USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 920 hydrogens (0 hets) HEADER TRANSCRIPTION 31-DEC-04 1YFB TITLE THE SOLUTION STRUCTURE OF THE N-DOMAIN OF THE TRANSCRIPTION TITLE 2 FACTOR ABRB COMPND MOL_ID: 1; COMPND 2 MOLECULE: TRANSITION STATE REGULATORY PROTEIN ABRB; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: N-TERMINAL DOMAIN; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; SOURCE 3 ORGANISM_TAXID: 1423; SOURCE 4 GENE: ABRB; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET30B KEYWDS NMR; HOMODIMER; BIOINFORMATICS; SWAPPED-HAIRPIN BARREL, KEYWDS 2 TRANSCRIPTION EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR V.TRUFFAULT,S.DJURANOVIC,M.COLES REVDAT 3 24-FEB-09 1YFB 1 VERSN REVDAT 2 21-JUN-05 1YFB 1 JRNL REVDAT 1 12-APR-05 1YFB 0 JRNL AUTH M.COLES,S.DJURANOVIC,J.SODING,T.FRICKEY,K.KORETKE, JRNL AUTH 2 V.TRUFFAULT,J.MARTIN,A.N.LUPAS JRNL TITL ABRB-LIKE TRANSCRIPTION FACTORS ASSUME A SWAPPED JRNL TITL 2 HAIRPIN FOLD THAT IS EVOLUTIONARILY RELATED TO JRNL TITL 3 DOUBLE-PSI BETA BARRELS. JRNL REF STRUCTURE V. 13 919 2005 JRNL REFN ISSN 0969-2126 JRNL PMID 15939023 JRNL DOI 10.1016/J.STR.2005.03.017 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR NIH-2.9.7 REMARK 3 AUTHORS : BRUNGER, A.T. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1YFB COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 20-JAN-05. REMARK 100 THE RCSB ID CODE IS RCSB031451. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 305 REMARK 210 PH : 5.8 REMARK 210 IONIC STRENGTH : 80MM REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 0.5MM ABRB-N; 20MM PHOSPHATE REMARK 210 BUFFER; 80MM KCL; 0.5MM ABRB-N REMARK 210 U-15N; 20MM PHOSPHATE BUFFER; REMARK 210 80MM KCL; 0.25MM ABRB-N U-15N, REMARK 210 0.25MM ABRB-N U-13C; 20MM REMARK 210 PHOSPHATE BUFFER; 80MM KCL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, 2D REMARK 210 NOESY, HNHA, 13C-FILTERED/ REMARK 210 EDITED NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ, 750 MHZ, 900 MHZ REMARK 210 SPECTROMETER MODEL : DMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR NIH-2.9.7, XWINNMR REMARK 210 3.5, NMRVIEW 5.0.15 REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 50 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : MINIMIZED AVERAGE STRUCTURE REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 MET A -5 REMARK 465 HIS A -4 REMARK 465 HIS A -3 REMARK 465 HIS A -2 REMARK 465 HIS A -1 REMARK 465 HIS A 0 REMARK 465 HIS A 1 REMARK 465 MET B -5 REMARK 465 HIS B -4 REMARK 465 HIS B -3 REMARK 465 HIS B -2 REMARK 465 HIS B -1 REMARK 465 HIS B 0 REMARK 465 HIS B 1 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 