOM 1160 O ILE A 73 10.547 24.983 -20.192 1.00 0.00 O ATOM 1161 CB ILE A 73 10.255 22.674 -17.898 1.00 0.00 C ATOM 1162 CG1 ILE A 73 10.582 22.078 -16.527 1.00 0.00 C ATOM 1163 CG2 ILE A 73 10.974 21.938 -19.029 1.00 0.00 C ATOM 1164 CD1 ILE A 73 9.360 21.378 -15.927 1.00 0.00 C ATOM 1165 H ILE A 73 9.329 24.402 -16.272 1.00 0.00 H ATOM 1166 HA ILE A 73 11.649 24.274 -17.993 1.00 0.00 H ATOM 1167 HB ILE A 73 9.184 22.544 -18.058 1.00 0.00 H ATOM 1168 HG12 ILE A 73 11.402 21.367 -16.622 1.00 0.00 H ATOM 1169 HG13 ILE A 73 10.920 22.866 -15.855 1.00 0.00 H ATOM 1170 HG21 ILE A 73 10.993 22.569 -19.918 1.00 0.00 H ATOM 1171 HG22 ILE A 73 11.995 21.710 -18.723 1.00 0.00 H ATOM 1172 HG23 ILE A 73 10.447 21.011 -19.253 1.00 0.00 H ATOM 1173 HD11 ILE A 73 8.523 21.449 -16.623 1.00 0.00 H ATOM 1174 HD12 ILE A 73 9.595 20.329 -15.747 1.00 0.00 H ATOM 1175 HD13 ILE A 73 9.092 21.858 -14.986 1.00 0.00 H ATOM 1176 N GLY A 74 8.741 25.414 -18.900 1.00 0.00 N ATOM 1177 CA GLY A 74 8.029 26.135 -19.942 1.00 0.00 C ATOM 1178 C GLY A 74 6.754 25.393 -20.349 1.00 0.00 C ATOM 1179 O GLY A 74 6.524 25.150 -21.532 1.00 0.00 O ATOM 1180 H GLY A 74 8.256 25.343 -18.029 1.00 0.00 H ATOM 1181 HA2 GLY A 74 7.776 27.135 -19.590 1.00 0.00 H ATOM 1182 HA3 GLY A 74 8.676 26.257 -20.811 1.00 0.00 H ATOM 1183 N GLY A 75 5.959 25.055 -19.345 1.00 0.00 N ATOM 1184 CA GLY A 75 4.713 24.346 -19.583 1.00 0.00 C ATOM 1185 C GLY A 75 3.638 24.777 -18.583 1.00 0.00 C ATOM 1186 O GLY A 75 3.422 25.969 -18.372 1.00 0.00 O ATOM 1187 H GLY A 75 6.154 25.257 -18.385 1.00 0.00 H ATOM 1188 HA2 GLY A 75 4.369 24.540 -20.599 1.00 0.00 H ATOM 1189 HA3 GLY A 75 4.880 23.272 -19.502 1.00 0.00 H ATOM 1190 N GLU A 76 2.991 23.782 -17.994 1.00 0.00 N ATOM 1191 CA GLU A 76 1.944 24.043 -17.020 1.00 0.00 C ATOM 1192 C GLU A 76 1.811 22.863 -16.055 1.00 0.00 C ATOM 1193 O GLU A 76 2.213 21.746 -16.375 1.00 0.00 O ATOM 1194 CB GLU A 76 0.612 24.336 -17.714 1.00 0.00 C ATOM 1195 CG GLU A 76 0.836 24.846 -19.139 1.00 0.00 C ATOM 1196 CD GLU A 76 1.178 26.337 -19.140 1.00 0.00 C ATOM 1197 OE1 GLU A 76 1.287 26.949 -18.068 1.00 0.00 O ATOM 1198 OE2 GLU A 76 1.333 26.859 -20.310 1.00 0.00 O ATOM 1199 H GLU A 76 3.171 22.815 -18.171 1.00 0.00 H ATOM 1200 HA GLU A 76 2.267 24.931 -16.478 1.00 0.00 H ATOM 1201 HB2 GLU A 76 0.003 23.432 -17.738 1.00 0.00 H ATOM 1202 HB3 GLU A 76 0.056 25.079 -17.141 1.00 0.00 H ATOM 1203 HG2 GLU A 76 1.643 24.283 -19.607 1.00 0.00 H ATOM 1204 HG3 GLU A 76 -0.060 24.674 -19.735 1.00 0.00 H ATOM 1205 HE2 GLU A 76 0.553 27.446 -20.529 1.00 0.00 H ATOM 1206 N MET A 77 1.246 23.153 -14.892 1.00 0.00 N ATOM 1207 CA MET A 77 1.055 22.130 -13.877 1.00 0.00 C ATOM 1208 C MET A 77 -0.426 21.779 -13.724 1.00 0.00 C ATOM 1209 O MET A 77 -1.250 22.652 -13.455 1.00 0.00 O ATOM 1210 CB MET A 77 1.603 22.631 -12.539 1.00 0.00 C ATOM 1211 CG MET A 77 1.998 21.460 -11.636 1.00 0.00 C ATOM 1212 SD MET A 77 0.788 20.154 -11.765 1.00 0.00 S ATOM 1213 CE MET A 77 1.862 18.729 -11.698 1.00 0.00 C ATOM 1214 H MET A 77 0.922 24.064 -14.639 1.00 0.00 H ATOM 1215 HA MET A 77 1.608 21.260 -14.231 1.00 0.00 H ATOM 1216 HB2 MET A 77 2.468 23.270 -12.712 1.00 0.00 H ATOM 1217 HB3 MET A 77 0.850 23.241 -12.040 1.00 0.00 H ATOM 1218 HG2 MET A 77 2.981 21.086 -11.922 1.00 0.00 H ATOM 1219 HG3 MET A 77 2.074 21.797 -10.602 1.00 0.00 H ATOM 1220 HE1 MET A 77 2.886 19.055 -11.518 1.00 0.00 H ATOM 1221 HE2 MET A 77 1.542 18.071 -10.891 1.00 0.00 H ATOM 1222 HE3 MET A 77 1.813 18.193 -12.646 1.00 0.00 H ATOM 1223 N VAL A 78 -0.719 20.499 -13.903 1.00 0.00 N ATOM 1224 CA VAL A 78 -2.087 20.022 -13.787 1.00 0.00 C ATOM 1225 C VAL A 78 -2.136 18.867 -12.784 1.00 0.00 C ATOM 1226 O VAL A 78 -1.160 18.135 -12.627 1.00 0.00 O ATOM 1227 CB VAL A 78 -2.626 19.639 -15.166 1.00 0.00 C ATOM 1228 CG1 VAL A 78 -3.939 18.863 -15.046 1.00 0.00 C ATOM 1229 CG2 VAL A 78 -2.799 20.876 -16.050 1.00 0.00 C ATOM 1230 H VAL A 78 -0.043 19.796 -14.122 1.00 0.00 H ATOM 1231 HA VAL A 78 -2.691 20.844 -13.404 1.00 0.00 H ATOM 1232 HB VAL A 78 -1.894 18.987 -15.643 1.00 0.00 H ATOM 1233 HG11 VAL A 78 -4.548 19.301 -14.255 1.00 0.00 H ATOM 1234 HG12 VAL A 78 -4.479 18.914 -15.991 1.00 0.00 H ATOM 1235 HG13 VAL A 78 -3.725 17.822 -14.805 1.00 0.00 H ATOM 1236 HG21 VAL A 78 -2.489 21.763 -15.498 1.00 0.00 H ATOM 1237 HG22 VAL A 78 -2.185 20.772 -16.944 1.00 0.00 H ATOM 1238 HG23 VAL A 78 -3.846 20.974 -16.337 1.00 0.00 H ATOM 1239 N VAL A 79 -3.282 18.740 -12.132 1.00 0.00 N ATOM 1240 CA VAL A 79 -3.471 17.687 -11.149 1.00 0.00 C ATOM 1241 C VAL A 79 -4.968 17.472 -10.920 1.00 0.00 C ATOM 1242 O VAL A 79 -5.717 18.431 -10.741 1.00 0.00 O ATOM 1243 CB VAL A 79 -2.713 18.028 -9.864 1.00 0.00 C ATOM 1244 CG1 VAL A 79 -3.231 19.330 -9.251 1.00 0.00 C ATOM 1245 CG2 VAL A 79 -2.793 