HEADER DNA BINDING PROTEIN 29-MAY-00 1F2R TITLE NMR STRUCTURE OF THE HETERODIMERIC COMPLEX BETWEEN CAD TITLE 2 DOMAINS OF CAD AND ICAD COMPND MOL_ID: 1; COMPND 2 MOLECULE: CASPASE-ACTIVATED DNASE; COMPND 3 CHAIN: C; COMPND 4 FRAGMENT: N-TERMINAL DOMAIN (CAD DOMAIN), RESIDUES 1-87; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: INHIBITOR OF CASPASE-ACTIVATED DNASE; COMPND 8 CHAIN: I; COMPND 9 FRAGMENT: N-TERMINAL DOMAIN (CAD DOMAIN), RESIDUES 1-100; COMPND 10 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; SOURCE 3 ORGANISM_COMMON: HOUSE MOUSE; SOURCE 4 ORGANISM_TAXID: 10090; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET32; SOURCE 9 MOL_ID: 2; SOURCE 10 ORGANISM_SCIENTIFIC: MUS MUSCULUS; SOURCE 11 ORGANISM_COMMON: HOUSE MOUSE; SOURCE 12 ORGANISM_TAXID: 10090; SOURCE 13 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 14 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 15 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 16 EXPRESSION_SYSTEM_PLASMID: PET32 KEYWDS ALPHA-BETA ROLL, PROTEIN-PROTEIN COMPLEX, DNA BINDING KEYWDS 2 PROTEIN EXPDTA SOLUTION NMR AUTHOR T.OTOMO,H.SAKAHIRA,K.UEGAKI,S.NAGATA,T.YAMAZAKI REVDAT 3 24-FEB-09 1F2R 1 VERSN REVDAT 2 30-AUG-00 1F2R 1 JRNL REVDAT 1 08-JUN-00 1F2R 0 JRNL AUTH T.OTOMO,H.SAKAHIRA,K.UEGAKI,S.NAGATA,T.YAMAZAKI JRNL TITL STRUCTURE OF THE HETERODIMERIC COMPLEX BETWEEN CAD JRNL TITL 2 DOMAINS OF CAD AND ICAD. JRNL REF NAT.STRUCT.BIOL. V. 7 658 2000 JRNL REFN ISSN 1072-8368 JRNL PMID 10932250 JRNL DOI 10.1038/77957 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH K.UEGAKI,T.OTOMO,H.SAKAHIRA,M.SHIMIZU,N.YUMOTO, REMARK 1 AUTH 2 Y.KYOGOKU,S.NAGATA,T.YAMAZAKI REMARK 1 TITL STRUCTURE OF THE CAD DOMAIN OF CASPASE-ACTIVATED REMARK 1 TITL 2 DNASE AND INTERACTION WITH THE CAD DOMAIN OF ITS REMARK 1 TITL 3 INHIBITOR. REMARK 1 REF J.MOL.BIOL. V. 297 1121 2000 REMARK 1 REFN ISSN 0022-2836 REMARK 1 DOI 10.1006/JMBI.2000.3643 REMARK 1 REFERENCE 2 REMARK 1 AUTH M.ENARI,H.SAKAHIRA,H.YOKOYAMA,K.OKAWA,A.IWAMATSU, REMARK 1 AUTH 2 S.NAGATA REMARK 1 TITL A CASPASE-ACTIVATED DNASE THAT DEGRADES DNA DURING REMARK 1 TITL 2 APOPTOSIS, AND ITS INHIBITOR ICAD. REMARK 1 REF NATURE V. 391 43 1998 REMARK 1 REFN ISSN 0028-0836 REMARK 1 DOI 10.1038/34112 REMARK 1 REFERENCE 3 REMARK 1 AUTH H.SAKAHIRA,M.ENARI,S.NAGATA REMARK 1 TITL CLEAVAGE OF CAD INHIBITOR IN CAD ACTIVATION AND REMARK 1 TITL 2 DNA DEGRADATION DURING APOPTOSIS. REMARK 1 REF NATURE V. 391 96 1998 REMARK 1 REFN ISSN 0028-0836 REMARK 1 DOI 10.1038/34214 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.841 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: THE STRUCTURES ARE BASED ON A TOTAL REMARK 3 OF 2646 RESTRAINTS, 2503 ARE NOE-DERIVED DISTANCE CONSTRAINTS, REMARK 3 93 DIHEDRAL ANGLE RESTRAINTS,50 DISTANCE RESTRAINTS FROM REMARK 3 HYDROGEN BONDS. REMARK 4 REMARK 4 1F2R COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 30-MAY-00. REMARK 100 THE RCSB ID CODE IS RCSB011172. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 308 REMARK 210 PH : 6.4 REMARK 210 IONIC STRENGTH : 0 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 0.6MM CAD U-15N,13C/0.6MM REMARK 210 ICAD UNLABELED; 20MM PHOPHATE REMARK 210 BUFFER PH6.4; 0.6MM CAD U-15N, REMARK 210 13C/0.6MM ICAD UNLABELED; 20MM REMARK 210 PHOPHATE BUFFER PH6.4; 0.6MM REMARK 210 ICAD U-15N,13C/0.6MM CAD REMARK 210 UNLABELED; 20MM PHOPHATE REMARK 210 BUFFER PH6.4; 0.6MM ICAD U- REMARK 210 15N,13C/0.6MM CAD UNLABELED; REMARK 210 20MM PHOPHATE BUFFER PH6.4 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY, 3D_ REMARK 210 15N-SEPARATED_NOESY, 4D_13C- REMARK 210 SEPARATED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ, 800 MHZ REMARK 210 SPECTROMETER MODEL : DMX, DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR 3.841 REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL 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: 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 CYS C 2 66.76 -114.37 REMARK 500 SER C 47 131.24 170.38 REMARK 500 THR C 59 -148.71 -146.99 REMARK 500 PRO C 67 -159.72 -61.21 REMARK 500 ASN C 68 -136.96 -61.12 REMARK 500 ASP C 69 82.53 -28.68 REMARK 500 GLU C 71 86.32 -59.11 REMARK 500 ALA C 77 73.82 -68.26 REMARK 500 TYR C 84 89.86 -50.31 REMARK 500 SER I 4 102.98 -51.03 REMARK 500 ALA I 7 -31.11 171.79 REMARK 500 ALA I 9 151.24 59.47 REMARK 500 PRO I 10 -157.63 -61.67 REMARK 500 ARG I 16 63.12 63.10 REMARK 500 PRO I 17 58.25 -63.63 REMARK 500 LEU I 18 119.35 57.74 REMARK 500 PRO I 20 83.86 -62.81 REMARK 500 ASN I 26 165.19 -45.90 REMARK 500 ARG I 29 70.63 -64.14 REMARK 500 SER I 37 -71.51 -85.30 REMARK 500 ASP I 53 156.82 -46.10 REMARK 500 VAL I 70 69.91 -106.78 REMARK 500 ASP I 73 30.51 -141.27 REMARK 500 LEU I 79 153.83 -40.89 REMARK 500 PRO I 80 173.36 -59.34 REMARK 500 SER I 81 59.11 -66.81 REMARK 500 ASN I 82 116.78 173.12 REMARK 500 ALA I 89 63.23 -66.65 REMARK 500 ASN I 91 -57.82 -158.46 REMARK 500 THR I 95 31.75 -89.60 REMARK 500 TYR I 96 -60.37 -127.01 REMARK 500 SER I 99 51.73 -94.19 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG C 6 0.19 SIDE_CHAIN REMARK 500 ARG C 14 0.19 SIDE_CHAIN REMARK 500 ARG C 27 0.21 SIDE_CHAIN REMARK 500 ARG C 34 0.21 SIDE_CHAIN REMARK 500 ARG C 39 0.30 SIDE_CHAIN REMARK 500 ARG C 48 0.29 SIDE_CHAIN REMARK 500 ARG I 5 0.27 SIDE_CHAIN REMARK 500 ARG I 16 0.30 SIDE_CHAIN REMARK 500 ARG I 24 0.29 SIDE_CHAIN REMARK 500 ARG I 25 0.31 SIDE_CHAIN REMARK 500 ARG I 29 0.29 SIDE_CHAIN REMARK 500 ARG I 43 0.32 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1C9F RELATED DB: PDB REMARK 900 1C9F IS THE NMR STRUCTURE OF THE CAD DOMAIN OF CAD IN THE REMARK 900 FREE STATE. DBREF 1F2R C 1 87 UNP O54788 DFFB_MOUSE 1 87 DBREF 1F2R I 1 100 UNP O54786 DFFA_MOUSE 1 100 SEQRES 1 C 87 MET CYS ALA VAL LEU ARG GLN PRO LYS CYS VAL LYS LEU SEQRES 2 C 87 ARG ALA LEU HIS SER ALA CYS LYS PHE GLY VAL ALA ALA SEQRES 3 C 87 ARG SER CYS GLN GLU LEU LEU ARG LYS GLY CYS VAL ARG SEQRES 4 C 87 PHE GLN LEU PRO MET PRO GLY SER ARG LEU CYS LEU TYR SEQRES 5 C 87 GLU ASP GLY THR GLU VAL THR ASP ASP CYS PHE PRO GLY SEQRES 6 C 87 LEU PRO ASN ASP ALA GLU LEU LEU LEU LEU THR ALA GLY SEQRES 7 C 87 GLU THR TRP HIS GLY TYR VAL SER ASP SEQRES 1 I 100 MET GLU LEU SER ARG GLY ALA SER ALA PRO ASP PRO ASP SEQRES 2 I 100 ASP VAL ARG PRO LEU LYS PRO CYS LEU LEU ARG ARG ASN SEQRES 3 I 100 HIS SER ARG ASP GLN HIS GLY VAL ALA ALA SER SER LEU SEQRES 4 I 100 GLU GLU LEU ARG SER LYS ALA CYS GLU LEU LEU ALA ILE SEQRES 5 I 100 ASP LYS SER LEU THR PRO ILE THR LEU VAL LEU ALA GLU SEQRES 6 I 100 ASP GLY THR ILE VAL ASP ASP ASP ASP TYR PHE LEU CYS SEQRES 7 I 100 LEU PRO SER ASN THR LYS PHE VAL ALA LEU ALA CYS ASN SEQRES 8 I 100 GLU LYS TRP THR TYR ASN ASP SER ASP HELIX 1 1 SER C 28 GLN C 41 1 14 HELIX 2 2 SER I 38 ALA I 51 1 14 HELIX 3 3 ASP I 53 THR I 57 5 5 SHEET 1 A 5 LYS C 21 ALA C 26 0 SHEET 2 A 5 LYS C 9 ARG C 14 -1 N LYS C 9 O ALA C 26 SHEET 3 A 5 ALA C 70 LEU C 75 1 O ALA C 70 N LYS C 12 SHEET 4 A 5 ARG C 48 LEU C 51 -1 N ARG C 48 O LEU C 75 SHEET 5 A 5 GLU C 57 VAL C 58 -1 N VAL C 58 O LEU C 49 SHEET 1 B 4 SER I 28 ALA I 36 0 SHEET 2 B 4 LYS I 19 ARG I 25 -1 N LYS I 19 O ALA I 36 SHEET 3 B 4 LYS I 84 LEU I 88 1 N PHE I 85 O LEU I 22 SHEET 4 B 4 THR I 60 LEU I 63 -1 O THR I 60 N LEU I 88 CISPEP 1 THR I 57 PRO I 58 0 -0.69 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 MET C 1 156.147 31.817 5.664 1.00 6.40 N ATOM 2 CA MET C 1 157.236 30.876 6.056 1.00 5.86 C ATOM 3 C MET C 1 157.020 29.513 5.394 1.00 5.11 C ATOM 4 O MET C 1 156.031 28.847 5.629 1.00 5.13 O ATOM 5 CB MET C 1 157.128 30.758 7.576 1.00 6.54 C ATOM 6 CG MET C 1 158.530 30.656 8.181 1.00 6.86 C ATOM 7 SD MET C 1 158.917 32.186 9.066 1.00 7.77 S ATOM 8 CE MET C 1 160.498 32.524 8.253 1.00 8.32 C ATOM 9 H1 MET C 1 156.174 32.655 6.278 1.00 6.71 H ATOM 10 H2 MET C 1 155.226 31.343 5.764 1.00 6.51 H ATOM 11 H3 MET C 1 156.281 32.111 4.676 1.00 6.66 H ATOM 12 HA MET C 1 158.198 31.280 5.784 1.00 5.92 H ATOM 13 HB2 MET C 1 156.628 31.630 7.971 1.00 7.17 H ATOM 14 HB3 MET C 1 156.564 29.873 7.830 1.00 6.48 H ATOM 15 HG2 MET C 1 158.566 29.823 8.868 1.00 6.82 H ATOM 16 HG3 MET C 1 159.252 30.503 7.392 1.00 6.93 H ATOM 17 HE1 MET C 1 160.365 33.308 7.520 1.00 8.66 H ATOM 18 HE2 MET C 1 160.850 31.631 7.761 1.00 8.47 H ATOM 19 HE3 MET C 1 161.223 32.835 8.993 1.00 8.47 H ATOM 20 N CYS C 2 157.939 29.091 4.568 1.00 4.80 N ATOM 21 CA CYS C 2 157.785 27.771 3.893 1.00 4.35 C ATOM 22 C CYS C 2 158.873 26.804 4.368 1.00 3.74 C ATOM 23 O CYS C 2 159.739 26.409 3.613 1.00 3.73 O ATOM 24 CB CYS C 2 157.946 28.067 2.401 1.00 4.98 C ATOM 25 SG CYS C 2 156.353 28.582 1.713 1.00 5.73 S ATOM 26 H CYS C 2 158.729 29.643 4.392 1.00 5.11 H ATOM 27 HA CYS C 2 156.806 27.361 4.084 1.00 4.43 H ATOM 28 HB2 CYS C 2 158.669 28.858 2.268 1.00 5.43 H ATOM 29 HB3 CYS C 2 158.287 27.178 1.893 1.00 4.97 H ATOM 30 HG CYS C 2 155.702 28.555 2.418 1.00 5.88 H ATOM 31 N ALA C 3 158.835 26.420 5.615 1.00 3.58 N ATOM 32 CA ALA C 3 159.867 25.479 6.136 1.00 3.30 C ATOM 33 C ALA C 3 160.067 24.319 5.157 1.00 2.76 C ATOM 34 O ALA C 3 159.158 23.561 4.883 1.00 2.75 O ATOM 35 CB ALA C 3 159.305 24.970 7.464 1.00 3.78 C ATOM 36 H ALA C 3 158.127 26.750 6.208 1.00 3.90 H ATOM 37 HA ALA C 3 160.798 25.996 6.304 1.00 3.56 H ATOM 38 HB1 ALA C 3 159.750 25.523 8.278 1.00 3.99 H ATOM 39 HB2 ALA C 3 159.534 23.921 7.573 1.00 3.89 H ATOM 40 HB3 ALA C 3 158.234 25.108 7.478 1.00 4.28 H ATOM 41 N VAL C 4 161.251 24.175 4.626 1.00 2.68 N ATOM 42 CA VAL C 4 161.507 23.064 3.664 1.00 2.43 C ATOM 43 C VAL C 4 161.757 21.756 4.418 1.00 2.09 C ATOM 44 O VAL C 4 162.703 21.634 5.171 1.00 2.23 O ATOM 45 CB VAL C 4 162.757 23.487 2.895 1.00 3.02 C ATOM 46 CG1 VAL C 4 163.332 22.280 2.150 1.00 3.30 C ATOM 47 CG2 VAL C 4 162.392 24.580 1.888 1.00 3.63 C ATOM 48 H VAL C 4 161.971 24.797 4.859 1.00 3.03 H ATOM 49 HA VAL C 4 160.677 22.956 2.985 1.00 2.40 H ATOM 50 HB VAL C 4 163.493 23.865 3.588 1.00 3.44 H ATOM 51 HG11 VAL C 4 162.540 21.778 1.615 1.00 3.35 H ATOM 52 HG12 VAL C 4 163.776 21.598 2.860 1.00 3.76 H ATOM 53 HG13 VAL C 4 164.085 22.614 1.451 1.00 3.65 H ATOM 54 HG21 VAL C 4 161.839 24.144 1.069 1.00 3.78 H ATOM 55 HG22 VAL C 4 163.294 25.038 1.510 1.00 4.21 H ATOM 56 HG23 VAL C 4 161.784 25.329 2.374 1.00 3.90 H ATOM 57 N LEU C 5 160.918 20.776 4.221 1.00 1.76 N ATOM 58 CA LEU C 5 161.111 19.477 4.927 1.00 1.50 C ATOM 59 C LEU C 5 162.147 18.624 4.190 1.00 1.58 C ATOM 60 O LEU C 5 162.504 18.900 3.062 1.00 1.81 O ATOM 61 CB LEU C 5 159.740 18.802 4.896 1.00 1.20 C ATOM 62 CG LEU C 5 159.307 18.460 6.322 1.00 1.17 C ATOM 63 CD1 LEU C 5 157.879 18.956 6.556 1.00 1.23 C ATOM 64 CD2 LEU C 5 159.357 16.943 6.519 1.00 1.14 C ATOM 65 H LEU C 5 160.162 20.894 3.609 1.00 1.78 H ATOM 66 HA LEU C 5 161.417 19.644 5.948 1.00 1.62 H ATOM 67 HB2 LEU C 5 159.019 19.472 4.450 1.00 1.26 H ATOM 68 HB3 LEU C 5 159.798 17.895 4.312 1.00 1.14 H ATOM 69 HG LEU C 5 159.973 18.938 7.025 1.00 1.44 H ATOM 70 HD11 LEU C 5 157.260 18.682 5.714 1.00 1.65 H ATOM 71 HD12 LEU C 5 157.884 20.030 6.665 1.00 1.64 H ATOM 72 HD13 LEU C 5 157.484 18.505 7.454 1.00 1.58 H ATOM 73 HD21 LEU C 5 158.706 16.664 7.334 1.00 1.67 H ATOM 74 HD22 LEU C 5 160.369 16.643 6.748 1.00 1.49 H ATOM 75 HD23 LEU C 5 159.032 16.451 5.614 1.00 1.46 H ATOM 76 N ARG C 6 162.633 17.589 4.819 1.00 1.51 N ATOM 77 CA ARG C 6 163.646 16.719 4.153 1.00 1.65 C ATOM 78 C ARG C 6 162.949 15.629 3.335 1.00 1.43 C ATOM 79 O ARG C 6 163.494 15.112 2.380 1.00 1.65 O ATOM 80 CB ARG C 6 164.449 16.099 5.297 1.00 1.86 C ATOM 81 CG ARG C 6 165.232 17.194 6.024 1.00 2.16 C ATOM 82 CD ARG C 6 166.657 17.255 5.471 1.00 2.47 C ATOM 83 NE ARG C 6 167.239 18.500 6.045 1.00 2.71 N ATOM 84 CZ ARG C 6 168.437 18.482 6.563 1.00 3.05 C ATOM 85 NH1 ARG C 6 169.379 17.775 6.002 1.00 3.34 N ATOM 86 NH2 ARG C 6 168.692 19.171 7.642 1.00 3.60 N ATOM 87 H ARG C 6 162.333 17.383 5.729 1.00 1.44 H ATOM 88 HA ARG C 6 164.294 17.308 3.524 1.00 1.88 H ATOM 89 HB2 ARG C 6 163.774 15.617 5.990 1.00 1.79 H ATOM 90 HB3 ARG C 6 165.138 15.370 4.900 1.00 1.97 H ATOM 91 HG2 ARG C 6 164.744 18.146 5.873 1.00 2.16 H ATOM 92 HG3 ARG C 6 165.267 16.971 7.080 1.00 2.51 H ATOM 93 HD2 ARG C 6 167.221 16.390 5.793 1.00 2.86 H ATOM 94 HD3 ARG C 6 166.641 17.317 4.395 1.00 2.67 H ATOM 95 HE ARG C 6 166.722 19.333 6.034 1.00 3.01 H ATOM 96 HH11 ARG C 6 169.184 17.247 5.175 1.00 3.45 H ATOM 97 HH12 ARG C 6 170.297 17.761 6.399 1.00 3.77 H ATOM 98 HH21 ARG C 6 167.969 19.712 8.072 1.00 3.84 H ATOM 99 HH22 ARG C 6 169.610 19.157 8.038 1.00 4.05 H ATOM 100 N GLN C 7 161.747 15.276 3.702 1.00 1.17 N ATOM 101 CA GLN C 7 161.016 14.220 2.945 1.00 1.03 C ATOM 102 C GLN C 7 159.503 14.380 3.143 1.00 0.87 C ATOM 103 O GLN C 7 159.065 14.875 4.163 1.00 0.82 O ATOM 104 CB GLN C 7 161.499 12.898 3.542 1.00 1.08 C ATOM 105 CG GLN C 7 161.222 12.885 5.047 1.00 1.52 C ATOM 106 CD GLN C 7 162.160 11.889 5.731 1.00 1.86 C ATOM 107 OE1 GLN C 7 163.076 11.379 5.116 1.00 2.27 O ATOM 108 NE2 GLN C 7 161.970 11.588 6.986 1.00 2.26 N ATOM 109 H GLN C 7 161.325 15.706 4.475 1.00 1.22 H ATOM 110 HA GLN C 7 161.266 14.265 1.897 1.00 1.15 H ATOM 111 HB2 GLN C 7 160.975 12.078 3.072 1.00 1.46 H ATOM 112 HB3 GLN C 7 162.560 12.792 3.373 1.00 1.38 H ATOM 113 HG2 GLN C 7 161.388 13.874 5.451 1.00 1.91 H ATOM 114 HG3 GLN C 7 160.198 12.592 5.223 1.00 1.89 H ATOM 115 HE21 GLN C 7 161.232 11.999 7.482 1.00 2.48 H ATOM 116 HE22 GLN C 7 162.565 10.951 7.433 1.00 2.62 H ATOM 117 N PRO C 8 158.750 13.954 2.159 1.00 0.84 N ATOM 118 CA PRO C 8 157.273 14.053 2.230 1.00 0.73 C ATOM 119 C PRO C 8 156.736 13.240 3.412 1.00 0.65 C ATOM 120 O PRO C 8 156.974 12.053 3.520 1.00 0.78 O ATOM 121 CB PRO C 8 156.830 13.444 0.896 1.00 0.81 C ATOM 122 CG PRO C 8 158.081 13.016 0.106 1.00 0.95 C ATOM 123 CD PRO C 8 159.328 13.356 0.933 1.00 0.96 C ATOM 124 HA PRO C 8 156.957 15.081 2.293 1.00 0.72 H ATOM 125 HB2 PRO C 8 156.203 12.583 1.082 1.00 0.79 H ATOM 126 HB3 PRO C 8 156.279 14.178 0.327 1.00 0.84 H ATOM 127 HG2 PRO C 8 158.046 11.952 -0.079 1.00 1.01 H ATOM 128 HG3 PRO C 8 158.117 13.547 -0.833 1.00 1.01 H ATOM 129 HD2 PRO C 8 159.888 12.459 1.166 1.00 1.04 H ATOM 130 HD3 PRO C 8 159.946 14.076 0.420 1.00 1.02 H ATOM 131 N LYS C 9 156.014 13.868 4.299 1.00 0.58 N ATOM 132 CA LYS C 9 155.464 13.128 5.472 1.00 0.51 C ATOM 133 C LYS C 9 154.481 12.053 5.003 1.00 0.48 C ATOM 134 O LYS C 9 154.184 11.939 3.830 1.00 0.56 O ATOM 135 CB LYS C 9 154.744 14.186 6.308 1.00 0.47 C ATOM 136 CG LYS C 9 155.421 14.304 7.675 1.00 0.99 C ATOM 137 CD LYS C 9 155.377 12.950 8.387 1.00 0.67 C ATOM 138 CE LYS C 9 155.936 13.101 9.804 1.00 0.92 C ATOM 139 NZ LYS C 9 157.405 13.266 9.621 1.00 1.79 N ATOM 140 H LYS C 9 155.833 14.826 4.195 1.00 0.68 H ATOM 141 HA LYS C 9 156.263 12.686 6.046 1.00 0.55 H ATOM 142 HB2 LYS C 9 154.788 15.138 5.799 1.00 0.82 H ATOM 143 HB3 LYS C 9 153.712 13.897 6.443 1.00 0.79 H ATOM 144 HG2 LYS C 9 156.449 14.609 7.542 1.00 1.65 H ATOM 145 HG3 LYS C 9 154.901 15.039 8.271 1.00 1.57 H ATOM 146 HD2 LYS C 9 154.355 12.603 8.437 1.00 0.65 H ATOM 147 HD3 LYS C 9 155.974 12.236 7.841 1.00 0.74 H ATOM 148 HE2 LYS C 9 155.513 13.974 10.282 1.00 1.26 H ATOM 149 HE3 LYS C 9 155.733 12.216 10.385 1.00 1.17 H ATOM 150 HZ1 LYS C 9 157.596 13.658 8.678 1.00 2.29 H ATOM 151 HZ2 LYS C 9 157.872 12.341 9.714 1.00 2.24 H ATOM 152 HZ3 LYS C 9 157.774 13.916 10.344 1.00 2.28 H ATOM 153 N CYS C 10 153.974 11.264 5.910 1.00 0.45 N ATOM 154 CA CYS C 10 153.011 10.197 5.513 1.00 0.43 C ATOM 155 C CYS C 10 151.965 9.986 6.612 1.00 0.40 C ATOM 156 O CYS C 10 152.266 10.024 7.791 1.00 0.43 O ATOM 157 CB CYS C 10 153.865 8.940 5.338 1.00 0.49 C ATOM 158 SG CYS C 10 154.809 9.062 3.798 1.00 0.54 S ATOM 159 H CYS C 10 154.226 11.371 6.851 1.00 0.49 H ATOM 160 HA CYS C 10 152.532 10.449 4.581 1.00 0.44 H ATOM 161 HB2 CYS C 10 154.546 8.848 6.171 1.00 0.56 H ATOM 162 HB3 CYS C 10 153.224 8.072 5.299 1.00 0.57 H ATOM 163 HG CYS C 10 155.563 9.634 3.957 1.00 1.08 H ATOM 164 N VAL C 11 150.737 9.759 6.240 1.00 0.37 N ATOM 165 CA VAL C 11 149.684 9.543 7.269 1.00 0.35 C ATOM 166 C VAL C 11 148.526 8.730 6.685 1.00 0.33 C ATOM 167 O VAL C 11 148.363 8.635 5.485 1.00 0.39 O ATOM 168 CB VAL C 11 149.213 10.945 7.659 1.00 0.35 C ATOM 169 CG1 VAL C 11 150.394 11.747 8.211 1.00 0.40 C ATOM 170 CG2 VAL C 11 148.649 11.654 6.426 1.00 0.37 C ATOM 171 H VAL C 11 150.509 9.728 5.287 1.00 0.38 H ATOM 172 HA VAL C 11 150.102 9.043 8.127 1.00 0.39 H ATOM 173 HB VAL C 11 148.446 10.868 8.416 1.00 0.43 H ATOM 174 HG11 VAL C 11 151.066 11.999 7.404 1.00 1.07 H ATOM 175 HG12 VAL C 11 150.919 11.155 8.946 1.00 1.05 H ATOM 176 HG13 VAL C 11 150.029 12.653 8.672 1.00 1.05 H ATOM 177 HG21 VAL C 11 147.655 11.284 6.222 1.00 1.05 H ATOM 178 HG22 VAL C 11 149.287 11.461 5.576 1.00 1.05 H ATOM 179 HG23 VAL C 11 148.606 12.717 6.610 1.00 1.12 H ATOM 180 N LYS C 12 147.719 8.143 7.527 1.00 0.35 N ATOM 181 CA LYS C 12 146.571 7.336 7.023 1.00 0.35 C ATOM 182 C LYS C 12 145.252 7.915 7.543 1.00 0.33 C ATOM 183 O LYS C 12 144.970 7.877 8.724 1.00 0.34 O ATOM 184 CB LYS C 12 146.798 5.930 7.580 1.00 0.40 C ATOM 185 CG LYS C 12 147.793 5.183 6.689 1.00 0.73 C ATOM 186 CD LYS C 12 147.438 3.695 6.662 1.00 0.73 C ATOM 187 CE LYS C 12 148.558 2.916 5.968 1.00 0.63 C ATOM 188 NZ LYS C 12 149.161 2.076 7.039 1.00 1.21 N ATOM 189 H LYS C 12 147.868 8.233 8.492 1.00 0.42 H ATOM 190 HA LYS C 12 146.573 7.311 5.945 1.00 0.37 H ATOM 191 HB2 LYS C 12 147.193 6.000 8.583 1.00 0.59 H ATOM 192 HB3 LYS C 12 145.861 5.394 7.598 1.00 0.56 H ATOM 193 HG2 LYS C 12 147.748 5.583 5.686 1.00 1.47 H ATOM 194 HG3 LYS C 12 148.791 5.306 7.082 1.00 1.24 H ATOM 195 HD2 LYS C 12 147.321 3.335 7.674 1.00 1.34 H ATOM 196 HD3 LYS C 12 146.515 3.555 6.120 1.00 1.47 H ATOM 197 HE2 LYS C 12 148.150 2.295 5.182 1.00 0.96 H ATOM 198 HE3 LYS C 12 149.297 3.593 5.569 1.00 0.89 H ATOM 199 HZ1 LYS C 12 149.006 2.526 7.963 1.00 1.43 H ATOM 200 HZ2 LYS C 12 150.183 1.978 6.867 1.00 1.74 H ATOM 201 HZ3 LYS C 12 148.717 1.136 7.035 1.00 1.68 H ATOM 202 N LEU C 13 144.445 8.452 6.671 1.00 0.32 N ATOM 203 CA LEU C 13 143.146 9.034 7.116 1.00 0.32 C ATOM 204 C LEU C 13 142.097 7.931 7.277 1.00 0.32 C ATOM 205 O LEU C 13 141.508 7.478 6.316 1.00 0.48 O ATOM 206 CB LEU C 13 142.743 9.998 6.000 1.00 0.35 C ATOM 207 CG LEU C 13 142.677 11.422 6.552 1.00 0.50 C ATOM 208 CD1 LEU C 13 144.091 11.915 6.863 1.00 0.81 C ATOM 209 CD2 LEU C 13 142.034 12.342 5.512 1.00 0.52 C ATOM 210 H LEU C 13 144.692 8.474 5.723 1.00 0.33 H ATOM 211 HA LEU C 13 143.272 9.574 8.041 1.00 0.32 H ATOM 212 HB2 LEU C 13 143.473 9.952 5.205 1.00 0.42 H ATOM 213 HB3 LEU C 13 141.774 9.718 5.615 1.00 0.43 H ATOM 214 HG LEU C 13 142.086 11.430 7.457 1.00 0.76 H ATOM 215 HD11 LEU C 13 144.112 12.995 6.826 1.00 1.35 H ATOM 216 HD12 LEU C 13 144.780 11.516 6.134 1.00 1.26 H ATOM 217 HD13 LEU C 13 144.379 11.584 7.850 1.00 1.50 H ATOM 218 HD21 LEU C 13 141.326 11.778 4.922 1.00 1.20 H ATOM 219 HD22 LEU C 13 142.800 12.745 4.866 1.00 1.01 H ATOM 220 HD23 LEU C 13 141.523 13.151 6.013 1.00 1.07 H ATOM 221 N ARG C 14 141.858 7.496 8.484 1.00 0.29 N ATOM 222 CA ARG C 14 140.845 6.423 8.704 1.00 0.31 C ATOM 223 C ARG C 14 139.575 7.011 9.326 1.00 0.31 C ATOM 224 O ARG C 14 139.633 7.813 10.237 1.00 0.35 O ATOM 225 CB ARG C 14 141.510 5.442 9.670 1.00 0.35 C ATOM 226 CG ARG C 14 140.464 4.462 10.203 1.00 0.46 C ATOM 227 CD ARG C 14 141.120 3.104 10.463 1.00 0.86 C ATOM 228 NE ARG C 14 140.065 2.101 10.147 1.00 1.10 N ATOM 229 CZ ARG C 14 139.921 1.045 10.901 1.00 1.50 C ATOM 230 NH1 ARG C 14 140.057 1.145 12.195 1.00 1.95 N ATOM 231 NH2 ARG C 14 139.640 -0.109 10.361 1.00 2.31 N ATOM 232 H ARG C 14 142.343 7.876 9.247 1.00 0.38 H ATOM 233 HA ARG C 14 140.615 5.926 7.775 1.00 0.34 H ATOM 234 HB2 ARG C 14 142.286 4.896 9.151 1.00 0.45 H ATOM 235 HB3 ARG C 14 141.944 5.987 10.495 1.00 0.40 H ATOM 236 HG2 ARG C 14 140.050 4.844 11.125 1.00 0.85 H ATOM 237 HG3 ARG C 14 139.676 4.345 9.475 1.00 1.00 H ATOM 238 HD2 ARG C 14 141.975 2.971 9.814 1.00 1.45 H ATOM 239 HD3 ARG C 14 141.413 3.018 11.497 1.00 1.54 H ATOM 240 HE ARG C 14 139.479 2.234 9.373 1.00 1.71 H ATOM 241 HH11 ARG C 14 140.272 2.029 12.609 1.00 2.25 H ATOM 242 HH12 ARG C 14 139.947 0.336 12.772 1.00 2.46 H ATOM 243 HH21 ARG C 14 139.536 -0.185 9.369 1.00 2.72 H ATOM 244 HH22 ARG C 14 139.530 -0.918 10.939 1.00 2.82 H ATOM 245 N ALA C 15 138.428 6.619 8.841 1.00 0.34 N ATOM 246 CA ALA C 15 137.156 7.157 9.406 1.00 0.36 C ATOM 247 C ALA C 15 136.654 6.253 10.535 1.00 0.47 C ATOM 248 O ALA C 15 137.206 5.202 10.793 1.00 0.61 O ATOM 249 CB ALA C 15 136.170 7.153 8.238 1.00 0.43 C ATOM 250 H ALA C 15 138.403 5.971 8.105 1.00 0.38 H ATOM 251 HA ALA C 15 137.299 8.164 9.764 1.00 0.35 H ATOM 252 HB1 ALA C 15 135.292 6.587 8.511 1.00 1.17 H ATOM 253 HB2 ALA C 15 136.636 6.700 7.375 1.00 0.99 H ATOM 254 HB3 ALA C 15 135.886 8.168 8.002 1.00 1.15 H ATOM 255 N LEU C 16 135.611 6.654 