LYS A 33 -4.61 74.65 REMARK 500 GLU A 43 14.47 58.27 REMARK 500 LYS B 33 -4.81 74.80 REMARK 500 GLU B 43 14.39 58.12 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1EKT RELATED DB: PDB REMARK 900 RELATED ID: 1YSF RELATED DB: PDB REMARK 900 ENSEMBLE OF 20 STRUCTURES DBREF 1YFB A 2 53 UNP P08874 ABRB_BACSU 2 53 DBREF 1YFB B 2 53 UNP P08874 ABRB_BACSU 2 53 SEQADV 1YFB MET A -5 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS A -4 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS A -3 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS A -2 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS A -1 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS A 0 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS A 1 UNP P08874 EXPRESSION TAG SEQADV 1YFB MET B -5 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS B -4 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS B -3 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS B -2 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS B -1 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS B 0 UNP P08874 EXPRESSION TAG SEQADV 1YFB HIS B 1 UNP P08874 EXPRESSION TAG SEQRES 1 A 59 MET HIS HIS HIS HIS HIS HIS PHE MET LYS SER THR GLY SEQRES 2 A 59 ILE VAL ARG LYS VAL ASP GLU LEU GLY ARG VAL VAL ILE SEQRES 3 A 59 PRO ILE GLU LEU ARG ARG THR LEU GLY ILE ALA GLU LYS SEQRES 4 A 59 ASP ALA LEU GLU ILE TYR VAL ASP ASP GLU LYS ILE ILE SEQRES 5 A 59 LEU LYS LYS TYR LYS PRO ASN SEQRES 1 B 59 MET HIS HIS HIS HIS HIS HIS PHE MET LYS SER THR GLY SEQRES 2 B 59 ILE VAL ARG LYS VAL ASP GLU LEU GLY ARG VAL VAL ILE SEQRES 3 B 59 PRO ILE GLU LEU ARG ARG THR LEU GLY ILE ALA GLU LYS SEQRES 4 B 59 ASP ALA LEU GLU ILE TYR VAL ASP ASP GLU LYS ILE ILE SEQRES 5 B 59 LEU LYS LYS TYR LYS PRO ASN HELIX 1 1 PRO A 21 LEU A 28 1 8 HELIX 2 2 PRO B 21 LEU B 28 1 8 SHEET 1 A 6 ILE A 8 LYS A 11 0 SHEET 2 A 6 ALA B 35 ASP B 41 -1 O ILE B 38 N ILE A 8 SHEET 3 A 6 LYS B 44 LYS B 49 -1 O LYS B 44 N ASP B 41 SHEET 4 A 6 LYS A 44 LYS A 49 -1 N LEU A 47 O ILE B 45 SHEET 5 A 6 ALA A 35 ASP A 41 -1 N ASP A 41 O LYS A 44 SHEET 6 A 6 ILE B 8 LYS B 11 -1 O ILE B 8 N ILE A 38 SHEET 1 B 2 ARG A 17 VAL A 19 0 SHEET 2 B 2 ARG B 17 VAL B 19 -1 O VAL B 18 N VAL A 18 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 3 MET CE :methyl -155:sc= -0.319 (180deg=-1.61!