16.878 -8.859 1.00 0.00 C ATOM 1246 H VAL A 79 -4.071 19.339 -12.266 1.00 0.00 H ATOM 1247 HA VAL A 79 -3.044 16.772 -11.560 1.00 0.00 H ATOM 1248 HB VAL A 79 -1.664 18.174 -10.123 1.00 0.00 H ATOM 1249 HG11 VAL A 79 -3.554 20.003 -10.046 1.00 0.00 H ATOM 1250 HG12 VAL A 79 -4.074 19.112 -8.595 1.00 0.00 H ATOM 1251 HG13 VAL A 79 -2.436 19.803 -8.675 1.00 0.00 H ATOM 1252 HG21 VAL A 79 -3.835 16.591 -8.717 1.00 0.00 H ATOM 1253 HG22 VAL A 79 -2.229 16.025 -9.237 1.00 0.00 H ATOM 1254 HG23 VAL A 79 -2.371 17.199 -7.906 1.00 0.00 H ATOM 1255 N CYS A 80 -5.360 16.206 -10.932 1.00 0.00 N ATOM 1256 CA CYS A 80 -6.754 15.852 -10.727 1.00 0.00 C ATOM 1257 C CYS A 80 -6.819 14.740 -9.679 1.00 0.00 C ATOM 1258 O CYS A 80 -5.840 14.485 -8.979 1.00 0.00 O ATOM 1259 CB CYS A 80 -7.432 15.443 -12.036 1.00 0.00 C ATOM 1260 SG CYS A 80 -6.749 13.850 -12.624 1.00 0.00 S ATOM 1261 H CYS A 80 -4.745 15.431 -11.079 1.00 0.00 H ATOM 1262 HA CYS A 80 -7.256 16.751 -10.369 1.00 0.00 H ATOM 1263 HB2 CYS A 80 -8.508 15.353 -11.886 1.00 0.00 H ATOM 1264 HB3 CYS A 80 -7.280 16.214 -12.791 1.00 0.00 H ATOM 1265 HG CYS A 80 -7.911 13.336 -13.017 1.00 0.00 H ATOM 1266 N ALA A 81 -7.981 14.108 -9.603 1.00 0.00 N ATOM 1267 CA ALA A 81 -8.186 13.029 -8.652 1.00 0.00 C ATOM 1268 C ALA A 81 -8.410 13.619 -7.259 1.00 0.00 C ATOM 1269 O ALA A 81 -7.820 13.157 -6.283 1.00 0.00 O ATOM 1270 CB ALA A 81 -6.990 12.076 -8.697 1.00 0.00 C ATOM 1271 H ALA A 81 -8.772 14.322 -10.176 1.00 0.00 H ATOM 1272 HA ALA A 81 -9.080 12.484 -8.956 1.00 0.00 H ATOM 1273 HB1 ALA A 81 -6.134 12.586 -9.138 1.00 0.00 H ATOM 1274 HB2 ALA A 81 -6.741 11.758 -7.684 1.00 0.00 H ATOM 1275 HB3 ALA A 81 -7.243 11.203 -9.299 1.00 0.00 H ATOM 1276 N ILE A 82 -9.264 14.630 -7.210 1.00 0.00 N ATOM 1277 CA ILE A 82 -9.575 15.287 -5.951 1.00 0.00 C ATOM 1278 C ILE A 82 -10.621 14.465 -5.197 1.00 0.00 C ATOM 1279 O ILE A 82 -10.894 13.320 -5.556 1.00 0.00 O ATOM 1280 CB ILE A 82 -9.991 16.739 -6.193 1.00 0.00 C ATOM 1281 CG1 ILE A 82 -9.692 17.607 -4.969 1.00 0.00 C ATOM 1282 CG2 ILE A 82 -11.460 16.826 -6.612 1.00 0.00 C ATOM 1283 CD1 ILE A 82 -8.184 17.733 -4.741 1.00 0.00 C ATOM 1284 H ILE A 82 -9.739 15.001 -8.008 1.00 0.00 H ATOM 1285 HA ILE A 82 -8.660 15.309 -5.359 1.00 0.00 H ATOM 1286 HB ILE A 82 -9.398 17.132 -7.019 1.00 0.00 H ATOM 1287 HG12 ILE A 82 -10.127 18.597 -5.105 1.00 0.00 H ATOM 1288 HG13 ILE A 82 -10.161 17.171 -4.087 1.00 0.00 H ATOM 1289 HG21 ILE A 82 -12.076 16.289 -5.890 1.00 0.00 H ATOM 1290 HG22 ILE A 82 -11.768 17.871 -6.645 1.00 0.00 H ATOM 1291 HG23 ILE A 82 -11.584 16.379 -7.599 1.00 0.00 H ATOM 1292 HD11 ILE A 82 -7.653 17.166 -5.506 1.00 0.00 H ATOM 1293 HD12 ILE A 82 -7.895 18.782 -4.801 1.00 0.00 H ATOM 1294 HD13 ILE A 82 -7.931 17.341 -3.756 1.00 0.00 H ATOM 1295 N SER A 83 -11.179 15.080 -4.164 1.00 0.00 N ATOM 1296 CA SER A 83 -12.190 14.420 -3.356 1.00 0.00 C ATOM 1297 C SER A 83 -12.795 15.412 -2.361 1.00 0.00 C ATOM 1298 O SER A 83 -12.223 16.471 -2.110 1.00 0.00 O ATOM 1299 CB SER A 83 -11.602 13.216 -2.615 1.00 0.00 C ATOM 1300 OG SER A 83 -12.614 12.416 -2.011 1.00 0.00 O ATOM 1301 H SER A 83 -10.952 16.011 -3.879 1.00 0.00 H ATOM 1302 HA SER A 83 -12.946 14.077 -4.062 1.00 0.00 H ATOM 1303 HB2 SER A 83 -11.026 12.607 -3.312 1.00 0.00 H ATOM 1304 HB3 SER A 83 -10.910 13.565 -1.849 1.00 0.00 H ATOM 1305 HG SER A 83 -12.482 11.455 -2.255 1.00 0.00 H ATOM 1306 N PRO A 84 -13.975 15.023 -1.807 1.00 0.00 N ATOM 1307 CA PRO A 84 -14.664 15.867 -0.846 1.00 0.00 C ATOM 1308 C PRO A 84 -13.970 15.824 0.518 1.00 0.00 C ATOM 1309 O PRO A 84 -14.315 16.589 1.417 1.00 0.00 O ATOM 1310 CB PRO A 84 -16.087 15.335 -0.805 1.00 0.00 C ATOM 1311 CG PRO A 84 -16.025 13.932 -1.388 1.00 0.00 C ATOM 1312 CD PRO A 84 -14.681 13.775 -2.081 1.00 0.00 C ATOM 1313 HA PRO A 84 -14.634 16.822 -1.138 1.00 0.00 H ATOM 1314 HB2 PRO A 84 -16.468 15.316 0.217 1.00 0.00 H ATOM 1315 HB3 PRO A 84 -16.758 15.969 -1.383 1.00 0.00 H ATOM 1316 HG2 PRO A 84 -16.139 13.186 -0.602 1.00 0.00 H ATOM 1317 HG3 PRO A 84 -16.839 13.777 -2.096 1.00 0.00 H ATOM 1318 HD2 PRO A 84 -14.133 12.917 -1.691 1.00 0.00 H ATOM 1319 HD3 PRO A 84 -14.803 13.616 -3.152 1.00 0.00 H ATOM 1320 N ALA A 85 -13.005 14.923 0.627 1.00 0.00 N ATOM 1321 CA ALA A 85 -12.260 14.770 1.865 1.00 0.00 C ATOM 1322 C ALA A 85 -10.764 14.718 1.551 1.00 0.00 C ATOM 1323 O ALA A 85 -9.995 14.090 2.278 1.00 0.00 O ATOM 1324 CB ALA A 85 -12.745 13.520 2.602 1.00 0.00 C ATOM 1325 H ALA A 85 -12.731 14.305 -0.110 1.00 0.00 H ATOM 1326 HA ALA A 85 -12.463 15.644 2.484 1.00 0.00 H ATOM 1327 HB1 ALA A 85 -13.806 13.371 2.405 1.00 0.00 H ATOM 1328 HB2 ALA A 85 -12.185 12.653 2.254 1.00 0.00 H ATOM 1329 HB3 ALA A 85 -12.589 13.647 3.674 1.00 0.00 H ATOM 1330 N VAL A 86 -10.395 15.387 0.469 1.00 