11.210 1.00 0.50 N ATOM 256 CA LEU C 16 135.075 5.817 12.322 1.00 0.63 C ATOM 257 C LEU C 16 134.071 4.796 11.780 1.00 0.80 C ATOM 258 O LEU C 16 134.146 3.620 12.077 1.00 1.03 O ATOM 259 CB LEU C 16 134.380 6.802 13.262 1.00 0.67 C ATOM 260 CG LEU C 16 135.172 6.912 14.565 1.00 0.72 C ATOM 261 CD1 LEU C 16 134.927 8.284 15.197 1.00 0.82 C ATOM 262 CD2 LEU C 16 134.714 5.818 15.532 1.00 0.94 C ATOM 263 H LEU C 16 135.180 7.505 10.986 1.00 0.51 H ATOM 264 HA LEU C 16 135.878 5.318 12.840 1.00 0.68 H ATOM 265 HB2 LEU C 16 134.325 7.773 12.789 1.00 0.74 H ATOM 266 HB3 LEU C 16 133.382 6.451 13.478 1.00 0.79 H ATOM 267 HG LEU C 16 136.226 6.795 14.357 1.00 0.82 H ATOM 268 HD11 LEU C 16 134.691 8.161 16.243 1.00 1.44 H ATOM 269 HD12 LEU C 16 134.103 8.769 14.696 1.00 1.39 H ATOM 270 HD13 LEU C 16 135.816 8.889 15.097 1.00 1.16 H ATOM 271 HD21 LEU C 16 134.637 6.227 16.528 1.00 1.35 H ATOM 272 HD22 LEU C 16 135.433 5.011 15.529 1.00 1.60 H ATOM 273 HD23 LEU C 16 133.750 5.443 15.221 1.00 1.32 H ATOM 274 N HIS C 17 133.131 5.235 10.989 1.00 0.85 N ATOM 275 CA HIS C 17 132.124 4.288 10.430 1.00 1.07 C ATOM 276 C HIS C 17 132.324 4.133 8.921 1.00 0.91 C ATOM 277 O HIS C 17 131.390 3.890 8.183 1.00 1.09 O ATOM 278 CB HIS C 17 130.769 4.929 10.729 1.00 1.42 C ATOM 279 CG HIS C 17 130.646 5.182 12.206 1.00 2.06 C ATOM 280 ND1 HIS C 17 129.679 6.022 12.735 1.00 2.77 N ATOM 281 CD2 HIS C 17 131.362 4.711 13.280 1.00 2.85 C ATOM 282 CE1 HIS C 17 129.836 6.031 14.071 1.00 3.65 C ATOM 283 NE2 HIS C 17 130.848 5.249 14.457 1.00 3.74 N ATOM 284 H HIS C 17 133.088 6.188 10.762 1.00 0.86 H ATOM 285 HA HIS C 17 132.195 3.331 10.921 1.00 1.34 H ATOM 286 HB2 HIS C 17 130.688 5.865 10.196 1.00 1.89 H ATOM 287 HB3 HIS C 17 129.979 4.265 10.411 1.00 1.70 H ATOM 288 HD1 HIS C 17 129.003 6.518 12.228 1.00 2.95 H ATOM 289 HD2 HIS C 17 132.196 4.028 13.221 1.00 3.12 H ATOM 290 HE1 HIS C 17 129.219 6.601 14.750 1.00 4.45 H ATOM 291 N SER C 18 133.536 4.270 8.457 1.00 0.98 N ATOM 292 CA SER C 18 133.796 4.129 6.995 1.00 1.28 C ATOM 293 C SER C 18 134.399 2.753 6.699 1.00 1.60 C ATOM 294 O SER C 18 134.352 2.271 5.584 1.00 2.40 O ATOM 295 CB SER C 18 134.795 5.235 6.662 1.00 1.26 C ATOM 296 OG SER C 18 135.071 5.214 5.268 1.00 1.86 O ATOM 297 H SER C 18 134.275 4.465 9.070 1.00 1.09 H ATOM 298 HA SER C 18 132.886 4.272 6.434 1.00 1.49 H ATOM 299 HB2 SER C 18 134.378 6.192 6.926 1.00 1.25 H ATOM 300 HB3 SER C 18 135.707 5.075 7.222 1.00 1.45 H ATOM 301 HG SER C 18 134.430 5.780 4.830 1.00 2.15 H ATOM 302 N ALA C 19 134.964 2.119 7.689 1.00 1.46 N ATOM 303 CA ALA C 19 135.570 0.775 7.465 1.00 1.88 C ATOM 304 C ALA C 19 136.765 0.884 6.514 1.00 1.23 C ATOM 305 O ALA C 19 137.252 -0.102 5.998 1.00 1.16 O ATOM 306 CB ALA C 19 134.456 -0.061 6.833 1.00 2.68 C ATOM 307 H ALA C 19 134.991 2.526 8.580 1.00 1.56 H ATOM 308 HA ALA C 19 135.872 0.337 8.403 1.00 2.38 H ATOM 309 HB1 ALA C 19 133.506 0.429 6.989 1.00 3.03 H ATOM 310 HB2 ALA C 19 134.436 -1.039 7.291 1.00 3.04 H ATOM 311 HB3 ALA C 19 134.640 -0.163 5.774 1.00 3.10 H ATOM 312 N CYS C 20 137.240 2.077 6.278 1.00 0.98 N ATOM 313 CA CYS C 20 138.403 2.248 5.361 1.00 0.56 C ATOM 314 C CYS C 20 139.183 3.514 5.726 1.00 0.47 C ATOM 315 O CYS C 20 138.812 4.247 6.622 1.00 0.53 O ATOM 316 CB CYS C 20 137.792 2.381 3.966 1.00 0.91 C ATOM 317 SG CYS C 20 137.280 0.749 3.374 1.00 2.14 S ATOM 318 H CYS C 20 136.833 2.859 6.705 1.00 1.30 H ATOM 319 HA CYS C 20 139.047 1.384 5.401 1.00 0.81 H ATOM 320 HB2 CYS C 20 136.934 3.034 4.009 1.00 1.17 H ATOM 321 HB3 CYS C 20 138.526 2.795 3.290 1.00 1.43 H ATOM 322 HG CYS C 20 136.476 0.504 3.838 1.00 2.48 H ATOM 323 N LYS C 21 140.260 3.776 5.039 1.00 0.41 N ATOM 324 CA LYS C 21 141.062 4.995 5.347 1.00 0.36 C ATOM 325 C LYS C 21 141.659 5.573 4.061 1.00 0.36 C ATOM 326 O LYS C 21 141.486 5.032 2.987 1.00 0.43 O ATOM 327 CB LYS C 21 142.170 4.514 6.284 1.00 0.37 C ATOM 328 CG LYS C 21 143.151 3.634 5.507 1.00 0.40 C ATOM 329 CD LYS C 21 143.135 2.218 6.084 1.00 0.52 C ATOM 330 CE LYS C 21 144.285 2.060 7.082 1.00 0.59 C ATOM 331 NZ LYS C 21 144.181 0.656 7.568 1.00 1.14 N ATOM 332 H LYS C 21 140.542 3.173 4.320 1.00 0.47 H ATOM 333 HA LYS C 21 140.451 5.731 5.844 1.00 0.36 H ATOM 334 HB2 LYS C 21 142.693 5.367 6.690 1.00 0.38 H ATOM 335 HB3 LYS C 21 141.736 3.940 7.090 1.00 0.42 H ATOM 336 HG2 LYS C 21 142.861 3.604 4.467 1.00 0.45 H ATOM 337 HG3 LYS C 21 144.146 4.044 5.591 1.00 0.40 H ATOM 338 HD2 LYS C 21 142.194 2.044 6.586 1.00 0.63 H ATOM 339 HD3 LYS C 21 143.255 1.502 5.284 1.00 0.57 H ATOM 340 HE2 LYS C 21 145.234 2.221 6.589 1.00 0.68 H ATOM 341 HE3 LYS C 21 144.165 2.746 7.905 1.00 0.94 H ATOM 342 HZ1 LYS C 21 143.644 0.635 8.458 1.00 1.67 H ATOM 343 HZ2 LYS C 21 145.136 0.275 7.731 1.00 1.64 H ATOM 344 HZ3 LYS C 21 143.693 0.077 6.857 1.00 1.52 H ATOM 345 N PHE C 22 142.360 6.669 4.161 1.00 0.34 N ATOM 346 CA PHE C 22 142.967 7.279 2.944 1.00 0.36 C ATOM 347 C PHE C 22 144.471 7.481 3.147 1.00 0.34 C ATOM 348 O PHE C 22 144.904 8.454 3.731 1.00 0.35 O ATOM 349 CB PHE C 22 142.262 8.626 2.783 1.00 0.39 C ATOM 350 CG PHE C 22 140.952 8.426 2.060 1.00 0.54 C ATOM 351 CD1 PHE C 22 139.848 7.902 2.743 1.00 1.33 C ATOM 352 CD2 PHE C 22 140.842 8.763 0.706 1.00 1.34 C ATOM 353 CE1 PHE C 22 138.634 7.715 2.072 1.00 1.47 C ATOM 354 CE2 PHE C 22 139.627 8.577 0.034 1.00 1.51 C ATOM 355 CZ PHE C 22 138.523 8.053 0.717 1.00 1.09 C ATOM 356 H PHE C 22 142.489 7.090 5.037 1.00 0.36 H ATOM 357 HA PHE C 22 142.782 6.661 2.080 1.00 0.38 H ATOM 358 HB2 PHE C 22 142.074 9.053 3.758 1.00 0.45 H ATOM 359 HB3 PHE C 22 142.889 9.295 2.212 1.00 0.48 H ATOM 360 HD1 PHE C 22 139.934 7.641 3.787 1.00 2.13 H ATOM 361 HD2 PHE C 22 141.694 9.168 0.179 1.00 2.12 H ATOM 362 HE1 PHE C 22 137.782 7.311 2.599 1.00 2.27 H ATOM 363 HE2 PHE C 22 139.542 8.837 -1.010 1.00 2.34 H ATOM 364 HZ PHE C 22 137.586 7.909 0.200 1.00 1.33 H ATOM 365 N GLY C 23 145.272 6.568 2.668 1.00 0.35 N ATOM 366 CA GLY C 23 146.746 6.709 2.833 1.00 0.36 C ATOM 367 C GLY C 23 147.261 7.806 1.900 1.00 0.37 C ATOM 368 O GLY C 23 147.185 7.692 0.692 1.00 0.40 O ATOM 369 H GLY C 23 144.903 5.790 2.199 1.00 0.36 H ATOM 370 HA2 GLY C 23 146.969 6.971 3.858 1.00 0.37 H ATOM 371 HA3 GLY C 23 147.227 5.776 2.586 1.00 0.40 H ATOM 372 N VAL C 24 147.783 8.869 2.448 1.00 0.37 N ATOM 373 CA VAL C 24 148.302 9.972 1.589 1.00 0.39 C ATOM 374 C VAL C 24 149.488 10.660 2.269 1.00 0.41 C ATOM 375 O VAL C 24 149.576 10.713 3.480 1.00 0.42 O ATOM 376 CB VAL C 24 147.130 10.943 1.442 1.00 0.39 C ATOM 377 CG1 VAL C 24 147.570 12.153 0.616 1.00 0.46 C ATOM 378 CG2 VAL C 24 145.971 10.238 0.733 1.00 0.39 C ATOM 379 H VAL C 24 147.834 8.942 3.424 1.00 0.39 H ATOM 380 HA VAL C 24 148.589 9.593 0.621 1.00 0.41 H ATOM 381 HB VAL C 24 146.810 11.272 2.420 1.00 0.38 H ATOM 382 HG11 VAL C 24 148.261 12.750 1.193 1.00 1.08 H ATOM 383 HG12 VAL C 24 146.706 12.748 0.361 1.00 1.16 H ATOM 384 HG13 VAL C 24 148.055 11.815 -0.288 1.00 1.08 H ATOM 385 HG21 VAL C 24 146.363 9.525 0.024 1.00 0.99 H ATOM 386 HG22 VAL C 24 145.370 10.969 0.213 1.00 1.12 H ATOM 387 HG23 VAL C 24 145.362 9.724 1.462 1.00 1.11 H ATOM 388 N ALA C 25 150.400 11.189 1.500 1.00 0.43 N ATOM 389 CA ALA C 25 151.579 11.874 2.105 1.00 0.46 C ATOM 390 C ALA C 25 151.768 13.256 1.475 1.00 0.51 C ATOM 391 O ALA C 25 151.100 13.612 0.524 1.00 0.52 O ATOM 392 CB ALA C 25 152.770 10.971 1.784 1.00 0.51 C ATOM 393 H ALA C 25 150.310 11.136 0.525 1.00 0.44 H ATOM 394 HA ALA C 25 151.458 11.959 3.173 1.00 0.45 H ATOM 395 HB1 ALA C 25 153.679 11.554 1.800 1.00 1.21 H ATOM 396 HB2 ALA C 25 152.638 10.536 0.804 1.00 1.05 H ATOM 397 HB3 ALA C 25 152.834 10.184 2.521 1.00 1.14 H ATOM 398 N ALA C 26 152.672 14.039 1.998 1.00 0.57 N ATOM 399 CA ALA C 26 152.901 15.398 1.427 1.00 0.63 C ATOM 400 C ALA C 26 154.033 16.104 2.176 1.00 0.60 C ATOM 401 O ALA C 26 154.353 15.767 3.299 1.00 0.59 O ATOM 402 CB ALA C 26 151.580 16.139 1.631 1.00 0.61 C ATOM 403 H ALA C 26 153.200 13.733 2.765 1.00 0.60 H ATOM 404 HA ALA C 26 153.128 15.332 0.376 1.00 0.73 H ATOM 405 HB1 ALA C 26 150.757 15.448 1.519 1.00 1.22 H ATOM 406 HB2 ALA C 26 151.492 16.926 0.896 1.00 1.21 H ATOM 407 HB3 ALA C 26 151.557 16.568 2.622 1.00 1.10 H ATOM 408 N ARG C 27 154.639 17.084 1.564 1.00 0.67 N ATOM 409 CA ARG C 27 155.748 17.814 2.242 1.00 0.67 C ATOM 410 C ARG C 27 155.187 18.985 3.052 1.00 0.60 C ATOM 411 O ARG C 27 155.858 19.971 3.283 1.00 0.72 O ATOM 412 CB ARG C 27 156.640 18.323 1.109 1.00 0.77 C ATOM 413 CG ARG C 27 157.881 17.436 0.999 1.00 1.13 C ATOM 414 CD ARG C 27 159.043 18.251 0.426 1.00 1.45 C ATOM 415 NE ARG C 27 158.998 18.003 -1.042 1.00 1.83 N ATOM 416 CZ ARG C 27 159.857 18.592 -1.829 1.00 2.41 C ATOM 417 NH1 ARG C 27 160.157 19.848 -1.644 1.00 2.81 N ATOM 418 NH2 ARG C 27 160.415 17.924 -2.802 1.00 3.15 N ATOM 419 H ARG C 27 154.364 17.341 0.659 1.00 0.77 H ATOM 420 HA ARG C 27 156.305 17.146 2.879 1.00 0.69 H ATOM 421 HB2 ARG C 27 156.091 18.294 0.179 1.00 0.88 H ATOM 422 HB3 ARG C 27 156.943 19.338 1.317 1.00 0.96 H ATOM 423 HG2 ARG C 27 158.148 17.067 1.979 1.00 1.46 H ATOM 424 HG3 ARG C 27 157.671 16.603 0.345 1.00 1.42 H ATOM 425 HD2 ARG C 27 158.903 19.302 0.637 1.00 1.75 H ATOM 426 HD3 ARG C 27 159.981 17.905 0.831 1.00 1.87 H ATOM 427 HE ARG C 27 158.324 17.399 -1.417 1.00 2.08 H ATOM 428 HH11 ARG C 27 159.729 20.360 -0.899 1.00 2.88 H ATOM 429 HH12 ARG C 27 160.815 20.299 -2.248 1.00 3.39 H ATOM 430 HH21 ARG C 27 160.184 16.961 -2.944 1.00 3.39 H ATOM 431 HH22 ARG C 27 161.072 18.375 -3.405 1.00 3.74 H ATOM 432 N SER C 28 153.960 18.884 3.484 1.00 0.54 N ATOM 433 CA SER C 28 153.356 19.992 4.278 1.00 0.52 C ATOM 434 C SER C 28 152.226 19.458 5.162 1.00 0.50 C ATOM 435 O SER C 28 151.160 19.120 4.687 1.00 0.51 O ATOM 436 CB SER C 28 152.808 20.969 3.239 1.00 0.55 C ATOM 437 OG SER C 28 153.824 21.899 2.888 1.00 1.37 O ATOM 438 H SER C 28 153.435 18.080 3.286 1.00 0.61 H ATOM 439 HA SER C 28 154.108 20.478 4.879 1.00 0.57 H ATOM 440 HB2 SER C 28 152.503 20.427 2.359 1.00 0.85 H ATOM 441 HB3 SER C 28 151.954 21.490 3.652 1.00 0.88 H ATOM 442 HG SER C 28 153.415 22.762 2.792 1.00 1.68 H ATOM 443 N CYS C 29 152.449 19.380 6.446 1.00 0.54 N ATOM 444 CA CYS C 29 151.386 18.869 7.358 1.00 0.56 C ATOM 445 C CYS C 29 150.045 19.530 7.027 1.00 0.50 C ATOM 446 O CYS C 29 149.009 18.894 7.039 1.00 0.60 O ATOM 447 CB CYS C 29 151.846 19.261 8.763 1.00 0.66 C ATOM 448 SG CYS C 29 152.329 21.005 8.775 1.00 1.77 S ATOM 449 H CYS C 29 153.316 19.659 6.810 1.00 0.59 H ATOM 450 HA CYS C 29 151.307 17.796 7.282 1.00 0.61 H ATOM 451 HB2 CYS C 29 151.037 19.106 9.462 1.00 1.32 H ATOM 452 HB3 CYS C 29 152.690 18.651 9.048 1.00 1.06 H ATOM 453 HG CYS C 29 153.287 21.047 8.813 1.00 2.22 H ATOM 454 N GLN C 30 150.056 20.801 6.731 1.00 0.46 N ATOM 455 CA GLN C 30 148.781 21.500 6.399 1.00 0.49 C ATOM 456 C GLN C 30 148.183 20.922 5.113 1.00 0.51 C ATOM 457 O GLN C 30 147.014 20.594 5.053 1.00 0.54 O ATOM 458 CB GLN C 30 149.172 22.965 6.198 1.00 0.51 C ATOM 459 CG GLN C 30 148.694 23.790 7.395 1.00 1.10 C ATOM 460 CD GLN C 30 148.935 25.276 7.121 1.00 1.69 C ATOM 461 OE1 GLN C 30 148.018 26.071 7.175 1.00 2.32 O ATOM 462 NE2 GLN C 30 150.138 25.686 6.826 1.00 2.34 N ATOM 463 H GLN C 30 150.901 21.296 6.726 1.00 0.53 H ATOM 464 HA GLN C 30 148.079 21.413 7.214 1.00 0.52 H ATOM 465 HB2 GLN C 30 150.246 23.041 6.112 1.00 1.08 H ATOM 466 HB3 GLN C 30 148.710 23.341 5.298 1.00 1.05 H ATOM 467 HG2 GLN C 30 147.639 23.618 7.553 1.00 1.77 H ATOM 468 HG3 GLN C 30 149.243 23.496 8.277 1.00 1.62 H ATOM 469 HE21 GLN C 30 150.877 25.045 6.782 1.00 2.60 H ATOM 470 HE22 GLN C 30 150.302 26.636 6.649 1.00 2.92 H ATOM 471 N GLU C 31 148.975 20.794 4.084 1.00 0.53 N ATOM 472 CA GLU C 31 148.452 20.236 2.804 1.00 0.58 C ATOM 473 C GLU C 31 147.661 18.952 3.071 1.00 0.53 C ATOM 474 O GLU C 31 146.578 18.760 2.554 1.00 0.58 O ATOM 475 CB GLU C 31 149.695 19.935 1.966 1.00 0.68 C ATOM 476 CG GLU C 31 149.286 19.693 0.511 1.00 0.86 C ATOM 477 CD GLU C 31 149.712 20.888 -0.344 1.00 1.34 C ATOM 478 OE1 GLU C 31 149.278 21.989 -0.047 1.00 2.13 O ATOM 479 OE2 GLU C 31 150.465 20.681 -1.282 1.00 1.79 O ATOM 480 H GLU C 31 149.915 21.063 4.153 1.00 0.52 H ATOM 481 HA GLU C 31 147.835 20.962 2.300 1.00 0.63 H ATOM 482 HB2 GLU C 31 150.374 20.774 2.016 1.00 0.82 H ATOM 483 HB3 GLU C 31 150.184 19.052 2.351 1.00 0.69 H ATOM 484 HG2 GLU C 31 149.768 18.798 0.146 1.00 1.22 H ATOM 485 HG3 GLU C 31 148.215 19.576 0.453 1.00 1.21 H ATOM 486 N LEU C 32 148.192 18.074 3.877 1.00 0.51 N ATOM 487 CA LEU C 32 147.470 16.804 4.178 1.00 0.47 C ATOM 488 C LEU C 32 146.135 17.107 4.865 1.00 0.40 C ATOM 489 O LEU C 32 145.112 16.543 4.532 1.00 0.44 O ATOM 490 CB LEU C 32 148.396 16.034 5.120 1.00 0.51 C ATOM 491 CG LEU C 32 149.743 15.799 4.433 1.00 0.83 C ATOM 492 CD1 LEU C 32 150.854 15.776 5.484 1.00 1.22 C ATOM 493 CD2 LEU C 32 149.711 14.458 3.697 1.00 1.16 C ATOM 494 H LEU C 32 149.067 18.248 4.285 1.00 0.57 H ATOM 495 HA LEU C 32 147.309 16.238 3.274 1.00 0.51 H ATOM 496 HB2 LEU C 32 148.547 16.607 6.023 1.00 0.71 H ATOM 497 HB3 LEU C 32 147.949 15.083 5.366 1.00 0.96 H ATOM 498 HG LEU C 32 149.931 16.596 3.728 1.00 1.31 H ATOM 499 HD11 LEU C 32 150.437 16.001 6.454 1.00 1.61 H ATOM 500 HD12 LEU C 32 151.601 16.515 5.234 1.00 1.56 H ATOM 501 HD13 LEU C 32 151.310 14.797 5.505 1.00 1.77 H ATOM 502 HD21 LEU C 32 148.964 13.819 4.144 1.00 1.53 H ATOM 503 HD22 LEU C 32 150.679 13.985 3.769 1.00 1.40 H ATOM 504 HD23 LEU C 32 149.468 14.624 2.657 1.00 1.83 H ATOM 505 N LEU C 33 146.139 17.994 5.823 1.00 0.37 N ATOM 506 CA LEU C 33 144.871 18.331 6.532 1.00 0.37 C ATOM 507 C LEU C 33 143.782 18.704 5.521 1.00 0.40 C ATOM 508 O LEU C 33 142.635 18.327 5.663 1.00 0.42 O ATOM 509 CB LEU C 33 145.217 19.532 7.413 1.00 0.43 C ATOM 510 CG LEU C 33 145.284 19.091 8.876 1.00 0.46 C ATOM 511 CD1 LEU C 33 145.464 20.317 9.772 1.00 0.60 C ATOM 512 CD2 LEU C 33 143.985 18.374 9.251 1.00 0.79 C ATOM 513 H LEU C 33 146.975 18.437 6.077 1.00 0.40 H ATOM 514 HA LEU C 33 144.550 17.505 7.145 1.00 0.36 H ATOM 515 HB2 LEU C 33 146.174 19.935 7.113 1.00 0.53 H ATOM 516 HB3 LEU C 33 144.457 20.291 7.302 1.00 0.70 H ATOM 517 HG LEU C 33 146.120 18.421 9.011 1.00 0.51 H ATOM 518 HD11 LEU C 33 145.753 21.165 9.168 1.00 1.25 H ATOM 519 HD12 LEU C 33 146.232 20.118 10.504 1.00 1.23 H ATOM 520 HD13 LEU C 33 144.534 20.535 10.276 1.00 1.06 H ATOM 521 HD21 LEU C 33 143.351 18.298 8.380 1.00 1.40 H ATOM 522 HD22 LEU C 33 143.474 18.933 10.021 1.00 1.16 H ATOM 523 HD23 LEU C 33 144.213 17.384 9.617 1.00 1.33 H ATOM 524 N ARG C 34 144.130 19.442 4.503 1.00 0.46 N ATOM 525 CA ARG C 34 143.114 19.839 3.487 1.00 0.53 C ATOM 526 C ARG C 34 142.618 18.607 2.724 1.00 0.52 C ATOM 527 O ARG C 34 141.462 18.241 2.802 1.00 0.53 O ATOM 528 CB ARG C 34 143.848 20.793 2.544 1.00 0.62 C ATOM 529 CG ARG C 34 143.287 22.207 2.707 1.00 0.91 C ATOM 530 CD ARG C 34 142.662 22.665 1.387 1.00 1.64 C ATOM 531 NE ARG C 34 141.722 23.756 1.766 1.00 1.93 N ATOM 532 CZ ARG C 34 141.177 24.499 0.841 1.00 2.25 C ATOM 533 NH1 ARG C 34 141.901 24.942 -0.150 1.00 2.82 N ATOM 534 NH2 ARG C 34 139.909 24.800 0.908 1.00 2.69 N ATOM 535 H ARG C 34 145.060 19.737 4.408 1.00 0.51 H ATOM 536 HA ARG C 34 142.289 20.349 3.957 1.00 0.55 H ATOM 537 HB2 ARG C 34 144.902 20.793 2.782 1.00 0.89 H ATOM 538 HB3 ARG C 34 143.710 20.469 1.524 1.00 0.92 H ATOM 539 HG2 ARG C 34 142.534 22.208 3.483 1.00 1.30 H ATOM 540 HG3 ARG C 34 144.085 22.882 2.979 1.00 1.51 H ATOM 541 HD2 ARG C 34 143.428 23.039 0.721 1.00 2.31 H ATOM 542 HD3 ARG C 34 142.122 21.855 0.925 1.00 2.16 H ATOM 543 HE ARG C 34 141.511 23.916 2.710 1.00 2.41 H ATOM 544 HH11 ARG C 34 142.873 24.711 -0.202 1.00 3.16 H ATOM 545 HH12 ARG C 34 141.484 25.511 -0.859 1.00 3.24 H ATOM 546 HH21 ARG C 34 139.354 24.462 1.668 1.00 2.92 H ATOM 547 HH22 ARG C 34 139.493 25.370 0.200 1.00 3.18 H ATOM 548 N LYS C 35 143.484 17.967 1.987 1.00 0.54 N ATOM 549 CA LYS C 35 143.062 16.760 1.218 1.00 0.57 C ATOM 550 C LYS C 35 142.155 15.874 2.076 1.00 0.50 C ATOM 551 O LYS C 35 141.143 15.379 1.620 1.00 0.61 O ATOM 552 CB LYS C 35 144.364 16.029 0.885 1.00 0.61 C ATOM 553 CG LYS C 35 144.615 16.095 -0.623 1.00 0.88 C ATOM 554 CD LYS C 35 146.118 16.003 -0.893 1.00 1.11 C ATOM 555 CE LYS C 35 146.570 17.230 -1.689 1.00 1.69 C ATOM 556 NZ LYS C 35 147.603 16.716 -2.632 1.00 2.32 N ATOM 557 H LYS C 35 144.411 18.280 1.937 1.00 0.58 H ATOM 558 HA LYS C 35 142.559 17.048 0.309 1.00 0.63 H ATOM 559 HB2 LYS C 35 145.184 16.499 1.409 1.00 0.80 H ATOM 560 HB3 LYS C 35 144.285 14.997 1.190 1.00 0.84 H ATOM 561 HG2 LYS C 35 144.110 15.273 -1.108 1.00 1.37 H ATOM 562 HG3 LYS C 35 144.239 17.030 -1.010 1.00 1.46 H ATOM 563 HD2 LYS C 35 146.651 15.966 0.046 1.00 1.70 H ATOM 564 HD3 LYS C 35 146.328 15.110 -1.463 1.00 1.49 H ATOM 565 HE2 LYS C 35 145.736 17.651 -2.233 1.00 1.98 H ATOM 566 HE3 LYS C 35 147.004 17.967 -1.031 1.00 2.33 H ATOM 567 HZ1 LYS C 35 148.483 16.526 -2.113 1.00 2.68 H ATOM 568 HZ2 LYS C 35 147.782 17.428 -3.370 1.00 2.79 H ATOM 569 HZ3 LYS C 35 147.265 15.837 -3.072 1.00 2.72 H ATOM 570 N GLY C 36 142.509 15.670 3.315 1.00 0.40 N ATOM 571 CA GLY C 36 141.667 14.816 4.200 1.00 0.38 C ATOM 572 C GLY C 36 140.286 15.453 4.364 1.00 0.38 C ATOM 573 O GLY C 36 139.271 14.797 4.241 1.00 0.47 O ATOM 574 H GLY C 36 143.329 16.078 3.664 1.00 0.40 H ATOM 575 HA2 GLY C 36 141.563 13.835 3.758 1.00 0.44 H ATOM 576 HA3 GLY C 36 142.136 14.727 5.168 1.00 0.37 H ATOM 577 N CYS C 37 140.239 16.727 4.642 1.00 0.44 N ATOM 578 CA CYS C 37 138.921 17.405 4.814 1.00 0.49 C ATOM 579 C CYS C 37 138.165 17.440 3.483 1.00 0.53 C ATOM 580 O CYS C 37 136.963 17.612 3.446 1.00 0.57 O ATOM 581 CB CYS C 37 139.262 18.823 5.275 1.00 0.57 C ATOM 582 SG CYS C 37 137.784 19.863 5.176 1.00 1.71 S ATOM 583 H CYS C 37 141.069 17.239 4.738 1.00 0.52 H ATOM 584 HA CYS C 37 138.335 16.904 5.568 1.00 0.49 H ATOM 585 HB2 CYS C 37 139.615 18.795 6.295 1.00 0.85 H ATOM 586 HB3 CYS C 37 140.033 19.232 4.639 1.00 1.20 H ATOM 587 HG CYS C 37 138.064 20.760 4.982 1.00 2.15 H ATOM 588 N VAL C 38 138.859 17.278 2.391 1.00 0.57 N ATOM 589 CA VAL C 38 138.178 17.303 1.064 1.00 0.65 C ATOM 590 C VAL C 38 137.594 15.925 0.742 1.00 0.64 C ATOM 591 O VAL C 38 136.561 15.810 0.114 1.00 0.72 O ATOM 592 CB VAL C 38 139.273 17.669 0.064 1.00 0.72 C ATOM 593 CG1 VAL C 38 138.724 17.557 -1.359 1.00 0.88 C ATOM 594 CG2 VAL C 38 139.737 19.104 0.320 1.00 0.74 C ATOM 595 H VAL C 38 139.828 17.141 2.441 1.00 0.58 H ATOM 596 HA VAL C 38 137.405 18.053 1.052 1.00 0.69 H ATOM 597 HB VAL C 38 140.106 16.992 0.182 1.00 0.72 H ATOM 598 HG11 VAL C 38 138.337 16.562 -1.519 1.00 1.05 H ATOM 599 HG12 VAL C 38 139.515 17.754 -2.067 1.00 1.40 H ATOM 600 HG13 VAL C 38 137.931 18.278 -1.496 1.00 1.55 H ATOM 601 HG21 VAL C 38 140.708 19.254 -0.130 1.00 1.37 H ATOM 602 HG22 VAL C 38 139.803 19.277 1.384 1.00 1.18 H ATOM 603 HG23 VAL C 38 139.029 19.795 -0.114 1.00 1.21 H ATOM 604 N ARG C 39 138.248 14.879 1.168 1.00 0.59 N ATOM 605 CA ARG C 39 137.729 13.510 0.885 1.00 0.61 C ATOM 606 C ARG C 39 136.795 13.055 2.009 1.00 0.60 C ATOM 607 O ARG C 39 135.955 12.197 1.823 1.00 0.79 O ATOM 608 CB ARG C 39 138.971 12.620 0.828 1.00 0.67 C ATOM 609 CG ARG C 39 139.669 12.804 -0.521 1.00 0.99 C ATOM 610 CD ARG C 39 139.423 11.573 -1.395 1.00 1.39 C ATOM 611 NE ARG C 39 140.056 11.899 -2.703 1.00 1.77 N ATOM 612 CZ ARG C 39 139.334 12.390 -3.673 1.00 2.48 C ATOM 613 NH1 ARG C 39 138.491 11.626 -4.311 1.00 3.14 N ATOM 614 NH2 ARG C 39 139.455 13.647 -4.003 1.00 3.05 N ATOM 615 H ARG C 39 139.080 14.993 1.673 1.00 0.57 H ATOM 616 HA ARG C 39 137.217 13.489 -0.064 1.00 0.64 H ATOM 617 HB2 ARG C 39 139.647 12.894 1.625 1.00 0.89 H ATOM 618 HB3 ARG C 39 138.680 11.587 0.942 1.00 0.84 H ATOM 619 HG2 ARG C 39 139.275 13.681 -1.013 1.00 1.48 H ATOM 620 HG3 ARG C 39 140.730 12.925 -0.363 1.00 1.72 H ATOM 621 HD2 ARG C 39 139.889 10.702 -0.956 1.00 1.99 H ATOM 622 HD3 ARG C 39 138.365 11.409 -1.527 1.00 1.90 H ATOM 623 HE ARG C 39 141.014 11.744 -2.836 1.00 2.06 H ATOM 624 HH11 ARG C 39 138.399 10.663 -4.058 1.00 3.23 H ATOM 625 HH12 ARG C 39 137.938 12.003 -5.054 1.00 3.81 H ATOM 626 HH21 ARG C 39 140.101 14.233 -3.514 1.00 3.05 H ATOM 627 HH22 ARG C 39 138.902 14.024 -4.746 1.00 3.79 H ATOM 628 N PHE C 40 136.935 13.623 3.176 1.00 0.49 N ATOM 629 CA PHE C 40 136.055 13.221 4.311 1.00 0.51 C ATOM 630 C PHE C 40 135.122 14.374 4.692 1.00 0.52 C ATOM 631 O PHE C 40 134.304 14.254 5.582 1.00 0.59 O ATOM 632 CB PHE C 40 137.012 12.903 5.460 1.00 0.57 C ATOM 633 CG PHE C 40 137.323 11.426 5.463 1.00 0.52 C ATOM 634 CD1 PHE C 40 136.289 10.492 5.323 1.00 1.24 C ATOM 635 CD2 PHE C 40 138.646 10.989 5.606 1.00 1.34 C ATOM 636 CE1 PHE C 40 136.577 9.122 5.326 1.00 1.30 C ATOM 637 CE2 PHE C 40 138.934 9.619 5.609 1.00 1.35 C ATOM 638 CZ PHE C 40 137.900 8.686 5.469 1.00 0.68 C ATOM 639 H PHE C 40 137.619 14.312 3.306 1.00 0.49 H ATOM 