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -179:sc= 0.638 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0199 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 92:sc= 1.24 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot 180:sc= -4.26! USER MOD Single : A 44 LYS NZ :NH3+ -144:sc= 0.31 (180deg=-0.0151) USER MOD Single : A 48 LYS NZ :NH3+ 158:sc= 0.126 (180deg=-0.557) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.157 K(o=-0.16,f=-2!) USER MOD Single : B 3 MET CE :methyl 137:sc= -0.149 (180deg=-1.02) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 SER OG : rot -173:sc= 0.195 USER MOD Single : B 6 THR OG1 : rot 180:sc= -0.018 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 THR OG1 : rot 92:sc= 1.21 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 TYR OH : rot 180:sc= -4.09! USER MOD Single : B 44 LYS NZ :NH3+ -150:sc= 0.295 (180deg=-0.0418) USER MOD Single : B 48 LYS NZ :NH3+ 155:sc= 0.0855 (180deg=-0.626) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot 180:sc= 0 USER MOD Single : B 51 LYS NZ :NH3+ -152:sc= -0.583 (180deg=-1.4!) USER MOD Single : B 53 ASN : amide:sc= -0.0124 K(o=-0.012,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 2 11.289 -19.463 25.985 1.00 8.95 N ATOM 2 CA PHE A 2 10.027 -18.718 25.708 1.00 8.27 C ATOM 3 C PHE A 2 9.577 -17.957 26.958 1.00 7.24 C ATOM 4 O PHE A 2 10.006 -18.242 28.058 1.00 7.05 O ATOM 5 CB PHE A 2 9.006 -19.794 25.338 1.00 8.63 C ATOM 6 CG PHE A 2 8.744 -20.673 26.538 1.00 9.10 C ATOM 7 CD1 PHE A 2 9.588 -21.756 26.810 1.00 9.38 C ATOM 8 CD2 PHE A 2 7.656 -20.405 27.378 1.00 9.54 C ATOM 9 CE1 PHE A 2 9.345 -22.571 27.922 1.00 10.06 C ATOM 10 CE2 PHE A 2 7.413 -21.220 28.490 1.00 10.22 C ATOM 11 CZ PHE A 2 8.257 -22.303 28.762 1.00 10.46 C ATOM 0 HA PHE A 2 10.148 -17.981 24.914 1.00 8.27 H new ATOM 0 HB2 PHE A 2 8.078 -19.330 25.004 1.00 8.63 H new ATOM 0 HB3 PHE A 2 9.379 -20.395 24.508 1.00 8.63 H new ATOM 0 HD1 PHE A 2 10.427 -21.963 26.162 1.00 9.38 H new ATOM 0 HD2 PHE A 2 7.004 -19.570 27.168 1.00 9.54 H new ATOM 0 HE1 PHE A 2 9.997 -23.406 28.132 1.00 10.06 H new ATOM 0 HE2 PHE A 2 6.574 -21.013 29.138 1.00 10.22 H new ATOM 0 HZ PHE A 2 8.069 -22.932 29.620 1.00 10.46 H new ATOM 21 N MET A 3 8.706 -16.998 26.799 1.00 6.80 N ATOM 22 CA MET A 3 8.220 -16.229 27.980 1.00 6.02 C ATOM 23 C MET A 3 6.862 -16.768 28.438 1.00 5.04 C ATOM 24 O MET A 3 6.012 -17.098 27.636 1.00 5.14 O ATOM 25 CB MET A 3 8.088 -14.788 27.487 1.00 6.59 C ATOM 26 CG MET A 3 9.470 -14.245 27.120 1.00 7.72 C ATOM 27 SD MET A 3 9.340 -12.486 26.712 1.00 8.46 S ATOM 28 CE MET A 3 8.186 -12.660 25.329 1.00 8.44 C ATOM 0 H MET A 3 8.310 -16.714 25.903 1.00 6.80 H new ATOM 0 HA MET A 3 8.896 -16.307 28.832 1.00 6.02 H new ATOM 0 HB2 MET A 3 7.428 -14.748 26.620 1.00 6.59 H new ATOM 0 HB3 MET A 3 7.636 -14.168 28.261 1.00 6.59 H new ATOM 0 HG2 MET A 3 10.160 -14.386 27.952 1.00 7.72 H new ATOM 0 HG3 MET A 3 9.876 -14.797 26.272 1.00 7.72 H new ATOM 0 HE1 MET A 3 8.296 -11.811 24.655 1.00 8.44 H new ATOM 0 HE2 MET A 3 8.401 -13.582 24.789 1.00 8.44 H new ATOM 0 HE3 MET A 3 7.165 -12.692 25.709 1.00 8.44 H new ATOM 38 N LYS A 4 6.663 -16.886 29.723 1.00 4.44 N ATOM 39 CA LYS A 4 5.373 -17.435 30.230 1.00 3.84 C ATOM 40 C LYS A 4 4.378 -16.302 30.500 1.00 3.23 C ATOM 41 O LYS A 4 4.703 -15.313 31.127 1.00 3.37 O ATOM 42 CB LYS A 4 5.732 -18.153 31.531 1.00 4.00 C ATOM 43 CG LYS A 4 4.518 -18.939 32.032 1.00 4.55 C ATOM 44 CD LYS A 4 4.856 -19.607 33.366 1.00 5.27 C ATOM 45 CE LYS A 4 3.696 -20.511 33.792 1.00 6.01 C ATOM 46 NZ LYS A 4 3.836 -20.643 35.269 1.00 6.50 N ATOM 0 H LYS A 4 7.337 -16.626 30.443 1.00 4.44 H new ATOM 0 HA LYS A 4 4.901 -18.104 29.510 1.00 3.84 H new ATOM 0 HB2 LYS A 4 6.573 -18.827 31.367 1.00 4.00 H new ATOM 0 HB3 LYS A 4 6.046 -17.430 32.283 1.00 4.00 H new ATOM 0 HG2 LYS A 4 3.665 -18.272 32.153 1.00 4.55 H new ATOM 0 HG3 LYS A 4 4.232 -19.693 31.298 1.00 4.55 H new ATOM 0 HD2 LYS A 4 5.771 -20.192 33.271 1.00 5.27 H new ATOM 0 HD3 LYS A 4 5.040 -18.850 34.128 1.00 5.27 H new ATOM 0 HE2 LYS A 4 2.735 -20.073 33.524 1.00 6.01 H new ATOM 0 HE3 LYS A 4 3.752 -21.483 33.301 1.00 6.01 H new ATOM 0 HZ1 LYS A 4 3.076 -21.250 35.637 1.00 6.50 H new ATOM 0 HZ2 LYS A 4 4.758 -21.069 35.494 1.00 6.50 H new ATOM 0 HZ3 LYS A 4 3.772 -19.703 35.709 1.00 6.50 H new ATOM 60 N SER A 5 3.154 -16.466 30.078 1.00 2.84 N ATOM 61 CA SER A 5 2.120 -15.429 30.363 1.00 2.22 C ATOM 62 C SER A 5 0.992 -16.037 31.202 1.00 1.21 C ATOM 63 O SER A 5 0.792 -17.235 31.211 1.00 1.13 O ATOM 64 CB SER A 5 1.598 -15.002 28.991 1.00 2.55 C ATOM 65 OG SER A 5 0.941 -16.101 28.375 1.00 2.99 O ATOM 0 H SER A 5 2.825 -17.273 29.548 1.00 2.84 H new ATOM 0 HA SER A 5 2.520 -14.585 30.925 1.00 2.22 H new ATOM 0 HB2 SER A 5 0.909 -14.164 29.096 1.00 2.55 H new ATOM 0 HB3 SER A 5 2.423 -14.660 28.366 1.00 2.55 H new ATOM 0 HG SER A 5 0.617 -15.834 27.490 1.00 2.99 H new ATOM 71 N THR A 6 0.278 -15.229 31.938 1.00 0.89 N ATOM 72 CA THR A 6 -0.801 -15.781 32.805 1.00 0.79 C ATOM 73 C THR A 6 -1.881 -16.443 31.948 1.00 0.72 C ATOM 74 O THR A 6 -2.455 -17.447 32.323 1.00 0.99 O ATOM 75 CB THR A 6 -1.373 -14.573 33.549 1.00 1.70 C ATOM 76 OG1 THR A 6 -1.944 -13.670 32.614 1.00 2.04 O ATOM 77 CG2 THR A 6 -0.256 -13.872 34.324 1.00 2.05 C ATOM 0 H THR A 6 0.394 -14.216 31.976 1.00 0.89 H new ATOM 0 HA THR A 6 -0.429 -16.542 33.491 1.00 0.79 H new ATOM 0 HB THR A 6 -2.141 -14.906 34.247 1.00 1.70 H new ATOM 0 HG1 THR A 6 -2.312 -12.896 33.089 1.00 2.04 H new ATOM 0 HG21 THR A 6 -0.665 -13.012 34.854 1.00 2.05 H new ATOM 0 HG22 THR A 6 0.180 -14.567 35.042 1.00 2.05 H new ATOM 0 HG23 THR A 6 0.514 -13.538 33.629 1.00 2.05 H new ATOM 85 N GLY A 7 -2.139 -15.912 30.784 1.00 0.45 N ATOM 86 CA GLY A 7 -3.154 -16.540 29.892 1.00 0.55 C ATOM 87 C GLY A 7 -4.551 -16.336 30.480 1.00 0.52 C ATOM 88 O GLY A 7 -5.349 -17.251 30.535 1.00 0.69 O ATOM 0 H GLY A 7 -1.692 -15.073 30.413 1.00 0.45 H new ATOM 0 HA2 GLY A 7 -3.100 -16.100 28.896 1.00 0.55 H new ATOM 0 HA3 GLY A 7 -2.947 -17.604 29.782 1.00 0.55 H new ATOM 92 N ILE A 8 -4.861 -15.144 30.913 1.00 0.35 N ATOM 93 CA ILE A 8 -6.219 -14.894 31.486 1.00 0.38 C ATOM 94 C ILE A 8 -6.978 -13.895 30.613 1.00 0.29 C ATOM 95 O ILE A 8 -6.419 -12.937 30.132 1.00 0.24 O ATOM 96 CB ILE A 8 -5.967 -14.304 32.871 1.00 0.43 C ATOM 97 CG1 ILE A 8 -5.059 -15.243 33.669 1.00 0.51 C ATOM 98 CG2 ILE A 8 -7.299 -14.139 33.605 1.00 0.53 C ATOM 99 CD1 ILE A 8 -4.705 -14.596 35.009 1.00 1.28 C ATOM 0 H ILE A 8 -4.239 -14.336 30.896 1.00 0.35 H new ATOM 0 HA ILE A 8 -6.819 -15.802 31.535 1.00 0.38 H new ATOM 0 HB ILE A 8 -5.485 -13.332 32.769 1.00 0.43 H new ATOM 0 HG12 ILE A 8 -5.560 -16.196 33.835 1.00 0.51 H new ATOM 0 HG13 ILE A 8 -4.151 -15.454 33.104 1.00 0.51 H new ATOM 0 HG21 ILE A 8 -7.120 -13.718 34.594 1.00 0.53 H new ATOM 0 HG22 ILE A 8 -7.947 -13.470 33.038 1.00 0.53 H new ATOM 0 HG23 ILE A 8 -7.781 -15.111 33.707 1.00 0.53 H new ATOM 0 HD11 ILE A 8 -4.058 -15.265 35.577 1.00 1.28 H new ATOM 0 HD12 ILE A 8 -4.186 -13.654 34.832 1.00 1.28 H new ATOM 0 HD13 ILE A 8 -5.618 -14.407 35.574 1.00 1.28 H new ATOM 111 N VAL A 9 -8.218 -14.161 30.325 1.00 0.31 N ATOM 112 CA VAL A 9 -8.967 -13.273 29.387 1.00 0.25 C ATOM 113 C VAL A 9 -10.153 -12.609 30.092 1.00 0.25 C ATOM 114 O VAL A 9 -10.820 -13.208 30.912 1.00 0.30 O ATOM 115 CB VAL A 9 -9.449 -14.192 28.265 1.00 0.27 C ATOM 116 CG1 VAL A 9 -10.278 -13.386 27.263 1.00 0.24 C ATOM 117 CG2 VAL A 9 -8.237 -14.799 27.548 1.00 0.28 C ATOM 0 H VAL A 9 -8.747 -14.951 30.695 1.00 0.31 H new ATOM 0 HA VAL A 9 -8.342 -12.463 29.010 1.00 0.25 H new ATOM 0 HB VAL A 9 -10.062 -14.988 28.687 1.00 0.27 H new ATOM 0 HG11 VAL A 9 -10.621 -14.042 26.463 1.00 0.24 H new ATOM 0 HG12 VAL A 9 -11.139 -12.951 27.770 1.00 0.24 H new ATOM 0 HG13 VAL A 9 -9.665 -12.590 26.841 1.00 0.24 H new ATOM 0 HG21 VAL A 9 -8.579 -15.455 26.747 1.00 0.28 H new ATOM 0 HG22 VAL A 9 -7.626 -14.001 27.127 1.00 0.28 H new ATOM 0 HG23 VAL A 9 -7.644 -15.374 28.259 1.00 0.28 H new ATOM 127 N ARG A 10 -10.441 -11.383 29.743 1.00 0.22 N ATOM 128 CA ARG A 10 -11.606 -10.678 30.350 1.00 0.25 C ATOM 129 C ARG A 10 -12.496 -10.103 29.245 1.00 0.21 C ATOM 130 O ARG A 10 -12.064 -9.915 28.127 1.00 0.20 O ATOM 131 CB ARG A 10 -10.999 -9.556 31.194 1.00 0.27 C ATOM 132 CG ARG A 10 -12.110 -8.831 31.954 1.00 0.33 C ATOM 133 CD ARG A 10 -12.635 -9.731 33.075 1.00 1.06 C ATOM 134 NE ARG A 10 -13.759 -8.969 33.686 1.00 1.33 N ATOM 135 CZ ARG A 10 -14.542 -9.543 34.560 1.00 1.82 C ATOM 136 NH1 ARG A 10 -14.344 -10.787 34.903 1.00 2.40 N ATOM 137 NH2 ARG A 10 -15.526 -8.870 35.092 1.00 2.40 N ATOM 0 H ARG A 10 -9.916 -10.837 29.060 1.00 0.22 H new ATOM 0 HA ARG A 10 -12.228 -11.341 30.951 1.00 0.25 H new ATOM 0 HB2 ARG A 10 -10.272 -9.966 31.895 1.00 0.27 H new ATOM 0 HB3 ARG A 10 -10.464 -8.854 30.554 1.00 0.27 H new ATOM 0 HG2 ARG A 10 -11.731 -7.898 32.370 1.00 0.33 H new ATOM 0 HG3 ARG A 10 -12.920 -8.570 31.273 1.00 0.33 H new ATOM 0 HD2 ARG A 10 -12.975 -10.690 32.685 1.00 1.06 H new ATOM 0 HD3 ARG A 10 -11.857 -9.943 33.808 1.00 1.06 H new ATOM 0 HE ARG A 10 -13.918 -7.997 33.422 1.00 1.33 H new ATOM 0 HH11 ARG A 10 -13.576 -11.314 34.488 1.00 2.40 H new ATOM 0 HH12 ARG A 10 -14.958 -11.232 35.586 1.00 2.40 H new ATOM 0 HH21 ARG A 10 -15.682 -7.898 34.825 1.00 2.40 H new ATOM 0 HH22 ARG A 10 -16.139 -9.316 35.775 1.00 2.40 H new ATOM 151 N LYS A 11 -13.737 -9.833 29.542 1.00 0.22 N ATOM 152 CA LYS A 11 -14.649 -9.284 28.496 1.00 0.21 C ATOM 153 C LYS A 11 -14.463 -7.769 28.370 1.00 0.18 C ATOM 154 O LYS A 11 -14.202 -7.082 29.337 1.00 0.18 O ATOM 155 CB LYS A 11 -16.060 -9.614 28.980 1.00 0.25 C ATOM 156 CG LYS A 11 -17.069 -9.285 27.879 1.00 1.15 C ATOM 157 CD LYS A 11 -18.471 -9.703 28.329 1.00 1.37 C ATOM 158 CE LYS A 11 -18.925 -8.809 29.485 1.00 2.37 C ATOM 159 NZ LYS A 11 -19.858 -7.826 28.867 1.00 2.74 N ATOM 0 H LYS A 11 -14.159 -9.968 30.461 1.00 0.22 H new ATOM 0 HA LYS A 11 -14.448 -9.710 27.513 1.00 0.21 H new ATOM 0 HB2 LYS A 11 -16.127 -10.669 29.245 1.00 0.25 H new ATOM 0 HB3 LYS A 11 -16.289 -9.044 29.880 1.00 0.25 H new ATOM 0 HG2 LYS A 11 -17.049 -8.217 27.660 1.00 1.15 H new ATOM 0 HG3 LYS A 11 -16.801 -9.804 26.959 1.00 1.15 H new ATOM 0 HD2 LYS A 11 -19.170 -9.622 27.497 1.00 1.37 H new ATOM 0 HD3 LYS A 11 -18.467 -10.747 28.643 1.00 1.37 H new ATOM 0 HE2 LYS A 11 -19.422 -9.390 30.262 1.00 2.37 H new ATOM 0 HE3 LYS A 11 -18.078 -8.309 29.954 1.00 2.37 H new ATOM 0 HZ1 LYS A 11 -20.213 -7.177 29.598 1.00 2.74 H new ATOM 0 HZ2 LYS A 11 -19.356 -7.283 28.136 1.00 2.74 H new ATOM 0 HZ3 LYS A 11 -20.658 -8.331 28.435 1.00 2.74 H new ATOM 173 N VAL A 12 -14.602 -7.245 27.182 1.00 0.16 N ATOM 174 CA VAL A 12 -14.438 -5.773 26.989 1.00 0.15 C ATOM 175 C VAL A 12 -15.735 -5.053 27.360 1.00 0.15 C ATOM 176 O VAL A 12 -16.798 -5.396 26.886 1.00 0.16 O ATOM 177 CB VAL A 12 -14.151 -5.589 25.497 1.00 0.14 C ATOM 178 CG1 VAL A 12 -13.573 -4.193 25.257 1.00 0.16 C ATOM 179 CG2 