0.00 N ATOM 1331 CA VAL A 86 -9.004 15.424 0.049 1.00 0.00 C ATOM 1332 C VAL A 86 -8.657 16.836 -0.426 1.00 0.00 C ATOM 1333 O VAL A 86 -7.543 17.312 -0.209 1.00 0.00 O ATOM 1334 CB VAL A 86 -8.750 14.356 -1.016 1.00 0.00 C ATOM 1335 CG1 VAL A 86 -7.550 14.727 -1.889 1.00 0.00 C ATOM 1336 CG2 VAL A 86 -8.558 12.979 -0.377 1.00 0.00 C ATOM 1337 H VAL A 86 -11.026 15.896 -0.117 1.00 0.00 H ATOM 1338 HA VAL A 86 -8.392 15.186 0.919 1.00 0.00 H ATOM 1339 HB VAL A 86 -9.629 14.307 -1.658 1.00 0.00 H ATOM 1340 HG11 VAL A 86 -6.825 15.282 -1.294 1.00 0.00 H ATOM 1341 HG12 VAL A 86 -7.085 13.819 -2.273 1.00 0.00 H ATOM 1342 HG13 VAL A 86 -7.885 15.344 -2.723 1.00 0.00 H ATOM 1343 HG21 VAL A 86 -7.860 13.060 0.457 1.00 0.00 H ATOM 1344 HG22 VAL A 86 -9.517 12.610 -0.013 1.00 0.00 H ATOM 1345 HG23 VAL A 86 -8.160 12.286 -1.118 1.00 0.00 H ATOM 1346 N LYS A 87 -9.630 17.468 -1.065 1.00 0.00 N ATOM 1347 CA LYS A 87 -9.442 18.816 -1.571 1.00 0.00 C ATOM 1348 C LYS A 87 -9.351 19.790 -0.395 1.00 0.00 C ATOM 1349 O LYS A 87 -9.049 20.968 -0.581 1.00 0.00 O ATOM 1350 CB LYS A 87 -10.538 19.169 -2.579 1.00 0.00 C ATOM 1351 CG LYS A 87 -11.592 20.081 -1.946 1.00 0.00 C ATOM 1352 CD LYS A 87 -12.871 20.105 -2.784 1.00 0.00 C ATOM 1353 CE LYS A 87 -13.816 21.211 -2.310 1.00 0.00 C ATOM 1354 NZ LYS A 87 -15.091 21.159 -3.060 1.00 0.00 N ATOM 1355 H LYS A 87 -10.533 17.074 -1.238 1.00 0.00 H ATOM 1356 HA LYS A 87 -8.493 18.834 -2.108 1.00 0.00 H ATOM 1357 HB2 LYS A 87 -10.098 19.663 -3.444 1.00 0.00 H ATOM 1358 HB3 LYS A 87 -11.012 18.256 -2.940 1.00 0.00 H ATOM 1359 HG2 LYS A 87 -11.820 19.734 -0.938 1.00 0.00 H ATOM 1360 HG3 LYS A 87 -11.194 21.091 -1.853 1.00 0.00 H ATOM 1361 HD2 LYS A 87 -12.620 20.261 -3.833 1.00 0.00 H ATOM 1362 HD3 LYS A 87 -13.372 19.139 -2.717 1.00 0.00 H ATOM 1363 HE2 LYS A 87 -14.010 21.099 -1.244 1.00 0.00 H ATOM 1364 HE3 LYS A 87 -13.345 22.184 -2.449 1.00 0.00 H ATOM 1365 HZ1 LYS A 87 -15.714 20.443 -2.702 1.00 0.00 H ATOM 1366 HZ2 LYS A 87 -15.596 22.037 -3.012 1.00 0.00 H ATOM 1367 N ARG A 88 -9.619 19.263 0.791 1.00 0.00 N ATOM 1368 CA ARG A 88 -9.571 20.071 1.997 1.00 0.00 C ATOM 1369 C ARG A 88 -8.130 20.480 2.306 1.00 0.00 C ATOM 1370 O ARG A 88 -7.896 21.449 3.027 1.00 0.00 O ATOM 1371 CB ARG A 88 -10.145 19.309 3.193 1.00 0.00 C ATOM 1372 CG ARG A 88 -9.139 18.287 3.726 1.00 0.00 C ATOM 1373 CD ARG A 88 -8.718 17.308 2.628 1.00 0.00 C ATOM 1374 NE ARG A 88 -8.317 16.016 3.229 1.00 0.00 N ATOM 1375 CZ ARG A 88 -8.006 15.851 4.532 1.00 0.00 C ATOM 1376 NH1 ARG A 88 -8.046 16.897 5.384 1.00 0.00 N ATOM 1377 NH2 ARG A 88 -7.661 14.651 4.961 1.00 0.00 N ATOM 1378 H ARG A 88 -9.864 18.304 0.934 1.00 0.00 H ATOM 1379 HA ARG A 88 -10.187 20.942 1.774 1.00 0.00 H ATOM 1380 HB2 ARG A 88 -10.409 20.011 3.984 1.00 0.00 H ATOM 1381 HB3 ARG A 88 -11.063 18.801 2.899 1.00 0.00 H ATOM 1382 HG2 ARG A 88 -8.261 18.804 4.114 1.00 0.00 H ATOM 1383 HG3 ARG A 88 -9.578 17.738 4.559 1.00 0.00 H ATOM 1384 HD2 ARG A 88 -9.541 17.155 1.931 1.00 0.00 H ATOM 1385 HD3 ARG A 88 -7.889 17.725 2.056 1.00 0.00 H ATOM 1386 HE ARG A 88 -8.274 15.215 2.632 1.00 0.00 H ATOM 1387 HH11 ARG A 88 -8.308 17.803 5.051 1.00 0.00 H ATOM 1388 HH12 ARG A 88 -7.814 16.767 6.348 1.00 0.00 H ATOM 1389 HH21 ARG A 88 -7.416 14.445 5.908 1.00 0.00 H ATOM 1390 N LEU A 89 -7.200 19.722 1.744 1.00 0.00 N ATOM 1391 CA LEU A 89 -5.787 19.994 1.948 1.00 0.00 C ATOM 1392 C LEU A 89 -5.427 21.323 1.281 1.00 0.00 C ATOM 1393 O LEU A 89 -4.750 22.158 1.878 1.00 0.00 O ATOM 1394 CB LEU A 89 -4.939 18.815 1.468 1.00 0.00 C ATOM 1395 CG LEU A 89 -4.459 17.849 2.553 1.00 0.00 C ATOM 1396 CD1 LEU A 89 -4.004 16.522 1.943 1.00 0.00 C ATOM 1397 CD2 LEU A 89 -3.368 18.488 3.414 1.00 0.00 C ATOM 1398 H LEU A 89 -7.398 18.935 1.159 1.00 0.00 H ATOM 1399 HA LEU A 89 -5.626 20.092 3.022 1.00 0.00 H ATOM 1400 HB2 LEU A 89 -5.518 18.250 0.737 1.00 0.00 H ATOM 1401 HB3 LEU A 89 -4.066 19.209 0.948 1.00 0.00 H ATOM 1402 HG LEU A 89 -5.300 17.629 3.211 1.00 0.00 H ATOM 1403 HD11 LEU A 89 -3.733 16.676 0.899 1.00 0.00 H ATOM 1404 HD12 LEU A 89 -3.139 16.147 2.491 1.00 0.00 H ATOM 1405 HD13 LEU A 89 -4.815 15.796 2.005 1.00 0.00 H ATOM 1406 HD21 LEU A 89 -2.888 19.291 2.854 1.00 0.00 H ATOM 1407 HD22 LEU A 89 -3.812 18.894 4.322 1.00 0.00 H ATOM 1408 HD23 LEU A 89 -2.625 17.735 3.677 1.00 0.00 H ATOM 1409 N PHE A 90 -5.895 21.477 0.051 1.00 0.00 N ATOM 1410 CA PHE A 90 -5.631 22.690 -0.704 1.00 0.00 C ATOM 1411 C PHE A 90 -6.685 23.760 -0.409 1.00 0.00 C ATOM 1412 O PHE A 90 -6.440 24.949 -0.607 1.00 0.00 O ATOM 1413 CB PHE A 90 -5.700 22.319 -2.186 1.00 0.00 C ATOM 1414 CG PHE A 90 -4.846 21.107 -2.564 1.00 0.00 C ATOM 1415 CD1 PHE A 90 -5.290 19.851 -2.292 1.00 0.00 C ATOM 1416 CD2 PHE A 90 -3.643 21.286 -3.173 1.00 0.00 C ATOM 1417 CE1 