640 HA PHE C 40 135.484 12.343 4.053 1.00 0.54 H ATOM 641 HB2 PHE C 40 137.927 13.464 5.331 1.00 0.66 H ATOM 642 HB3 PHE C 40 136.552 13.175 6.398 1.00 0.64 H ATOM 643 HD1 PHE C 40 135.269 10.829 5.212 1.00 2.09 H ATOM 644 HD2 PHE C 40 139.443 11.709 5.714 1.00 2.20 H ATOM 645 HE1 PHE C 40 135.780 8.402 5.218 1.00 2.17 H ATOM 646 HE2 PHE C 40 139.954 9.282 5.720 1.00 2.20 H ATOM 647 HZ PHE C 40 138.122 7.629 5.472 1.00 0.79 H ATOM 648 N GLN C 41 135.239 15.490 4.026 1.00 0.50 N ATOM 649 CA GLN C 41 134.359 16.649 4.352 1.00 0.56 C ATOM 650 C GLN C 41 134.480 17.000 5.837 1.00 0.61 C ATOM 651 O GLN C 41 133.530 16.903 6.588 1.00 0.89 O ATOM 652 CB GLN C 41 132.943 16.174 4.026 1.00 0.62 C ATOM 653 CG GLN C 41 132.707 16.271 2.517 1.00 0.91 C ATOM 654 CD GLN C 41 131.209 16.413 2.242 1.00 1.59 C ATOM 655 OE1 GLN C 41 130.392 15.900 2.981 1.00 2.14 O ATOM 656 NE2 GLN C 41 130.811 17.093 1.202 1.00 2.15 N ATOM 657 H GLN C 41 135.906 15.567 3.312 1.00 0.48 H ATOM 658 HA GLN C 41 134.613 17.500 3.741 1.00 0.56 H ATOM 659 HB2 GLN C 41 132.825 15.148 4.345 1.00 0.64 H ATOM 660 HB3 GLN C 41 132.227 16.796 4.541 1.00 0.89 H ATOM 661 HG2 GLN C 41 133.229 17.133 2.127 1.00 0.94 H ATOM 662 HG3 GLN C 41 133.076 15.378 2.037 1.00 1.18 H ATOM 663 HE21 GLN C 41 131.470 17.507 0.606 1.00 2.40 H ATOM 664 HE22 GLN C 41 129.853 17.190 1.016 1.00 2.63 H ATOM 665 N LEU C 42 135.643 17.407 6.266 1.00 0.62 N ATOM 666 CA LEU C 42 135.827 17.763 7.702 1.00 0.69 C ATOM 667 C LEU C 42 136.751 18.983 7.831 1.00 0.69 C ATOM 668 O LEU C 42 137.956 18.851 7.751 1.00 0.72 O ATOM 669 CB LEU C 42 136.478 16.532 8.333 1.00 0.73 C ATOM 670 CG LEU C 42 135.764 16.191 9.641 1.00 0.85 C ATOM 671 CD1 LEU C 42 135.279 14.741 9.594 1.00 0.75 C ATOM 672 CD2 LEU C 42 136.734 16.365 10.811 1.00 1.23 C ATOM 673 H LEU C 42 136.397 17.477 5.644 1.00 0.78 H ATOM 674 HA LEU C 42 134.875 17.954 8.169 1.00 0.74 H ATOM 675 HB2 LEU C 42 136.402 15.697 7.651 1.00 0.67 H ATOM 676 HB3 LEU C 42 137.518 16.738 8.536 1.00 0.81 H ATOM 677 HG LEU C 42 134.917 16.849 9.771 1.00 0.95 H ATOM 678 HD11 LEU C 42 135.957 14.155 8.992 1.00 1.12 H ATOM 679 HD12 LEU C 42 134.290 14.706 9.161 1.00 1.38 H ATOM 680 HD13 LEU C 42 135.247 14.340 10.596 1.00 1.27 H ATOM 681 HD21 LEU C 42 136.199 16.741 11.670 1.00 1.58 H ATOM 682 HD22 LEU C 42 137.509 17.065 10.535 1.00 1.62 H ATOM 683 HD23 LEU C 42 137.180 15.412 11.054 1.00 1.80 H ATOM 684 N PRO C 43 136.159 20.137 8.026 1.00 0.69 N ATOM 685 CA PRO C 43 136.948 21.383 8.165 1.00 0.73 C ATOM 686 C PRO C 43 137.902 21.284 9.359 1.00 0.68 C ATOM 687 O PRO C 43 137.708 20.491 10.258 1.00 0.83 O ATOM 688 CB PRO C 43 135.868 22.442 8.405 1.00 0.77 C ATOM 689 CG PRO C 43 134.489 21.756 8.393 1.00 0.77 C ATOM 690 CD PRO C 43 134.685 20.258 8.120 1.00 0.71 C ATOM 691 HA PRO C 43 137.487 21.601 7.257 1.00 0.78 H ATOM 692 HB2 PRO C 43 136.032 22.915 9.363 1.00 0.76 H ATOM 693 HB3 PRO C 43 135.907 23.184 7.622 1.00 0.85 H ATOM 694 HG2 PRO C 43 134.009 21.891 9.352 1.00 0.77 H ATOM 695 HG3 PRO C 43 133.876 22.186 7.616 1.00 0.85 H ATOM 696 HD2 PRO C 43 134.298 19.667 8.940 1.00 0.67 H ATOM 697 HD3 PRO C 43 134.225 19.974 7.187 1.00 0.76 H ATOM 698 N MET C 44 138.934 22.082 9.373 1.00 0.63 N ATOM 699 CA MET C 44 139.899 22.032 10.507 1.00 0.61 C ATOM 700 C MET C 44 139.291 22.664 11.768 1.00 0.59 C ATOM 701 O MET C 44 139.317 22.065 12.825 1.00 0.59 O ATOM 702 CB MET C 44 141.114 22.829 10.034 1.00 0.66 C ATOM 703 CG MET C 44 142.347 21.924 10.022 1.00 0.68 C ATOM 704 SD MET C 44 143.772 22.855 9.407 1.00 1.58 S ATOM 705 CE MET C 44 143.288 22.886 7.663 1.00 2.11 C ATOM 706 H MET C 44 139.075 22.714 8.637 1.00 0.72 H ATOM 707 HA MET C 44 140.188 21.011 10.705 1.00 0.61 H ATOM 708 HB2 MET C 44 140.932 23.204 9.036 1.00 0.68 H ATOM 709 HB3 MET C 44 141.285 23.658 10.704 1.00 0.70 H ATOM 710 HG2 MET C 44 142.549 21.578 11.025 1.00 0.93 H ATOM 711 HG3 MET C 44 142.166 21.076 9.378 1.00 0.78 H ATOM 712 HE1 MET C 44 143.032 21.885 7.344 1.00 2.58 H ATOM 713 HE2 MET C 44 144.109 23.252 7.067 1.00 2.53 H ATOM 714 HE3 MET C 44 142.436 23.539 7.539 1.00 2.55 H ATOM 715 N PRO C 45 138.765 23.859 11.628 1.00 0.62 N ATOM 716 CA PRO C 45 138.158 24.560 12.786 1.00 0.65 C ATOM 717 C PRO C 45 136.937 23.794 13.306 1.00 0.64 C ATOM 718 O PRO C 45 136.902 23.362 14.442 1.00 0.69 O ATOM 719 CB PRO C 45 137.748 25.909 12.188 1.00 0.70 C ATOM 720 CG PRO C 45 138.138 25.930 10.697 1.00 0.70 C ATOM 721 CD PRO C 45 138.746 24.571 10.326 1.00 0.65 C ATOM 722 HA PRO C 45 138.884 24.708 13.569 1.00 0.67 H ATOM 723 HB2 PRO C 45 136.679 26.038 12.287 1.00 0.72 H ATOM 724 HB3 PRO C 45 138.260 26.706 12.704 1.00 0.73 H ATOM 725 HG2 PRO C 45 137.258 26.111 10.096 1.00 0.72 H ATOM 726 HG3 PRO C 45 138.864 26.709 10.523 1.00 0.73 H ATOM 727 HD2 PRO C 45 138.117 24.061 9.611 1.00 0.65 H ATOM 728 HD3 PRO C 45 139.747 24.692 9.947 1.00 0.67 H ATOM 729 N GLY C 46 135.934 23.628 12.488 1.00 0.66 N ATOM 730 CA GLY C 46 134.716 22.896 12.941 1.00 0.69 C ATOM 731 C GLY C 46 134.897 21.395 12.709 1.00 0.64 C ATOM 732 O GLY C 46 133.979 20.704 12.313 1.00 0.72 O ATOM 733 H GLY C 46 135.979 23.987 11.578 1.00 0.71 H ATOM 734 HA2 GLY C 46 134.557 23.082 13.993 1.00 0.72 H ATOM 735 HA3 GLY C 46 133.860 23.242 12.381 1.00 0.74 H ATOM 736 N SER C 47 136.072 20.883 12.955 1.00 0.58 N ATOM 737 CA SER C 47 136.309 19.423 12.750 1.00 0.54 C ATOM 738 C SER C 47 137.803 19.110 12.872 1.00 0.48 C ATOM 739 O SER C 47 138.635 19.765 12.276 1.00 0.51 O ATOM 740 CB SER C 47 135.813 19.132 11.334 1.00 0.58 C ATOM 741 OG SER C 47 134.724 18.221 11.396 1.00 1.25 O ATOM 742 H SER C 47 136.799 21.456 13.275 1.00 0.62 H ATOM 743 HA SER C 47 135.744 18.846 13.465 1.00 0.57 H ATOM 744 HB2 SER C 47 135.484 20.046 10.870 1.00 1.11 H ATOM 745 HB3 SER C 47 136.620 18.705 10.752 1.00 0.82 H ATOM 746 HG SER C 47 133.910 18.730 11.392 1.00 1.70 H ATOM 747 N ARG C 48 138.149 18.114 13.640 1.00 0.45 N ATOM 748 CA ARG C 48 139.588 17.761 13.800 1.00 0.46 C ATOM 749 C ARG C 48 139.777 16.246 13.687 1.00 0.39 C ATOM 750 O ARG C 48 138.915 15.537 13.208 1.00 0.40 O ATOM 751 CB ARG C 48 139.962 18.246 15.201 1.00 0.56 C ATOM 752 CG ARG C 48 140.608 19.630 15.107 1.00 0.72 C ATOM 753 CD ARG C 48 140.531 20.324 16.469 1.00 0.86 C ATOM 754 NE ARG C 48 139.684 21.527 16.240 1.00 1.56 N ATOM 755 CZ ARG C 48 139.398 22.323 17.234 1.00 1.89 C ATOM 756 NH1 ARG C 48 138.609 21.915 18.190 1.00 2.49 N ATOM 757 NH2 ARG C 48 139.899 23.527 17.271 1.00 2.24 N ATOM 758 H ARG C 48 137.462 17.599 14.113 1.00 0.45 H ATOM 759 HA ARG C 48 140.186 18.272 13.062 1.00 0.50 H ATOM 760 HB2 ARG C 48 139.072 18.303 15.811 1.00 0.61 H ATOM 761 HB3 ARG C 48 140.661 17.555 15.648 1.00 0.62 H ATOM 762 HG2 ARG C 48 141.642 19.525 14.813 1.00 0.89 H ATOM 763 HG3 ARG C 48 140.083 20.223 14.373 1.00 0.77 H ATOM 764 HD2 ARG C 48 140.071 19.670 17.197 1.00 1.27 H ATOM 765 HD3 ARG C 48 141.515 20.622 16.796 1.00 1.18 H ATOM 766 HE ARG C 48 139.341 21.722 15.342 1.00 2.11 H ATOM 767 HH11 ARG C 48 138.224 20.993 18.162 1.00 2.92 H ATOM 768 HH12 ARG C 48 138.390 22.525 18.952 1.00 2.81 H ATOM 769 HH21 ARG C 48 140.503 23.841 16.538 1.00 2.53 H ATOM 770 HH22 ARG C 48 139.680 24.137 18.033 1.00 2.58 H ATOM 771 N LEU C 49 140.900 15.744 14.124 1.00 0.39 N ATOM 772 CA LEU C 49 141.142 14.275 14.040 1.00 0.38 C ATOM 773 C LEU C 49 141.680 13.750 15.374 1.00 0.43 C ATOM 774 O LEU C 49 141.943 14.504 16.289 1.00 0.64 O ATOM 775 CB LEU C 49 142.188 14.109 12.938 1.00 0.37 C ATOM 776 CG LEU C 49 141.624 14.633 11.616 1.00 0.36 C ATOM 777 CD1 LEU C 49 142.344 15.926 11.230 1.00 0.44 C ATOM 778 CD2 LEU C 49 141.838 13.585 10.521 1.00 0.34 C ATOM 779 H LEU C 49 141.584 16.333 14.507 1.00 0.43 H ATOM 780 HA LEU C 49 140.235 13.759 13.769 1.00 0.40 H ATOM 781 HB2 LEU C 49 143.076 14.667 13.198 1.00 0.40 H ATOM 782 HB3 LEU C 49 142.437 13.064 12.832 1.00 0.43 H ATOM 783 HG LEU C 49 140.568 14.829 11.728 1.00 0.44 H ATOM 784 HD11 LEU C 49 142.903 15.769 10.319 1.00 1.11 H ATOM 785 HD12 LEU C 49 143.020 16.213 12.022 1.00 1.19 H ATOM 786 HD13 LEU C 49 141.618 16.710 11.075 1.00 1.02 H ATOM 787 HD21 LEU C 49 142.881 13.305 10.490 1.00 1.11 H ATOM 788 HD22 LEU C 49 141.548 13.998 9.566 1.00 1.05 H ATOM 789 HD23 LEU C 49 141.238 12.714 10.735 1.00 1.01 H ATOM 790 N CYS C 50 141.845 12.461 15.490 1.00 0.36 N ATOM 791 CA CYS C 50 142.366 11.886 16.763 1.00 0.41 C ATOM 792 C CYS C 50 143.178 10.620 16.477 1.00 0.38 C ATOM 793 O CYS C 50 142.705 9.696 15.845 1.00 0.39 O ATOM 794 CB CYS C 50 141.122 11.552 17.587 1.00 0.48 C ATOM 795 SG CYS C 50 139.940 10.645 16.558 1.00 1.45 S ATOM 796 H CYS C 50 141.627 11.870 14.739 1.00 0.41 H ATOM 797 HA CYS C 50 142.970 12.612 17.284 1.00 0.46 H ATOM 798 HB2 CYS C 50 141.403 10.944 18.433 1.00 1.23 H ATOM 799 HB3 CYS C 50 140.666 12.467 17.937 1.00 1.26 H ATOM 800 HG CYS C 50 139.287 10.247 17.138 1.00 1.93 H ATOM 801 N LEU C 51 144.398 10.571 16.937 1.00 0.45 N ATOM 802 CA LEU C 51 145.242 9.366 16.691 1.00 0.47 C ATOM 803 C LEU C 51 144.448 8.092 16.992 1.00 0.47 C ATOM 804 O LEU C 51 143.823 7.969 18.027 1.00 0.52 O ATOM 805 CB LEU C 51 146.419 9.504 17.658 1.00 0.58 C ATOM 806 CG LEU C 51 147.559 10.256 16.971 1.00 0.62 C ATOM 807 CD1 LEU C 51 148.468 10.883 18.029 1.00 0.78 C ATOM 808 CD2 LEU C 51 148.371 9.279 16.118 1.00 0.70 C ATOM 809 H LEU C 51 144.761 11.328 17.443 1.00 0.53 H ATOM 810 HA LEU C 51 145.599 9.357 15.674 1.00 0.46 H ATOM 811 HB2 LEU C 51 146.102 10.051 18.534 1.00 0.60 H ATOM 812 HB3 LEU C 51 146.762 8.523 17.950 1.00 0.65 H ATOM 813 HG LEU C 51 147.150 11.033 16.341 1.00 0.60 H ATOM 814 HD11 LEU C 51 148.369 10.339 18.957 1.00 1.37 H ATOM 815 HD12 LEU C 51 148.183 11.913 18.184 1.00 1.15 H ATOM 816 HD13 LEU C 51 149.494 10.840 17.694 1.00 1.28 H ATOM 817 HD21 LEU C 51 148.883 9.822 15.337 1.00 1.22 H ATOM 818 HD22 LEU C 51 147.708 8.551 15.674 1.00 1.27 H ATOM 819 HD23 LEU C 51 149.095 8.774 16.740 1.00 1.13 H ATOM 820 N TYR C 52 144.469 7.144 16.096 1.00 0.46 N ATOM 821 CA TYR C 52 143.718 5.878 16.332 1.00 0.49 C ATOM 822 C TYR C 52 144.509 4.963 17.270 1.00 0.57 C ATOM 823 O TYR C 52 144.128 3.836 17.522 1.00 0.69 O ATOM 824 CB TYR C 52 143.579 5.238 14.950 1.00 0.51 C ATOM 825 CG TYR C 52 142.782 3.961 15.062 1.00 0.57 C ATOM 826 CD1 TYR C 52 141.389 4.014 15.199 1.00 1.37 C ATOM 827 CD2 TYR C 52 143.435 2.723 15.028 1.00 1.24 C ATOM 828 CE1 TYR C 52 140.650 2.830 15.302 1.00 1.46 C ATOM 829 CE2 TYR C 52 142.695 1.539 15.131 1.00 1.28 C ATOM 830 CZ TYR C 52 141.303 1.592 15.268 1.00 0.82 C ATOM 831 OH TYR C 52 140.574 0.424 15.369 1.00 0.98 O ATOM 832 H TYR C 52 144.981 7.264 15.269 1.00 0.48 H ATOM 833 HA TYR C 52 142.742 6.088 16.741 1.00 0.50 H ATOM 834 HB2 TYR C 52 143.071 5.923 14.286 1.00 0.54 H ATOM 835 HB3 TYR C 52 144.559 5.016 14.557 1.00 0.58 H ATOM 836 HD1 TYR C 52 140.886 4.969 15.226 1.00 2.18 H ATOM 837 HD2 TYR C 52 144.509 2.682 14.923 1.00 2.06 H ATOM 838 HE1 TYR C 52 139.576 2.871 15.408 1.00 2.30 H ATOM 839 HE2 TYR C 52 143.199 0.584 15.105 1.00 2.09 H ATOM 840 HH TYR C 52 140.166 0.404 16.237 1.00 1.24 H ATOM 841 N GLU C 53 145.609 5.437 17.787 1.00 0.58 N ATOM 842 CA GLU C 53 146.425 4.595 18.707 1.00 0.70 C ATOM 843 C GLU C 53 145.960 4.783 20.154 1.00 0.76 C ATOM 844 O GLU C 53 145.774 3.831 20.885 1.00 0.91 O ATOM 845 CB GLU C 53 147.859 5.098 18.536 1.00 0.82 C ATOM 846 CG GLU C 53 148.797 4.283 19.429 1.00 1.20 C ATOM 847 CD GLU C 53 149.486 3.203 18.593 1.00 1.68 C ATOM 848 OE1 GLU C 53 148.949 2.852 17.556 1.00 2.24 O ATOM 849 OE2 GLU C 53 150.539 2.745 19.006 1.00 2.34 O ATOM 850 H GLU C 53 145.899 6.348 17.571 1.00 0.55 H ATOM 851 HA GLU C 53 146.363 3.556 18.423 1.00 0.72 H ATOM 852 HB2 GLU C 53 148.158 4.989 17.504 1.00 1.30 H ATOM 853 HB3 GLU C 53 147.911 6.139 18.819 1.00 1.12 H ATOM 854 HG2 GLU C 53 149.541 4.937 19.860 1.00 1.71 H ATOM 855 HG3 GLU C 53 148.227 3.816 20.218 1.00 1.89 H ATOM 856 N ASP C 54 145.770 6.005 20.572 1.00 0.73 N ATOM 857 CA ASP C 54 145.318 6.252 21.971 1.00 0.87 C ATOM 858 C ASP C 54 144.266 7.364 22.000 1.00 0.82 C ATOM 859 O ASP C 54 143.961 7.915 23.038 1.00 0.92 O ATOM 860 CB ASP C 54 146.577 6.685 22.722 1.00 1.01 C ATOM 861 CG ASP C 54 146.542 6.124 24.145 1.00 1.51 C ATOM 862 OD1 ASP C 54 146.544 4.912 24.283 1.00 2.36 O ATOM 863 OD2 ASP C 54 146.515 6.916 25.072 1.00 1.88 O ATOM 864 H ASP C 54 145.926 6.760 19.966 1.00 0.69 H ATOM 865 HA ASP C 54 144.923 5.347 22.405 1.00 0.96 H ATOM 866 HB2 ASP C 54 147.450 6.309 22.207 1.00 1.41 H ATOM 867 HB3 ASP C 54 146.619 7.763 22.763 1.00 1.36 H ATOM 868 N GLY C 55 143.709 7.696 20.868 1.00 0.74 N ATOM 869 CA GLY C 55 142.678 8.772 20.832 1.00 0.74 C ATOM 870 C GLY C 55 143.325 10.114 21.176 1.00 0.74 C ATOM 871 O GLY C 55 142.871 10.828 22.047 1.00 1.03 O ATOM 872 H GLY C 55 143.969 7.239 20.041 1.00 0.76 H ATOM 873 HA2 GLY C 55 142.245 8.821 19.843 1.00 0.69 H ATOM 874 HA3 GLY C 55 141.905 8.554 21.554 1.00 0.83 H ATOM 875 N THR C 56 144.383 10.465 20.497 1.00 0.71 N ATOM 876 CA THR C 56 145.059 11.763 20.786 1.00 0.74 C ATOM 877 C THR C 56 144.559 12.844 19.823 1.00 0.68 C ATOM 878 O THR C 56 144.748 12.758 18.627 1.00 0.60 O ATOM 879 CB THR C 56 146.549 11.497 20.565 1.00 0.78 C ATOM 880 OG1 THR C 56 146.780 10.096 20.527 1.00 0.83 O ATOM 881 CG2 THR C 56 147.354 12.118 21.707 1.00 0.96 C ATOM 882 H THR C 56 144.734 9.875 19.798 1.00 0.86 H ATOM 883 HA THR C 56 144.885 12.059 21.808 1.00 0.83 H ATOM 884 HB THR C 56 146.858 11.939 19.631 1.00 0.72 H ATOM 885 HG1 THR C 56 147.647 9.928 20.904 1.00 1.13 H ATOM 886 HG21 THR C 56 146.861 13.016 22.049 1.00 1.51 H ATOM 887 HG22 THR C 56 148.346 12.365 21.356 1.00 1.39 H ATOM 888 HG23 THR C 56 147.426 11.413 22.522 1.00 1.34 H ATOM 889 N GLU C 57 143.924 13.860 20.336 1.00 0.78 N ATOM 890 CA GLU C 57 143.414 14.945 19.449 1.00 0.76 C ATOM 891 C GLU C 57 144.547 15.490 18.575 1.00 0.73 C ATOM 892 O GLU C 57 145.605 15.840 19.059 1.00 0.86 O ATOM 893 CB GLU C 57 142.901 16.027 20.400 1.00 0.88 C ATOM 894 CG GLU C 57 141.380 15.919 20.523 1.00 1.46 C ATOM 895 CD GLU C 57 140.845 17.119 21.305 1.00 1.94 C ATOM 896 OE1 GLU C 57 141.118 18.237 20.898 1.00 2.44 O ATOM 897 OE2 GLU C 57 140.171 16.902 22.298 1.00 2.43 O ATOM 898 H GLU C 57 143.783 13.912 21.304 1.00 0.89 H ATOM 899 HA GLU C 57 142.606 14.580 18.835 1.00 0.72 H ATOM 900 HB2 GLU C 57 143.353 15.894 21.372 1.00 1.15 H ATOM 901 HB3 GLU C 57 143.161 17.000 20.011 1.00 1.29 H ATOM 902 HG2 GLU C 57 140.939 15.905 19.537 1.00 1.94 H ATOM 903 HG3 GLU C 57 141.125 15.009 21.045 1.00 1.82 H ATOM 904 N VAL C 58 144.332 15.567 17.290 1.00 0.64 N ATOM 905 CA VAL C 58 145.396 16.090 16.386 1.00 0.64 C ATOM 906 C VAL C 58 144.823 17.171 15.466 1.00 0.58 C ATOM 907 O VAL C 58 143.680 17.110 15.058 1.00 0.56 O ATOM 908 CB VAL C 58 145.854 14.880 15.572 1.00 0.69 C ATOM 909 CG1 VAL C 58 147.001 15.291 14.646 1.00 0.78 C ATOM 910 CG2 VAL C 58 146.335 13.781 16.521 1.00 0.85 C ATOM 911 H VAL C 58 143.471 15.280 16.919 1.00 0.64 H ATOM 912 HA VAL C 58 146.221 16.481 16.961 1.00 0.74 H ATOM 913 HB VAL C 58 145.029 14.512 14.980 1.00 0.68 H ATOM 914 HG11 VAL C 58 146.777 16.248 14.198 1.00 1.09 H ATOM 915 HG12 VAL C 58 147.121 14.549 13.871 1.00 1.31 H ATOM 916 HG13 VAL C 58 147.915 15.366 15.217 1.00 1.37 H ATOM 917 HG21 VAL C 58 147.409 13.685 16.446 1.00 1.44 H ATOM 918 HG22 VAL C 58 145.871 12.844 16.251 1.00 1.40 H ATOM 919 HG23 VAL C 58 146.067 14.037 17.535 1.00 1.20 H ATOM 920 N THR C 59 145.607 18.161 15.138 1.00 0.64 N ATOM 921 CA THR C 59 145.106 19.245 14.245 1.00 0.67 C ATOM 922 C THR C 59 146.243 19.778 13.370 1.00 0.66 C ATOM 923 O THR C 59 147.153 19.058 13.011 1.00 0.69 O ATOM 924 CB THR C 59 144.600 20.336 15.191 1.00 0.72 C ATOM 925 OG1 THR C 59 144.166 19.741 16.406 1.00 0.77 O ATOM 926 CG2 THR C 59 143.433 21.079 14.539 1.00 0.84 C ATOM 927 H THR C 59 146.526 18.192 15.478 1.00 0.70 H ATOM 928 HA THR C 59 144.295 18.884 13.632 1.00 0.73 H ATOM 929 HB THR C 59 145.397 21.034 15.395 1.00 0.77 H ATOM 930 HG1 THR C 59 144.104 20.433 17.069 1.00 1.04 H ATOM 931 HG21 THR C 59 142.672 21.274 15.279 1.00 1.30 H ATOM 932 HG22 THR C 59 143.019 20.474 13.746 1.00 1.31 H ATOM 933 HG23 THR C 59 143.786 22.015 14.130 1.00 1.27 H ATOM 934 N ASP C 60 146.199 21.036 13.023 1.00 0.68 N ATOM 935 CA ASP C 60 147.278 21.613 12.171 1.00 0.71 C ATOM 936 C ASP C 60 148.411 22.154 13.047 1.00 0.72 C ATOM 937 O ASP C 60 149.316 22.812 12.572 1.00 0.99 O ATOM 938 CB ASP C 60 146.607 22.749 11.399 1.00 0.78 C ATOM 939 CG ASP C 60 146.320 23.914 12.348 1.00 1.54 C ATOM 940 OD1 ASP C 60 147.225 24.699 12.581 1.00 2.11 O ATOM 941 OD2 ASP C 60 145.201 24.002 12.825 1.00 2.33 O ATOM 942 H ASP C 60 145.456 21.600 13.323 1.00 0.70 H ATOM 943 HA ASP C 60 147.653 20.872 11.484 1.00 0.73 H ATOM 944 HB2 ASP C 60 147.263 23.082 10.607 1.00 1.32 H ATOM 945 HB3 ASP C 60 145.679 22.397 10.974 1.00 1.11 H ATOM 946 N ASP C 61 148.369 21.882 14.322 1.00 0.65 N ATOM 947 CA ASP C 61 149.445 22.381 15.227 1.00 0.68 C ATOM 948 C ASP C 61 150.099 21.210 15.967 1.00 0.68 C ATOM 949 O ASP C 61 151.158 21.343 16.547 1.00 0.83 O ATOM 950 CB ASP C 61 148.735 23.309 16.213 1.00 0.75 C ATOM 951 CG ASP C 61 149.505 24.626 16.320 1.00 1.10 C ATOM 952 OD1 ASP C 61 150.655 24.586 16.725 1.00 1.79 O ATOM 953 OD2 ASP C 61 148.932 25.653 15.994 1.00 1.61 O ATOM 954 H ASP C 61 147.631 21.350 14.686 1.00 0.76 H ATOM 955 HA ASP C 61 150.183 22.933 14.667 1.00 0.73 H ATOM 956 HB2 ASP C 61 147.731 23.505 15.863 1.00 0.94 H ATOM 957 HB3 ASP C 61 148.693 22.839 17.184 1.00 1.02 H ATOM 958 N CYS C 62 149.475 20.063 15.950 1.00 0.66 N ATOM 959 CA CYS C 62 150.061 18.885 16.651 1.00 0.75 C ATOM 960 C CYS C 62 150.123 17.684 15.703 1.00 0.64 C ATOM 961 O CYS C 62 150.363 16.567 16.116 1.00 0.61 O ATOM 962 CB CYS C 62 149.108 18.602 17.813 1.00 0.88 C ATOM 963 SG CYS C 62 149.946 18.950 19.379 1.00 1.36 S ATOM 964 H CYS C 62 148.622 19.977 15.476 1.00 0.70 H ATOM 965 HA CYS C 62 151.043 19.120 17.029 1.00 0.86 H ATOM 966 HB2 CYS C 62 148.235 19.232 17.724 1.00 0.97 H ATOM 967 HB3 CYS C 62 148.807 17.565 17.787 1.00 1.18 H ATOM 968 HG CYS C 62 150.029 18.123 19.860 1.00 1.78 H ATOM 969 N PHE C 63 149.908 17.906 14.435 1.00 0.68 N ATOM 970 CA PHE C 63 149.955 16.778 13.463 1.00 0.61 C ATOM 971 C PHE C 63 151.411 16.401 13.126 1.00 0.61 C ATOM 972 O PHE C 63 151.749 15.233 13.134 1.00 0.60 O ATOM 973 CB PHE C 63 149.193 17.281 12.227 1.00 0.66 C ATOM 974 CG PHE C 63 149.668 16.556 10.987 1.00 0.64 C ATOM 975 CD1 PHE C 63 150.864 16.937 10.366 1.00 1.45 C ATOM 976 CD2 PHE C 63 148.911 15.503 10.460 1.00 1.20 C ATOM 977 CE1 PHE C 63 151.302 16.266 9.218 1.00 1.46 C ATOM 978 CE2 PHE C 63 149.350 14.831 9.312 1.00 1.23 C ATOM 979 CZ PHE C 63 150.545 15.213 8.691 1.00 0.72 C ATOM 980 H PHE C 63 149.716 18.815 14.122 1.00 0.79 H ATOM 981 HA PHE C 63 149.444 15.921 13.875 1.00 0.60 H ATOM 982 HB2 PHE C 63 148.138 17.095 12.363 1.00 0.70 H ATOM 983 HB3 PHE C 63 149.353 18.340 12.108 1.00 0.71 H ATOM 984 HD1 PHE C 63 151.448 17.749 10.772 1.00 2.29 H ATOM 985 HD2 PHE C 63 147.989 15.208 10.938 1.00 2.02 H ATOM 986 HE1 PHE C 63 152.224 16.560 8.740 1.00 2.30 H ATOM 987 HE2 PHE C 63 148.766 14.019 8.905 1.00 2.04 H ATOM 988 HZ PHE C 63 150.883 14.695 7.806 1.00 0.79 H ATOM 989 N PRO C 64 152.237 17.384 12.839 1.00 0.69 N ATOM 990 CA PRO C 64 153.654 17.099 12.504 1.00 0.78 C ATOM 991 C PRO C 64 154.371 16.465 13.700 1.00 0.78 C ATOM 992 O PRO C 64 155.402 15.838 13.556 1.00 0.89 O ATOM 993 CB PRO C 64 154.217 18.488 12.197 1.00 0.91 C ATOM 994 CG PRO C 64 153.095 19.528 12.371 1.00 0.90 C ATOM 995 CD PRO C 64 151.820 18.807 12.830 1.00 0.77 C ATOM 996 HA PRO C 64 153.724 16.468 11.633 1.00 0.79 H ATOM 997 HB2 PRO C 64 155.028 18.709 12.878 1.00 0.97 H ATOM 998 HB3 PRO C 64 154.579 18.517 11.180 1.00 0.98 H ATOM 999 HG2 PRO C 64 153.388 20.257 13.113 1.00 0.96 H ATOM 1000 HG3 PRO C 64 152.909 20.022 11.429 1.00 0.95 H ATOM 1001 HD2 PRO C 64 151.539 19.140 13.819 1.00 0.79 H ATOM 1002 HD3 PRO C 64 151.022 18.963 12.126 1.00 0.77 H ATOM 1003 N GLY C 65 153.834 16.624 14.878 1.00 0.74 N ATOM 1004 CA GLY C 65 154.485 16.031 16.081 1.00 0.79 C ATOM 1005 C GLY C 65 154.466 14.506 15.973 1.00 0.72 C ATOM 1006 O GLY C 65 155.200 13.817 16.653 1.00 0.77 O ATOM 1007 H GLY C 65 153.002 17.133 14.973 1.00 0.74 H ATOM 1008 HA2 GLY C 65 155.508 16.377 16.142 1.00 0.88 H ATOM 1009 HA3 GLY C 65 153.949 16.333 16.967 1.00 0.82 H ATOM 1010 N LEU C 66 153.631 13.971 15.125 1.00 0.66 N ATOM 1011 CA LEU C 66 153.567 12.489 14.976 1.00 0.61 C ATOM 1012 C LEU C 66 154.555 12.021 13.900 1.00 0.59 C ATOM 1013 O LEU C 66 154.889 12.769 13.003 1.00 0.63 O ATOM 1014 CB LEU C 66 152.128 12.195 14.548 1.00 0.59 C ATOM 1015 CG LEU C 66 151.160 12.958 15.453 1.00 0.62 C ATOM 1016 CD1 LEU C 66 149.723 12.552 15.123 1.00 0.69 C ATOM 1017 CD2 LEU C 66 151.460 12.623 16.916 1.00 0.72 C ATOM 1018 H LEU C 66 153.047 14.544 14.585 1.00 0.68 H ATOM 1019 HA LEU