PHE A 90 -4.497 18.726 -2.643 1.00 0.00 C ATOM 1418 CE2 PHE A 90 -2.850 20.162 -3.524 1.00 0.00 C ATOM 1419 CZ PHE A 90 -3.294 18.905 -3.252 1.00 0.00 C ATOM 1420 H PHE A 90 -6.445 20.793 -0.428 1.00 0.00 H ATOM 1421 HA PHE A 90 -4.650 23.055 -0.398 1.00 0.00 H ATOM 1422 HB2 PHE A 90 -6.738 22.116 -2.451 1.00 0.00 H ATOM 1423 HB3 PHE A 90 -5.381 23.175 -2.780 1.00 0.00 H ATOM 1424 HD1 PHE A 90 -6.254 19.707 -1.804 1.00 0.00 H ATOM 1425 HD2 PHE A 90 -3.288 22.293 -3.391 1.00 0.00 H ATOM 1426 HE1 PHE A 90 -4.853 17.719 -2.425 1.00 0.00 H ATOM 1427 HE2 PHE A 90 -1.886 20.306 -4.012 1.00 0.00 H ATOM 1428 HZ PHE A 90 -2.685 18.042 -3.521 1.00 0.00 H ATOM 1429 N ASP A 91 -7.835 23.299 0.061 1.00 0.00 N ATOM 1430 CA ASP A 91 -8.926 24.202 0.385 1.00 0.00 C ATOM 1431 C ASP A 91 -8.553 25.024 1.620 1.00 0.00 C ATOM 1432 O ASP A 91 -8.959 26.178 1.748 1.00 0.00 O ATOM 1433 CB ASP A 91 -10.206 23.426 0.702 1.00 0.00 C ATOM 1434 CG ASP A 91 -11.422 23.810 -0.144 1.00 0.00 C ATOM 1435 OD1 ASP A 91 -11.353 23.845 -1.382 1.00 0.00 O ATOM 1436 OD2 ASP A 91 -12.489 24.084 0.527 1.00 0.00 O ATOM 1437 H ASP A 91 -8.026 22.330 0.220 1.00 0.00 H ATOM 1438 HA ASP A 91 -9.060 24.820 -0.503 1.00 0.00 H ATOM 1439 HB2 ASP A 91 -10.011 22.362 0.569 1.00 0.00 H ATOM 1440 HB3 ASP A 91 -10.453 23.575 1.753 1.00 0.00 H ATOM 1441 HD2 ASP A 91 -13.132 24.592 -0.046 1.00 0.00 H ATOM 1442 N MET A 92 -7.784 24.397 2.498 1.00 0.00 N ATOM 1443 CA MET A 92 -7.350 25.057 3.718 1.00 0.00 C ATOM 1444 C MET A 92 -6.100 25.903 3.469 1.00 0.00 C ATOM 1445 O MET A 92 -5.907 26.936 4.109 1.00 0.00 O ATOM 1446 CB MET A 92 -7.050 24.006 4.788 1.00 0.00 C ATOM 1447 CG MET A 92 -6.968 24.645 6.176 1.00 0.00 C ATOM 1448 SD MET A 92 -6.227 23.502 7.331 1.00 0.00 S ATOM 1449 CE MET A 92 -6.037 24.573 8.746 1.00 0.00 C ATOM 1450 H MET A 92 -7.459 23.458 2.387 1.00 0.00 H ATOM 1451 HA MET A 92 -8.179 25.700 4.014 1.00 0.00 H ATOM 1452 HB2 MET A 92 -7.828 23.242 4.781 1.00 0.00 H ATOM 1453 HB3 MET A 92 -6.110 23.505 4.558 1.00 0.00 H ATOM 1454 HG2 MET A 92 -6.378 25.560 6.129 1.00 0.00 H ATOM 1455 HG3 MET A 92 -7.964 24.924 6.517 1.00 0.00 H ATOM 1456 HE1 MET A 92 -6.776 25.372 8.700 1.00 0.00 H ATOM 1457 HE2 MET A 92 -6.182 23.996 9.660 1.00 0.00 H ATOM 1458 HE3 MET A 92 -5.036 25.004 8.744 1.00 0.00 H ATOM 1459 N SER A 93 -5.283 25.435 2.536 1.00 0.00 N ATOM 1460 CA SER A 93 -4.057 26.135 2.195 1.00 0.00 C ATOM 1461 C SER A 93 -4.386 27.479 1.543 1.00 0.00 C ATOM 1462 O SER A 93 -3.716 28.478 1.798 1.00 0.00 O ATOM 1463 CB SER A 93 -3.183 25.293 1.263 1.00 0.00 C ATOM 1464 OG SER A 93 -1.811 25.672 1.332 1.00 0.00 O ATOM 1465 H SER A 93 -5.448 24.594 2.020 1.00 0.00 H ATOM 1466 HA SER A 93 -3.538 26.286 3.141 1.00 0.00 H ATOM 1467 HB2 SER A 93 -3.282 24.240 1.527 1.00 0.00 H ATOM 1468 HB3 SER A 93 -3.538 25.400 0.238 1.00 0.00 H ATOM 1469 HG SER A 93 -1.733 26.628 1.615 1.00 0.00 H ATOM 1470 N GLY A 94 -5.419 27.461 0.713 1.00 0.00 N ATOM 1471 CA GLY A 94 -5.847 28.666 0.024 1.00 0.00 C ATOM 1472 C GLY A 94 -4.961 28.947 -1.191 1.00 0.00 C ATOM 1473 O GLY A 94 -5.104 29.980 -1.844 1.00 0.00 O ATOM 1474 H GLY A 94 -5.958 26.644 0.509 1.00 0.00 H ATOM 1475 HA2 GLY A 94 -6.884 28.559 -0.295 1.00 0.00 H ATOM 1476 HA3 GLY A 94 -5.810 29.514 0.709 1.00 0.00 H ATOM 1477 N LEU A 95 -4.064 28.010 -1.459 1.00 0.00 N ATOM 1478 CA LEU A 95 -3.155 28.143 -2.585 1.00 0.00 C ATOM 1479 C LEU A 95 -3.611 27.219 -3.716 1.00 0.00 C ATOM 1480 O LEU A 95 -2.880 27.005 -4.681 1.00 0.00 O ATOM 1481 CB LEU A 95 -1.711 27.902 -2.139 1.00 0.00 C ATOM 1482 CG LEU A 95 -0.632 28.650 -2.925 1.00 0.00 C ATOM 1483 CD1 LEU A 95 -1.090 30.069 -3.269 1.00 0.00 C ATOM 1484 CD2 LEU A 95 0.699 28.644 -2.171 1.00 0.00 C ATOM 1485 H LEU A 95 -3.953 27.173 -0.923 1.00 0.00 H ATOM 1486 HA LEU A 95 -3.216 29.173 -2.934 1.00 0.00 H ATOM 1487 HB2 LEU A 95 -1.625 28.179 -1.088 1.00 0.00 H ATOM 1488 HB3 LEU A 95 -1.505 26.833 -2.205 1.00 0.00 H ATOM 1489 HG LEU A 95 -0.471 28.127 -3.867 1.00 0.00 H ATOM 1490 HD11 LEU A 95 -2.005 30.023 -3.859 1.00 0.00 H ATOM 1491 HD12 LEU A 95 -1.278 30.623 -2.349 1.00 0.00 H ATOM 1492 HD13 LEU A 95 -0.312 30.572 -3.844 1.00 0.00 H ATOM 1493 HD21 LEU A 95 0.775 27.734 -1.576 1.00 0.00 H ATOM 1494 HD22 LEU A 95 1.521 28.681 -2.885 1.00 0.00 H ATOM 1495 HD23 LEU A 95 0.749 29.513 -1.514 1.00 0.00 H ATOM 1496 N PHE A 96 -4.819 26.697 -3.559 1.00 0.00 N ATOM 1497 CA PHE A 96 -5.382 25.801 -4.555 1.00 0.00 C ATOM 1498 C PHE A 96 -5.226 26.379 -5.963 1.00 0.00 C ATOM 1499 O PHE A 96 -5.046 25.636 -6.926 1.00 0.00 O ATOM 1500 CB PHE A 96 -6.872 25.658 -4.237 1.00 0.00 C ATOM 1501 CG PHE A 96 -7.394 24.224 -4.335 1.00 0.00 C ATOM 1502 CD1 PHE A 96 -6.557 23.219 -4.708 1.00 0.00 C ATOM 1503 CD2 PHE A 96 -8.696 23.953 -4.049 1.00 0.00 C ATOM 1504 CE1 PHE A 96 -7.042 21.887 -4.799 1.00 0.00 C ATOM 1505 CE2 PHE A 96 -9.181 22.622 -4.141 1.00 0.00 C ATOM 1506 CZ PHE A 96 -8.344 21.617 -4.514 1.00 0.00 C ATOM 1507 H PHE A 96 -5.408 26.876 -2.770 1.00 0.00 H ATOM 1508 HA PHE A 96 -4.837 24.859 -4.488 1.00 0.00 H ATOM 1509 HB2 PHE A 96 -7.055 26.033 -3.230 1.00 0.00 H ATOM 1510 HB3 PHE A 96 -7.440 26.289 -4.920 1.00 0.00 H ATOM 1511 HD1 PHE A 96 -5.514 23.436 -4.937 1.00 0.00 H ATOM 1512 HD2 PHE A 96 -9.367 24.758 -3.751 1.00 0.00 H ATOM 1513 HE1 PHE A 96 -6.371 21.082 -5.098 1.00 0.00 H ATOM 1514 HE2 PHE A 96 -10.225 22.405 -3.912 1.00 0.00 H ATOM 1515 HZ PHE A 96 -8.716 20.595 -4.584 1.00 0.00 H ATOM 1516 N LYS A 97 -5.300 27.700 -6.037 1.00 0.00 N ATOM 1517 CA LYS A 97 -5.170 28.386 -7.311 1.00 0.00 C ATOM 1518 C LYS A 97 -3.781 28.114 -7.892 1.00 0.00 C ATOM 1519 O LYS A 97 -3.590 28.169 -9.106 1.00 0.00 O ATOM 1520 CB LYS A 97 -5.489 29.874 -7.153 1.00 0.00 C ATOM 1521 CG LYS A 97 -6.746 30.078 -6.305 1.00 0.00 C ATOM 1522 CD LYS A 97 -7.615 31.201 -6.875 1.00 0.00 C ATOM 1523 CE LYS A 97 -8.789 31.512 -5.944 1.00 0.00 C ATOM 1524 NZ LYS A 97 -9.623 32.598 -6.506 1.00 0.00 N ATOM 1525 H LYS A 97 -5.447 28.297 -5.248 1.00 0.00 H ATOM 1526 HA LYS A 97 -5.915 27.966 -7.986 1.00 0.00 H ATOM 1527 HB2 LYS A 97 -4.646 30.384 -6.687 1.00 0.00 H ATOM 1528 HB3 LYS A 97 -5.631 30.326 -8.135 1.00 0.00 H ATOM 1529 HG2 LYS A 97 -7.320 29.152 -6.271 1.00 0.00 H ATOM 1530 HG3 LYS A 97 -6.464 30.317 -5.280 1.00 0.00 H ATOM 1531 HD2 LYS A 97 -7.011 32.098 -7.015 1.00 0.00 H ATOM 1532 HD3 LYS A 97 -7.991 30.913 -7.857 1.00 0.00 H ATOM 1533 HE2 LYS A 97 -9.396 30.617 -5.803 1.00 0.00 H ATOM 1534 HE3 LYS A 97 -8.416 31.802 -4.962 1.00 0.00 H ATOM 1535 HZ1 LYS A 97 -10.608 32.462 -6.310 1.00 0.00 H ATOM 1536 HZ2 LYS A 97 -9.371 33.505 -6.127 1.00 0.00 H ATOM 1537 N ILE A 98 -2.846 27.826 -6.998 1.00 0.00 N ATOM 1538 CA ILE A 98 -1.481 27.542 -7.407 1.00 0.00 C ATOM 1539 C ILE A 98 -1.356 26.058 -7.756 1.00 0.00 C ATOM 1540 O ILE A 98 -0.323 25.621 -8.263 1.00 0.00 O ATOM 1541 CB ILE A 98 -0.493 28.008 -6.336 1.00 0.00 C ATOM 1542 CG1 ILE A 98 0.624 28.853 -6.951 1.00 0.00 C ATOM 1543 CG2 ILE A 98 0.056 26.820 -5.543 1.00 0.00 C ATOM 1544 CD1 ILE A 98 1.931 28.061 -7.030 1.00 0.00 C ATOM 1545 H ILE A 98 -3.009 27.784 -6.012 1.00 0.00 H ATOM 1546 HA ILE A 98 -1.282 28.127 -8.306 1.00 0.00 H ATOM 1547 HB ILE A 98 -1.028 28.645 -5.632 1.00 0.00 H ATOM 1548 HG12 ILE A 98 0.332 29.179 -7.949 1.00 0.00 H ATOM 1549 HG13 ILE A 98 0.776 29.752 -6.354 1.00 0.00 H ATOM 1550 HG21 ILE A 98 0.501 26.100 -6.230 1.00 0.00 H ATOM 1551 HG22 ILE A 98 0.814 27.170 -4.843 1.00 0.00 H ATOM 1552 HG23 ILE A 98 -0.755 26.344 -4.993 1.00 0.00 H ATOM 1553 HD11 ILE A 98 1.709 27.015 -7.243 1.00 0.00 H ATOM 1554 HD12 ILE A 98 2.556 28.469 -7.824 1.00 0.00 H ATOM 1555 HD13 ILE A 98 2.458 28.134 -6.078 1.00 0.00 H ATOM 1556 N ILE A 99 -2.421 25.324 -7.472 1.00 0.00 N ATOM 1557 CA ILE A 99 -2.443 23.898 -7.749 1.00 0.00 C ATOM 1558 C ILE A 99 -3.493 23.608 -8.824 1.00 0.00 C ATOM 1559 O ILE A 99 -3.501 22.528 -9.413 1.00 0.00 O ATOM 1560 CB ILE A 99 -2.650 23.104 -6.458 1.00 0.00 C ATOM 1561 CG1 ILE A 99 -1.392 23.134 -5.588 1.00 0.00 C ATOM 1562 CG2 ILE A 99 -3.104 21.674 -6.760 1.00 0.00 C ATOM 1563 CD1 ILE A 99 -0.152 22.763 -6.404 1.00 0.00 C ATOM 1564 H ILE A 99 -3.257 25.687 -7.060 1.00 0.00 H ATOM 1565 HA ILE A 99 -1.463 23.626 -8.141 1.00 0.00 H ATOM 1566 HB ILE A 99 -3.447 23.581 -5.888 1.00 0.00 H ATOM 1567 HG12 ILE A 99 -1.266 24.128 -5.160 1.00 0.00 H ATOM 1568 HG13 ILE A 99 -1.505 22.440 -4.755 1.00 0.00 H ATOM 1569 HG21 ILE A 99 -3.931 21.698 -7.470 1.00 0.00 H ATOM 1570 HG22 ILE A 99 -2.274 21.112 -7.188 1.00 0.00 H ATOM 1571 HG23 ILE A 99 -3.431 21.194 -5.838 1.00 0.00 H ATOM 1572 HD11 ILE A 99 -0.444 22.553 -7.433 1.00 0.00 H ATOM 1573 HD12 ILE A 99 0.555 23.592 -6.388 1.00 0.00 H ATOM 1574 HD13 ILE A 99 0.316 21.878 -5.972 1.00 0.00 H ATOM 1575 N ARG A 100 -4.352 24.591 -9.048 1.00 0.00 N ATOM 1576 CA ARG A 100 -5.403 24.455 -10.041 1.00 0.00 C ATOM 1577 C ARG A 100 -5.829 22.991 -10.167 1.00 0.00 C ATOM 1578 O ARG A 100 -5.289 22.253 -10.990 1.00 0.00 O ATOM 1579 CB ARG A 100 -4.939 24.963 -11.408 1.00 0.00 C ATOM 1580 CG ARG A 100 -6.102 25.576 -12.190 1.00 0.00 C ATOM 1581 CD ARG A 100 -5.840 25.520 -13.696 1.00 0.00 C ATOM 1582 NE ARG A 100 -6.490 26.669 -14.366 1.00 0.00 N ATOM 1583 CZ ARG A 100 -5.872 27.840 -14.628 1.00 0.00 C ATOM 1584 NH1 ARG A 100 -4.582 28.028 -14.277 1.00 0.00 N ATOM 1585 NH2 ARG A 100 -6.549 28.800 -15.231 1.00 0.00 N ATOM 1586 H ARG A 100 -4.338 25.466 -8.564 1.00 0.00 H ATOM 1587 HA ARG A 100 -6.222 25.071 -9.668 1.00 0.00 H ATOM 1588 HB2 ARG A 100 -4.153 25.707 -11.275 1.00 0.00 H ATOM 1589 HB3 ARG A 100 -4.506 24.141 -11.978 1.00 0.00 H ATOM 1590 HG2 ARG A 100 -7.023 25.042 -11.957 1.00 0.00 H ATOM 1591 HG3 ARG A 100 -6.248 26.611 -11.881 1.00 0.00 H ATOM 1592 HD2 ARG A 100 -4.768 25.535 -13.888 1.00 0.00 H ATOM 1593 HD3 ARG A 100 -6.224 24.585 -14.105 1.00 0.00 H ATOM 1594 HE ARG A 100 -7.446 26.571 -14.642 1.00 0.00 H ATOM 1595 HH11 ARG A 100 -4.077 27.296 -13.820 1.00 0.00 H ATOM 1596 HH12 ARG A 100 -4.132 28.899 -14.475 1.00 0.00 H ATOM 1597 HH21 ARG A 100 -6.166 29.695 -15.460 1.00 0.00 H ATOM 1598 N PHE A 101 -6.792 22.615 -9.340 1.00 0.00 N ATOM 1599 CA PHE A 101 -7.297 21.252 -9.349 1.00 0.00 C ATOM 1600 C PHE A 101 -8.670 21.180 -10.021 1.00 0.00 C ATOM 1601 O PHE A 101 -9.262 22.209 -10.343 1.00 0.00 O ATOM 1602 CB PHE A 101 -7.435 20.817 -7.888 1.00 0.00 C ATOM 1603 CG PHE A 101 -6.874 19.423 -7.600 1.00 0.00 C ATOM 1604 CD1 PHE A 101 -7.657 18.325 -7.778 1.00 0.00 C ATOM 1605 CD2 PHE A 101 -5.593 19.282 -7.164 1.00 0.00 C ATOM 1606 CE1 PHE A 101 -7.136 17.031 -7.510 1.00 0.00 C ATOM 1607 CE2 PHE A 101 -5.073 17.988 -6.896 1.00 0.00 C ATOM 1608 CZ PHE A 101 -5.855 16.890 -7.075 1.00 0.00 C ATOM 1609 H PHE A 101 -7.226 23.221 -8.673 1.00 0.00 H ATOM 1610 HA PHE A 101 -6.586 20.648 -9.912 1.00 0.00 H ATOM 1611 HB2 PHE A 101 -6.924 21.541 -7.254 1.00 0.00 H ATOM 1612 HB3 PHE A 101 -8.489 20.837 -7.612 1.00 0.00 H ATOM 1613 HD1 PHE A 101 -8.683 18.438 -8.127 1.00 0.00 H ATOM 1614 HD2 PHE A 101 -4.966 20.162 -7.021 1.00 0.00 H ATOM 1615 HE1 PHE A 101 -7.763 16.151 -7.653 1.00 0.00 H ATOM 1616 HE2 PHE A 101 -4.047 17.875 -6.547 1.00 0.00 H ATOM 1617 HZ PHE A 101 -5.456 15.897 -6.869 1.00 0.00 H ATOM 1618 N GLU A 102 -9.135 19.955 -10.214 1.00 0.00 N ATOM 1619 CA GLU A 102 -10.426 19.735 -10.844 1.00 0.00 C ATOM 1620 C GLU A 102 -11.091 18.484 -10.268 1.00 0.00 C ATOM 1621 O GLU A 102 -10.939 18.184 -9.085 1.00 0.00 O ATOM 1622 CB GLU A 102 -10.284 19.631 -12.364 1.00 0.00 C ATOM 1623 CG GLU A 102 -11.322 20.503 -13.073 1.00 0.00 C ATOM 1624 CD GLU A 102 -12.582 19.699 -13.400 1.00 0.00 C ATOM 1625 OE1 GLU A 102 -12.491 18.499 -13.699 1.00 0.00 O ATOM 1626 OE2 GLU A 102 -13.685 20.364 -13.333 1.00 0.00 O ATOM 1627 H GLU A 102 -8.647 19.123 -9.949 1.00 0.00 H ATOM 1628 HA GLU A 102 -11.021 20.616 -10.601 1.00 0.00 H ATOM 1629 HB2 GLU A 102 -9.281 19.939 -12.661 1.00 0.00 H ATOM 1630 HB3 GLU A 102 -10.403 18.593 -12.673 1.00 0.00 H ATOM 1631 HG2 GLU A 102 -11.582 21.352 -12.441 1.00 0.00 H ATOM 1632 HG3 GLU A 102 -10.896 20.908 -13.991 1.00 0.00 H ATOM 1633 HE2 GLU A 102 -14.459 19.763 -13.535 1.00 0.00 H ATOM 1634 N GLN A 103 -11.815 17.787 -11.132 1.00 0.00 N ATOM 1635 CA GLN A 103 -12.506 16.575 -10.724 1.00 0.00 C ATOM 1636 C GLN A 103 -12.701 15.646 -11.923 1.00 0.00 C ATOM 1637 O GLN A 103 -13.703 15.740 -12.630 1.00 0.00 O ATOM 1638 CB GLN A 103 -13.845 16.904 -10.062 1.00 0.00 C ATOM 1639 CG GLN A 103 -13.688 18.028 -9.035 1.00 0.00 C ATOM 1640 CD GLN A 103 -15.047 18.450 -8.472 1.00 0.00 C ATOM 1641 OE1 GLN A 103 -16.087 18.260 -9.082 1.00 0.00 O ATOM 1642 NE2 GLN A 103 -14.981 19.032 -7.278 1.00 0.00 N ATOM 1643 H GLN A 103 -11.933 18.037 -12.093 1.00 0.00 H ATOM 1644 HA GLN A 103 -11.852 16.102 -9.991 1.00 0.00 H ATOM 1645 HB2 GLN A 103 -14.568 17.200 -10.822 1.00 0.00 H ATOM 1646 HB3 GLN A 103 -14.242 16.014 -9.574 1.00 0.00 H ATOM 1647 HG2 GLN A 103 -13.041 17.696 -8.223 1.00 0.00 H ATOM 1648 HG3 GLN A 103 -13.201 18.885 -9.501 1.00 0.00 H ATOM 1649 HE21 GLN A 103 -14.095 19.158 -6.832 1.00 0.00 H ATOM 1650 HE22 GLN A 103 -15.817 19.344 -6.827 1.00 0.00 H ATOM 1651 N SER A 104 -11.727 14.768 -12.116 1.00 0.00 N ATOM 1652 CA SER A 104 -11.778 13.823 -13.218 1.00 0.00 C ATOM 1653 C SER A 104 -12.142 14.549 -14.514 1.00 0.00 C ATOM 1654 O SER A 104 -11.346 14.593 -15.450 1.00 0.00 O ATOM 1655 CB SER A 104 -12.783 12.703 -12.936 1.00 0.00 C ATOM 1656 OG SER A 104 -13.029 11.905 -14.090 1.00 0.00 O ATOM 1657 H SER A 104 -10.915 14.698 -11.536 1.00 0.00 H ATOM 1658 HA SER A 104 -10.775 13.402 -13.284 1.00 0.00 H ATOM 1659 HB2 SER A 104 -12.405 12.072 -12.132 1.00 0.00 H ATOM 1660 HB3 SER A 104 -13.720 13.137 -12.588 1.00 0.00 H ATOM 1661 HG SER A 104 -13.658 12.379 -14.706 1.00 0.00 H ATOM 1662 N GLU A 105 -13.347 15.101 -14.527 1.00 0.00 N ATOM 1663 CA GLU A 105 -13.827 15.823 -15.693 1.00 0.00 C ATOM 1664 C GLU A 105 -12.667 16.541 -16.387 1.00 0.00 C ATOM 1665 O GLU A 105 -12.673 16.704 -17.606 1.00 0.00 O ATOM 1666 CB GLU A 105 -14.933 16.808 -15.312 1.00 0.00 C ATOM 1667 CG GLU A 105 -15.394 17.613 -16.528 1.00 0.00 C ATOM 1668 CD GLU A 105 -16.914 17.788 -16.526 1.00 0.00 C ATOM 1669 OE1 GLU A 105 -17.626 17.016 -15.867 1.00 0.00 O ATOM 1670 OE2 GLU A 105 -17.351 18.769 -17.241 1.00 0.00 O ATOM 1671 H GLU A 105 -13.988 15.062 -13.761 1.00 0.00 H ATOM 1672 HA GLU A 105 -14.239 