C 66 153.777 12.006 15.917 1.00 0.64 H ATOM 1020 HB2 LEU C 66 151.987 12.507 13.523 1.00 0.58 H ATOM 1021 HB3 LEU C 66 151.937 11.136 14.632 1.00 0.59 H ATOM 1022 HG LEU C 66 151.280 14.020 15.293 1.00 0.63 H ATOM 1023 HD11 LEU C 66 149.074 12.825 15.941 1.00 1.26 H ATOM 1024 HD12 LEU C 66 149.678 11.484 14.968 1.00 1.06 H ATOM 1025 HD13 LEU C 66 149.403 13.059 14.225 1.00 1.14 H ATOM 1026 HD21 LEU C 66 150.851 13.241 17.559 1.00 1.28 H ATOM 1027 HD22 LEU C 66 152.504 12.809 17.121 1.00 1.21 H ATOM 1028 HD23 LEU C 66 151.237 11.583 17.100 1.00 1.17 H ATOM 1029 N PRO C 67 154.993 10.791 14.024 1.00 0.57 N ATOM 1030 CA PRO C 67 155.952 10.219 13.049 1.00 0.60 C ATOM 1031 C PRO C 67 155.342 10.195 11.645 1.00 0.61 C ATOM 1032 O PRO C 67 154.402 10.908 11.354 1.00 0.85 O ATOM 1033 CB PRO C 67 156.164 8.798 13.580 1.00 0.62 C ATOM 1034 CG PRO C 67 155.311 8.610 14.850 1.00 0.59 C ATOM 1035 CD PRO C 67 154.556 9.914 15.136 1.00 0.56 C ATOM 1036 HA PRO C 67 156.882 10.762 13.058 1.00 0.65 H ATOM 1037 HB2 PRO C 67 155.860 8.082 12.829 1.00 0.63 H ATOM 1038 HB3 PRO C 67 157.205 8.652 13.821 1.00 0.68 H ATOM 1039 HG2 PRO C 67 154.605 7.806 14.697 1.00 0.58 H ATOM 1040 HG3 PRO C 67 155.953 8.375 15.686 1.00 0.64 H ATOM 1041 HD2 PRO C 67 153.487 9.751 15.105 1.00 0.53 H ATOM 1042 HD3 PRO C 67 154.856 10.333 16.084 1.00 0.61 H ATOM 1043 N ASN C 68 155.868 9.377 10.773 1.00 0.57 N ATOM 1044 CA ASN C 68 155.316 9.304 9.390 1.00 0.55 C ATOM 1045 C ASN C 68 153.850 8.857 9.438 1.00 0.50 C ATOM 1046 O ASN C 68 153.094 9.325 10.258 1.00 0.47 O ATOM 1047 CB ASN C 68 156.181 8.263 8.677 1.00 0.63 C ATOM 1048 CG ASN C 68 157.655 8.649 8.809 1.00 1.20 C ATOM 1049 OD1 ASN C 68 158.155 8.821 9.903 1.00 1.90 O ATOM 1050 ND2 ASN C 68 158.378 8.792 7.732 1.00 1.82 N ATOM 1051 H ASN C 68 156.624 8.809 11.030 1.00 0.73 H ATOM 1052 HA ASN C 68 155.404 10.259 8.897 1.00 0.56 H ATOM 1053 HB2 ASN C 68 156.020 7.293 9.125 1.00 0.98 H ATOM 1054 HB3 ASN C 68 155.912 8.226 7.632 1.00 0.99 H ATOM 1055 HD21 ASN C 68 157.976 8.653 6.849 1.00 2.15 H ATOM 1056 HD22 ASN C 68 159.324 9.039 7.806 1.00 2.35 H ATOM 1057 N ASP C 69 153.458 7.965 8.555 1.00 0.50 N ATOM 1058 CA ASP C 69 152.050 7.464 8.505 1.00 0.47 C ATOM 1059 C ASP C 69 151.378 7.508 9.881 1.00 0.46 C ATOM 1060 O ASP C 69 151.322 6.522 10.588 1.00 0.51 O ATOM 1061 CB ASP C 69 152.174 6.016 8.030 1.00 0.54 C ATOM 1062 CG ASP C 69 153.262 5.305 8.837 1.00 1.28 C ATOM 1063 OD1 ASP C 69 153.570 5.773 9.921 1.00 2.05 O ATOM 1064 OD2 ASP C 69 153.768 4.304 8.357 1.00 2.06 O ATOM 1065 H ASP C 69 154.092 7.629 7.905 1.00 0.54 H ATOM 1066 HA ASP C 69 151.485 8.026 7.787 1.00 0.44 H ATOM 1067 HB2 ASP C 69 151.230 5.510 8.171 1.00 1.27 H ATOM 1068 HB3 ASP C 69 152.438 6.002 6.983 1.00 1.19 H ATOM 1069 N ALA C 70 150.870 8.646 10.264 1.00 0.42 N ATOM 1070 CA ALA C 70 150.202 8.758 11.591 1.00 0.43 C ATOM 1071 C ALA C 70 148.729 8.356 11.476 1.00 0.39 C ATOM 1072 O ALA C 70 147.984 8.913 10.694 1.00 0.46 O ATOM 1073 CB ALA C 70 150.327 10.233 11.975 1.00 0.44 C ATOM 1074 H ALA C 70 150.935 9.431 9.677 1.00 0.39 H ATOM 1075 HA ALA C 70 150.707 8.144 12.320 1.00 0.49 H ATOM 1076 HB1 ALA C 70 149.577 10.479 12.712 1.00 1.12 H ATOM 1077 HB2 ALA C 70 150.184 10.846 11.097 1.00 1.10 H ATOM 1078 HB3 ALA C 70 151.309 10.416 12.386 1.00 1.10 H ATOM 1079 N GLU C 71 148.303 7.394 12.247 1.00 0.37 N ATOM 1080 CA GLU C 71 146.878 6.959 12.179 1.00 0.35 C ATOM 1081 C GLU C 71 145.952 8.136 12.500 1.00 0.29 C ATOM 1082 O GLU C 71 145.547 8.329 13.629 1.00 0.32 O ATOM 1083 CB GLU C 71 146.745 5.868 13.241 1.00 0.41 C ATOM 1084 CG GLU C 71 147.802 4.788 13.001 1.00 0.57 C ATOM 1085 CD GLU C 71 147.211 3.415 13.326 1.00 1.40 C ATOM 1086 OE1 GLU C 71 145.999 3.289 13.289 1.00 2.11 O ATOM 1087 OE2 GLU C 71 147.982 2.512 13.608 1.00 2.11 O ATOM 1088 H GLU C 71 148.920 6.956 12.871 1.00 0.41 H ATOM 1089 HA GLU C 71 146.653 6.555 11.205 1.00 0.35 H ATOM 1090 HB2 GLU C 71 146.888 6.300 14.221 1.00 0.47 H ATOM 1091 HB3 GLU C 71 145.762 5.425 13.182 1.00 0.44 H ATOM 1092 HG2 GLU C 71 148.112 4.812 11.966 1.00 1.13 H ATOM 1093 HG3 GLU C 71 148.655 4.970 13.637 1.00 0.97 H ATOM 1094 N LEU C 72 145.615 8.923 11.515 1.00 0.26 N ATOM 1095 CA LEU C 72 144.717 10.087 11.766 1.00 0.23 C ATOM 1096 C LEU C 72 143.253 9.673 11.596 1.00 0.22 C ATOM 1097 O LEU C 72 142.765 9.519 10.494 1.00 0.28 O ATOM 1098 CB LEU C 72 145.107 11.123 10.711 1.00 0.23 C ATOM 1099 CG LEU C 72 145.616 12.389 11.401 1.00 0.29 C ATOM 1100 CD1 LEU C 72 146.909 12.076 12.156 1.00 0.40 C ATOM 1101 CD2 LEU C 72 145.888 13.467 10.349 1.00 0.34 C ATOM 1102 H LEU C 72 145.953 8.751 10.612 1.00 0.28 H ATOM 1103 HA LEU C 72 144.884 10.487 12.754 1.00 0.24 H ATOM 1104 HB2 LEU C 72 145.886 10.718 10.080 1.00 0.30 H ATOM 1105 HB3 LEU C 72 144.245 11.365 10.108 1.00 0.27 H ATOM 1106 HG LEU C 72 144.869 12.743 12.098 1.00 0.34 H ATOM 1107 HD11 LEU C 72 146.875 11.061 12.523 1.00 1.03 H ATOM 1108 HD12 LEU C 72 147.014 12.757 12.988 1.00 1.12 H ATOM 1109 HD13 LEU C 72 147.751 12.190 11.490 1.00 1.15 H ATOM 1110 HD21 LEU C 72 146.273 14.353 10.833 1.00 1.11 H ATOM 1111 HD22 LEU C 72 144.970 13.709 9.835 1.00 1.10 H ATOM 1112 HD23 LEU C 72 146.614 13.101 9.638 1.00 1.01 H ATOM 1113 N LEU C 73 142.548 9.493 12.680 1.00 0.22 N ATOM 1114 CA LEU C 73 141.115 9.091 12.579 1.00 0.23 C ATOM 1115 C LEU C 73 140.232 10.327 12.386 1.00 0.23 C ATOM 1116 O LEU C 73 140.610 11.430 12.725 1.00 0.26 O ATOM 1117 CB LEU C 73 140.800 8.409 13.911 1.00 0.27 C ATOM 1118 CG LEU C 73 139.485 7.636 13.792 1.00 0.35 C ATOM 1119 CD1 LEU C 73 139.741 6.297 13.099 1.00 0.50 C ATOM 1120 CD2 LEU C 73 138.914 7.385 15.189 1.00 0.47 C ATOM 1121 H LEU C 73 142.959 9.623 13.560 1.00 0.27 H ATOM 1122 HA LEU C 73 140.975 8.395 11.767 1.00 0.24 H ATOM 1123 HB2 LEU C 73 141.599 7.726 14.163 1.00 0.30 H ATOM 1124 HB3 LEU C 73 140.707 9.156 14.685 1.00 0.30 H ATOM 1125 HG LEU C 73 138.781 8.213 13.210 1.00 0.43 H ATOM 1126 HD11 LEU C 73 140.736 6.292 12.679 1.00 1.07 H ATOM 1127 HD12 LEU C 73 139.017 6.155 12.311 1.00 1.09 H ATOM 1128 HD13 LEU C 73 139.651 5.496 13.819 1.00 1.27 H ATOM 1129 HD21 LEU C 73 139.718 7.150 15.870 1.00 1.19 H ATOM 1130 HD22 LEU C 73 138.221 6.558 15.151 1.00 1.00 H ATOM 1131 HD23 LEU C 73 138.399 8.271 15.532 1.00 1.05 H ATOM 1132 N LEU C 74 139.059 10.150 11.843 1.00 0.26 N ATOM 1133 CA LEU C 74 138.154 11.316 11.628 1.00 0.30 C ATOM 1134 C LEU C 74 137.412 11.657 12.924 1.00 0.33 C ATOM 1135 O LEU C 74 136.899 10.790 13.603 1.00 0.44 O ATOM 1136 CB LEU C 74 137.170 10.858 10.552 1.00 0.40 C ATOM 1137 CG LEU C 74 136.703 12.066 9.739 1.00 0.77 C ATOM 1138 CD1 LEU C 74 137.847 12.559 8.852 1.00 1.32 C ATOM 1139 CD2 LEU C 74 135.517 11.661 8.861 1.00 0.87 C ATOM 1140 H LEU C 74 138.772 9.252 11.577 1.00 0.31 H ATOM 1141 HA LEU C 74 138.713 12.168 11.278 1.00 0.31 H ATOM 1142 HB2 LEU C 74 137.657 10.149 9.897 1.00 0.78 H ATOM 1143 HB3 LEU C 74 136.316 10.389 11.019 1.00 0.75 H ATOM 1144 HG LEU C 74 136.403 12.857 10.411 1.00 1.13 H ATOM 1145 HD11 LEU C 74 138.763 12.061 9.135 1.00 1.72 H ATOM 1146 HD12 LEU C 74 137.965 13.626 8.975 1.00 1.67 H ATOM 1147 HD13 LEU C 74 137.623 12.339 7.819 1.00 1.98 H ATOM 1148 HD21 LEU C 74 134.599 11.778 9.418 1.00 1.38 H ATOM 1149 HD22 LEU C 74 135.627 10.630 8.561 1.00 1.45 H ATOM 1150 HD23 LEU C 74 135.488 12.290 7.983 1.00 1.25 H ATOM 1151 N LEU C 75 137.353 12.914 13.272 1.00 0.35 N ATOM 1152 CA LEU C 75 136.645 13.309 14.524 1.00 0.42 C ATOM 1153 C LEU C 75 136.141 14.750 14.414 1.00 0.46 C ATOM 1154 O LEU C 75 136.912 15.688 14.402 1.00 0.74 O ATOM 1155 CB LEU C 75 137.696 13.192 15.628 1.00 0.48 C ATOM 1156 CG LEU C 75 137.051 13.499 16.981 1.00 0.66 C ATOM 1157 CD1 LEU C 75 137.790 12.739 18.084 1.00 0.81 C ATOM 1158 CD2 LEU C 75 137.136 15.002 17.255 1.00 0.81 C ATOM 1159 H LEU C 75 137.774 13.598 12.711 1.00 0.41 H ATOM 1160 HA LEU C 75 135.825 12.636 14.722 1.00 0.47 H ATOM 1161 HB2 LEU C 75 138.096 12.188 15.639 1.00 0.46 H ATOM 1162 HB3 LEU C 75 138.493 13.896 15.443 1.00 0.54 H ATOM 1163 HG LEU C 75 136.016 13.192 16.964 1.00 0.68 H ATOM 1164 HD11 LEU C 75 137.283 11.805 18.279 1.00 1.35 H ATOM 1165 HD12 LEU C 75 137.806 13.335 18.984 1.00 1.42 H ATOM 1166 HD13 LEU C 75 138.803 12.539 17.767 1.00 1.19 H ATOM 1167 HD21 LEU C 75 138.143 15.346 17.071 1.00 1.39 H ATOM 1168 HD22 LEU C 75 136.873 15.196 18.285 1.00 1.16 H ATOM 1169 HD23 LEU C 75 136.452 15.526 16.604 1.00 1.41 H ATOM 1170 N THR C 76 134.851 14.933 14.333 1.00 0.51 N ATOM 1171 CA THR C 76 134.301 16.315 14.224 1.00 0.54 C ATOM 1172 C THR C 76 134.122 16.924 15.618 1.00 0.59 C ATOM 1173 O THR C 76 134.216 16.243 16.620 1.00 0.64 O ATOM 1174 CB THR C 76 132.946 16.149 13.534 1.00 0.64 C ATOM 1175 OG1 THR C 76 132.020 15.572 14.444 1.00 0.69 O ATOM 1176 CG2 THR C 76 133.100 15.241 12.314 1.00 0.71 C ATOM 1177 H THR C 76 134.245 14.164 14.345 1.00 0.73 H ATOM 1178 HA THR C 76 134.948 16.932 13.622 1.00 0.50 H ATOM 1179 HB THR C 76 132.584 17.114 13.215 1.00 0.69 H ATOM 1180 HG1 THR C 76 131.155 15.575 14.028 1.00 1.06 H ATOM 1181 HG21 THR C 76 134.149 15.092 12.106 1.00 1.20 H ATOM 1182 HG22 THR C 76 132.626 15.701 11.460 1.00 1.30 H ATOM 1183 HG23 THR C 76 132.634 14.287 12.514 1.00 1.14 H ATOM 1184 N ALA C 77 133.866 18.201 15.689 1.00 0.68 N ATOM 1185 CA ALA C 77 133.682 18.852 17.018 1.00 0.77 C ATOM 1186 C ALA C 77 132.391 18.355 17.674 1.00 0.83 C ATOM 1187 O ALA C 77 131.405 19.063 17.740 1.00 0.99 O ATOM 1188 CB ALA C 77 133.591 20.348 16.717 1.00 0.86 C ATOM 1189 H ALA C 77 133.795 18.733 14.869 1.00 0.75 H ATOM 1190 HA ALA C 77 134.530 18.654 17.655 1.00 0.76 H ATOM 1191 HB1 ALA C 77 133.011 20.500 15.818 1.00 1.35 H ATOM 1192 HB2 ALA C 77 134.584 20.748 16.577 1.00 1.21 H ATOM 1193 HB3 ALA C 77 133.113 20.853 17.543 1.00 1.33 H ATOM 1194 N GLY C 78 132.389 17.144 18.160 1.00 0.83 N ATOM 1195 CA GLY C 78 131.161 16.604 18.811 1.00 0.91 C ATOM 1196 C GLY C 78 131.408 15.160 19.249 1.00 0.92 C ATOM 1197 O GLY C 78 130.972 14.737 20.301 1.00 1.20 O ATOM 1198 H GLY C 78 133.194 16.589 18.096 1.00 0.86 H ATOM 1199 HA2 GLY C 78 130.917 17.207 19.674 1.00 0.99 H ATOM 1200 HA3 GLY C 78 130.341 16.629 18.110 1.00 0.93 H ATOM 1201 N GLU C 79 132.105 14.398 18.450 1.00 0.74 N ATOM 1202 CA GLU C 79 132.379 12.981 18.822 1.00 0.80 C ATOM 1203 C GLU C 79 133.860 12.804 19.167 1.00 0.72 C ATOM 1204 O GLU C 79 134.713 13.506 18.662 1.00 0.67 O ATOM 1205 CB GLU C 79 132.018 12.168 17.578 1.00 0.87 C ATOM 1206 CG GLU C 79 130.654 12.617 17.052 1.00 1.37 C ATOM 1207 CD GLU C 79 130.051 11.510 16.185 1.00 2.11 C ATOM 1208 OE1 GLU C 79 130.162 10.357 16.569 1.00 2.64 O ATOM 1209 OE2 GLU C 79 129.490 11.833 15.152 1.00 2.72 O ATOM 1210 H GLU C 79 132.448 14.759 17.605 1.00 0.68 H ATOM 1211 HA GLU C 79 131.759 12.681 19.651 1.00 0.92 H ATOM 1212 HB2 GLU C 79 132.768 12.324 16.816 1.00 1.22 H ATOM 1213 HB3 GLU C 79 131.976 11.119 17.833 1.00 1.38 H ATOM 1214 HG2 GLU C 79 129.996 12.821 17.885 1.00 1.54 H ATOM 1215 HG3 GLU C 79 130.773 13.511 16.459 1.00 1.92 H ATOM 1216 N THR C 80 134.173 11.870 20.024 1.00 0.77 N ATOM 1217 CA THR C 80 135.599 11.651 20.399 1.00 0.73 C ATOM 1218 C THR C 80 135.967 10.173 20.247 1.00 0.70 C ATOM 1219 O THR C 80 135.147 9.296 20.436 1.00 0.77 O ATOM 1220 CB THR C 80 135.695 12.079 21.864 1.00 0.83 C ATOM 1221 OG1 THR C 80 134.667 11.443 22.610 1.00 0.97 O ATOM 1222 CG2 THR C 80 135.539 13.597 21.966 1.00 0.95 C ATOM 1223 H THR C 80 133.470 11.314 20.421 1.00 0.88 H ATOM 1224 HA THR C 80 136.246 12.265 19.793 1.00 0.69 H ATOM 1225 HB THR C 80 136.658 11.794 22.260 1.00 0.88 H ATOM 1226 HG1 THR C 80 134.997 11.289 23.498 1.00 1.26 H ATOM 1227 HG21 THR C 80 134.592 13.831 22.430 1.00 1.44 H ATOM 1228 HG22 THR C 80 135.571 14.030 20.977 1.00 1.27 H ATOM 1229 HG23 THR C 80 136.342 14.003 22.563 1.00 1.28 H ATOM 1230 N TRP C 81 137.194 9.891 19.906 1.00 0.64 N ATOM 1231 CA TRP C 81 137.617 8.470 19.743 1.00 0.64 C ATOM 1232 C TRP C 81 138.140 7.920 21.073 1.00 0.71 C ATOM 1233 O TRP C 81 139.167 8.340 21.568 1.00 1.00 O ATOM 1234 CB TRP C 81 138.732 8.508 18.696 1.00 0.61 C ATOM 1235 CG TRP C 81 139.489 7.218 18.718 1.00 0.59 C ATOM 1236 CD1 TRP C 81 140.825 7.100 18.544 1.00 0.59 C ATOM 1237 CD2 TRP C 81 138.981 5.867 18.922 1.00 0.65 C ATOM 1238 NE1 TRP C 81 141.170 5.763 18.628 1.00 0.64 N ATOM 1239 CE2 TRP C 81 140.068 4.964 18.860 1.00 0.67 C ATOM 1240 CE3 TRP C 81 137.696 5.344 19.153 1.00 0.73 C ATOM 1241 CZ2 TRP C 81 139.887 3.589 19.021 1.00 0.76 C ATOM 1242 CZ3 TRP C 81 137.510 3.961 19.315 1.00 0.82 C ATOM 1243 CH2 TRP C 81 138.604 3.086 19.250 1.00 0.83 C ATOM 1244 H TRP C 81 137.840 10.614 19.759 1.00 0.63 H ATOM 1245 HA TRP C 81 136.794 7.872 19.384 1.00 0.68 H ATOM 1246 HB2 TRP C 81 138.301 8.655 17.717 1.00 0.63 H ATOM 1247 HB3 TRP C 81 139.405 9.323 18.918 1.00 0.66 H ATOM 1248 HD1 TRP C 81 141.511 7.915 18.368 1.00 0.60 H ATOM 1249 HE1 TRP C 81 142.078 5.406 18.536 1.00 0.67 H ATOM 1250 HE3 TRP C 81 136.847 6.009 19.205 1.00 0.75 H ATOM 1251 HZ2 TRP C 81 140.733 2.920 18.969 1.00 0.80 H ATOM 1252 HZ3 TRP C 81 136.519 3.569 19.492 1.00 0.90 H ATOM 1253 HH2 TRP C 81 138.455 2.023 19.375 1.00 0.92 H ATOM 1254 N HIS C 82 137.441 6.984 21.655 1.00 0.81 N ATOM 1255 CA HIS C 82 137.900 6.409 22.952 1.00 0.85 C ATOM 1256 C HIS C 82 139.402 6.116 22.899 1.00 0.87 C ATOM 1257 O HIS C 82 140.148 6.491 23.781 1.00 1.56 O ATOM 1258 CB HIS C 82 137.105 5.113 23.114 1.00 0.92 C ATOM 1259 CG HIS C 82 136.497 5.066 24.489 1.00 1.29 C ATOM 1260 ND1 HIS C 82 135.200 5.487 24.738 1.00 1.87 N ATOM 1261 CD2 HIS C 82 136.996 4.651 25.699 1.00 1.85 C ATOM 1262 CE1 HIS C 82 134.964 5.317 26.052 1.00 2.23 C ATOM 1263 NE2 HIS C 82 136.026 4.811 26.685 1.00 2.20 N ATOM 1264 H HIS C 82 136.615 6.659 21.239 1.00 1.05 H ATOM 1265 HA HIS C 82 137.675 7.083 23.763 1.00 0.87 H ATOM 1266 HB2 HIS C 82 136.322 5.076 22.372 1.00 1.02 H ATOM 1267 HB3 HIS C 82 137.765 4.268 22.984 1.00 1.04 H ATOM 1268 HD1 HIS C 82 134.570 5.843 24.078 1.00 2.32 H ATOM 1269 HD2 HIS C 82 137.990 4.261 25.862 1.00 2.38 H ATOM 1270 HE1 HIS C 82 134.030 5.560 26.536 1.00 2.82 H ATOM 1271 N GLY C 83 139.850 5.449 21.871 1.00 1.00 N ATOM 1272 CA GLY C 83 141.302 5.134 21.763 1.00 1.03 C ATOM 1273 C GLY C 83 141.495 3.617 21.718 1.00 1.05 C ATOM 1274 O GLY C 83 140.716 2.866 22.270 1.00 1.19 O ATOM 1275 H GLY C 83 139.231 5.156 21.169 1.00 1.58 H ATOM 1276 HA2 GLY C 83 141.700 5.576 20.860 1.00 1.02 H ATOM 1277 HA3 GLY C 83 141.822 5.534 22.620 1.00 1.13 H ATOM 1278 N TYR C 84 142.528 3.161 21.063 1.00 1.04 N ATOM 1279 CA TYR C 84 142.771 1.692 20.982 1.00 1.17 C ATOM 1280 C TYR C 84 142.712 1.068 22.379 1.00 1.44 C ATOM 1281 O TYR C 84 143.708 0.972 23.069 1.00 1.82 O ATOM 1282 CB TYR C 84 144.174 1.556 20.392 1.00 1.20 C ATOM 1283 CG TYR C 84 144.461 0.102 20.100 1.00 1.21 C ATOM 1284 CD1 TYR C 84 143.929 -0.500 18.954 1.00 1.98 C ATOM 1285 CD2 TYR C 84 145.259 -0.643 20.976 1.00 1.58 C ATOM 1286 CE1 TYR C 84 144.196 -1.847 18.683 1.00 2.29 C ATOM 1287 CE2 TYR C 84 145.525 -1.991 20.706 1.00 1.88 C ATOM 1288 CZ TYR C 84 144.994 -2.593 19.559 1.00 1.95 C ATOM 1289 OH TYR C 84 145.257 -3.921 19.292 1.00 2.46 O ATOM 1290 H TYR C 84 143.144 3.784 20.625 1.00 1.02 H ATOM 1291 HA TYR C 84 142.049 1.226 20.330 1.00 1.28 H ATOM 1292 HB2 TYR C 84 144.236 2.126 19.477 1.00 1.46 H ATOM 1293 HB3 TYR C 84 144.900 1.929 21.099 1.00 1.34 H ATOM 1294 HD1 TYR C 84 143.313 0.075 18.278 1.00 2.68 H ATOM 1295 HD2 TYR C 84 145.669 -0.179 21.861 1.00 2.21 H ATOM 1296 HE1 TYR C 84 143.786 -2.312 17.798 1.00 3.11 H ATOM 1297 HE2 TYR C 84 146.141 -2.566 21.381 1.00 2.55 H ATOM 1298 HH TYR C 84 145.497 -4.348 20.118 1.00 2.83 H ATOM 1299 N VAL C 85 141.553 0.644 22.802 1.00 1.52 N ATOM 1300 CA VAL C 85 141.432 0.027 24.153 1.00 1.88 C ATOM 1301 C VAL C 85 141.736 -1.472 24.080 1.00 1.86 C ATOM 1302 O VAL C 85 141.543 -2.105 23.061 1.00 1.82 O ATOM 1303 CB VAL C 85 139.981 0.258 24.567 1.00 2.34 C ATOM 1304 CG1 VAL C 85 139.778 -0.218 26.007 1.00 3.09 C ATOM 1305 CG2 VAL C 85 139.656 1.751 24.475 1.00 2.72 C ATOM 1306 H VAL C 85 140.761 0.731 22.230 1.00 1.54 H ATOM 1307 HA VAL C 85 142.095 0.512 24.850 1.00 2.12 H ATOM 1308 HB VAL C 85 139.328 -0.296 23.910 1.00 2.40 H ATOM 1309 HG11 VAL C 85 139.159 -1.104 26.009 1.00 3.29 H ATOM 1310 HG12 VAL C 85 139.295 0.560 26.579 1.00 3.58 H ATOM 1311 HG13 VAL C 85 140.736 -0.448 26.448 1.00 3.48 H ATOM 1312 HG21 VAL C 85 140.572 2.321 24.513 1.00 3.01 H ATOM 1313 HG22 VAL C 85 139.021 2.033 25.302 1.00 3.03 H ATOM 1314 HG23 VAL C 85 139.145 1.951 23.544 1.00 3.10 H ATOM 1315 N SER C 86 142.209 -2.044 25.153 1.00 2.19 N ATOM 1316 CA SER C 86 142.524 -3.501 25.143 1.00 2.39 C ATOM 1317 C SER C 86 141.582 -4.250 26.089 1.00 2.65 C ATOM 1318 O SER C 86 141.954 -5.228 26.706 1.00 2.96 O ATOM 1319 CB SER C 86 143.966 -3.598 25.636 1.00 2.76 C ATOM 1320 OG SER C 86 144.625 -4.659 24.956 1.00 3.40 O ATOM 1321 H SER C 86 142.358 -1.515 25.965 1.00 2.45 H ATOM 1322 HA SER C 86 142.448 -3.897 24.143 1.00 2.39 H ATOM 1323 HB2 SER C 86 144.481 -2.674 25.434 1.00 2.85 H ATOM 1324 HB3 SER C 86 143.969 -3.783 26.703 1.00 3.08 H ATOM 1325 HG SER C 86 145.020 -4.300 24.158 1.00 3.68 H ATOM 1326 N ASP C 87 140.363 -3.799 26.207 1.00 2.76 N ATOM 1327 CA ASP C 87 139.399 -4.485 27.114 1.00 3.26 C ATOM 1328 C ASP C 87 138.566 -5.503 26.328 1.00 3.51 C ATOM 1329 O ASP C 87 138.573 -6.681 26.624 1.00 4.07 O ATOM 1330 CB ASP C 87 138.509 -3.369 27.661 1.00 3.70 C ATOM 1331 CG ASP C 87 137.868 -3.823 28.974 1.00 4.19 C ATOM 1332 OD1 ASP C 87 137.145 -4.805 28.949 1.00 4.61 O ATOM 1333 OD2 ASP C 87 138.112 -3.181 29.983 1.00 4.55 O ATOM 1334 OXT ASP C 87 137.851 -5.056 25.331 1.00 3.62 O ATOM 1335 H ASP C 87 140.082 -3.008 25.701 1.00 2.64 H ATOM 1336 HA ASP C 87 139.922 -4.970 27.923 1.00 3.50 H ATOM 1337 HB2 ASP C 87 139.107 -2.487 27.838 1.00 3.79 H ATOM 1338 HB3 ASP C 87 137.734 -3.141 26.945 1.00 3.98 H TER 1339 ASP C 87 ATOM 1340 N MET I 1 172.507 13.601 -21.241 1.00 23.41 N ATOM 1341 CA MET I 1 172.229 12.994 -19.906 1.00 23.35 C ATOM 1342 C MET I 1 173.540 12.731 -19.160 1.00 22.85 C ATOM 1343 O MET I 1 173.556 12.546 -17.960 1.00 23.07 O ATOM 1344 CB MET I 1 171.513 11.679 -20.212 1.00 23.50 C ATOM 1345 CG MET I 1 171.477 10.810 -18.954 1.00 23.67 C ATOM 1346 SD MET I 1 170.723 11.741 -17.598 1.00 23.83 S ATOM 1347 CE MET I 1 169.344 10.611 -17.286 1.00 23.96 C ATOM 1348 H1 MET I 1 172.833 12.863 -21.896 1.00 23.29 H ATOM 1349 H2 MET I 1 173.243 14.330 -21.143 1.00 23.38 H ATOM 1350 H3 MET I 1 171.638 14.033 -21.613 1.00 23.71 H ATOM 1351 HA MET I 1 171.587 13.637 -19.326 1.00 23.67 H ATOM 1352 HB2 MET I 1 170.503 11.886 -20.536 1.00 23.73 H ATOM 1353 HB3 MET I 1 172.041 11.154 -20.994 1.00 23.36 H ATOM 1354 HG2 MET I 1 170.896 9.920 -19.147 1.00 23.63 H ATOM 1355 HG3 MET I 1 172.484 10.529 -18.681 1.00 23.85 H ATOM 1356 HE1 MET I 1 168.418 11.169 -17.276 1.00 23.92 H ATOM 1357 HE2 MET I 1 169.481 10.130 -16.331 1.00 23.84 H ATOM 1358 HE3 MET I 1 169.311 9.861 -18.064 1.00 24.29 H ATOM 1359 N GLU I 2 174.640 12.713 -19.862 1.00 22.28 N ATOM 1360 CA GLU I 2 175.948 12.460 -19.191 1.00 21.88 C ATOM 1361 C GLU I 2 176.168 13.472 -18.062 1.00 21.32 C ATOM 1362 O GLU I 2 176.965 13.257 -17.170 1.00 21.05 O ATOM 1363 CB GLU I 2 176.999 12.643 -20.287 1.00 21.94 C ATOM 1364 CG GLU I 2 176.760 13.971 -21.008 1.00 22.34 C ATOM 1365 CD GLU I 2 176.349 13.699 -22.456 1.00 22.46 C ATOM 1366 OE1 GLU I 2 177.049 12.951 -23.119 1.00 22.61 O ATOM 1367 OE2 GLU I 2 175.342 14.244 -22.878 1.00 22.50 O ATOM 1368 H GLU I 2 174.607 12.864 -20.830 1.00 22.18 H ATOM 1369 HA GLU I 2 175.987 11.453 -18.808 1.00 22.09 H ATOM 1370 HB2 GLU I 2 177.984 12.645 -19.843 1.00 22.17 H ATOM 1371 HB3 GLU I 2 176.924 11.832 -20.996 1.00 21.60 H ATOM 1372 HG2 GLU I 2 175.974 14.518 -20.506 1.00 22.35 H ATOM 1373 HG3 GLU I 2 177.668 14.555 -20.997 1.00 22.63 H ATOM 1374 N LEU I 3 175.469 14.573 -18.095 1.00 21.24 N ATOM 1375 CA LEU I 3 175.641 15.597 -17.025 1.00 20.82 C ATOM 1376 C LEU I 3 175.568 14.937 -15.645 1.00 20.37 C ATOM 1377 O LEU I 3 174.590 14.304 -15.298 1.00 20.49 O ATOM 1378 CB LEU I 3 174.478 16.571 -17.219 1.00 21.39 C ATOM 1379 CG LEU I 3 175.006 18.006 -17.193 1.00 21.57 C ATOM 1380 CD1 LEU I 3 174.405 18.794 -18.358 1.00 22.07 C ATOM 1381 CD2 LEU I 3 174.610 18.670 -15.872 1.00 21.86 C ATOM 1382 H LEU I 3 174.832 14.727 -18.824 1.00 21.54 H ATOM 1383 HA LEU I 3 176.579 16.114 -17.146 1.00 20.58 H ATOM 1384 HB2 LEU I 3 174.003 16.378 -18.170 1.00 21.77 H ATOM 1385 HB3 LEU I 3 173.760 16.439 -16.423 1.00 21.42 H ATOM 1386 HG LEU I 3 176.083 17.995 -17.284 1.00 21.27 H ATOM 1387 HD11 LEU I 3 173.963 18.109 -19.066 1.00 22.13 H ATOM 1388 HD12 LEU I 3 175.181 19.365 -18.845 1.00 22.20 H ATOM 1389 HD13 LEU I 3 173.646 19.465 -17.984 1.00 22.35 H ATOM 1390 HD21 LEU I 3 175.368 19.384 -15.586 1.00 21.86 H ATOM 1391 HD22 LEU I 3 174.518 17.916 -15.104 1.00 22.22 H ATOM 