15.062 -16.355 1.00 0.00 H ATOM 1673 HB2 GLU A 105 -15.778 16.266 -14.888 1.00 0.00 H ATOM 1674 HB3 GLU A 105 -14.570 17.486 -14.539 1.00 0.00 H ATOM 1675 HG2 GLU A 105 -14.912 18.591 -16.526 1.00 0.00 H ATOM 1676 HG3 GLU A 105 -15.084 17.107 -17.443 1.00 0.00 H ATOM 1677 HE2 GLU A 105 -17.758 18.421 -18.086 1.00 0.00 H ATOM 1678 N GLN A 106 -11.700 16.952 -15.580 1.00 0.00 N ATOM 1679 CA GLN A 106 -10.537 17.650 -16.101 1.00 0.00 C ATOM 1680 C GLN A 106 -9.715 16.717 -16.993 1.00 0.00 C ATOM 1681 O GLN A 106 -8.816 17.165 -17.703 1.00 0.00 O ATOM 1682 CB GLN A 106 -9.682 18.215 -14.965 1.00 0.00 C ATOM 1683 CG GLN A 106 -8.235 18.419 -15.416 1.00 0.00 C ATOM 1684 CD GLN A 106 -7.527 19.454 -14.539 1.00 0.00 C ATOM 1685 OE1 GLN A 106 -6.482 19.206 -13.961 1.00 0.00 O ATOM 1686 NE2 GLN A 106 -8.154 20.626 -14.473 1.00 0.00 N ATOM 1687 H GLN A 106 -11.703 16.816 -14.589 1.00 0.00 H ATOM 1688 HA GLN A 106 -10.934 18.474 -16.693 1.00 0.00 H ATOM 1689 HB2 GLN A 106 -10.100 19.165 -14.630 1.00 0.00 H ATOM 1690 HB3 GLN A 106 -9.709 17.537 -14.112 1.00 0.00 H ATOM 1691 HG2 GLN A 106 -7.699 17.471 -15.370 1.00 0.00 H ATOM 1692 HG3 GLN A 106 -8.217 18.744 -16.456 1.00 0.00 H ATOM 1693 HE21 GLN A 106 -9.009 20.764 -14.973 1.00 0.00 H ATOM 1694 HE22 GLN A 106 -7.770 21.368 -13.925 1.00 0.00 H ATOM 1695 N GLN A 107 -10.052 15.438 -16.928 1.00 0.00 N ATOM 1696 CA GLN A 107 -9.357 14.439 -17.722 1.00 0.00 C ATOM 1697 C GLN A 107 -8.952 15.025 -19.075 1.00 0.00 C ATOM 1698 O GLN A 107 -7.930 14.640 -19.642 1.00 0.00 O ATOM 1699 CB GLN A 107 -10.217 13.186 -17.902 1.00 0.00 C ATOM 1700 CG GLN A 107 -10.083 12.628 -19.320 1.00 0.00 C ATOM 1701 CD GLN A 107 -10.607 11.193 -19.396 1.00 0.00 C ATOM 1702 OE1 GLN A 107 -10.352 10.365 -18.537 1.00 0.00 O ATOM 1703 NE2 GLN A 107 -11.351 10.945 -20.470 1.00 0.00 N ATOM 1704 H GLN A 107 -10.784 15.082 -16.347 1.00 0.00 H ATOM 1705 HA GLN A 107 -8.467 14.181 -17.148 1.00 0.00 H ATOM 1706 HB2 GLN A 107 -9.918 12.428 -17.179 1.00 0.00 H ATOM 1707 HB3 GLN A 107 -11.261 13.425 -17.699 1.00 0.00 H ATOM 1708 HG2 GLN A 107 -10.635 13.259 -20.017 1.00 0.00 H ATOM 1709 HG3 GLN A 107 -9.037 12.654 -19.627 1.00 0.00 H ATOM 1710 HE21 GLN A 107 -11.522 11.670 -21.138 1.00 0.00 H ATOM 1711 HE22 GLN A 107 -11.740 10.034 -20.610 1.00 0.00 H ATOM 1712 N ALA A 108 -9.774 15.947 -19.555 1.00 0.00 N ATOM 1713 CA ALA A 108 -9.513 16.591 -20.832 1.00 0.00 C ATOM 1714 C ALA A 108 -8.591 17.792 -20.613 1.00 0.00 C ATOM 1715 O ALA A 108 -7.530 17.885 -21.229 1.00 0.00 O ATOM 1716 CB ALA A 108 -10.839 16.985 -21.485 1.00 0.00 C ATOM 1717 H ALA A 108 -10.603 16.255 -19.088 1.00 0.00 H ATOM 1718 HA ALA A 108 -9.008 15.867 -21.471 1.00 0.00 H ATOM 1719 HB1 ALA A 108 -11.636 16.348 -21.102 1.00 0.00 H ATOM 1720 HB2 ALA A 108 -11.062 18.027 -21.253 1.00 0.00 H ATOM 1721 HB3 ALA A 108 -10.763 16.861 -22.565 1.00 0.00 H ATOM 1722 N LEU A 109 -9.028 18.682 -19.735 1.00 0.00 N ATOM 1723 CA LEU A 109 -8.255 19.873 -19.427 1.00 0.00 C ATOM 1724 C LEU A 109 -6.941 19.464 -18.760 1.00 0.00 C ATOM 1725 O LEU A 109 -5.981 20.233 -18.748 1.00 0.00 O ATOM 1726 CB LEU A 109 -9.087 20.852 -18.597 1.00 0.00 C ATOM 1727 CG LEU A 109 -9.294 22.240 -19.206 1.00 0.00 C ATOM 1728 CD1 LEU A 109 -10.386 23.010 -18.460 1.00 0.00 C ATOM 1729 CD2 LEU A 109 -7.978 23.019 -19.257 1.00 0.00 C ATOM 1730 H LEU A 109 -9.893 18.599 -19.238 1.00 0.00 H ATOM 1731 HA LEU A 109 -8.025 20.366 -20.372 1.00 0.00 H ATOM 1732 HB2 LEU A 109 -10.066 20.406 -18.418 1.00 0.00 H ATOM 1733 HB3 LEU A 109 -8.609 20.972 -17.625 1.00 0.00 H ATOM 1734 HG LEU A 109 -9.634 22.115 -20.234 1.00 0.00 H ATOM 1735 HD11 LEU A 109 -10.257 22.874 -17.386 1.00 0.00 H ATOM 1736 HD12 LEU A 109 -10.315 24.070 -18.703 1.00 0.00 H ATOM 1737 HD13 LEU A 109 -11.365 22.633 -18.759 1.00 0.00 H ATOM 1738 HD21 LEU A 109 -7.142 22.322 -19.193 1.00 0.00 H ATOM 1739 HD22 LEU A 109 -7.919 23.572 -20.194 1.00 0.00 H ATOM 1740 HD23 LEU A 109 -7.935 23.716 -18.420 1.00 0.00 H ATOM 1741 N LEU A 110 -6.939 18.254 -18.221 1.00 0.00 N ATOM 1742 CA LEU A 110 -5.757 17.733 -17.554 1.00 0.00 C ATOM 1743 C LEU A 110 -4.575 17.763 -18.524 1.00 0.00 C ATOM 1744 O LEU A 110 -3.451 18.070 -18.129 1.00 0.00 O ATOM 1745 CB LEU A 110 -6.038 16.347 -16.971 1.00 0.00 C ATOM 1746 CG LEU A 110 -5.158 15.923 -15.793 1.00 0.00 C ATOM 1747 CD1 LEU A 110 -5.924 16.021 -14.473 1.00 0.00 C ATOM 1748 CD2 LEU A 110 -4.578 14.526 -16.017 1.00 0.00 C ATOM 1749 H LEU A 110 -7.724 17.634 -18.234 1.00 0.00 H ATOM 1750 HA LEU A 110 -5.535 18.396 -16.718 1.00 0.00 H ATOM 1751 HB2 LEU A 110 -7.080 16.313 -16.650 1.00 0.00 H ATOM 1752 HB3 LEU A 110 -5.926 15.610 -17.766 1.00 0.00 H ATOM 1753 HG LEU A 110 -4.317 16.614 -15.729 1.00 0.00 H ATOM 1754 HD11 LEU A 110 -6.885 15.516 -14.572 1.00 0.00 H ATOM 1755 HD12 LEU A 110 -5.345 15.547 -13.680 1.00 0.00 H ATOM 1756 HD13 LEU A 110 -6.089 17.070 -14.225 1.00 0.00 H ATOM 1757 HD21 LEU A 110 -4.266 14.424 -17.057 1.00 0.00 H ATOM 1758 HD22 LEU A 110 -3.717 14.380 -15.364 1.00 0.00 H ATOM 1759 HD23 LEU A 110 -5.337 13.777 -15.791 1.00 0.00 H ATOM 1760 N THR A 111 -4.868 17.442 -19.776 1.00 0.00 N ATOM 1761 CA THR A 111 -3.843 17.428 -20.805 1.00 0.00 C ATOM 1762 C THR A 111 -3.126 18.779 -20.861 1.00 0.00 C ATOM 1763 O THR A 111 -2.204 18.964 -21.654 1.00 0.00 O ATOM 1764 CB THR A 111 -4.506 17.037 -22.127 1.00 0.00 C ATOM 1765 OG1 THR A 111 -4.095 15.688 -22.336 1.00 0.00 O ATOM 1766 CG2 THR A 111 -3.921 17.793 -23.322 1.00 0.00 C ATOM 1767 H THR A 111 -5.785 17.194 -20.089 1.00 0.00 H ATOM 1768 HA THR A 111 -3.096 16.681 -20.537 1.00 0.00 H ATOM 1769 HB THR A 111 -5.587 17.168 -22.075 1.00 0.00 H ATOM 1770 HG1 THR A 111 -4.890 15.116 -22.536 1.00 0.00 H ATOM 1771 HG21 THR A 111 -2.842 17.642 -23.355 1.00 0.00 H ATOM 1772 HG22 THR A 111 -4.368 17.419 -24.243 1.00 0.00 H ATOM 1773 HG23 THR A 111 -4.137 18.856 -23.220 1.00 0.00 H ATOM 1774 N LEU A 112 -3.578 19.688 -20.010 1.00 0.00 N ATOM 1775 CA LEU A 112 -2.991 21.016 -19.952 1.00 0.00 C ATOM 1776 C LEU A 112 -3.898 22.002 -20.690 1.00 0.00 C ATOM 1777 O LEU A 112 -3.487 23.121 -20.994 1.00 0.00 O ATOM 1778 CB LEU A 112 -1.554 20.990 -20.479 1.00 0.00 C ATOM 1779 CG LEU A 112 -1.203 22.052 -21.523 1.00 0.00 C ATOM 1780 CD1 LEU A 112 0.022 22.861 -21.092 1.00 0.00 C ATOM 1781 CD2 LEU A 112 -1.017 21.422 -22.905 1.00 0.00 C ATOM 1782 H LEU A 112 -4.328 19.530 -19.369 1.00 0.00 H ATOM 1783 HA LEU A 112 -2.944 21.307 -18.903 1.00 0.00 H ATOM 1784 HB2 LEU A 112 -0.876 21.103 -19.633 1.00 0.00 H ATOM 1785 HB3 LEU A 112 -1.364 20.007 -20.911 1.00 0.00 H ATOM 1786 HG LEU A 112 -2.039 22.748 -21.597 1.00 0.00 H ATOM 1787 HD11 LEU A 112 -0.061 23.110 -20.034 1.00 0.00 H ATOM 1788 HD12 LEU A 112 0.923 22.271 -21.257 1.00 0.00 H ATOM 1789 HD13 LEU A 112 0.076 23.778 -21.678 1.00 0.00 H ATOM 1790 HD21 LEU A 112 -1.010 20.336 -22.811 1.00 0.00 H ATOM 1791 HD22 LEU A 112 -1.836 21.725 -23.556 1.00 0.00 H ATOM 1792 HD23 LEU A 112 -0.071 21.755 -23.331 1.00 0.00 H ATOM 1793 N GLY A 113 -5.115 21.552 -20.956 1.00 0.00 N ATOM 1794 CA GLY A 113 -6.085 22.381 -21.652 1.00 0.00 C ATOM 1795 C GLY A 113 -5.459 23.041 -22.882 1.00 0.00 C ATOM 1796 O GLY A 113 -5.869 24.129 -23.285 1.00 0.00 O ATOM 1797 H GLY A 113 -5.442 20.641 -20.705 1.00 0.00 H ATOM 1798 HA2 GLY A 113 -6.937 21.774 -21.955 1.00 0.00 H ATOM 1799 HA3 GLY A 113 -6.463 23.149 -20.977 1.00 0.00 H ATOM 1800 N VAL A 114 -4.475 22.355 -23.446 1.00 0.00 N ATOM 1801 CA VAL A 114 -3.789 22.860 -24.623 1.00 0.00 C ATOM 1802 C VAL A 114 -3.140 21.693 -25.370 1.00 0.00 C ATOM 1803 O VAL A 114 -1.949 21.432 -25.205 1.00 0.00 O ATOM 1804 CB VAL A 114 -2.787 23.944 -24.220 1.00 0.00 C ATOM 1805 CG1 VAL A 114 -1.783 24.207 -25.344 1.00 0.00 C ATOM 1806 CG2 VAL A 114 -3.506 25.232 -23.815 1.00 0.00 C ATOM 1807 H VAL A 114 -4.147 21.472 -23.112 1.00 0.00 H ATOM 1808 HA VAL A 114 -4.539 23.317 -25.270 1.00 0.00 H ATOM 1809 HB VAL A 114 -2.233 23.583 -23.354 1.00 0.00 H ATOM 1810 HG11 VAL A 114 -1.807 23.381 -26.054 1.00 0.00 H ATOM 1811 HG12 VAL A 114 -2.044 25.133 -25.855 1.00 0.00 H ATOM 1812 HG13 VAL A 114 -0.781 24.295 -24.923 1.00 0.00 H ATOM 1813 HG21 VAL A 114 -4.561 25.159 -24.081 1.00 0.00 H ATOM 1814 HG22 VAL A 114 -3.413 25.377 -22.738 1.00 0.00 H ATOM 1815 HG23 VAL A 114 -3.058 26.078 -24.335 1.00 0.00 H ATOM 1816 N ALA A 115 -3.951 21.023 -26.175 1.00 0.00 N ATOM 1817 CA ALA A 115 -3.470 19.891 -26.948 1.00 0.00 C ATOM 1818 C ALA A 115 -4.655 19.005 -27.338 1.00 0.00 C ATOM 1819 O ALA A 115 -4.988 18.059 -26.626 1.00 0.00 O ATOM 1820 CB ALA A 115 -2.416 19.131 -26.140 1.00 0.00 C ATOM 1821 H ALA A 115 -4.919 21.241 -26.302 1.00 0.00 H ATOM 1822 HA ALA A 115 -3.005 20.281 -27.853 1.00 0.00 H ATOM 1823 HB1 ALA A 115 -2.771 18.992 -25.119 1.00 0.00 H ATOM 1824 HB2 ALA A 115 -2.237 18.159 -26.599 1.00 0.00 H ATOM 1825 HB3 ALA A 115 -1.487 19.703 -26.127 1.00 0.00 H ATOM 1826 N SER A 116 -5.259 19.343 -28.468 1.00 0.00 N ATOM 1827 CA SER A 116 -6.400 18.590 -28.961 1.00 0.00 C ATOM 1828 C SER A 116 -7.579 18.737 -27.997 1.00 0.00 C ATOM 1829 O SER A 116 -8.727 18.509 -28.377 1.00 0.00 O ATOM 1830 CB SER A 116 -6.046 17.113 -29.147 1.00 0.00 C ATOM 1831 OG SER A 116 -7.049 16.413 -29.878 1.00 0.00 O ATOM 1832 H SER A 116 -4.981 20.114 -29.041 1.00 0.00 H ATOM 1833 HA SER A 116 -6.639 19.030 -29.929 1.00 0.00 H ATOM 1834 HB2 SER A 116 -5.093 17.031 -29.669 1.00 0.00 H ATOM 1835 HB3 SER A 116 -5.917 16.646 -28.171 1.00 0.00 H ATOM 1836 HG SER A 116 -7.870 16.306 -29.318 1.00 0.00 H TER 1837 SER A 116 MASTER 146 0 0 4 4 1 1 6 1836 1 0 9 END