1392 HD23 LEU I 3 173.665 19.177 -15.993 1.00 21.83 H ATOM 1393 N SER I 4 176.598 15.078 -14.855 1.00 19.98 N ATOM 1394 CA SER I 4 176.590 14.458 -13.499 1.00 19.67 C ATOM 1395 C SER I 4 175.310 14.837 -12.750 1.00 19.02 C ATOM 1396 O SER I 4 175.176 15.935 -12.248 1.00 19.00 O ATOM 1397 CB SER I 4 177.815 15.036 -12.791 1.00 19.73 C ATOM 1398 OG SER I 4 178.036 16.365 -13.243 1.00 19.90 O ATOM 1399 H SER I 4 177.378 15.591 -15.155 1.00 19.97 H ATOM 1400 HA SER I 4 176.680 13.386 -13.574 1.00 20.00 H ATOM 1401 HB2 SER I 4 177.647 15.046 -11.727 1.00 20.11 H ATOM 1402 HB3 SER I 4 178.679 14.421 -13.011 1.00 19.39 H ATOM 1403 HG SER I 4 177.294 16.903 -12.956 1.00 20.03 H ATOM 1404 N ARG I 5 174.370 13.936 -12.670 1.00 18.61 N ATOM 1405 CA ARG I 5 173.099 14.244 -11.953 1.00 18.09 C ATOM 1406 C ARG I 5 172.827 13.184 -10.882 1.00 17.32 C ATOM 1407 O ARG I 5 172.130 12.216 -11.117 1.00 17.33 O ATOM 1408 CB ARG I 5 172.016 14.208 -13.032 1.00 18.41 C ATOM 1409 CG ARG I 5 171.135 15.454 -12.917 1.00 18.62 C ATOM 1410 CD ARG I 5 171.996 16.707 -13.088 1.00 18.91 C ATOM 1411 NE ARG I 5 172.222 17.210 -11.704 1.00 19.24 N ATOM 1412 CZ ARG I 5 173.421 17.564 -11.326 1.00 19.81 C ATOM 1413 NH1 ARG I 5 174.066 18.489 -11.982 1.00 20.03 N ATOM 1414 NH2 ARG I 5 173.975 16.989 -10.293 1.00 20.28 N ATOM 1415 H ARG I 5 174.499 13.056 -13.082 1.00 18.72 H ATOM 1416 HA ARG I 5 173.145 15.226 -11.509 1.00 18.19 H ATOM 1417 HB2 ARG I 5 172.481 14.182 -14.007 1.00 18.85 H ATOM 1418 HB3 ARG I 5 171.407 13.326 -12.900 1.00 18.20 H ATOM 1419 HG2 ARG I 5 170.377 15.429 -13.686 1.00 18.48 H ATOM 1420 HG3 ARG I 5 170.664 15.473 -11.946 1.00 18.82 H ATOM 1421 HD2 ARG I 5 172.937 16.455 -13.558 1.00 18.95 H ATOM 1422 HD3 ARG I 5 171.470 17.448 -13.669 1.00 18.96 H ATOM 1423 HE ARG I 5 171.471 17.275 -11.077 1.00 19.12 H ATOM 1424 HH11 ARG I 5 173.642 18.928 -12.775 1.00 19.75 H ATOM 1425 HH12 ARG I 5 174.984 18.760 -11.692 1.00 20.54 H ATOM 1426 HH21 ARG I 5 173.482 16.278 -9.792 1.00 20.20 H ATOM 1427 HH22 ARG I 5 174.894 17.259 -10.004 1.00 20.78 H ATOM 1428 N GLY I 6 173.370 13.359 -9.708 1.00 16.77 N ATOM 1429 CA GLY I 6 173.141 12.362 -8.624 1.00 16.12 C ATOM 1430 C GLY I 6 172.638 13.077 -7.367 1.00 15.25 C ATOM 1431 O GLY I 6 172.462 12.473 -6.328 1.00 15.18 O ATOM 1432 H GLY I 6 173.928 14.148 -9.540 1.00 16.87 H ATOM 1433 HA2 GLY I 6 172.405 11.641 -8.949 1.00 16.37 H ATOM 1434 HA3 GLY I 6 174.067 11.856 -8.399 1.00 16.16 H ATOM 1435 N ALA I 7 172.406 14.359 -7.454 1.00 14.72 N ATOM 1436 CA ALA I 7 171.913 15.111 -6.264 1.00 13.98 C ATOM 1437 C ALA I 7 171.913 16.614 -6.555 1.00 13.34 C ATOM 1438 O ALA I 7 171.098 17.356 -6.043 1.00 13.14 O ATOM 1439 CB ALA I 7 172.902 14.781 -5.145 1.00 14.00 C ATOM 1440 H ALA I 7 172.554 14.827 -8.301 1.00 14.90 H ATOM 1441 HA ALA I 7 170.923 14.779 -5.992 1.00 14.10 H ATOM 1442 HB1 ALA I 7 173.295 15.697 -4.730 1.00 14.21 H ATOM 1443 HB2 ALA I 7 173.712 14.189 -5.544 1.00 13.94 H ATOM 1444 HB3 ALA I 7 172.395 14.223 -4.371 1.00 14.03 H ATOM 1445 N SER I 8 172.822 17.069 -7.374 1.00 13.19 N ATOM 1446 CA SER I 8 172.874 18.524 -7.699 1.00 12.76 C ATOM 1447 C SER I 8 171.889 18.848 -8.826 1.00 11.89 C ATOM 1448 O SER I 8 171.414 17.970 -9.519 1.00 12.01 O ATOM 1449 CB SER I 8 174.311 18.777 -8.152 1.00 13.49 C ATOM 1450 OG SER I 8 174.811 19.939 -7.502 1.00 13.82 O ATOM 1451 H SER I 8 173.470 16.454 -7.777 1.00 13.48 H ATOM 1452 HA SER I 8 172.654 19.114 -6.823 1.00 12.80 H ATOM 1453 HB2 SER I 8 174.927 17.933 -7.891 1.00 13.79 H ATOM 1454 HB3 SER I 8 174.330 18.916 -9.225 1.00 13.62 H ATOM 1455 HG SER I 8 174.550 20.704 -8.020 1.00 14.00 H ATOM 1456 N ALA I 9 171.577 20.101 -9.014 1.00 11.18 N ATOM 1457 CA ALA I 9 170.621 20.476 -10.096 1.00 10.47 C ATOM 1458 C ALA I 9 169.269 19.787 -9.867 1.00 9.91 C ATOM 1459 O ALA I 9 169.212 18.722 -9.287 1.00 9.70 O ATOM 1460 CB ALA I 9 171.269 19.975 -11.387 1.00 10.44 C ATOM 1461 H ALA I 9 171.969 20.795 -8.444 1.00 11.24 H ATOM 1462 HA ALA I 9 170.497 21.547 -10.136 1.00 10.66 H ATOM 1463 HB1 ALA I 9 170.908 18.982 -11.609 1.00 10.36 H ATOM 1464 HB2 ALA I 9 172.342 19.951 -11.265 1.00 10.45 H ATOM 1465 HB3 ALA I 9 171.014 20.640 -12.199 1.00 10.69 H ATOM 1466 N PRO I 10 168.219 20.421 -10.329 1.00 9.92 N ATOM 1467 CA PRO I 10 166.856 19.861 -10.167 1.00 9.68 C ATOM 1468 C PRO I 10 166.737 18.512 -10.884 1.00 8.80 C ATOM 1469 O PRO I 10 167.719 17.840 -11.129 1.00 8.80 O ATOM 1470 CB PRO I 10 165.974 20.919 -10.836 1.00 10.08 C ATOM 1471 CG PRO I 10 166.874 22.055 -11.360 1.00 10.55 C ATOM 1472 CD PRO I 10 168.335 21.720 -11.032 1.00 10.46 C ATOM 1473 HA PRO I 10 166.598 19.768 -9.125 1.00 10.10 H ATOM 1474 HB2 PRO I 10 165.433 20.473 -11.659 1.00 9.66 H ATOM 1475 HB3 PRO I 10 165.276 21.318 -10.117 1.00 10.68 H ATOM 1476 HG2 PRO I 10 166.753 22.149 -12.430 1.00 10.37 H ATOM 1477 HG3 PRO I 10 166.602 22.984 -10.881 1.00 11.32 H ATOM 1478 HD2 PRO I 10 168.916 21.620 -11.939 1.00 10.24 H ATOM 1479 HD3 PRO I 10 168.763 22.464 -10.379 1.00 11.16 H ATOM 1480 N ASP I 11 165.541 18.112 -11.219 1.00 8.28 N ATOM 1481 CA ASP I 11 165.358 16.807 -11.917 1.00 7.62 C ATOM 1482 C ASP I 11 166.241 15.732 -11.269 1.00 6.54 C ATOM 1483 O ASP I 11 167.093 15.160 -11.919 1.00 6.60 O ATOM 1484 CB ASP I 11 165.796 17.063 -13.359 1.00 8.20 C ATOM 1485 CG ASP I 11 164.973 16.187 -14.306 1.00 9.03 C ATOM 1486 OD1 ASP I 11 164.514 15.144 -13.869 1.00 9.63 O ATOM 1487 OD2 ASP I 11 164.816 16.573 -15.453 1.00 9.24 O ATOM 1488 H ASP I 11 164.762 18.669 -11.011 1.00 8.49 H ATOM 1489 HA ASP I 11 164.322 16.508 -11.893 1.00 7.81 H ATOM 1490 HB2 ASP I 11 165.640 18.104 -13.603 1.00 8.51 H ATOM 1491 HB3 ASP I 11 166.843 16.821 -13.467 1.00 7.96 H ATOM 1492 N PRO I 12 166.008 15.491 -10.002 1.00 5.77 N ATOM 1493 CA PRO I 12 166.793 14.475 -9.262 1.00 4.80 C ATOM 1494 C PRO I 12 166.600 13.089 -9.883 1.00 4.82 C ATOM 1495 O PRO I 12 165.688 12.866 -10.654 1.00 5.12 O ATOM 1496 CB PRO I 12 166.186 14.538 -7.857 1.00 4.40 C ATOM 1497 CG PRO I 12 165.066 15.597 -7.846 1.00 5.29 C ATOM 1498 CD PRO I 12 164.956 16.213 -9.247 1.00 6.11 C ATOM 1499 HA PRO I 12 167.836 14.743 -9.228 1.00 4.70 H ATOM 1500 HB2 PRO I 12 165.776 13.572 -7.596 1.00 4.12 H ATOM 1501 HB3 PRO I 12 166.948 14.814 -7.144 1.00 4.10 H ATOM 1502 HG2 PRO I 12 164.129 15.131 -7.579 1.00 5.49 H ATOM 1503 HG3 PRO I 12 165.304 16.370 -7.131 1.00 5.41 H ATOM 1504 HD2 PRO I 12 163.978 16.027 -9.670 1.00 6.67 H ATOM 1505 HD3 PRO I 12 165.172 17.269 -9.221 1.00 6.50 H ATOM 1506 N ASP I 13 167.451 12.156 -9.554 1.00 4.83 N ATOM 1507 CA ASP I 13 167.313 10.786 -10.126 1.00 5.18 C ATOM 1508 C ASP I 13 166.312 9.971 -9.303 1.00 4.48 C ATOM 1509 O ASP I 13 165.790 8.971 -9.755 1.00 5.00 O ATOM 1510 CB ASP I 13 168.711 10.174 -10.031 1.00 6.29 C ATOM 1511 CG ASP I 13 169.376 10.199 -11.409 1.00 7.05 C ATOM 1512 OD1 ASP I 13 169.427 11.265 -12.000 1.00 7.61 O ATOM 1513 OD2 ASP I 13 169.823 9.153 -11.849 1.00 7.30 O ATOM 1514 H ASP I 13 168.180 12.356 -8.929 1.00 4.84 H ATOM 1515 HA ASP I 13 167.002 10.837 -11.157 1.00 5.43 H ATOM 1516 HB2 ASP I 13 169.307 10.743 -9.332 1.00 6.51 H ATOM 1517 HB3 ASP I 13 168.635 9.152 -9.690 1.00 6.57 H ATOM 1518 N ASP I 14 166.040 10.392 -8.098 1.00 3.55 N ATOM 1519 CA ASP I 14 165.073 9.643 -7.246 1.00 3.27 C ATOM 1520 C ASP I 14 163.665 10.222 -7.411 1.00 2.18 C ATOM 1521 O ASP I 14 162.809 10.050 -6.566 1.00 2.32 O ATOM 1522 CB ASP I 14 165.569 9.843 -5.813 1.00 3.92 C ATOM 1523 CG ASP I 14 167.044 9.449 -5.722 1.00 4.75 C ATOM 1524 OD1 ASP I 14 167.316 8.264 -5.628 1.00 5.29 O ATOM 1525 OD2 ASP I 14 167.877 10.341 -5.746 1.00 5.16 O ATOM 1526 H ASP I 14 166.472 11.201 -7.753 1.00 3.31 H ATOM 1527 HA ASP I 14 165.082 8.594 -7.496 1.00 3.77 H ATOM 1528 HB2 ASP I 14 165.454 10.881 -5.536 1.00 4.33 H ATOM 1529 HB3 ASP I 14 164.991 9.225 -5.143 1.00 3.74 H ATOM 1530 N VAL I 15 163.419 10.909 -8.493 1.00 1.66 N ATOM 1531 CA VAL I 15 162.067 11.499 -8.709 1.00 1.10 C ATOM 1532 C VAL I 15 161.107 10.442 -9.262 1.00 1.01 C ATOM 1533 O VAL I 15 160.710 10.490 -10.410 1.00 1.69 O ATOM 1534 CB VAL I 15 162.280 12.615 -9.732 1.00 1.73 C ATOM 1535 CG1 VAL I 15 163.254 13.650 -9.166 1.00 2.52 C ATOM 1536 CG2 VAL I 15 162.859 12.023 -11.018 1.00 2.29 C ATOM 1537 H VAL I 15 164.123 11.037 -9.163 1.00 2.20 H ATOM 1538 HA VAL I 15 161.684 11.911 -7.789 1.00 1.47 H ATOM 1539 HB VAL I 15 161.334 13.092 -9.946 1.00 2.15 H ATOM 1540 HG11 VAL I 15 163.825 14.086 -9.972 1.00 3.06 H ATOM 1541 HG12 VAL I 15 163.924 13.170 -8.468 1.00 2.74 H ATOM 1542 HG13 VAL I 15 162.700 14.425 -8.657 1.00 2.98 H ATOM 1543 HG21 VAL I 15 163.167 11.003 -10.839 1.00 2.77 H ATOM 1544 HG22 VAL I 15 163.712 12.607 -11.331 1.00 2.66 H ATOM 1545 HG23 VAL I 15 162.107 12.041 -11.793 1.00 2.62 H ATOM 1546 N ARG I 16 160.730 9.487 -8.456 1.00 0.88 N ATOM 1547 CA ARG I 16 159.795 8.431 -8.939 1.00 0.73 C ATOM 1548 C ARG I 16 160.443 7.627 -10.073 1.00 0.70 C ATOM 1549 O ARG I 16 159.961 7.639 -11.188 1.00 0.68 O ATOM 1550 CB ARG I 16 158.573 9.193 -9.454 1.00 0.75 C ATOM 1551 CG ARG I 16 157.367 8.889 -8.564 1.00 0.81 C ATOM 1552 CD ARG I 16 156.569 10.175 -8.332 1.00 1.26 C ATOM 1553 NE ARG I 16 157.192 10.802 -7.133 1.00 1.48 N ATOM 1554 CZ ARG I 16 157.188 12.100 -7.000 1.00 1.81 C ATOM 1555 NH1 ARG I 16 156.072 12.726 -6.743 1.00 2.11 N ATOM 1556 NH2 ARG I 16 158.299 12.773 -7.125 1.00 2.49 N ATOM 1557 H ARG I 16 161.060 9.466 -7.533 1.00 1.43 H ATOM 1558 HA ARG I 16 159.509 7.780 -8.128 1.00 0.73 H ATOM 1559 HB2 ARG I 16 158.778 10.253 -9.435 1.00 0.89 H ATOM 1560 HB3 ARG I 16 158.358 8.885 -10.466 1.00 0.70 H ATOM 1561 HG2 ARG I 16 156.738 8.156 -9.048 1.00 0.83 H ATOM 1562 HG3 ARG I 16 157.707 8.503 -7.615 1.00 0.91 H ATOM 1563 HD2 ARG I 16 156.655 10.828 -9.189 1.00 1.90 H ATOM 1564 HD3 ARG I 16 155.534 9.945 -8.133 1.00 1.85 H ATOM 1565 HE ARG I 16 157.605 10.240 -6.445 1.00 2.00 H ATOM 1566 HH11 ARG I 16 155.221 12.211 -6.647 1.00 2.43 H ATOM 1567 HH12 ARG I 16 156.069 13.721 -6.640 1.00 2.44 H ATOM 1568 HH21 ARG I 16 159.154 12.293 -7.323 1.00 2.94 H ATOM 1569 HH22 ARG I 16 158.296 13.767 -7.023 1.00 2.85 H ATOM 1570 N PRO I 17 161.521 6.953 -9.754 1.00 0.78 N ATOM 1571 CA PRO I 17 162.240 6.138 -10.763 1.00 0.88 C ATOM 1572 C PRO I 17 161.354 4.994 -11.272 1.00 0.78 C ATOM 1573 O PRO I 17 161.705 3.836 -11.171 1.00 0.87 O ATOM 1574 CB PRO I 17 163.432 5.594 -9.968 1.00 1.04 C ATOM 1575 CG PRO I 17 163.346 6.121 -8.522 1.00 1.04 C ATOM 1576 CD PRO I 17 162.078 6.972 -8.381 1.00 0.89 C ATOM 1577 HA PRO I 17 162.587 6.751 -11.578 1.00 0.95 H ATOM 1578 HB2 PRO I 17 163.402 4.514 -9.964 1.00 1.07 H ATOM 1579 HB3 PRO I 17 164.353 5.931 -10.419 1.00 1.18 H ATOM 1580 HG2 PRO I 17 163.304 5.288 -7.835 1.00 1.07 H ATOM 1581 HG3 PRO I 17 164.212 6.728 -8.305 1.00 1.17 H ATOM 1582 HD2 PRO I 17 161.391 6.520 -7.677 1.00 0.85 H ATOM 1583 HD3 PRO I 17 162.322 7.982 -8.089 1.00 0.95 H ATOM 1584 N LEU I 18 160.213 5.311 -11.821 1.00 0.68 N ATOM 1585 CA LEU I 18 159.307 4.243 -12.340 1.00 0.64 C ATOM 1586 C LEU I 18 158.946 3.258 -11.223 1.00 0.60 C ATOM 1587 O LEU I 18 159.800 2.610 -10.651 1.00 0.78 O ATOM 1588 CB LEU I 18 160.109 3.542 -13.437 1.00 0.82 C ATOM 1589 CG LEU I 18 159.896 4.267 -14.767 1.00 1.17 C ATOM 1590 CD1 LEU I 18 160.901 3.749 -15.798 1.00 1.81 C ATOM 1591 CD2 LEU I 18 158.474 4.007 -15.268 1.00 1.40 C ATOM 1592 H LEU I 18 159.950 6.252 -11.896 1.00 0.68 H ATOM 1593 HA LEU I 18 158.414 4.679 -12.759 1.00 0.59 H ATOM 1594 HB2 LEU I 18 161.158 3.556 -13.182 1.00 1.12 H ATOM 1595 HB3 LEU I 18 159.775 2.519 -13.530 1.00 1.32 H ATOM 1596 HG LEU I 18 160.042 5.329 -14.625 1.00 1.55 H ATOM 1597 HD11 LEU I 18 160.371 3.267 -16.606 1.00 2.27 H ATOM 1598 HD12 LEU I 18 161.565 3.039 -15.328 1.00 2.12 H ATOM 1599 HD13 LEU I 18 161.476 4.576 -16.187 1.00 2.20 H ATOM 1600 HD21 LEU I 18 157.765 4.307 -14.511 1.00 1.65 H ATOM 1601 HD22 LEU I 18 158.353 2.954 -15.477 1.00 1.86 H ATOM 1602 HD23 LEU I 18 158.300 4.575 -16.170 1.00 1.84 H ATOM 1603 N LYS I 19 157.685 3.139 -10.911 1.00 0.58 N ATOM 1604 CA LYS I 19 157.266 2.196 -9.833 1.00 0.54 C ATOM 1605 C LYS I 19 156.439 1.048 -10.426 1.00 0.51 C ATOM 1606 O LYS I 19 155.231 1.145 -10.525 1.00 0.53 O ATOM 1607 CB LYS I 19 156.411 3.038 -8.884 1.00 0.58 C ATOM 1608 CG LYS I 19 156.920 2.873 -7.451 1.00 0.81 C ATOM 1609 CD LYS I 19 157.465 4.210 -6.945 1.00 1.13 C ATOM 1610 CE LYS I 19 158.931 4.044 -6.541 1.00 1.60 C ATOM 1611 NZ LYS I 19 158.892 3.285 -5.260 1.00 2.20 N ATOM 1612 H LYS I 19 157.011 3.669 -11.386 1.00 0.72 H ATOM 1613 HA LYS I 19 158.128 1.809 -9.310 1.00 0.57 H ATOM 1614 HB2 LYS I 19 156.474 4.078 -9.171 1.00 0.64 H ATOM 1615 HB3 LYS I 19 155.384 2.712 -8.939 1.00 0.62 H ATOM 1616 HG2 LYS I 19 156.108 2.550 -6.816 1.00 1.04 H ATOM 1617 HG3 LYS I 19 157.708 2.135 -7.432 1.00 1.16 H ATOM 1618 HD2 LYS I 19 157.388 4.949 -7.730 1.00 1.75 H ATOM 1619 HD3 LYS I 19 156.891 4.532 -6.089 1.00 1.60 H ATOM 1620 HE2 LYS I 19 159.467 3.486 -7.296 1.00 2.10 H ATOM 1621 HE3 LYS I 19 159.390 5.008 -6.386 1.00 2.09 H ATOM 1622 HZ1 LYS I 19 158.036 2.695 -5.232 1.00 2.62 H ATOM 1623 HZ2 LYS I 19 158.879 3.953 -4.462 1.00 2.67 H ATOM 1624 HZ3 LYS I 19 159.731 2.677 -5.191 1.00 2.52 H ATOM 1625 N PRO I 20 157.117 -0.010 -10.801 1.00 0.52 N ATOM 1626 CA PRO I 20 156.434 -1.188 -11.386 1.00 0.54 C ATOM 1627 C PRO I 20 155.474 -1.809 -10.366 1.00 0.58 C ATOM 1628 O PRO I 20 155.810 -2.750 -9.675 1.00 1.10 O ATOM 1629 CB PRO I 20 157.599 -2.134 -11.694 1.00 0.59 C ATOM 1630 CG PRO I 20 158.915 -1.454 -11.272 1.00 0.61 C ATOM 1631 CD PRO I 20 158.591 -0.082 -10.665 1.00 0.56 C ATOM 1632 HA PRO I 20 155.917 -0.926 -12.293 1.00 0.54 H ATOM 1633 HB2 PRO I 20 157.472 -3.056 -11.144 1.00 0.64 H ATOM 1634 HB3 PRO I 20 157.626 -2.344 -12.753 1.00 0.61 H ATOM 1635 HG2 PRO I 20 159.421 -2.066 -10.540 1.00 0.65 H ATOM 1636 HG3 PRO I 20 159.549 -1.323 -12.136 1.00 0.64 H ATOM 1637 HD2 PRO I 20 158.887 -0.046 -9.625 1.00 0.59 H ATOM 1638 HD3 PRO I 20 159.059 0.709 -11.229 1.00 0.59 H ATOM 1639 N CYS I 21 154.283 -1.285 -10.266 1.00 0.52 N ATOM 1640 CA CYS I 21 153.304 -1.842 -9.289 1.00 0.51 C ATOM 1641 C CYS I 21 152.513 -2.989 -9.922 1.00 0.49 C ATOM 1642 O CYS I 21 152.439 -3.115 -11.128 1.00 0.68 O ATOM 1643 CB CYS I 21 152.375 -0.676 -8.953 1.00 0.49 C ATOM 1644 SG CYS I 21 152.984 0.175 -7.476 1.00 0.75 S ATOM 1645 H CYS I 21 154.033 -0.524 -10.831 1.00 0.89 H ATOM 1646 HA CYS I 21 153.809 -2.178 -8.398 1.00 0.55 H ATOM 1647 HB2 CYS I 21 152.350 0.015 -9.782 1.00 0.53 H ATOM 1648 HB3 CYS I 21 151.379 -1.051 -8.767 1.00 0.64 H ATOM 1649 HG CYS I 21 153.623 0.834 -7.756 1.00 1.14 H ATOM 1650 N LEU I 22 151.917 -3.824 -9.115 1.00 0.40 N ATOM 1651 CA LEU I 22 151.127 -4.961 -9.668 1.00 0.40 C ATOM 1652 C LEU I 22 149.630 -4.667 -9.542 1.00 0.36 C ATOM 1653 O LEU I 22 149.048 -4.804 -8.485 1.00 0.50 O ATOM 1654 CB LEU I 22 151.514 -6.165 -8.810 1.00 0.43 C ATOM 1655 CG LEU I 22 153.034 -6.212 -8.653 1.00 0.45 C ATOM 1656 CD1 LEU I 22 153.412 -7.317 -7.666 1.00 0.53 C ATOM 1657 CD2 LEU I 22 153.678 -6.502 -10.012 1.00 0.49 C ATOM 1658 H LEU I 22 151.987 -3.702 -8.146 1.00 0.47 H ATOM 1659 HA LEU I 22 151.392 -5.140 -10.698 1.00 0.42 H ATOM 1660 HB2 LEU I 22 151.053 -6.077 -7.837 1.00 0.44 H ATOM 1661 HB3 LEU I 22 151.175 -7.072 -9.289 1.00 0.46 H ATOM 1662 HG LEU I 22 153.387 -5.261 -8.281 1.00 0.49 H ATOM 1663 HD11 LEU I 22 154.363 -7.743 -7.948 1.00 0.89 H ATOM 1664 HD12 LEU I 22 152.655 -8.087 -7.680 1.00 1.11 H ATOM 1665 HD13 LEU I 22 153.484 -6.902 -6.671 1.00 1.22 H ATOM 1666 HD21 LEU I 22 153.807 -7.568 -10.129 1.00 1.13 H ATOM 1667 HD22 LEU I 22 154.640 -6.015 -10.065 1.00 1.08 H ATOM 1668 HD23 LEU I 22 153.041 -6.127 -10.799 1.00 1.12 H ATOM 1669 N LEU I 23 149.004 -4.260 -10.612 1.00 0.30 N ATOM 1670 CA LEU I 23 147.546 -3.955 -10.550 1.00 0.28 C ATOM 1671 C LEU I 23 146.730 -5.248 -10.619 1.00 0.35 C ATOM 1672 O LEU I 23 147.095 -6.189 -11.295 1.00 0.53 O ATOM 1673 CB LEU I 23 147.272 -3.081 -11.775 1.00 0.37 C ATOM 1674 CG LEU I 23 147.220 -1.612 -11.353 1.00 0.46 C ATOM 1675 CD1 LEU I 23 146.064 -1.403 -10.373 1.00 0.53 C ATOM 1676 CD2 LEU I 23 148.538 -1.231 -10.675 1.00 0.49 C ATOM 1677 H LEU I 23 149.492 -4.153 -11.455 1.00 0.38 H ATOM 1678 HA LEU I 23 147.313 -3.409 -9.649 1.00 0.25 H ATOM 1679 HB2 LEU I 23 148.060 -3.221 -12.500 1.00 0.43 H ATOM 1680 HB3 LEU I 23 146.326 -3.362 -12.213 1.00 0.45 H ATOM 1681 HG LEU I 23 147.069 -0.993 -12.225 1.00 0.59 H ATOM 1682 HD11 LEU I 23 145.325 -2.176 -10.517 1.00 1.11 H ATOM 1683 HD12 LEU I 23 145.614 -0.437 -10.549 1.00 1.18 H ATOM 1684 HD13 LEU I 23 146.439 -1.446 -9.361 1.00 1.18 H ATOM 1685 HD21 LEU I 23 148.608 -0.155 -10.605 1.00 1.16 H ATOM 1686 HD22 LEU I 23 149.365 -1.609 -11.257 1.00 1.21 H ATOM 1687 HD23 LEU I 23 148.569 -1.658 -9.683 1.00 1.00 H ATOM 1688 N ARG I 24 145.628 -5.301 -9.922 1.00 0.29 N ATOM 1689 CA ARG I 24 144.789 -6.533 -9.946 1.00 0.43 C ATOM 1690 C ARG I 24 143.305 -6.161 -9.983 1.00 0.33 C ATOM 1691 O ARG I 24 142.865 -5.253 -9.305 1.00 0.40 O ATOM 1692 CB ARG I 24 145.126 -7.267 -8.648 1.00 0.60 C ATOM 1693 CG ARG I 24 144.202 -8.476 -8.490 1.00 0.90 C ATOM 1694 CD ARG I 24 142.962 -8.071 -7.688 1.00 0.64 C ATOM 1695 NE ARG I 24 143.269 -8.461 -6.284 1.00 0.90 N ATOM 1696 CZ ARG I 24 142.526 -9.345 -5.675 1.00 1.14 C ATOM 1697 NH1 ARG I 24 142.522 -10.585 -6.082 1.00 1.86 N ATOM 1698 NH2 ARG I 24 141.788 -8.989 -4.660 1.00 1.66 N ATOM 1699 H ARG I 24 145.352 -4.531 -9.383 1.00 0.24 H ATOM 1700 HA ARG I 24 145.046 -7.148 -10.794 1.00 0.61 H ATOM 1701 HB2 ARG I 24 146.153 -7.599 -8.679 1.00 1.16 H ATOM 1702 HB3 ARG I 24 144.988 -6.599 -7.811 1.00 1.16 H ATOM 1703 HG2 ARG I 24 143.901 -8.829 -9.466 1.00 1.52 H ATOM 1704 HG3 ARG I 24 144.725 -9.263 -7.967 1.00 1.70 H ATOM 1705 HD2 ARG I 24 142.802 -7.004 -7.759 1.00 0.77 H ATOM 1706 HD3 ARG I 24 142.095 -8.608 -8.040 1.00 0.81 H ATOM 1707 HE ARG I 24 144.028 -8.054 -5.817 1.00 1.27 H ATOM 1708 HH11 ARG I 24 143.087 -10.858 -6.860 1.00 2.44 H ATOM 1709 HH12 ARG I 24 141.953 -11.262 -5.615 1.00 2.18 H ATOM 1710 HH21 ARG I 24 141.792 -8.039 -4.348 1.00 2.19 H ATOM 1711 HH22 ARG I 24 141.219 -9.666 -4.193 1.00 1.99 H ATOM 1712 N ARG I 25 142.529 -6.855 -10.770 1.00 0.47 N ATOM 1713 CA ARG I 25 141.074 -6.540 -10.849 1.00 0.53 C ATOM 1714 C ARG I 25 140.258 -7.625 -10.140 1.00 0.73 C ATOM 1715 O ARG I 25 140.343 -8.792 -10.468 1.00 1.10 O ATOM 1716 CB ARG I 25 140.755 -6.519 -12.344 1.00 0.73 C ATOM 1717 CG ARG I 25 139.290 -6.129 -12.547 1.00 0.88 C ATOM 1718 CD ARG I 25 138.979 -6.066 -14.044 1.00 1.14 C ATOM 1719 NE ARG I 25 137.500 -6.210 -14.135 1.00 1.70 N ATOM 1720 CZ ARG I 25 136.927 -6.337 -15.300 1.00 2.21 C ATOM 1721 NH1 ARG I 25 136.688 -5.280 -16.027 1.00 2.82 N ATOM 1722 NH2 ARG I 25 136.593 -7.520 -15.738 1.00 2.69 N ATOM 1723 H ARG I 25 142.903 -7.583 -11.309 1.00 0.65 H ATOM 1724 HA ARG I 25 140.873 -5.573 -10.416 1.00 0.43 H ATOM 1725 HB2 ARG I 25 141.392 -5.799 -12.838 1.00 1.19 H ATOM 1726 HB3 ARG I 25 140.926 -7.499 -12.763 1.00 1.25 H ATOM 1727 HG2 ARG I 25 138.654 -6.866 -12.077 1.00 1.43 H ATOM 1728 HG3 ARG I 25 139.109 -5.162 -12.103 1.00 1.35 H ATOM 1729 HD2 ARG I 25 139.293 -5.115 -14.452 1.00 1.56 H ATOM 1730 HD3 ARG I 25 139.463 -6.879 -14.564 1.00 1.65 H ATOM 1731 HE ARG I 25 136.957 -6.210 -13.319 1.00 2.16 H ATOM 1732 HH11 ARG I 25 136.943 -4.374 -15.691 1.00 3.10 H ATOM 1733 HH12 ARG I 25 136.248 -5.377 -16.920 1.00 3.31 H ATOM 1734 HH21 ARG I 25 136.777 -8.330 -15.181 1.00 2.91 H ATOM 1735 HH22 ARG I 25 136.154 -7.617 -16.631 1.00 3.17 H ATOM 1736 N ASN I 26 139.469 -7.250 -9.170 1.00 0.79 N ATOM 1737 CA ASN I 26 138.650 -8.261 -8.443 1.00 1.02 C ATOM 1738 C ASN I 26 137.973 -9.207 -9.438 1.00 1.25 C ATOM 1739 O ASN I 26 137.910 -8.936 -10.621 1.00 1.67 O ATOM 1740 CB ASN I 26 137.604 -7.451 -7.677 1.00 1.24 C ATOM 1741 CG ASN I 26 136.999 -8.316 -6.569 1.00 2.16 C ATOM 1742 OD1 ASN I 26 137.584 -8.470 -5.515 1.00 2.99 O ATOM 1743 ND2 ASN I 26 135.844 -8.891 -6.765 1.00 2.56 N ATOM 1744 H ASN I 26 139.415 -6.303 -8.920 1.00 0.91 H ATOM 1745 HA ASN I 26 139.264 -8.817 -7.752 1.00 1.14 H ATOM 1746 HB2 ASN I 26 138.072 -6.580 -7.240 1.00 1.58 H ATOM 1747 HB3 ASN I 26 136.823 -7.139 -8.354 1.00 1.19 H ATOM 1748 HD21 ASN I 26 135.372 -8.766 -7.615 1.00 2.48 H ATOM 1749 HD22 ASN I 26 135.448 -9.447 -6.062 1.00 3.28 H ATOM 1750 N HIS I 27 137.467 -10.315 -8.969 1.00 1.76 N ATOM 1751 CA HIS I 27 136.796 -11.276 -9.891 1.00 2.18 C ATOM 1752 C HIS I 27 137.812 -11.858 -10.878 1.00 1.93 C ATOM 1753 O HIS I 27 137.458 -12.536 -11.821 1.00 1.93 O ATOM 1754 CB HIS I 27 135.744 -10.448 -10.630 1.00 2.63 C ATOM 1755 CG HIS I 27 134.373 -10.975 -10.308 1.00 2.78 C ATOM 1756 ND1 HIS I 27 133.675 -11.798 -11.177 1.00 3.19 N ATOM 1757 CD2 HIS I 27 133.557 -10.804 -9.217 1.00 2.87 C ATOM 1758 CE1 HIS I 27 132.495 -12.090 -10.600 1.00 3.33 C ATOM 1759 NE2 HIS I 27 132.372 -11.509 -9.403 1.00 3.18 N ATOM 1760 H HIS I 27 137.529 -10.515 -8.012 1.00 2.21 H ATOM 1761 HA HIS I 27 136.319 -12.064 -9.331 1.00 2.48 H ATOM 1762 HB2 HIS I 27 135.815 -9.416 -10.319 1.00 2.75 H ATOM 1763 HB3 HIS I 27 135.915 -10.516 -11.694 1.00 2.95 H ATOM 1764 HD1 HIS I 27 133.984 -12.111 -12.053 1.00 3.51 H ATOM 1765 HD2 HIS I 27 133.799 -10.212 -8.346 1.00 2.95 H ATOM 1766 HE1 HIS I 27 131.739 -12.717 -11.049 1.00 3.71 H ATOM 1767 N SER I 28 139.074 -11.598 -10.666 1.00 1.84 N ATOM 1768 CA SER I 28 140.112 -12.137 -11.591 1.00 1.67 C ATOM 1769 C SER I 28 141.480 -12.145 -10.902 1.00 1.45 C ATOM 1770 O SER I 28 142.206 -11.171 -10.929 1.00 1.66 O ATOM 1771 CB SER I 28 140.118 -11.178 -12.781 1.00 1.62 C ATOM 1772 OG SER I 28 139.590 -11.842 -13.922 1.00 1.95 O ATOM 1773 H SER I 28 139.339 -11.050 -9.899 1.00 1.99 H ATOM 1774 HA SER I 28 139.848 -13.129 -11.919 1.00 1.82 H ATOM 1775 HB2 SER I 28 139.508 -10.319 -12.557 1.00 1.78 H ATOM 1776 HB3 SER I 28 141.132 -10.855 -12.977 1.00 1.91 H ATOM 1777 HG SER I 28 139.148 -11.188 -14.468 1.00 2.20 H ATOM 1778 N ARG I 29 141.836 -13.238 -10.284 1.00 1.36 N ATOM 1779 CA ARG I 29 143.156 -13.308 -9.593 1.00 1.30 C ATOM 1780 C ARG I 29 144.293 -13.181 -10.609 1.00 1.17 C ATOM 1781 O ARG I 29 145.000 -14.130 -10.886 1.00 1.71 O ATOM 1782 CB ARG I 29 143.181 -14.684 -8.928 1.00 1.54 C ATOM 1783 CG ARG I 29 142.758 -14.550 -7.464 1.00 1.49 C ATOM 1784 CD ARG I 29 143.999 -14.381 -6.587 1.00 2.10 C ATOM 1785 NE ARG I 29 143.876 -15.433 -5.540 1.00 2.25 N ATOM 1786 CZ ARG I 29 143.168 -15.205 -4.468 1.00 2.77 C ATOM 1787 NH1 ARG I 29 143.540 -14.282 -3.624 1.00 3.32 N ATOM 1788 NH2 ARG I 29 142.087 -15.900 -4.240 1.00 3.30 N ATOM 1789 H ARG I 29 141.236 -14.012 -10.273 1.00 1.57 H ATOM 1790 HA ARG I 29 143.231 -12.535 -8.844 1.00 1.30 H ATOM 1791 HB2 ARG I 29 142.499 -15.345 -9.443 1.00 1.71 H ATOM 1792 HB3 ARG I 29 144.181 -15.089 -8.976 1.00 1.87 H ATOM 1793 HG2 ARG I 29 142.116 -13.688 -7.353 1.00 1.68 H ATOM 1794 HG3 ARG I 29 142.224 -15.438 -7.161 1.00 1.87 H ATOM 1795 HD2 ARG I 29 144.896 -14.532 -7.173 1.00 2.61 H ATOM 1796 HD3 ARG I 29 144.007 -13.404 -6.130 1.00 2.60 H ATOM 1797 HE ARG I 29 144.326 -16.295 -5.656 1.00 2.42 H ATOM 1798 HH11 ARG I 29 144.369 -13.750 -3.798 1.00 3.46 H ATOM 1799 HH12 ARG I 29 142.998 -14.108 -2.802 1.00 3.92 H ATOM 1800 HH21 ARG I 29 141.801 -16.607 -4.888 1.00 3.44 H ATOM 1801 HH22 ARG I 29 141.544 -15.725 -3.419 1.00 3.89 H ATOM 1802 N ASP I 30 144.476 -12.016 -11.167 1.00 0.86 N ATOM 1803 CA ASP I 30 145.569 -11.829 -12.164 1.00 0.86 C ATOM 1804 C ASP I 30 146.259 -10.481 -11.945 1.00 0.74 C ATOM 1805 O ASP I 30 145.676 -9.434 -12.143 1.00 0.87 O ATOM 1806 CB ASP I 30 144.872 -11.861 -13.525 1.00 1.08 C ATOM 1807 CG ASP I 30 145.512 -12.938 -14.402 1.00 1.42 C ATOM 1808 OD1 ASP I 30 145.362 -14.104 -14.079 1.00 2.03 O ATOM 1809 OD2 ASP I 30 146.141 -12.578 -15.384 1.00 1.84 O ATOM 1810 H ASP I 30 143.896 -11.263 -10.929 1.00 1.10 H ATOM 1811 HA ASP I 30 146.282 -12.635 -12.097 1.00 0.96 H ATOM 1812 HB2 ASP I 30 143.823 -12.084 -13.387 1.00 1.33 H ATOM 1813 HB3 ASP I 30 144.976 -10.899 -14.005 1.00 1.17 H ATOM 1814 N GLN I 31 147.499 -10.498 -11.537 1.00 0.65 N ATOM 1815 CA GLN I 31 148.225 -9.217 -11.305 1.00 0.55 C ATOM 1816 C GLN I 31 148.954 -8.784 -12.579 1.00 0.52 C ATOM 1817 O GLN I 31 149.333 -9.599 -13.397 1.00 0.85 O ATOM 1818 CB GLN I 31 149.228 -9.527 -10.193 1.00 0.66 C ATOM 1819 CG GLN I 31 148.796 -8.825 -8.904 1.00 0.71 C ATOM 1820 CD GLN I 31 148.858 -9.814 -7.739 1.00 1.17 C ATOM 1821 OE1 GLN I 31 149.679 -10.710 -7.731 1.00 1.95 O ATOM 1822 NE2 GLN I 31 148.019 -9.689 -6.747 1.00 1.58 N ATOM 1823 H GLN I 31 147.952 -11.353 -11.382 1.00 0.77 H ATOM 1824 HA GLN I 31 147.542 -8.449 -10.980 1.00 0.57 H ATOM 1825 HB2 GLN I 31 149.264 -10.594 -10.028 1.00 1.04 H ATOM 1826 HB3 GLN I 31 150.207 -9.174 -10.482 1.00 0.78 H ATOM 1827 HG2 GLN I 31 149.458 -7.993 -8.708 1.00 0.89 H ATOM 1828 HG3 GLN I 31 147.785 -8.463 -9.013 1.00 0.93 H ATOM 1829 HE21 GLN I 31 147.357 -8.967 -6.754 1.00 2.01 H ATOM 1830 HE22 GLN I 31 148.051 -10.318 -5.996 1.00 1.93 H ATOM 1831 N HIS I 32 149.154 -7.506 -12.754 1.00 0.55 N ATOM 1832 CA HIS I 32 149.859 -7.022 -13.975 1.00 0.55 C ATOM 1833 C HIS I 32 150.984 -6.057 -13.588 1.00 0.53 C ATOM 1834 O HIS I 32 150.763 -5.067 -12.919 1.00 0.59 O ATOM 1835 CB HIS I 32 148.788 -6.296 -14.791 1.00 0.64 C ATOM 1836 CG HIS I 32 147.579 -7.180 -14.932 1.00 0.71 C ATOM 1837 ND1 HIS I 32 147.382 -7.991 -16.038 1.00 1.37 N ATOM 1838 CD2 HIS I 32 146.495 -7.388 -14.117 1.00 0.70 C ATOM 1839 CE1 HIS I 32 146.219 -8.645 -15.860 1.00 1.77 C ATOM 1840 NE2 HIS I 32 145.637 -8.314 -14.704 1.00 1.34 N ATOM 1841 H HIS I 32 148.842 -6.865 -12.082 1.00 0.82 H ATOM 1842 HA HIS I 32 150.252 -7.853 -14.539 1.00 0.61 H ATOM 1843 HB2 HIS I 32 148.510 -5.383 -14.287 1.00 0.99 H ATOM 1844 HB3 HIS I 32 149.179 -6.063 -15.770 1.00 0.93 H ATOM 1845 HD1 HIS I 32 147.981 -8.074 -16.810 1.00 1.59 H ATOM 1846 HD2 HIS I 32 146.332 -6.907 -13.163 1.00 0.56 H ATOM 1847 HE1 HIS I 32 145.807 -9.350 -16.566 1.00 2.39 H ATOM 1848 N GLY I 33 152.189 -6.339 -14.003 1.00 0.57 N ATOM 1849 CA GLY I 33 153.325 -5.438 -13.658 1.00 0.60 C ATOM 1850 C GLY I 33 153.233 -4.158 -14.491 1.00 0.56 C ATOM 1851 O GLY I 33 153.315 -4.188 -15.703 1.00 0.69 O ATOM 1852 H GLY I 33 152.347 -7.142 -14.542 1.00 0.64 H ATOM 1853 HA2 GLY I 33 153.282 -5.190 -12.607 1.00 0.63 H ATOM 1854 HA3 GLY I 33 154.258 -5.936 -13.873 1.00 0.68 H ATOM 1855 N VAL I 34 153.061 -3.033 -13.852 1.00 0.49 N ATOM 1856 CA VAL I 34 152.963 -1.754 -14.611 1.00 0.50 C ATOM 1857 C VAL I 34 153.999 -0.749 -14.099 1.00 0.56 C ATOM 1858 O VAL I 34 153.990 -0.363 -12.947 1.00 1.01 O ATOM 1859 CB VAL I 34 151.543 -1.247 -14.352 1.00 0.50 C ATOM 1860 CG1 VAL I 34 150.551 -2.399 -14.520 1.00 0.46 C ATOM 1861 CG2 VAL I 34 151.446 -0.700 -12.925 1.00 0.59 C ATOM 1862 H VAL I 34 152.996 -3.029 -12.874 1.00 0.55 H ATOM 1863 HA VAL I 34 153.101 -1.932 -15.666 1.00 0.52 H ATOM 1864 HB VAL I 34 151.307 -0.463 -15.057 1.00 0.55 H ATOM 1865 HG11 VAL I 34 150.619 -3.060 -13.669 1.00 1.12 H ATOM 1866 HG12 VAL I 34 150.786 -2.947 -15.421 1.00 1.07 H ATOM 1867 HG13 VAL I 34 149.549 -2.003 -14.590 1.00 1.13 H ATOM 1868 HG21 VAL I 34 151.966 0.245 -12.866 1.00 1.15 H ATOM 1869 HG22 VAL I 34 151.896 -1.403 -12.239 1.00 1.05 H ATOM 1870 HG23 VAL I 34 150.408 -0.557 -12.664 1.00 1.34 H ATOM 1871 N ALA I 35 154.892 -0.321 -14.948 1.00 0.48 N ATOM 1872 CA ALA I 35 155.927 0.660 -14.513 1.00 0.48 C ATOM 1873 C ALA I 35 155.365 2.082 -14.574 1.00 0.43 C ATOM 1874 O ALA I 35 155.212 2.654 -15.636 1.00 0.54 O ATOM 1875 CB ALA I 35 157.075 0.494 -15.509 1.00 0.57 C ATOM 1876 H ALA I 35 154.882 -0.643 -15.874 1.00 0.77 H ATOM 1877 HA ALA I 35 156.269 0.432 -13.516 1.00 0.49 H ATOM 1878 HB1 ALA I 35 156.825 -0.281 -16.219 1.00 1.18 H ATOM 1879 HB2 ALA I 35 157.975 0.220 -14.979 1.00 1.16 H ATOM 1880 HB3 ALA I 35 157.234 1.424 -16.033 1.00 1.08 H ATOM 1881 N ALA I 36 155.054 2.657 -13.445 1.00 0.39 N ATOM 1882 CA ALA I 36 154.500 4.042 -13.445 1.00 0.39 C ATOM 1883 C ALA I 36 155.120 4.861 -12.310 1.00 0.42 C ATOM 1884 O ALA I 36 155.218 4.409 -11.187 1.00 0.52 O ATOM 1885 CB ALA I 36 152.998 3.868 -13.223 1.00 0.38 C ATOM 1886 H ALA I 36 155.183 2.180 -12.598 1.00 0.46 H ATOM 1887 HA ALA I 36 154.679 4.519 -14.396 1.00 0.42 H ATOM 1888 HB1 ALA I 36 152.456 4.471 -13.937 1.00 1.06 H ATOM 1889 HB2 ALA I 36 152.743 4.182 -12.221 1.00 1.11 H ATOM 1890 HB3 ALA I 36 152.732 2.830 -13.353 1.00 1.05 H ATOM 1891 N SER I 37 155.536 6.064 -12.595 1.00 0.44 N ATOM 1892 CA SER I 37 156.147 6.913 -11.532 1.00 0.50 C ATOM 1893 C SER I 37 155.053 7.650 -10.754 1.00 0.51 C ATOM 1894 O SER I 37 154.774 7.340 -9.613 1.00 0.59 O ATOM 1895 CB SER I 37 157.037 7.904 -12.284 1.00 0.58 C ATOM 1896 OG SER I 37 156.774 9.222 -11.821 1.00 1.27 O ATOM 1897 H SER I 37 155.446 6.410 -13.507 1.00 0.50 H ATOM 1898 HA SER I 37 156.745 6.313 -10.865 1.00 0.52 H ATOM 1899 HB2 SER I 37 158.072 7.667 -12.106 1.00 1.29 H ATOM 1900 HB3 SER I 37 156.832 7.836 -13.345 1.00 1.20 H ATOM 1901 HG SER I 37 156.698 9.796 -12.588 1.00 1.42 H ATOM 1902 N SER I 38 154.430 8.620 -11.364 1.00 0.54 N ATOM 1903 CA SER I 38 153.354 9.375 -10.660 1.00 0.62 C ATOM 1904 C SER I 38 152.026 8.619 -10.765 1.00 0.56 C ATOM 1905 O SER I 38 151.792 7.885 -11.705 1.00 0.52 O ATOM 1906 CB SER I 38 153.269 10.713 -11.391 1.00 0.74 C ATOM 1907 OG SER I 38 152.570 11.648 -10.581 1.00 1.47 O ATOM 1908 H SER I 38 154.670 8.853 -12.285 1.00 0.57 H ATOM 1909 HA SER I 38 153.618 9.534 -9.627 1.00 0.68 H ATOM 1910 HB2 SER I 38 154.262 11.084 -11.583 1.00 1.13 H ATOM 1911 HB3 SER I 38 152.751 10.577 -12.331 1.00 1.20 H ATOM 1912 HG SER I 38 153.173 12.362 -10.364 1.00 1.80 H ATOM 1913 N LEU I 39 151.154 8.792 -9.809 1.00 0.69 N ATOM 1914 CA LEU I 39 149.845 8.081 -9.861 1.00 0.70 C ATOM 1915 C LEU I 39 149.262 8.155 -11.272 1.00 0.64 C ATOM 1916 O LEU I 39 148.898 7.156 -11.856 1.00 0.63 O ATOM 1917 CB LEU I 39 148.946 8.823 -8.872 1.00 0.95 C ATOM 1918 CG LEU I 39 147.971 7.837 -8.227 1.00 0.89 C ATOM 1919 CD1 LEU I 39 146.887 8.608 -7.473 1.00 1.18 C ATOM 1920 CD2 LEU I 39 147.320 6.979 -9.315 1.00 1.32 C ATOM 1921 H LEU I 39 151.360 9.389 -9.059 1.00 0.84 H ATOM 1922 HA LEU I 39 149.961 7.054 -9.554 1.00 0.67 H ATOM 1923 HB2 LEU I 39 149.555 9.280 -8.106 1.00 1.21 H ATOM 1924 HB3 LEU I 39 148.390 9.587 -9.394 1.00 1.00 H ATOM 1925 HG LEU I 39 148.506 7.201 -7.536 1.00 0.88 H ATOM 1926 HD11 LEU I 39 146.075 8.838 -8.146 1.00 1.81 H ATOM 1927 HD12 LEU I 39 147.304 9.526 -7.084 1.00 1.66 H ATOM 1928 HD13 LEU I 39 146.519 8.005 -6.656 1.00 1.46 H ATOM 1929 HD21 LEU I 39 147.075 7.599 -10.164 1.00 1.43 H ATOM 1930 HD22 LEU I 39 146.419 6.527 -8.927 1.00 1.97 H ATOM 1931 HD23 LEU I 39 148.008 6.204 -9.622 1.00 1.81 H ATOM 1932 N GLU I 40 149.171 9.333 -11.824 1.00 0.70 N ATOM 1933 CA GLU I 40 148.611 9.470 -13.199 1.00 0.76 C ATOM 1934 C GLU I 40 149.159 8.365 -14.106 1.00 0.65 C ATOM 1935 O GLU I 40 148.436 7.764 -14.875 1.00 0.75 O ATOM 1936 CB GLU I 40 149.082 10.842 -13.682 1.00 0.91 C ATOM 1937 CG GLU I 40 147.875 11.766 -13.854 1.00 1.39 C ATOM 1938 CD GLU I 40 148.358 13.192 -14.126 1.00 1.84 C ATOM 1939 OE1 GLU I 40 149.340 13.338 -14.834 1.00 2.11 O ATOM 1940 OE2 GLU I 40 147.737 14.113 -13.621 1.00 2.56 O ATOM 1941 H GLU I 40 149.471 10.128 -11.336 1.00 0.78 H ATOM 1942 HA GLU I 40 147.533 9.438 -13.172 1.00 0.84 H ATOM 1943 HB2 GLU I 40 149.760 11.266 -12.955 1.00 1.32 H ATOM 1944 HB3 GLU I 40 149.589 10.736 -14.629 1.00 1.46 H ATOM 1945 HG2 GLU I 40 147.275 11.423 -14.685 1.00 2.11 H ATOM 1946 HG3 GLU I 40 147.281 11.755 -12.952 1.00 1.85 H ATOM 1947 N GLU I 41 150.432 8.093 -14.020 1.00 0.53 N ATOM 1948 CA GLU I 41 151.026 7.027 -14.877 1.00 0.54 C ATOM 1949 C GLU I 41 150.465 5.657 -14.484 1.00 0.43 C ATOM 1950 O GLU I 41 150.096 4.862 -15.325 1.00 0.49 O ATOM 1951 CB GLU I 41 152.529 7.089 -14.603 1.00 0.56 C ATOM 1952 CG GLU I 41 153.179 8.096 -15.554 1.00 0.92 C ATOM 1953 CD GLU I 41 154.666 7.769 -15.703 1.00 1.33 C ATOM 1954 OE1 GLU I 41 155.031 6.632 -15.453 1.00 2.00 O ATOM 1955 OE2 GLU I 41 155.415 8.662 -16.063 1.00 1.94 O ATOM 1956 H GLU I 41 150.999 8.589 -13.393 1.00 0.51 H ATOM 1957 HA GLU I 41 150.832 7.229 -15.918 1.00 0.70 H ATOM 1958 HB2 GLU I 41 152.695 7.397 -13.581 1.00 0.72 H ATOM 1959 HB3 GLU I 41 152.964 6.114 -14.761 1.00 0.69 H ATOM 1960 HG2 GLU I 41 152.699 8.040 -16.520 1.00 1.46 H ATOM 1961 HG3 GLU I 41 153.070 9.092 -15.153 1.00 1.64 H ATOM 1962 N LEU I 42 150.398 5.376 -13.211 1.00 0.35 N ATOM 1963 CA LEU I 42 149.861 4.057 -12.767 1.00 0.32 C ATOM 1964 C LEU I 42 148.377 3.940 -13.131 1.00 0.36 C ATOM 1965 O LEU I 42 147.963 3.012 -13.796 1.00 0.45 O ATOM 1966 CB LEU I 42 150.045 4.046 -11.249 1.00 0.36 C ATOM 1967 CG LEU I 42 149.806 2.634 -10.712 1.00 0.38 C ATOM 1968 CD1 LEU I 42 150.601 1.627 -11.544 1.00 0.49 C ATOM 1969 CD2 LEU I 42 150.262 2.560 -9.253 1.00 0.54 C ATOM 1970 H LEU I 42 150.700 6.031 -12.548 1.00 0.39 H ATOM 1971 HA LEU I 42 150.423 3.252 -13.213 1.00 0.35 H ATOM 1972 HB2 LEU I 42 151.051 4.358 -11.007 1.00 0.43 H ATOM 1973 HB3 LEU I 42 149.339 4.726 -10.795 1.00 0.37 H ATOM 1974 HG LEU I 42 148.753 2.400 -10.774 1.00 0.34 H ATOM 1975 HD11 LEU I 42 151.611 1.986 -11.676 1.00 1.05 H ATOM 1976 HD12 LEU I 42 150.132 1.508 -12.510 1.00 1.13 H ATOM 1977 HD13 LEU I 42 150.622 0.675 -11.035 1.00 1.19 H ATOM 1978 HD21 LEU I 42 149.849 1.676 -8.790 1.00 1.13 H ATOM 1979 HD22 LEU I 42 149.920 3.437 -8.724 1.00 1.19 H ATOM 1980 HD23 LEU I 42 151.341 2.515 -9.215 1.00 1.08 H ATOM 1981 N ARG I 43 147.576 4.876 -12.701 1.00 0.38 N ATOM 1982 CA ARG I 43 146.121 4.820 -13.024 1.00 0.45 C ATOM 1983 C ARG I 43 145.923 4.464 -14.499 1.00 0.46 C ATOM 1984 O ARG I 43 145.358 3.441 -14.830 1.00 0.50 O ATOM 1985 CB ARG I 43 145.599 6.229 -12.738 1.00 0.55 C ATOM 1986 CG ARG I 43 144.471 6.157 -11.708 1.00 1.05 C ATOM 1987 CD ARG I 43 143.123 6.107 -12.430 1.00 0.92 C ATOM 1988 NE ARG I 43 142.318 7.200 -11.818 1.00 1.20 N ATOM 1989 CZ ARG I 43 141.802 8.131 -12.573 1.00 1.49 C ATOM 1990 NH1 ARG I 43 140.629 7.954 -13.118 1.00 2.12 N ATOM 1991 NH2 ARG I 43 142.458 9.239 -12.783 1.00 2.14 N ATOM 1992 H ARG I 43 147.931 5.617 -12.167 1.00 0.41 H ATOM 1993 HA ARG I 43 145.621 4.105 -12.391 1.00 0.48 H ATOM 1994 HB2 ARG I 43 146.402 6.839 -12.352 1.00 0.66 H ATOM 1995 HB3 ARG I 43 145.222 6.665 -13.651 1.00 0.90 H ATOM 1996 HG2 ARG I 43 144.591 5.269 -11.104 1.00 1.62 H ATOM 1997 HG3 ARG I 43 144.505 7.031 -11.075 1.00 1.65 H ATOM 1998 HD2 ARG I 43 143.258 6.283 -13.488 1.00 1.06 H ATOM 1999 HD3 ARG I 43 142.642 5.156 -12.264 1.00 1.19 H ATOM 2000 HE ARG I 43 142.175 7.220 -10.849 1.00 1.71 H ATOM 2001 HH11 ARG I 43 140.126 7.105 -12.956 1.00 2.46 H ATOM 2002 HH12 ARG I 43 140.234 8.668 -13.697 1.00 2.69 H ATOM 2003 HH21 ARG I 43 143.357 9.375 -12.366 1.00 2.52 H ATOM 2004 HH22 ARG I 43 142.063 9.952 -13.362 1.00 2.68 H ATOM 2005 N SER I 44 146.386 5.301 -15.388 1.00 0.48 N ATOM 2006 CA SER I 44 146.226 5.009 -16.841 1.00 0.55 C ATOM 2007 C SER I 44 146.575 3.547 -17.127 1.00 0.50 C ATOM 2008 O SER I 44 145.766 2.790 -17.626 1.00 0.57 O ATOM 2009 CB SER I 44 147.210 5.942 -17.543 1.00 0.62 C ATOM 2010 OG SER I 44 146.537 6.640 -18.582 1.00 1.45 O ATOM 2011 H SER I 44 146.841 6.120 -15.099 1.00 0.50 H ATOM 2012 HA SER I 44 145.219 5.226 -17.160 1.00 0.61 H ATOM 2013 HB2 SER I 44 147.603 6.653 -16.835 1.00 1.25 H ATOM 2014 HB3 SER I 44 148.024 5.360 -17.955 1.00 1.16 H ATOM 2015 HG SER I 44 147.090 7.376 -18.853 1.00 1.78 H ATOM 2016 N LYS I 45 147.776 3.142 -16.813 1.00 0.44 N ATOM 2017 CA LYS I 45 148.176 1.729 -17.066 1.00 0.44 C ATOM 2018 C LYS I 45 147.096 0.775 -16.549 1.00 0.40 C ATOM 2019 O LYS I 45 146.752 -0.196 -17.193 1.00 0.50 O ATOM 2020 CB LYS I 45 149.477 1.539 -16.286 1.00 0.45 C ATOM 2021 CG LYS I 45 150.578 2.397 -16.912 1.00 0.62 C ATOM 2022 CD LYS I 45 150.785 1.980 -18.369 1.00 1.23 C ATOM 2023 CE LYS I 45 152.143 2.489 -18.859 1.00 1.77 C ATOM 2024 NZ LYS I 45 152.268 1.974 -20.251 1.00 2.18 N ATOM 2025 H LYS I 45 148.414 3.768 -16.411 1.00 0.45 H ATOM 2026 HA LYS I 45 148.350 1.568 -18.119 1.00 0.50 H ATOM 2027 HB2 LYS I 45 149.326 1.838 -15.259 1.00 0.53 H ATOM 2028 HB3 LYS I 45 149.769 0.501 -16.320 1.00 0.51 H ATOM 2029 HG2 LYS I 45 150.289 3.438 -16.872 1.00 1.14 H ATOM 2030 HG3 LYS I 45 151.498 2.257 -16.366 1.00 1.33 H ATOM 2031 HD2 LYS I 45 150.755 0.903 -18.443 1.00 1.85 H ATOM 2032 HD3 LYS I 45 150.002 2.405 -18.980 1.00 1.81 H ATOM 2033 HE2 LYS I 45 152.162 3.570 -18.851 1.00 2.16 H ATOM 2034 HE3 LYS I 45 152.936 2.093 -18.245 1.00 2.36 H ATOM 2035 HZ1 LYS I 45 153.272 1.937 -20.518 1.00 2.57 H ATOM 2036 HZ2 LYS I 45 151.758 2.607 -20.901 1.00 2.72 H ATOM 2037 HZ3 LYS I 45 151.862 1.019 -20.305 1.00 2.34 H ATOM 2038 N ALA I 46 146.560 1.045 -15.391 1.00 0.36 N ATOM 2039 CA ALA I 46 145.503 0.153 -14.833 1.00 0.37 C ATOM 2040 C ALA I 46 144.234 0.240 -15.686 1.00 0.42 C ATOM 2041 O ALA I 46 143.439 -0.678 -15.727 1.00 0.50 O ATOM 2042 CB ALA I 46 145.240 0.684 -13.424 1.00 0.35 C ATOM 2043 H ALA I 46 146.851 1.833 -14.888 1.00 0.43 H ATOM 2044 HA ALA I 46 145.856 -0.865 -14.784 1.00 0.42 H ATOM 2045 HB1 ALA I 46 144.451 0.108 -12.963 1.00 1.03 H ATOM 2046 HB2 ALA I 46 144.943 1.721 -13.479 1.00 0.96 H ATOM 2047 HB3 ALA I 46 146.140 0.599 -12.833 1.00 1.10 H ATOM 2048 N CYS I 47 144.040 1.335 -16.369 1.00 0.47 N ATOM 2049 CA CYS I 47 142.823 1.476 -17.219 1.00 0.58 C ATOM 2050 C CYS I 47 142.975 0.650 -18.499 1.00 0.60 C ATOM 2051 O CYS I 47 142.059 -0.022 -18.929 1.00 0.79 O ATOM 2052 CB CYS I 47 142.741 2.967 -17.549 1.00 0.66 C ATOM 2053 SG CYS I 47 141.157 3.627 -16.973 1.00 1.36 S ATOM 2054 H CYS I 47 144.694 2.064 -16.324 1.00 0.48 H ATOM 2055 HA CYS I 47 141.944 1.171 -16.674 1.00 0.62 H ATOM 2056 HB2 CYS I 47 143.549 3.490 -17.058 1.00 0.92 H ATOM 2057 HB3 CYS I 47 142.820 3.104 -18.618 1.00 1.20 H ATOM 2058 HG CYS I 47 141.237 4.582 -16.914 1.00 1.64 H ATOM 2059 N GLU I 48 144.128 0.695 -19.110 1.00 0.52 N ATOM 2060 CA GLU I 48 144.341 -0.088 -20.361 1.00 0.56 C ATOM 2061 C GLU I 48 144.593 -1.561 -20.027 1.00 0.54 C ATOM 2062 O GLU I 48 144.341 -2.441 -20.827 1.00 0.63 O ATOM 2063 CB GLU I 48 145.577 0.534 -21.010 1.00 0.58 C ATOM 2064 CG GLU I 48 145.251 0.936 -22.450 1.00 1.03 C ATOM 2065 CD GLU I 48 146.467 1.621 -23.076 1.00 1.45 C ATOM 2066 OE1 GLU I 48 147.233 2.216 -22.337 1.00 2.03 O ATOM 2067 OE2 GLU I 48 146.611 1.539 -24.285 1.00 2.14 O ATOM 2068 H GLU I 48 144.854 1.243 -18.746 1.00 0.56 H ATOM 2069 HA GLU I 48 143.490 0.011 -21.017 1.00 0.60 H ATOM 2070 HB2 GLU I 48 145.876 1.408 -20.450 1.00 0.76 H ATOM 2071 HB3 GLU I 48 146.383 -0.185 -21.013 1.00 0.80 H ATOM 2072 HG2 GLU I 48 144.999 0.055 -23.022 1.00 1.59 H ATOM 2073 HG3 GLU I 48 144.415 1.619 -22.453 1.00 1.74 H ATOM 2074 N LEU I 49 145.087 -1.837 -18.851 1.00 0.49 N ATOM 2075 CA LEU I 49 145.354 -3.253 -18.467 1.00 0.50 C ATOM 2076 C LEU I 49 144.098 -3.882 -17.859 1.00 0.52 C ATOM 2077 O LEU I 49 143.755 -5.011 -18.149 1.00 0.73 O ATOM 2078 CB LEU I 49 146.473 -3.178 -17.429 1.00 0.51 C ATOM 2079 CG LEU I 49 147.828 -3.253 -18.134 1.00 0.58 C ATOM 2080 CD1 LEU I 49 148.418 -1.848 -18.261 1.00 0.74 C ATOM 2081 CD2 LEU I 49 148.778 -4.132 -17.317 1.00 0.59 C ATOM 2082 H LEU I 49 145.283 -1.113 -18.220 1.00 0.50 H ATOM 2083 HA LEU I 49 145.685 -3.820 -19.323 1.00 0.53 H ATOM 2084 HB2 LEU I 49 146.399 -2.246 -16.887 1.00 0.58 H ATOM 2085 HB3 LEU I 49 146.382 -4.004 -16.740 1.00 0.54 H ATOM 2086 HG LEU I 49 147.697 -3.679 -19.118 1.00 0.66 H ATOM 2087 HD11 LEU I 49 147.714 -1.206 -18.770 1.00 1.36 H ATOM 2088 HD12 LEU I 49 149.338 -1.893 -18.825 1.00 1.26 H ATOM 2089 HD13 LEU I 49 148.619 -1.451 -17.276 1.00 1.24 H ATOM 2090 HD21 LEU I 49 148.879 -5.095 -17.797 1.00 0.97 H ATOM 2091 HD22 LEU I 49 148.378 -4.266 -16.323 1.00 1.27 H ATOM 2092 HD23 LEU I 49 149.745 -3.657 -17.256 1.00 1.20 H ATOM 2093 N LEU I 50 143.410 -3.160 -17.018 1.00 0.47 N ATOM 2094 CA LEU I 50 142.176 -3.716 -16.393 1.00 0.50 C ATOM 2095 C LEU I 50 140.936 -3.238 -17.153 1.00 0.57 C ATOM 2096 O LEU I 50 139.822 -3.604 -16.835 1.00 0.66 O ATOM 2097 CB LEU I 50 142.174 -3.167 -14.965 1.00 0.45 C ATOM 2098 CG LEU I 50 143.502 -3.507 -14.287 1.00 0.53 C ATOM 2099 CD1 LEU I 50 143.449 -3.082 -12.818 1.00 0.90 C ATOM 2100 CD2 LEU I 50 143.746 -5.015 -14.372 1.00 0.69 C ATOM 2101 H LEU I 50 143.704 -2.251 -16.798 1.00 0.55 H ATOM 2102 HA LEU I 50 142.215 -4.793 -16.373 1.00 0.57 H ATOM 2103 HB2 LEU I 50 142.046 -2.095 -14.993 1.00 0.60 H ATOM 2104 HB3 LEU I 50 141.364 -3.614 -14.409 1.00 0.58 H ATOM 2105 HG LEU I 50 144.304 -2.981 -14.784 1.00 0.79 H ATOM 2106 HD11 LEU I 50 143.123 -3.916 -12.214 1.00 1.33 H ATOM 2107 HD12 LEU I 50 142.754 -2.263 -12.705 1.00 1.36 H ATOM 2108 HD13 LEU I 50 144.431 -2.767 -12.499 1.00 1.53 H ATOM 2109 HD21 LEU I 50 143.737 -5.323 -15.407 1.00 1.30 H ATOM 2110 HD22 LEU I 50 142.967 -5.536 -13.835 1.00 1.29 H ATOM 2111 HD23 LEU I 50 144.705 -5.250 -13.935 1.00 1.19 H ATOM 2112 N ALA I 51 141.121 -2.424 -18.156 1.00 0.61 N ATOM 2113 CA ALA I 51 139.952 -1.924 -18.935 1.00 0.74 C ATOM 2114 C ALA I 51 139.007 -1.137 -18.024 1.00 0.79 C ATOM 2115 O ALA I 51 137.801 -1.250 -18.117 1.00 0.98 O ATOM 2116 CB ALA I 51 139.262 -3.182 -19.465 1.00 0.86 C ATOM 2117 H ALA I 51 142.027 -2.141 -18.397 1.00 0.60 H ATOM 2118 HA ALA I 51 140.282 -1.310 -19.758 1.00 0.75 H ATOM 2119 HB1 ALA I 51 138.665 -3.622 -18.681 1.00 1.44 H ATOM 2120 HB2 ALA I 51 140.009 -3.891 -19.791 1.00 1.27 H ATOM 2121 HB3 ALA I 51 138.627 -2.920 -20.298 1.00 1.32 H ATOM 2122 N ILE I 52 139.546 -0.340 -17.142 1.00 0.72 N ATOM 2123 CA ILE I 52 138.678 0.453 -16.225 1.00 0.81 C ATOM 2124 C ILE I 52 137.984 1.579 -16.996 1.00 0.98 C ATOM 2125 O ILE I 52 138.461 2.696 -17.046 1.00 1.12 O ATOM 2126 CB ILE I 52 139.632 1.029 -15.178 1.00 0.73 C ATOM 2127 CG1 ILE I 52 140.254 -0.114 -14.373 1.00 0.59 C ATOM 2128 CG2 ILE I 52 138.858 1.954 -14.238 1.00 0.86 C ATOM 2129 CD1 ILE I 52 139.199 -0.721 -13.445 1.00 0.55 C ATOM 2130 H ILE I 52 140.521 -0.264 -17.083 1.00 0.71 H ATOM 2131 HA ILE I 52 137.950 -0.184 -15.749 1.00 0.84 H ATOM 2132 HB ILE I 52 140.412 1.590 -15.673 1.00 0.76 H ATOM 2133 HG12 ILE I 52 140.619 -0.874 -15.049 1.00 0.59 H ATOM 2134 HG13 ILE I 52 141.073 0.266 -13.782 1.00 0.57 H ATOM 2135 HG21 ILE I 52 138.977 2.977 -14.561 1.00 1.42 H ATOM 2136 HG22 ILE I 52 139.239 1.846 -13.233 1.00 1.27 H ATOM 2137 HG23 ILE I 52 137.811 1.691 -14.255 1.00 1.30 H ATOM 2138 HD11 ILE I 52 138.905 0.011 -12.707 1.00 1.15 H ATOM 2139 HD12 ILE I 52 139.611 -1.587 -12.949 1.00 1.03 H ATOM 2140 HD13 ILE I 52 138.336 -1.014 -14.024 1.00 1.20 H ATOM 2141 N ASP I 53 136.861 1.296 -17.596 1.00 1.09 N ATOM 2142 CA ASP I 53 136.138 2.351 -18.363 1.00 1.26 C ATOM 2143 C ASP I 53 136.071 3.645 -17.547 1.00 1.12 C ATOM 2144 O ASP I 53 136.169 3.633 -16.336 1.00 0.99 O ATOM 2145 CB ASP I 53 134.735 1.787 -18.588 1.00 1.39 C ATOM 2146 CG ASP I 53 134.451 1.708 -20.089 1.00 1.84 C ATOM 2147 OD1 ASP I 53 135.225 1.071 -20.785 1.00 2.42 O ATOM 2148 OD2 ASP I 53 133.466 2.286 -20.517 1.00 2.25 O ATOM 2149 H ASP I 53 136.493 0.389 -17.544 1.00 1.13 H ATOM 2150 HA ASP I 53 136.621 2.527 -19.311 1.00 1.44 H ATOM 2151 HB2 ASP I 53 134.672 0.799 -18.156 1.00 1.55 H ATOM 2152 HB3 ASP I 53 134.008 2.433 -18.120 1.00 1.43 H ATOM 2153 N LYS I 54 135.906 4.762 -18.202 1.00 1.22 N ATOM 2154 CA LYS I 54 135.833 6.056 -17.463 1.00 1.17 C ATOM 2155 C LYS I 54 134.497 6.167 -16.723 1.00 1.07 C ATOM 2156 O LYS I 54 134.299 7.047 -15.909 1.00 1.10 O ATOM 2157 CB LYS I 54 135.940 7.135 -18.540 1.00 1.38 C ATOM 2158 CG LYS I 54 136.192 8.492 -17.880 1.00 1.92 C ATOM 2159 CD LYS I 54 137.583 8.998 -18.268 1.00 2.50 C ATOM 2160 CE LYS I 54 137.944 10.211 -17.408 1.00 3.22 C ATOM 2161 NZ LYS I 54 138.605 11.162 -18.345 1.00 3.87 N ATOM 2162 H LYS I 54 135.829 4.751 -19.179 1.00 1.38 H ATOM 2163 HA LYS I 54 136.656 6.142 -16.771 1.00 1.13 H ATOM 2164 HB2 LYS I 54 136.758 6.899 -19.205 1.00 1.47 H ATOM 2165 HB3 LYS I 54 135.019 7.176 -19.102 1.00 1.57 H ATOM 2166 HG2 LYS I 54 135.445 9.198 -18.213 1.00 2.19 H ATOM 2167 HG3 LYS I 54 136.136 8.387 -16.807 1.00 2.26 H ATOM 2168 HD2 LYS I 54 138.309 8.213 -18.108 1.00 2.81 H ATOM 2169 HD3 LYS I 54 137.585 9.283 -19.309 1.00 2.76 H ATOM 2170 HE2 LYS I 54 137.049 10.652 -16.989 1.00 3.52 H ATOM 2171 HE3 LYS I 54 138.628 9.928 -16.625 1.00 3.51 H ATOM 2172 HZ1 LYS I 54 138.166 11.087 -19.284 1.00 4.09 H ATOM 2173 HZ2 LYS I 54 139.617 10.931 -18.415 1.00 4.27 H ATOM 2174 HZ3 LYS I 54 138.494 12.133 -17.990 1.00 4.16 H ATOM 2175 N SER I 55 133.580 5.281 -16.998 1.00 1.07 N ATOM 2176 CA SER I 55 132.259 5.337 -16.309 1.00 1.07 C ATOM 2177 C SER I 55 132.354 4.666 -14.936 1.00 0.98 C ATOM 2178 O SER I 55 131.451 4.752 -14.128 1.00 1.05 O ATOM 2179 CB SER I 55 131.304 4.566 -17.218 1.00 1.21 C ATOM 2180 OG SER I 55 129.972 4.734 -16.749 1.00 1.63 O ATOM 2181 H SER I 55 133.759 4.578 -17.658 1.00 1.15 H ATOM 2182 HA SER I 55 131.929 6.359 -16.208 1.00 1.11 H ATOM 2183 HB2 SER I 55 131.376 4.945 -18.224 1.00 1.52 H ATOM 2184 HB3 SER I 55 131.569 3.517 -17.211 1.00 1.58 H ATOM 2185 HG SER I 55 129.374 4.467 -17.452 1.00 1.94 H ATOM 2186 N LEU I 56 133.443 3.999 -14.667 1.00 0.90 N ATOM 2187 CA LEU I 56 133.597 3.322 -13.347 1.00 0.84 C ATOM 2188 C LEU I 56 134.373 4.219 -12.379 1.00 0.81 C ATOM 2189 O LEU I 56 134.581 3.877 -11.232 1.00 0.89 O ATOM 2190 CB LEU I 56 134.387 2.048 -13.647 1.00 0.77 C ATOM 2191 CG LEU I 56 133.644 1.221 -14.697 1.00 0.94 C ATOM 2192 CD1 LEU I 56 134.647 0.385 -15.493 1.00 1.16 C ATOM 2193 CD2 LEU I 56 132.646 0.292 -14.001 1.00 1.30 C ATOM 2194 H LEU I 56 134.160 3.942 -15.333 1.00 0.92 H ATOM 2195 HA LEU I 56 132.632 3.069 -12.938 1.00 0.94 H ATOM 2196 HB2 LEU I 56 135.366 2.311 -14.022 1.00 0.74 H ATOM 2197 HB3 LEU I 56 134.492 1.467 -12.743 1.00 0.78 H ATOM 2198 HG LEU I 56 133.115 1.883 -15.368 1.00 1.00 H ATOM 2199 HD11 LEU I 56 135.364 -0.058 -14.817 1.00 1.45 H ATOM 2200 HD12 LEU I 56 135.163 1.018 -16.200 1.00 1.52 H ATOM 2201 HD13 LEU I 56 134.124 -0.396 -16.025 1.00 1.70 H ATOM 2202 HD21 LEU I 56 132.165 -0.335 -14.737 1.00 1.76 H ATOM 2203 HD22 LEU I 56 131.902 0.883 -13.488 1.00 1.53 H ATOM 2204 HD23 LEU I 56 133.169 -0.327 -13.287 1.00 1.81 H ATOM 2205 N THR I 57 134.803 5.364 -12.833 1.00 0.85 N ATOM 2206 CA THR I 57 135.565 6.283 -11.939 1.00 0.93 C ATOM 2207 C THR I 57 134.597 7.057 -11.034 1.00 1.09 C ATOM 2208 O THR I 57 133.408 7.071 -11.281 1.00 1.19 O ATOM 2209 CB THR I 57 136.292 7.237 -12.889 1.00 1.05 C ATOM 2210 OG1 THR I 57 135.414 7.613 -13.941 1.00 1.12 O ATOM 2211 CG2 THR I 57 137.522 6.541 -13.473 1.00 1.03 C ATOM 2212 H THR I 57 134.625 5.621 -13.762 1.00 0.91 H ATOM 2213 HA THR I 57 136.278 5.729 -11.354 1.00 0.88 H ATOM 2214 HB THR I 57 136.603 8.117 -12.349 1.00 1.23 H ATOM 2215 HG1 THR I 57 134.992 8.439 -13.694 1.00 1.52 H ATOM 2216 HG21 THR I 57 137.280 5.513 -13.699 1.00 1.32 H ATOM 2217 HG22 THR I 57 138.328 6.572 -12.755 1.00 1.43 H ATOM 2218 HG23 THR I 57 137.826 7.047 -14.378 1.00 1.50 H ATOM 2219 N PRO I 58 135.132 7.691 -10.017 1.00 1.18 N ATOM 2220 CA PRO I 58 136.592 7.657 -9.736 1.00 1.17 C ATOM 2221 C PRO I 58 137.022 6.267 -9.254 1.00 1.07 C ATOM 2222 O PRO I 58 136.451 5.714 -8.336 1.00 1.68 O ATOM 2223 CB PRO I 58 136.735 8.682 -8.606 1.00 1.36 C ATOM 2224 CG PRO I 58 135.342 9.253 -8.277 1.00 1.47 C ATOM 2225 CD PRO I 58 134.295 8.496 -9.102 1.00 1.39 C ATOM 2226 HA PRO I 58 137.163 7.967 -10.594 1.00 1.18 H ATOM 2227 HB2 PRO I 58 137.148 8.201 -7.730 1.00 1.39 H ATOM 2228 HB3 PRO I 58 137.386 9.483 -8.922 1.00 1.47 H ATOM 2229 HG2 PRO I 58 135.138 9.126 -7.223 1.00 1.55 H ATOM 2230 HG3 PRO I 58 135.310 10.302 -8.529 1.00 1.59 H ATOM 2231 HD2 PRO I 58 133.693 7.860 -8.466 1.00 1.45 H ATOM 2232 HD3 PRO I 58 133.677 9.179 -9.662 1.00 1.50 H ATOM 2233 N ILE I 59 138.025 5.700 -9.867 1.00 0.83 N ATOM 2234 CA ILE I 59 138.491 4.348 -9.442 1.00 0.64 C ATOM 2235 C ILE I 59 139.095 4.414 -8.036 1.00 0.60 C ATOM 2236 O ILE I 59 139.519 5.458 -7.581 1.00 0.68 O ATOM 2237 CB ILE I 59 139.556 3.957 -10.465 1.00 0.62 C ATOM 2238 CG1 ILE I 59 138.958 4.024 -11.872 1.00 0.97 C ATOM 2239 CG2 ILE I 59 140.037 2.533 -10.184 1.00 1.09 C ATOM 2240 CD1 ILE I 59 140.081 4.202 -12.896 1.00 0.86 C ATOM 2241 H ILE I 59 138.474 6.163 -10.605 1.00 1.24 H ATOM 2242 HA ILE I 59 137.677 3.643 -9.471 1.00 0.66 H ATOM 2243 HB ILE I 59 140.389 4.639 -10.393 1.00 0.85 H ATOM 2244 HG12 ILE I 59 138.423 3.108 -12.079 1.00 1.41 H ATOM 2245 HG13 ILE I 59 138.279 4.860 -11.937 1.00 1.33 H ATOM 2246 HG21 ILE I 59 140.379 2.464 -9.161 1.00 1.66 H ATOM 2247 HG22 ILE I 59 140.850 2.289 -10.852 1.00 1.61 H ATOM 2248 HG23 ILE I 59 139.223 1.840 -10.339 1.00 1.59 H ATOM 2249 HD11 ILE I 59 140.571 3.254 -13.062 1.00 1.32 H ATOM 2250 HD12 ILE I 59 140.799 4.917 -12.522 1.00 1.12 H ATOM 2251 HD13 ILE I 59 139.666 4.561 -13.826 1.00 1.46 H ATOM 2252 N THR I 60 139.137 3.308 -7.345 1.00 0.53 N ATOM 2253 CA THR I 60 139.714 3.310 -5.969 1.00 0.53 C ATOM 2254 C THR I 60 140.860 2.300 -5.875 1.00 0.48 C ATOM 2255 O THR I 60 140.656 1.105 -5.966 1.00 0.57 O ATOM 2256 CB THR I 60 138.558 2.898 -5.055 1.00 0.61 C ATOM 2257 OG1 THR I 60 137.390 3.624 -5.415 1.00 0.84 O ATOM 2258 CG2 THR I 60 138.922 3.200 -3.601 1.00 0.60 C ATOM 2259 H THR I 60 138.790 2.476 -7.729 1.00 0.53 H ATOM 2260 HA THR I 60 140.058 4.298 -5.706 1.00 0.54 H ATOM 2261 HB THR I 60 138.373 1.841 -5.163 1.00 0.71 H ATOM 2262 HG1 THR I 60 137.319 4.381 -4.830 1.00 1.04 H ATOM 2263 HG21 THR I 60 139.753 3.890 -3.573 1.00 1.18 H ATOM 2264 HG22 THR I 60 139.199 2.283 -3.101 1.00 1.28 H ATOM 2265 HG23 THR I 60 138.072 3.640 -3.101 1.00 1.13 H ATOM 2266 N LEU I 61 142.064 2.769 -5.695 1.00 0.44 N ATOM 2267 CA LEU I 61 143.222 1.834 -5.597 1.00 0.43 C ATOM 2268 C LEU I 61 143.502 1.489 -4.132 1.00 0.48 C ATOM 2269 O LEU I 61 144.189 2.210 -3.436 1.00 0.84 O ATOM 2270 CB LEU I 61 144.401 2.597 -6.201 1.00 0.46 C ATOM 2271 CG LEU I 61 144.022 3.113 -7.589 1.00 0.42 C ATOM 2272 CD1 LEU I 61 144.648 4.491 -7.810 1.00 0.45 C ATOM 2273 CD2 LEU I 61 144.540 2.142 -8.652 1.00 0.65 C ATOM 2274 H LEU I 61 142.208 3.736 -5.625 1.00 0.50 H ATOM 2275 HA LEU I 61 143.032 0.938 -6.166 1.00 0.42 H ATOM 2276 HB2 LEU I 61 144.654 3.431 -5.562 1.00 0.53 H ATOM 2277 HB3 LEU I 61 145.252 1.937 -6.285 1.00 0.51 H ATOM 2278 HG LEU I 61 142.946 3.191 -7.663 1.00 0.66 H ATOM 2279 HD11 LEU I 61 145.575 4.382 -8.354 1.00 1.08 H ATOM 2280 HD12 LEU I 61 144.843 4.955 -6.855 1.00 1.09 H ATOM 2281 HD13 LEU I 61 143.968 5.109 -8.378 1.00 1.22 H ATOM 2282 HD21 LEU I 61 143.711 1.596 -9.076 1.00 1.39 H ATOM 2283 HD22 LEU I 61 145.234 1.449 -8.199 1.00 1.13 H ATOM 2284 HD23 LEU I 61 145.042 2.696 -9.432 1.00 1.09 H ATOM 2285 N VAL I 62 142.977 0.393 -3.658 1.00 0.38 N ATOM 2286 CA VAL I 62 143.217 0.005 -2.238 1.00 0.39 C ATOM 2287 C VAL I 62 144.259 -1.114 -2.165 1.00 0.39 C ATOM 2288 O VAL I 62 144.171 -2.104 -2.864 1.00 0.43 O ATOM 2289 CB VAL I 62 141.863 -0.485 -1.725 1.00 0.44 C ATOM 2290 CG1 VAL I 62 140.894 0.695 -1.635 1.00 0.45 C ATOM 2291 CG2 VAL I 62 141.300 -1.533 -2.687 1.00 0.57 C ATOM 2292 H VAL I 62 142.426 -0.176 -4.235 1.00 0.59 H ATOM 2293 HA VAL I 62 143.541 0.859 -1.665 1.00 0.39 H ATOM 2294 HB VAL I 62 141.988 -0.923 -0.745 1.00 0.50 H ATOM 2295 HG11 VAL I 62 139.926 0.396 -2.008 1.00 1.05 H ATOM 2296 HG12 VAL I 62 141.271 1.516 -2.227 1.00 1.18 H ATOM 2297 HG13 VAL I 62 140.802 1.007 -0.605 1.00 1.09 H ATOM 2298 HG21 VAL I 62 140.448 -1.122 -3.209 1.00 1.15 H ATOM 2299 HG22 VAL I 62 140.995 -2.406 -2.130 1.00 1.13 H ATOM 2300 HG23 VAL I 62 142.060 -1.810 -3.402 1.00 1.22 H ATOM 2301 N LEU I 63 145.245 -0.965 -1.323 1.00 0.40 N ATOM 2302 CA LEU I 63 146.292 -2.020 -1.205 1.00 0.42 C ATOM 2303 C LEU I 63 145.660 -3.350 -0.789 1.00 0.46 C ATOM 2304 O LEU I 63 144.910 -3.420 0.165 1.00 0.52 O ATOM 2305 CB LEU I 63 147.243 -1.516 -0.119 1.00 0.45 C ATOM 2306 CG LEU I 63 147.828 -0.165 -0.536 1.00 0.48 C ATOM 2307 CD1 LEU I 63 148.329 0.578 0.703 1.00 0.50 C ATOM 2308 CD2 LEU I 63 148.995 -0.392 -1.500 1.00 0.59 C ATOM 2309 H LEU I 63 145.297 -0.158 -0.768 1.00 0.43 H ATOM 2310 HA LEU I 63 146.823 -2.130 -2.138 1.00 0.42 H ATOM 2311 HB2 LEU I 63 146.701 -1.403 0.809 1.00 0.50 H ATOM 2312 HB3 LEU I 63 148.045 -2.226 0.016 1.00 0.50 H ATOM 2313 HG LEU I 63 147.064 0.422 -1.024 1.00 0.60 H ATOM 2314 HD11 LEU I 63 147.904 0.129 1.589 1.00 1.16 H ATOM 2315 HD12 LEU I 63 148.030 1.615 0.646 1.00 1.07 H ATOM 2316 HD13 LEU I 63 149.406 0.516 0.749 1.00 1.13 H ATOM 2317 HD21 LEU I 63 149.527 0.537 -1.645 1.00 1.25 H ATOM 2318 HD22 LEU I 63 148.616 -0.741 -2.449 1.00 1.08 H ATOM 2319 HD23 LEU I 63 149.666 -1.130 -1.086 1.00 1.19 H ATOM 2320 N ALA I 64 145.957 -4.406 -1.495 1.00 0.49 N ATOM 2321 CA ALA I 64 145.373 -5.730 -1.138 1.00 0.55 C ATOM 2322 C ALA I 64 145.923 -6.205 0.210 1.00 0.61 C ATOM 2323 O ALA I 64 145.263 -6.910 0.947 1.00 0.73 O ATOM 2324 CB ALA I 64 145.814 -6.672 -2.259 1.00 0.60 C ATOM 2325 H ALA I 64 146.564 -4.328 -2.260 1.00 0.51 H ATOM 2326 HA ALA I 64 144.297 -5.672 -1.108 1.00 0.55 H ATOM 2327 HB1 ALA I 64 146.494 -7.411 -1.862 1.00 1.25 H ATOM 2328 HB2 ALA I 64 146.310 -6.104 -3.032 1.00 1.18 H ATOM 2329 HB3 ALA I 64 144.949 -7.166 -2.676 1.00 1.03 H ATOM 2330 N GLU I 65 147.128 -5.824 0.537 1.00 0.64 N ATOM 2331 CA GLU I 65 147.719 -6.253 1.837 1.00 0.72 C ATOM 2332 C GLU I 65 146.972 -5.596 3.001 1.00 0.75 C ATOM 2333 O GLU I 65 146.463 -6.262 3.880 1.00 1.04 O ATOM 2334 CB GLU I 65 149.169 -5.772 1.791 1.00 0.87 C ATOM 2335 CG GLU I 65 149.892 -6.437 0.617 1.00 1.18 C ATOM 2336 CD GLU I 65 151.402 -6.395 0.857 1.00 1.86 C ATOM 2337 OE1 GLU I 65 151.869 -7.142 1.701 1.00 2.37 O ATOM 2338 OE2 GLU I 65 152.066 -5.617 0.192 1.00 2.57 O ATOM 2339 H GLU I 65 147.644 -5.255 -0.072 1.00 0.69 H ATOM 2340 HA GLU I 65 147.690 -7.327 1.928 1.00 0.73 H ATOM 2341 HB2 GLU I 65 149.188 -4.699 1.665 1.00 1.26 H ATOM 2342 HB3 GLU I 65 149.666 -6.035 2.712 1.00 1.31 H ATOM 2343 HG2 GLU I 65 149.568 -7.464 0.532 1.00 1.62 H ATOM 2344 HG3 GLU I 65 149.659 -5.909 -0.295 1.00 1.63 H ATOM 2345 N ASP I 66 146.902 -4.293 3.012 1.00 0.74 N ATOM 2346 CA ASP I 66 146.189 -3.593 4.119 1.00 0.82 C ATOM 2347 C ASP I 66 144.787 -3.176 3.664 1.00 0.72 C ATOM 2348 O ASP I 66 143.803 -3.452 4.320 1.00 0.88 O ATOM 2349 CB ASP I 66 147.042 -2.362 4.424 1.00 0.97 C ATOM 2350 CG ASP I 66 148.011 -2.683 5.564 1.00 1.21 C ATOM 2351 OD1 ASP I 66 147.696 -3.557 6.355 1.00 1.77 O ATOM 2352 OD2 ASP I 66 149.051 -2.049 5.627 1.00 1.65 O ATOM 2353 H ASP I 66 147.320 -3.774 2.293 1.00 0.89 H ATOM 2354 HA ASP I 66 146.130 -4.227 4.990 1.00 0.95 H ATOM 2355 HB2 ASP I 66 147.602 -2.085 3.542 1.00 1.12 H ATOM 2356 HB3 ASP I 66 146.403 -1.544 4.717 1.00 1.19 H ATOM 2357 N GLY I 67 144.690 -2.514 2.543 1.00 0.55 N ATOM 2358 CA GLY I 67 143.354 -2.080 2.047 1.00 0.52 C ATOM 2359 C GLY I 67 143.234 -0.559 2.160 1.00 0.48 C ATOM 2360 O GLY I 67 142.177 0.007 1.965 1.00 0.57 O ATOM 2361 H GLY I 67 145.497 -2.302 2.028 1.00 0.55 H ATOM 2362 HA2 GLY I 67 143.240 -2.376 1.014 1.00 0.50 H ATOM 2363 HA3 GLY I 67 142.581 -2.543 2.642 1.00 0.62 H ATOM 2364 N THR I 68 144.311 0.108 2.474 1.00 0.45 N ATOM 2365 CA THR I 68 144.258 1.593 2.599 1.00 0.42 C ATOM 2366 C THR I 68 143.977 2.231 1.236 1.00 0.44 C ATOM 2367 O THR I 68 144.689 2.007 0.277 1.00 0.47 O ATOM 2368 CB THR I 68 145.644 1.997 3.103 1.00 0.44 C ATOM 2369 OG1 THR I 68 145.859 1.437 4.391 1.00 0.50 O ATOM 2370 CG2 THR I 68 145.736 3.521 3.185 1.00 0.48 C ATOM 2371 H THR I 68 145.154 -0.366 2.628 1.00 0.52 H ATOM 2372 HA THR I 68 143.506 1.885 3.315 1.00 0.42 H ATOM 2373 HB THR I 68 146.396 1.631 2.421 1.00 0.49 H ATOM 2374 HG1 THR I 68 146.026 0.498 4.283 1.00 0.95 H ATOM 2375 HG21 THR I 68 145.235 3.865 4.078 1.00 1.10 H ATOM 2376 HG22 THR I 68 145.264 3.957 2.317 1.00 1.08 H ATOM 2377 HG23 THR I 68 146.774 3.818 3.217 1.00 1.10 H ATOM 2378 N ILE I 69 142.946 3.025 1.143 1.00 0.47 N ATOM 2379 CA ILE I 69 142.623 3.677 -0.159 1.00 0.49 C ATOM 2380 C ILE I 69 143.762 4.609 -0.578 1.00 0.50 C ATOM 2381 O ILE I 69 144.203 5.447 0.183 1.00 0.66 O ATOM 2382 CB ILE I 69 141.347 4.476 0.103 1.00 0.50 C ATOM 2383 CG1 ILE I 69 140.228 3.523 0.528 1.00 0.56 C ATOM 2384 CG2 ILE I 69 140.934 5.210 -1.174 1.00 0.63 C ATOM 2385 CD1 ILE I 69 139.253 4.258 1.448 1.00 0.79 C ATOM 2386 H ILE I 69 142.385 3.194 1.928 1.00 0.50 H ATOM 2387 HA ILE I 69 142.443 2.933 -0.919 1.00 0.53 H ATOM 2388 HB ILE I 69 141.529 5.195 0.889 1.00 0.46 H ATOM 2389 HG12 ILE I 69 139.703 3.171 -0.349 1.00 0.77 H ATOM 2390 HG13 ILE I 69 140.652 2.681 1.055 1.00 0.89 H ATOM 2391 HG21 ILE I 69 141.811 5.422 -1.767 1.00 0.98 H ATOM 2392 HG22 ILE I 69 140.442 6.135 -0.913 1.00 1.17 H ATOM 2393 HG23 ILE I 69 140.256 4.590 -1.742 1.00 1.30 H ATOM 2394 HD11 ILE I 69 139.234 5.306 1.188 1.00 1.40 H ATOM 2395 HD12 ILE I 69 139.572 4.148 2.473 1.00 1.23 H ATOM 2396 HD13 ILE I 69 138.264 3.841 1.331 1.00 1.41 H ATOM 2397 N VAL I 70 144.240 4.470 -1.783 1.00 0.47 N ATOM 2398 CA VAL I 70 145.350 5.349 -2.249 1.00 0.49 C ATOM 2399 C VAL I 70 144.823 6.379 -3.251 1.00 0.49 C ATOM 2400 O VAL I 70 145.117 6.321 -4.428 1.00 0.59 O ATOM 2401 CB VAL I 70 146.344 4.406 -2.925 1.00 0.54 C ATOM 2402 CG1 VAL I 70 147.644 5.158 -3.216 1.00 0.65 C ATOM 2403 CG2 VAL I 70 146.637 3.224 -1.997 1.00 0.56 C ATOM 2404 H VAL I 70 143.870 3.788 -2.382 1.00 0.55 H ATOM 2405 HA VAL I 70 145.819 5.841 -1.412 1.00 0.50 H ATOM 2406 HB VAL I 70 145.923 4.043 -3.852 1.00 0.55 H ATOM 2407 HG11 VAL I 70 147.861 5.104 -4.273 1.00 1.12 H ATOM 2408 HG12 VAL I 70 148.452 4.708 -2.659 1.00 1.25 H ATOM 2409 HG13 VAL I 70 147.535 6.191 -2.923 1.00 0.99 H ATOM 2410 HG21 VAL I 70 146.125 2.346 -2.361 1.00 1.30 H ATOM 2411 HG22 VAL I 70 146.291 3.455 -1.000 1.00 1.20 H ATOM 2412 HG23 VAL I 70 147.700 3.038 -1.975 1.00 0.96 H ATOM 2413 N ASP I 71 144.046 7.323 -2.794 1.00 0.46 N ATOM 2414 CA ASP I 71 143.504 8.354 -3.724 1.00 0.48 C ATOM 2415 C ASP I 71 144.476 9.532 -3.830 1.00 0.54 C ATOM 2416 O ASP I 71 144.090 10.644 -4.131 1.00 0.76 O ATOM 2417 CB ASP I 71 142.182 8.798 -3.097 1.00 0.55 C ATOM 2418 CG ASP I 71 141.093 8.823 -4.171 1.00 1.17 C ATOM 2419 OD1 ASP I 71 141.407 8.529 -5.313 1.00 1.88 O ATOM 2420 OD2 ASP I 71 139.963 9.134 -3.834 1.00 1.75 O ATOM 2421 H ASP I 71 143.820 7.354 -1.841 1.00 0.47 H ATOM 2422 HA ASP I 71 143.325 7.925 -4.697 1.00 0.46 H ATOM 2423 HB2 ASP I 71 141.903 8.106 -2.316 1.00 0.83 H ATOM 2424 HB3 ASP I 71 142.295 9.787 -2.679 1.00 0.84 H ATOM 2425 N ASP I 72 145.736 9.294 -3.590 1.00 0.42 N ATOM 2426 CA ASP I 72 146.736 10.396 -3.681 1.00 0.46 C ATOM 2427 C ASP I 72 147.927 9.950 -4.533 1.00 0.44 C ATOM 2428 O ASP I 72 147.914 8.889 -5.125 1.00 0.48 O ATOM 2429 CB ASP I 72 147.175 10.655 -2.239 1.00 0.49 C ATOM 2430 CG ASP I 72 148.016 9.479 -1.742 1.00 1.58 C ATOM 2431 OD1 ASP I 72 147.495 8.376 -1.706 1.00 2.46 O ATOM 2432 OD2 ASP I 72 149.168 9.700 -1.405 1.00 2.19 O ATOM 2433 H ASP I 72 146.026 8.388 -3.352 1.00 0.42 H ATOM 2434 HA ASP I 72 146.285 11.283 -4.096 1.00 0.55 H ATOM 2435 HB2 ASP I 72 147.763 11.561 -2.200 1.00 0.99 H ATOM 2436 HB3 ASP I 72 146.304 10.763 -1.611 1.00 1.06 H ATOM 2437 N ASP I 73 148.957 10.747 -4.601 1.00 0.57 N ATOM 2438 CA ASP I 73 150.142 10.359 -5.418 1.00 0.70 C ATOM 2439 C ASP I 73 151.436 10.770 -4.712 1.00 0.59 C ATOM 2440 O ASP I 73 152.431 11.065 -5.342 1.00 0.63 O ATOM 2441 CB ASP I 73 149.983 11.119 -6.733 1.00 0.91 C ATOM 2442 CG ASP I 73 150.142 12.620 -6.480 1.00 1.02 C ATOM 2443 OD1 ASP I 73 150.084 13.016 -5.328 1.00 1.47 O ATOM 2444 OD2 ASP I 73 150.320 13.347 -7.443 1.00 1.65 O ATOM 2445 H ASP I 73 148.951 11.600 -4.117 1.00 0.69 H ATOM 2446 HA ASP I 73 150.137 9.297 -5.606 1.00 0.82 H ATOM 2447 HB2 ASP I 73 150.738 10.788 -7.431 1.00 1.14 H ATOM 2448 HB3 ASP I 73 149.004 10.927 -7.143 1.00 1.16 H ATOM 2449 N ASP I 74 151.431 10.788 -3.408 1.00 0.56 N ATOM 2450 CA ASP I 74 152.663 11.176 -2.664 1.00 0.53 C ATOM 2451 C ASP I 74 152.964 10.146 -1.572 1.00 0.61 C ATOM 2452 O ASP I 74 153.926 10.268 -0.839 1.00 0.91 O ATOM 2453 CB ASP I 74 152.342 12.536 -2.044 1.00 0.55 C ATOM 2454 CG ASP I 74 153.019 13.641 -2.858 1.00 1.00 C ATOM 2455 OD1 ASP I 74 154.033 13.358 -3.474 1.00 1.68 O ATOM 2456 OD2 ASP I 74 152.513 14.751 -2.849 1.00 1.58 O ATOM 2457 H ASP I 74 150.618 10.544 -2.917 1.00 0.63 H ATOM 2458 HA ASP I 74 153.498 11.266 -3.340 1.00 0.56 H ATOM 2459 HB2 ASP I 74 151.272 12.690 -2.048 1.00 0.72 H ATOM 2460 HB3 ASP I 74 152.707 12.565 -1.029 1.00 0.78 H ATOM 2461 N TYR I 75 152.149 9.133 -1.456 1.00 0.57 N ATOM 2462 CA TYR I 75 152.391 8.099 -0.409 1.00 0.65 C ATOM 2463 C TYR I 75 152.359 6.695 -1.019 1.00 0.89 C ATOM 2464 O TYR I 75 152.677 5.720 -0.367 1.00 1.13 O ATOM 2465 CB TYR I 75 151.245 8.271 0.589 1.00 0.55 C ATOM 2466 CG TYR I 75 151.205 7.080 1.516 1.00 0.51 C ATOM 2467 CD1 TYR I 75 152.140 6.967 2.551 1.00 1.36 C ATOM 2468 CD2 TYR I 75 150.232 6.088 1.340 1.00 1.26 C ATOM 2469 CE1 TYR I 75 152.104 5.862 3.409 1.00 1.35 C ATOM 2470 CE2 TYR I 75 150.196 4.983 2.198 1.00 1.31 C ATOM 2471 CZ TYR I 75 151.132 4.870 3.233 1.00 0.59 C ATOM 2472 OH TYR I 75 151.097 3.781 4.080 1.00 0.69 O ATOM 2473 H TYR I 75 151.377 9.053 -2.055 1.00 0.70 H ATOM 2474 HA TYR I 75 153.334 8.275 0.082 1.00 0.72 H ATOM 2475 HB2 TYR I 75 151.402 9.172 1.166 1.00 0.52 H ATOM 2476 HB3 TYR I 75 150.310 8.343 0.055 1.00 0.66 H ATOM 2477 HD1 TYR I 75 152.890 7.732 2.687 1.00 2.26 H ATOM 2478 HD2 TYR I 75 149.510 6.176 0.541 1.00 2.13 H ATOM 2479 HE1 TYR I 75 152.826 5.775 4.208 1.00 2.22 H ATOM 2480 HE2 TYR I 75 149.446 4.218 2.063 1.00 2.21 H ATOM 2481 HH TYR I 75 151.978 3.658 4.442 1.00 1.18 H ATOM 2482 N PHE I 76 151.976 6.578 -2.262 1.00 0.94 N ATOM 2483 CA PHE I 76 151.927 5.229 -2.894 1.00 1.24 C ATOM 2484 C PHE I 76 153.200 4.986 -3.718 1.00 1.23 C ATOM 2485 O PHE I 76 153.362 3.956 -4.340 1.00 1.37 O ATOM 2486 CB PHE I 76 150.639 5.240 -3.746 1.00 1.36 C ATOM 2487 CG PHE I 76 150.928 5.416 -5.223 1.00 1.21 C ATOM 2488 CD1 PHE I 76 151.461 4.359 -5.970 1.00 1.81 C ATOM 2489 CD2 PHE I 76 150.636 6.634 -5.848 1.00 1.73 C ATOM 2490 CE1 PHE I 76 151.706 4.521 -7.339 1.00 2.20 C ATOM 2491 CE2 PHE I 76 150.876 6.794 -7.218 1.00 2.08 C ATOM 2492 CZ PHE I 76 151.412 5.739 -7.963 1.00 2.09 C ATOM 2493 H PHE I 76 151.720 7.371 -2.775 1.00 0.85 H ATOM 2494 HA PHE I 76 151.843 4.474 -2.127 1.00 1.48 H ATOM 2495 HB2 PHE I 76 150.115 4.308 -3.604 1.00 1.92 H ATOM 2496 HB3 PHE I 76 150.007 6.051 -3.413 1.00 1.49 H ATOM 2497 HD1 PHE I 76 151.687 3.419 -5.490 1.00 2.45 H ATOM 2498 HD2 PHE I 76 150.225 7.451 -5.273 1.00 2.38 H ATOM 2499 HE1 PHE I 76 152.120 3.706 -7.914 1.00 2.98 H ATOM 2500 HE2 PHE I 76 150.651 7.734 -7.698 1.00 2.81 H ATOM 2501 HZ PHE I 76 151.597 5.864 -9.019 1.00 2.59 H ATOM 2502 N LEU I 77 154.119 5.917 -3.701 1.00 1.17 N ATOM 2503 CA LEU I 77 155.390 5.722 -4.465 1.00 1.27 C ATOM 2504 C LEU I 77 156.505 5.279 -3.511 1.00 1.18 C ATOM 2505 O LEU I 77 157.645 5.127 -3.903 1.00 1.21 O ATOM 2506 CB LEU I 77 155.756 7.081 -5.087 1.00 1.59 C ATOM 2507 CG LEU I 77 154.523 7.977 -5.249 1.00 0.95 C ATOM 2508 CD1 LEU I 77 154.934 9.275 -5.944 1.00 0.93 C ATOM 2509 CD2 LEU I 77 153.473 7.267 -6.102 1.00 1.36 C ATOM 2510 H LEU I 77 153.983 6.731 -3.173 1.00 1.14 H ATOM 2511 HA LEU I 77 155.250 4.987 -5.242 1.00 1.33 H ATOM 2512 HB2 LEU I 77 156.471 7.580 -4.450 1.00 2.04 H ATOM 2513 HB3 LEU I 77 156.203 6.916 -6.056 1.00 2.36 H ATOM 2514 HG LEU I 77 154.110 8.205 -4.277 1.00 1.29 H ATOM 2515 HD11 LEU I 77 154.272 9.463 -6.776 1.00 1.38 H ATOM 2516 HD12 LEU I 77 155.948 9.184 -6.304 1.00 1.47 H ATOM 2517 HD13 LEU I 77 154.873 10.094 -5.243 1.00 1.38 H ATOM 2518 HD21 LEU I 77 153.165 6.354 -5.616 1.00 1.77 H ATOM 2519 HD22 LEU I 77 153.890 7.038 -7.071 1.00 1.96 H ATOM 2520 HD23 LEU I 77 152.620 7.916 -6.223 1.00 1.76 H ATOM 2521 N CYS I 78 156.189 5.082 -2.259 1.00 1.16 N ATOM 2522 CA CYS I 78 157.236 4.660 -1.282 1.00 1.22 C ATOM 2523 C CYS I 78 157.508 3.159 -1.402 1.00 1.05 C ATOM 2524 O CYS I 78 158.635 2.738 -1.574 1.00 1.20 O ATOM 2525 CB CYS I 78 156.653 4.989 0.092 1.00 1.40 C ATOM 2526 SG CYS I 78 157.852 5.959 1.039 1.00 1.82 S ATOM 2527 H CYS I 78 155.266 5.217 -1.959 1.00 1.18 H ATOM 2528 HA CYS I 78 158.144 5.221 -1.439 1.00 1.36 H ATOM 2529 HB2 CYS I 78 155.743 5.558 -0.030 1.00 1.72 H ATOM 2530 HB3 CYS I 78 156.436 4.071 0.619 1.00 1.65 H ATOM 2531 HG CYS I 78 157.368 6.483 1.681 1.00 2.03 H ATOM 2532 N LEU I 79 156.486 2.351 -1.311 1.00 0.86 N ATOM 2533 CA LEU I 79 156.688 0.876 -1.420 1.00 0.77 C ATOM 2534 C LEU I 79 157.705 0.567 -2.526 1.00 0.68 C ATOM 2535 O LEU I 79 157.866 1.342 -3.447 1.00 0.67 O ATOM 2536 CB LEU I 79 155.310 0.316 -1.777 1.00 0.81 C ATOM 2537 CG LEU I 79 154.302 0.715 -0.697 1.00 0.85 C ATOM 2538 CD1 LEU I 79 153.043 1.282 -1.356 1.00 1.04 C ATOM 2539 CD2 LEU I 79 153.929 -0.515 0.133 1.00 1.16 C ATOM 2540 H LEU I 79 155.587 2.713 -1.171 1.00 0.91 H ATOM 2541 HA LEU I 79 157.019 0.470 -0.478 1.00 0.88 H ATOM 2542 HB2 LEU I 79 154.995 0.715 -2.731 1.00 0.89 H ATOM 2543 HB3 LEU I 79 155.363 -0.761 -1.837 1.00 0.91 H ATOM 2544 HG LEU I 79 154.741 1.465 -0.056 1.00 0.79 H ATOM 2545 HD11 LEU I 79 152.955 2.332 -1.119 1.00 1.41 H ATOM 2546 HD12 LEU I 79 152.175 0.756 -0.988 1.00 1.55 H ATOM 2547 HD13 LEU I 79 153.111 1.160 -2.427 1.00 1.41 H ATOM 2548 HD21 LEU I 79 153.271 -1.152 -0.440 1.00 1.42 H ATOM 2549 HD22 LEU I 79 153.428 -0.201 1.037 1.00 1.78 H ATOM 2550 HD23 LEU I 79 154.825 -1.062 0.390 1.00 1.60 H ATOM 2551 N PRO I 80 158.369 -0.556 -2.398 1.00 0.72 N ATOM 2552 CA PRO I 80 159.386 -0.956 -3.400 1.00 0.73 C ATOM 2553 C PRO I 80 158.756 -1.078 -4.790 1.00 0.61 C ATOM 2554 O PRO I 80 157.556 -0.974 -4.949 1.00 0.69 O ATOM 2555 CB PRO I 80 159.854 -2.318 -2.878 1.00 0.90 C ATOM 2556 CG PRO I 80 159.085 -2.644 -1.582 1.00 1.00 C ATOM 2557 CD PRO I 80 158.140 -1.478 -1.262 1.00 0.89 C ATOM 2558 HA PRO I 80 160.209 -0.261 -3.410 1.00 0.81 H ATOM 2559 HB2 PRO I 80 159.656 -3.079 -3.620 1.00 0.89 H ATOM 2560 HB3 PRO I 80 160.912 -2.283 -2.668 1.00 1.04 H ATOM 2561 HG2 PRO I 80 158.513 -3.551 -1.718 1.00 1.06 H ATOM 2562 HG3 PRO I 80 159.783 -2.774 -0.769 1.00 1.16 H ATOM 2563 HD2 PRO I 80 157.112 -1.816 -1.238 1.00 0.89 H ATOM 2564 HD3 PRO I 80 158.413 -1.004 -0.333 1.00 0.98 H ATOM 2565 N SER I 81 159.558 -1.294 -5.796 1.00 0.58 N ATOM 2566 CA SER I 81 159.008 -1.420 -7.177 1.00 0.60 C ATOM 2567 C SER I 81 158.156 -2.688 -7.290 1.00 0.73 C ATOM 2568 O SER I 81 158.427 -3.560 -8.091 1.00 1.48 O ATOM 2569 CB SER I 81 160.234 -1.517 -8.085 1.00 0.71 C ATOM 2570 OG SER I 81 161.380 -1.822 -7.301 1.00 1.25 O ATOM 2571 H SER I 81 160.523 -1.373 -5.645 1.00 0.67 H ATOM 2572 HA SER I 81 158.426 -0.548 -7.434 1.00 0.59 H ATOM 2573 HB2 SER I 81 160.084 -2.297 -8.812 1.00 1.07 H ATOM 2574 HB3 SER I 81 160.375 -0.573 -8.597 1.00 0.94 H ATOM 2575 HG SER I 81 161.684 -2.698 -7.548 1.00 1.70 H ATOM 2576 N ASN I 82 157.130 -2.797 -6.492 1.00 0.74 N ATOM 2577 CA ASN I 82 156.264 -4.009 -6.552 1.00 0.75 C ATOM 2578 C ASN I 82 155.240 -3.983 -5.415 1.00 0.69 C ATOM 2579 O ASN I 82 155.589 -4.018 -4.251 1.00 1.04 O ATOM 2580 CB ASN I 82 157.224 -5.186 -6.382 1.00 0.97 C ATOM 2581 CG ASN I 82 157.352 -5.936 -7.709 1.00 1.56 C ATOM 2582 OD1 ASN I 82 156.908 -5.460 -8.735 1.00 2.23 O ATOM 2583 ND2 ASN I 82 157.944 -7.098 -7.732 1.00 2.27 N ATOM 2584 H ASN I 82 156.929 -2.083 -5.851 1.00 1.28 H ATOM 2585 HA ASN I 82 155.768 -4.071 -7.507 1.00 0.83 H ATOM 2586 HB2 ASN I 82 158.194 -4.818 -6.081 1.00 1.33 H ATOM 2587 HB3 ASN I 82 156.842 -5.856 -5.627 1.00 1.61 H ATOM 2588 HD21 ASN I 82 158.302 -7.482 -6.904 1.00 2.48 H ATOM 2589 HD22 ASN I 82 158.031 -7.587 -8.577 1.00 2.95 H ATOM 2590 N THR I 83 153.978 -3.923 -5.741 1.00 0.59 N ATOM 2591 CA THR I 83 152.933 -3.896 -4.678 1.00 0.59 C ATOM 2592 C THR I 83 151.591 -4.368 -5.244 1.00 0.49 C ATOM 2593 O THR I 83 151.299 -4.185 -6.410 1.00 0.54 O ATOM 2594 CB THR I 83 152.849 -2.431 -4.245 1.00 0.67 C ATOM 2595 OG1 THR I 83 154.093 -1.793 -4.500 1.00 0.78 O ATOM 2596 CG2 THR I 83 152.530 -2.355 -2.751 1.00 0.94 C ATOM 2597 H THR I 83 153.717 -3.896 -6.686 1.00 0.80 H ATOM 2598 HA THR I 83 153.228 -4.510 -3.843 1.00 0.72 H ATOM 2599 HB THR I 83 152.069 -1.935 -4.801 1.00 0.72 H ATOM 2600 HG1 THR I 83 154.231 -1.130 -3.820 1.00 1.24 H ATOM 2601 HG21 THR I 83 151.929 -1.479 -2.556 1.00 1.42 H ATOM 2602 HG22 THR I 83 153.451 -2.292 -2.190 1.00 1.37 H ATOM 2603 HG23 THR I 83 151.986 -3.238 -2.454 1.00 1.51 H ATOM 2604 N LYS I 84 150.771 -4.974 -4.429 1.00 0.49 N ATOM 2605 CA LYS I 84 149.450 -5.457 -4.924 1.00 0.43 C ATOM 2606 C LYS I 84 148.434 -4.312 -4.920 1.00 0.38 C ATOM 2607 O LYS I 84 147.820 -4.017 -3.914 1.00 0.45 O ATOM 2608 CB LYS I 84 149.031 -6.548 -3.937 1.00 0.51 C ATOM 2609 CG LYS I 84 149.534 -7.905 -4.433 1.00 0.56 C ATOM 2610 CD LYS I 84 150.474 -8.513 -3.390 1.00 0.82 C ATOM 2611 CE LYS I 84 151.770 -8.963 -4.070 1.00 1.04 C ATOM 2612 NZ LYS I 84 152.567 -9.605 -2.988 1.00 1.42 N ATOM 2613 H LYS I 84 151.025 -5.112 -3.493 1.00 0.60 H ATOM 2614 HA LYS I 84 149.546 -5.873 -5.914 1.00 0.41 H ATOM 2615 HB2 LYS I 84 149.456 -6.338 -2.967 1.00 0.62 H ATOM 2616 HB3 LYS I 84 147.954 -6.571 -3.862 1.00 0.65 H ATOM 2617 HG2 LYS I 84 148.693 -8.565 -4.589 1.00 0.76 H ATOM 2618 HG3 LYS I 84 150.067 -7.774 -5.362 1.00 0.77 H ATOM 2619 HD2 LYS I 84 150.700 -7.773 -2.635 1.00 1.35 H ATOM 2620 HD3 LYS I 84 149.998 -9.365 -2.928 1.00 1.05 H ATOM 2621 HE2 LYS I 84 151.553 -9.674 -4.855 1.00 1.27 H ATOM 2622 HE3 LYS I 84 152.302 -8.112 -4.466 1.00 1.62 H ATOM 2623 HZ1 LYS I 84 152.420 -9.093 -2.096 1.00 1.80 H ATOM 2624 HZ2 LYS I 84 153.577 -9.580 -3.241 1.00 2.01 H ATOM 2625 HZ3 LYS I 84 152.263 -10.592 -2.872 1.00 1.77 H ATOM 2626 N PHE I 85 148.254 -3.664 -6.038 1.00 0.32 N ATOM 2627 CA PHE I 85 147.279 -2.537 -6.099 1.00 0.30 C ATOM 2628 C PHE I 85 145.916 -3.042 -6.579 1.00 0.28 C ATOM 2629 O PHE I 85 145.723 -3.324 -7.746 1.00 0.32 O ATOM 2630 CB PHE I 85 147.874 -1.555 -7.108 1.00 0.31 C ATOM 2631 CG PHE I 85 148.773 -0.578 -6.388 1.00 0.32 C ATOM 2632 CD1 PHE I 85 149.613 -1.026 -5.362 1.00 1.30 C ATOM 2633 CD2 PHE I 85 148.766 0.775 -6.747 1.00 1.19 C ATOM 2634 CE1 PHE I 85 150.446 -0.120 -4.694 1.00 1.35 C ATOM 2635 CE2 PHE I 85 149.599 1.680 -6.080 1.00 1.18 C ATOM 2636 CZ PHE I 85 150.439 1.233 -5.053 1.00 0.44 C ATOM 2637 H PHE I 85 148.760 -3.917 -6.838 1.00 0.36 H ATOM 2638 HA PHE I 85 147.188 -2.065 -5.134 1.00 0.32 H ATOM 2639 HB2 PHE I 85 148.448 -2.098 -7.844 1.00 0.33 H ATOM 2640 HB3 PHE I 85 147.077 -1.015 -7.598 1.00 0.33 H ATOM 2641 HD1 PHE I 85 149.619 -2.070 -5.085 1.00 2.19 H ATOM 2642 HD2 PHE I 85 148.118 1.120 -7.539 1.00 2.10 H ATOM 2643 HE1 PHE I 85 151.095 -0.466 -3.902 1.00 2.26 H ATOM 2644 HE2 PHE I 85 149.594 2.724 -6.357 1.00 2.06 H ATOM 2645 HZ PHE I 85 151.082 1.931 -4.537 1.00 0.51 H ATOM 2646 N VAL I 86 144.968 -3.159 -5.689 1.00 0.29 N ATOM 2647 CA VAL I 86 143.619 -3.646 -6.096 1.00 0.30 C ATOM 2648 C VAL I 86 142.811 -2.506 -6.722 1.00 0.29 C ATOM 2649 O VAL I 86 142.396 -1.584 -6.048 1.00 0.34 O ATOM 2650 CB VAL I 86 142.962 -4.121 -4.800 1.00 0.35 C ATOM 2651 CG1 VAL I 86 141.531 -4.577 -5.088 1.00 0.40 C ATOM 2652 CG2 VAL I 86 143.762 -5.292 -4.223 1.00 0.44 C ATOM 2653 H VAL I 86 145.144 -2.927 -4.753 1.00 0.34 H ATOM 2654 HA VAL I 86 143.707 -4.470 -6.787 1.00 0.30 H ATOM 2655 HB VAL I 86 142.944 -3.309 -4.087 1.00 0.40 H ATOM 2656 HG11 VAL I 86 141.170 -4.089 -5.981 1.00 1.08 H ATOM 2657 HG12 VAL I 86 140.895 -4.316 -4.254 1.00 1.09 H ATOM 2658 HG13 VAL I 86 141.515 -5.647 -5.231 1.00 0.97 H ATOM 2659 HG21 VAL I 86 144.630 -5.473 -4.839 1.00 1.05 H ATOM 2660 HG22 VAL I 86 143.142 -6.176 -4.204 1.00 1.18 H ATOM 2661 HG23 VAL I 86 144.077 -5.052 -3.218 1.00 1.10 H ATOM 2662 N ALA I 87 142.585 -2.561 -8.006 1.00 0.29 N ATOM 2663 CA ALA I 87 141.805 -1.479 -8.673 1.00 0.32 C ATOM 2664 C ALA I 87 140.305 -1.697 -8.457 1.00 0.36 C ATOM 2665 O ALA I 87 139.782 -2.767 -8.699 1.00 0.51 O ATOM 2666 CB ALA I 87 142.156 -1.596 -10.157 1.00 0.34 C ATOM 2667 H ALA I 87 142.929 -3.313 -8.532 1.00 0.31 H ATOM 2668 HA ALA I 87 142.104 -0.513 -8.299 1.00 0.32 H ATOM 2669 HB1 ALA I 87 141.677 -2.470 -10.573 1.00 1.02 H ATOM 2670 HB2 ALA I 87 143.226 -1.685 -10.268 1.00 0.93 H ATOM 2671 HB3 ALA I 87 141.812 -0.715 -10.679 1.00 1.01 H ATOM 2672 N LEU I 88 139.609 -0.691 -8.002 1.00 0.41 N ATOM 2673 CA LEU I 88 138.143 -0.843 -7.771 1.00 0.45 C ATOM 2674 C LEU I 88 137.367 0.184 -8.599 1.00 0.53 C ATOM 2675 O LEU I 88 137.004 1.238 -8.115 1.00 0.72 O ATOM 2676 CB LEU I 88 137.948 -0.584 -6.277 1.00 0.50 C ATOM 2677 CG LEU I 88 137.433 -1.857 -5.604 1.00 0.53 C ATOM 2678 CD1 LEU I 88 138.598 -2.583 -4.930 1.00 0.56 C ATOM 2679 CD2 LEU I 88 136.385 -1.488 -4.551 1.00 0.64 C ATOM 2680 H LEU I 88 140.049 0.164 -7.813 1.00 0.52 H ATOM 2681 HA LEU I 88 137.825 -1.844 -8.017 1.00 0.44 H ATOM 2682 HB2 LEU I 88 138.891 -0.297 -5.835 1.00 0.50 H ATOM 2683 HB3 LEU I 88 137.229 0.209 -6.140 1.00 0.57 H ATOM 2684 HG LEU I 88 136.988 -2.502 -6.347 1.00 0.54 H ATOM 2685 HD11 LEU I 88 138.673 -3.586 -5.324 1.00 1.27 H ATOM 2686 HD12 LEU I 88 138.427 -2.627 -3.864 1.00 1.13 H ATOM 2687 HD13 LEU I 88 139.516 -2.050 -5.126 1.00 1.09 H ATOM 2688 HD21 LEU I 88 136.743 -0.658 -3.962 1.00 1.08 H ATOM 2689 HD22 LEU I 88 136.208 -2.337 -3.907 1.00 1.29 H ATOM 2690 HD23 LEU I 88 135.464 -1.211 -5.042 1.00 1.18 H ATOM 2691 N ALA I 89 137.109 -0.114 -9.842 1.00 0.54 N ATOM 2692 CA ALA I 89 136.355 0.846 -10.698 1.00 0.64 C ATOM 2693 C ALA I 89 134.917 0.985 -10.191 1.00 0.75 C ATOM 2694 O ALA I 89 133.972 0.649 -10.877 1.00 1.19 O ATOM 2695 CB ALA I 89 136.375 0.230 -12.097 1.00 0.78 C ATOM 2696 H ALA I 89 137.410 -0.970 -10.214 1.00 0.61 H ATOM 2697 HA ALA I 89 136.846 1.806 -10.710 1.00 0.63 H ATOM 2698 HB1 ALA I 89 136.576 1.001 -12.826 1.00 1.24 H ATOM 2699 HB2 ALA I 89 135.416 -0.221 -12.305 1.00 1.35 H ATOM 2700 HB3 ALA I 89 137.146 -0.524 -12.147 1.00 1.25 H ATOM 2701 N CYS I 90 134.744 1.477 -8.995 1.00 0.69 N ATOM 2702 CA CYS I 90 133.367 1.636 -8.447 1.00 0.80 C ATOM 2703 C CYS I 90 132.528 0.395 -8.761 1.00 1.08 C ATOM 2704 O CYS I 90 131.344 0.483 -9.020 1.00 1.46 O ATOM 2705 CB CYS I 90 132.797 2.864 -9.157 1.00 0.92 C ATOM 2706 SG CYS I 90 131.581 3.670 -8.085 1.00 1.48 S ATOM 2707 H CYS I 90 135.520 1.742 -8.457 1.00 0.90 H ATOM 2708 HA CYS I 90 133.402 1.808 -7.383 1.00 0.75 H ATOM 2709 HB2 CYS I 90 133.596 3.556 -9.378 1.00 1.18 H ATOM 2710 HB3 CYS I 90 132.320 2.559 -10.077 1.00 1.25 H ATOM 2711 HG CYS I 90 131.928 4.529 -7.836 1.00 1.75 H ATOM 2712 N ASN I 91 133.133 -0.762 -8.742 1.00 0.96 N ATOM 2713 CA ASN I 91 132.370 -2.008 -9.040 1.00 1.28 C ATOM 2714 C ASN I 91 133.094 -3.224 -8.457 1.00 1.03 C ATOM 2715 O ASN I 91 132.548 -3.961 -7.661 1.00 1.10 O ATOM 2716 CB ASN I 91 132.328 -2.090 -10.566 1.00 1.65 C ATOM 2717 CG ASN I 91 131.105 -2.900 -11.000 1.00 2.25 C ATOM 2718 OD1 ASN I 91 130.488 -3.570 -10.195 1.00 2.77 O ATOM 2719 ND2 ASN I 91 130.725 -2.868 -12.248 1.00 2.67 N ATOM 2720 H ASN I 91 134.089 -0.811 -8.531 1.00 0.73 H ATOM 2721 HA ASN I 91 131.368 -1.940 -8.647 1.00 1.55 H ATOM 2722 HB2 ASN I 91 132.266 -1.094 -10.979 1.00 1.68 H ATOM 2723 HB3 ASN I 91 133.223 -2.574 -10.926 1.00 1.69 H ATOM 2724 HD21 ASN I 91 131.223 -2.328 -12.898 1.00 2.85 H ATOM 2725 HD22 ASN I 91 129.943 -3.383 -12.536 1.00 3.07 H ATOM 2726 N GLU I 92 134.321 -3.439 -8.847 1.00 0.81 N ATOM 2727 CA GLU I 92 135.079 -4.607 -8.315 1.00 0.65 C ATOM 2728 C GLU I 92 134.855 -4.740 -6.806 1.00 0.81 C ATOM 2729 O GLU I 92 134.661 -3.763 -6.110 1.00 1.39 O ATOM 2730 CB GLU I 92 136.546 -4.298 -8.614 1.00 0.51 C ATOM 2731 CG GLU I 92 136.916 -4.858 -9.989 1.00 0.64 C ATOM 2732 CD GLU I 92 136.373 -3.935 -11.080 1.00 1.00 C ATOM 2733 OE1 GLU I 92 136.580 -2.738 -10.974 1.00 1.80 O ATOM 2734 OE2 GLU I 92 135.757 -4.442 -12.004 1.00 1.40 O ATOM 2735 H GLU I 92 134.744 -2.832 -9.490 1.00 0.83 H ATOM 2736 HA GLU I 92 134.782 -5.512 -8.822 1.00 0.72 H ATOM 2737 HB2 GLU I 92 136.696 -3.227 -8.609 1.00 0.58 H ATOM 2738 HB3 GLU I 92 137.171 -4.753 -7.861 1.00 0.50 H ATOM 2739 HG2 GLU I 92 137.992 -4.923 -10.073 1.00 0.80 H ATOM 2740 HG3 GLU I 92 136.486 -5.842 -10.104 1.00 0.96 H ATOM 2741 N LYS I 93 134.880 -5.941 -6.296 1.00 1.30 N ATOM 2742 CA LYS I 93 134.669 -6.134 -4.833 1.00 1.54 C ATOM 2743 C LYS I 93 135.775 -5.432 -4.042 1.00 1.25 C ATOM 2744 O LYS I 93 136.921 -5.407 -4.446 1.00 1.20 O ATOM 2745 CB LYS I 93 134.733 -7.647 -4.620 1.00 1.90 C ATOM 2746 CG LYS I 93 134.049 -8.005 -3.299 1.00 2.15 C ATOM 2747 CD LYS I 93 134.355 -9.462 -2.944 1.00 2.19 C ATOM 2748 CE LYS I 93 135.647 -9.528 -2.128 1.00 2.03 C ATOM 2749 NZ LYS I 93 135.589 -10.839 -1.423 1.00 2.46 N ATOM 2750 H LYS I 93 135.039 -6.715 -6.875 1.00 1.88 H ATOM 2751 HA LYS I 93 133.700 -5.761 -4.540 1.00 1.83 H ATOM 2752 HB2 LYS I 93 134.229 -8.147 -5.434 1.00 2.34 H ATOM 2753 HB3 LYS I 93 135.764 -7.962 -4.586 1.00 2.08 H ATOM 2754 HG2 LYS I 93 134.418 -7.358 -2.516 1.00 2.43 H ATOM 2755 HG3 LYS I 93 132.982 -7.878 -3.399 1.00 2.65 H ATOM 2756 HD2 LYS I 93 133.540 -9.869 -2.363 1.00 2.55 H ATOM 2757 HD3 LYS I 93 134.474 -10.036 -3.851 1.00 2.44 H ATOM 2758 HE2 LYS I 93 136.507 -9.488 -2.783 1.00 2.15 H ATOM 2759 HE3 LYS I 93 135.682 -8.724 -1.410 1.00 2.14 H ATOM 2760 HZ1 LYS I 93 134.623 -11.004 -1.076 1.00 2.80 H ATOM 2761 HZ2 LYS I 93 136.250 -10.829 -0.619 1.00 2.75 H ATOM 2762 HZ3 LYS I 93 135.854 -11.599 -2.080 1.00 2.78 H ATOM 2763 N TRP I 94 135.442 -4.860 -2.917 1.00 1.27 N ATOM 2764 CA TRP I 94 136.475 -4.159 -2.101 1.00 1.23 C ATOM 2765 C TRP I 94 137.342 -5.177 -1.356 1.00 1.12 C ATOM 2766 O TRP I 94 136.944 -6.305 -1.138 1.00 1.20 O ATOM 2767 CB TRP I 94 135.683 -3.302 -1.113 1.00 1.70 C ATOM 2768 CG TRP I 94 136.321 -1.954 -0.997 1.00 1.00 C ATOM 2769 CD1 TRP I 94 136.001 -0.876 -1.750 1.00 1.09 C ATOM 2770 CD2 TRP I 94 137.376 -1.521 -0.091 1.00 0.97 C ATOM 2771 NE1 TRP I 94 136.793 0.190 -1.363 1.00 0.90 N ATOM 2772 CE2 TRP I 94 137.657 -0.158 -0.344 1.00 1.34 C ATOM 2773 CE3 TRP I 94 138.110 -2.173 0.917 1.00 1.42 C ATOM 2774 CZ2 TRP I 94 138.631 0.535 0.377 1.00 2.31 C ATOM 2775 CZ3 TRP I 94 139.091 -1.480 1.644 1.00 2.39 C ATOM 2776 CH2 TRP I 94 139.351 -0.128 1.374 1.00 2.87 C ATOM 2777 H TRP I 94 134.512 -4.890 -2.609 1.00 1.47 H ATOM 2778 HA TRP I 94 137.087 -3.529 -2.727 1.00 1.21 H ATOM 2779 HB2 TRP I 94 134.669 -3.191 -1.465 1.00 2.26 H ATOM 2780 HB3 TRP I 94 135.678 -3.781 -0.145 1.00 2.41 H ATOM 2781 HD1 TRP I 94 135.250 -0.852 -2.526 1.00 1.68 H ATOM 2782 HE1 TRP I 94 136.760 1.089 -1.752 1.00 1.01 H ATOM 2783 HE3 TRP I 94 137.918 -3.214 1.132 1.00 1.19 H ATOM 2784 HZ2 TRP I 94 138.827 1.575 0.165 1.00 2.70 H ATOM 2785 HZ3 TRP I 94 139.649 -1.990 2.415 1.00 2.84 H ATOM 2786 HH2 TRP I 94 140.106 0.399 1.937 1.00 3.69 H ATOM 2787 N THR I 95 138.525 -4.790 -0.963 1.00 1.09 N ATOM 2788 CA THR I 95 139.416 -5.736 -0.232 1.00 1.11 C ATOM 2789 C THR I 95 139.168 -5.641 1.275 1.00 1.07 C ATOM 2790 O THR I 95 140.063 -5.829 2.075 1.00 1.34 O ATOM 2791 CB THR I 95 140.837 -5.284 -0.572 1.00 1.35 C ATOM 2792 OG1 THR I 95 140.886 -3.864 -0.597 1.00 1.75 O ATOM 2793 CG2 THR I 95 141.235 -5.834 -1.942 1.00 1.61 C ATOM 2794 H THR I 95 138.827 -3.876 -1.149 1.00 1.15 H ATOM 2795 HA THR I 95 139.258 -6.746 -0.578 1.00 1.14 H ATOM 2796 HB THR I 95 141.522 -5.656 0.173 1.00 1.97 H ATOM 2797 HG1 THR I 95 141.682 -3.587 -0.137 1.00 1.83 H ATOM 2798 HG21 THR I 95 142.019 -6.567 -1.822 1.00 2.05 H ATOM 2799 HG22 THR I 95 141.589 -5.026 -2.566 1.00 2.08 H ATOM 2800 HG23 THR I 95 140.377 -6.298 -2.407 1.00 2.04 H ATOM 2801 N TYR I 96 137.959 -5.349 1.669 1.00 1.40 N ATOM 2802 CA TYR I 96 137.654 -5.241 3.125 1.00 1.57 C ATOM 2803 C TYR I 96 136.462 -6.132 3.483 1.00 1.59 C ATOM 2804 O TYR I 96 136.570 -7.035 4.290 1.00 2.04 O ATOM 2805 CB TYR I 96 137.309 -3.768 3.348 1.00 1.84 C ATOM 2806 CG TYR I 96 137.006 -3.536 4.809 1.00 2.31 C ATOM 2807 CD1 TYR I 96 138.048 -3.498 5.743 1.00 2.30 C ATOM 2808 CD2 TYR I 96 135.682 -3.360 5.229 1.00 3.22 C ATOM 2809 CE1 TYR I 96 137.766 -3.284 7.097 1.00 2.80 C ATOM 2810 CE2 TYR I 96 135.400 -3.145 6.583 1.00 3.70 C ATOM 2811 CZ TYR I 96 136.442 -3.107 7.517 1.00 3.35 C ATOM 2812 OH TYR I 96 136.164 -2.896 8.852 1.00 3.91 O ATOM 2813 H TYR I 96 137.251 -5.200 1.008 1.00 1.81 H ATOM 2814 HA TYR I 96 138.518 -5.510 3.712 1.00 1.81 H ATOM 2815 HB2 TYR I 96 138.147 -3.153 3.052 1.00 1.96 H ATOM 2816 HB3 TYR I 96 136.445 -3.507 2.756 1.00 1.89 H ATOM 2817 HD1 TYR I 96 139.069 -3.634 5.419 1.00 2.34 H ATOM 2818 HD2 TYR I 96 134.878 -3.390 4.508 1.00 3.74 H ATOM 2819 HE1 TYR I 96 138.569 -3.254 7.818 1.00 3.08 H ATOM 2820 HE2 TYR I 96 134.379 -3.009 6.907 1.00 4.52 H ATOM 2821 HH TYR I 96 136.908 -3.219 9.365 1.00 4.23 H ATOM 2822 N ASN I 97 135.326 -5.886 2.890 1.00 1.82 N ATOM 2823 CA ASN I 97 134.128 -6.720 3.197 1.00 2.24 C ATOM 2824 C ASN I 97 134.029 -6.970 4.704 1.00 2.41 C ATOM 2825 O ASN I 97 134.018 -8.097 5.157 1.00 2.74 O ATOM 2826 CB ASN I 97 134.358 -8.035 2.450 1.00 2.53 C ATOM 2827 CG ASN I 97 133.069 -8.449 1.736 1.00 3.11 C ATOM 2828 OD1 ASN I 97 132.364 -7.617 1.200 1.00 3.52 O ATOM 2829 ND2 ASN I 97 132.731 -9.709 1.706 1.00 3.70 N ATOM 2830 H ASN I 97 135.260 -5.154 2.243 1.00 2.13 H ATOM 2831 HA ASN I 97 133.232 -6.242 2.834 1.00 2.51 H ATOM 2832 HB2 ASN I 97 135.146 -7.902 1.723 1.00 2.48 H ATOM 2833 HB3 ASN I 97 134.640 -8.804 3.153 1.00 2.83 H ATOM 2834 HD21 ASN I 97 133.299 -10.379 2.138 1.00 3.87 H ATOM 2835 HD22 ASN I 97 131.907 -9.984 1.251 1.00 4.25 H ATOM 2836 N ASP I 98 133.957 -5.926 5.485 1.00 2.48 N ATOM 2837 CA ASP I 98 133.858 -6.105 6.962 1.00 2.84 C ATOM 2838 C ASP I 98 134.831 -7.191 7.429 1.00 2.81 C ATOM 2839 O ASP I 98 134.523 -7.983 8.297 1.00 3.26 O ATOM 2840 CB ASP I 98 132.413 -6.535 7.214 1.00 3.42 C ATOM 2841 CG ASP I 98 131.820 -5.695 8.346 1.00 4.10 C ATOM 2842 OD1 ASP I 98 131.571 -4.522 8.119 1.00 4.40 O ATOM 2843 OD2 ASP I 98 131.625 -6.238 9.421 1.00 4.70 O ATOM 2844 H ASP I 98 133.966 -5.025 5.100 1.00 2.49 H ATOM 2845 HA ASP I 98 134.060 -5.175 7.468 1.00 3.03 H ATOM 2846 HB2 ASP I 98 131.833 -6.390 6.314 1.00 3.36 H ATOM 2847 HB3 ASP I 98 132.391 -7.578 7.492 1.00 3.78 H ATOM 2848 N SER I 99 136.005 -7.235 6.860 1.00 2.65 N ATOM 2849 CA SER I 99 136.996 -8.270 7.272 1.00 3.19 C ATOM 2850 C SER I 99 137.932 -7.707 8.345 1.00 3.61 C ATOM 2851 O SER I 99 139.139 -7.779 8.230 1.00 4.15 O ATOM 2852 CB SER I 99 137.776 -8.600 6.001 1.00 3.20 C ATOM 2853 OG SER I 99 138.705 -9.640 6.277 1.00 3.79 O ATOM 2854 H SER I 99 136.235 -6.587 6.161 1.00 2.42 H ATOM 2855 HA SER I 99 136.492 -9.151 7.635 1.00 3.55 H ATOM 2856 HB2 SER I 99 137.095 -8.929 5.233 1.00 3.19 H ATOM 2857 HB3 SER I 99 138.299 -7.716 5.661 1.00 3.35 H ATOM 2858 HG SER I 99 138.493 -10.386 5.712 1.00 4.18 H ATOM 2859 N ASP I 100 137.383 -7.146 9.388 1.00 3.70 N ATOM 2860 CA ASP I 100 138.242 -6.578 10.467 1.00 4.28 C ATOM 2861 C ASP I 100 138.789 -7.701 11.352 1.00 4.55 C ATOM 2862 O ASP I 100 138.631 -7.688 12.557 1.00 4.79 O ATOM 2863 CB ASP I 100 137.314 -5.665 11.270 1.00 4.63 C ATOM 2864 CG ASP I 100 138.117 -4.951 12.359 1.00 5.10 C ATOM 2865 OD1 ASP I 100 138.721 -3.936 12.052 1.00 5.43 O ATOM 2866 OD2 ASP I 100 138.114 -5.430 13.480 1.00 5.50 O ATOM 2867 OXT ASP I 100 139.433 -8.673 10.764 1.00 4.91 O ATOM 2868 H ASP I 100 136.407 -7.097 9.461 1.00 3.62 H ATOM 2869 HA ASP I 100 139.049 -6.003 10.043 1.00 4.58 H ATOM 2870 HB2 ASP I 100 136.870 -4.934 10.610 1.00 4.74 H ATOM 2871 HB3 ASP I 100 136.536 -6.256 11.729 1.00 4.91 H TER 2872 ASP I 100 MASTER 164 0 0 3 9 0 0 6 2870 2 0 15 END