VAL A 12 -13.150 -6.645 25.024 1.00 0.14 C ATOM 0 H VAL A 12 -14.822 -7.771 26.336 1.00 0.16 H new ATOM 0 HA VAL A 12 -13.642 -5.365 27.612 1.00 0.15 H new ATOM 0 HB VAL A 12 -15.080 -5.701 24.937 1.00 0.14 H new ATOM 0 HG11 VAL A 12 -13.368 -4.062 24.194 1.00 0.16 H new ATOM 0 HG12 VAL A 12 -14.291 -3.441 25.584 1.00 0.16 H new ATOM 0 HG13 VAL A 12 -12.647 -4.081 25.821 1.00 0.16 H new ATOM 0 HG21 VAL A 12 -12.951 -6.507 23.961 1.00 0.14 H new ATOM 0 HG22 VAL A 12 -12.220 -6.542 25.584 1.00 0.14 H new ATOM 0 HG23 VAL A 12 -13.565 -7.639 25.190 1.00 0.14 H new ATOM 189 N ASP A 13 -15.659 -4.051 28.190 1.00 0.15 N ATOM 190 CA ASP A 13 -16.896 -3.313 28.568 1.00 0.16 C ATOM 191 C ASP A 13 -17.210 -2.241 27.514 1.00 0.17 C ATOM 192 O ASP A 13 -16.629 -2.220 26.447 1.00 0.18 O ATOM 193 CB ASP A 13 -16.598 -2.696 29.942 1.00 0.15 C ATOM 194 CG ASP A 13 -15.990 -1.303 29.786 1.00 0.15 C ATOM 195 OD1 ASP A 13 -14.790 -1.214 29.594 1.00 0.14 O ATOM 196 OD2 ASP A 13 -16.736 -0.343 29.860 1.00 0.17 O ATOM 0 H ASP A 13 -14.799 -3.712 28.621 1.00 0.15 H new ATOM 0 HA ASP A 13 -17.773 -3.959 28.616 1.00 0.16 H new ATOM 0 HB2 ASP A 13 -17.516 -2.634 30.526 1.00 0.15 H new ATOM 0 HB3 ASP A 13 -15.912 -3.338 30.494 1.00 0.15 H new ATOM 201 N GLU A 14 -18.211 -1.440 27.750 1.00 0.19 N ATOM 202 CA GLU A 14 -18.666 -0.484 26.697 1.00 0.22 C ATOM 203 C GLU A 14 -17.526 0.433 26.234 1.00 0.21 C ATOM 204 O GLU A 14 -17.467 0.818 25.083 1.00 0.23 O ATOM 205 CB GLU A 14 -19.771 0.336 27.364 1.00 0.23 C ATOM 206 CG GLU A 14 -20.943 -0.580 27.721 1.00 1.27 C ATOM 207 CD GLU A 14 -22.075 0.251 28.329 1.00 1.47 C ATOM 208 OE1 GLU A 14 -21.846 1.419 28.598 1.00 2.02 O ATOM 209 OE2 GLU A 14 -23.150 -0.294 28.515 1.00 1.91 O ATOM 0 H GLU A 14 -18.735 -1.404 28.625 1.00 0.19 H new ATOM 0 HA GLU A 14 -19.011 -1.008 25.806 1.00 0.22 H new ATOM 0 HB2 GLU A 14 -19.387 0.820 28.262 1.00 0.23 H new ATOM 0 HB3 GLU A 14 -20.106 1.128 26.694 1.00 0.23 H new ATOM 0 HG2 GLU A 14 -21.297 -1.099 26.830 1.00 1.27 H new ATOM 0 HG3 GLU A 14 -20.619 -1.344 28.428 1.00 1.27 H new ATOM 216 N LEU A 15 -16.693 0.882 27.131 1.00 0.19 N ATOM 217 CA LEU A 15 -15.655 1.881 26.737 1.00 0.20 C ATOM 218 C LEU A 15 -14.418 1.201 26.138 1.00 0.18 C ATOM 219 O LEU A 15 -13.498 1.861 25.696 1.00 0.18 O ATOM 220 CB LEU A 15 -15.287 2.611 28.027 1.00 0.20 C ATOM 221 CG LEU A 15 -14.121 3.564 27.752 1.00 0.25 C ATOM 222 CD1 LEU A 15 -14.418 4.389 26.496 1.00 0.30 C ATOM 223 CD2 LEU A 15 -13.941 4.505 28.944 1.00 0.47 C ATOM 0 H LEU A 15 -16.684 0.605 28.113 1.00 0.19 H new ATOM 0 HA LEU A 15 -16.032 2.558 25.971 1.00 0.20 H new ATOM 0 HB2 LEU A 15 -16.146 3.167 28.402 1.00 0.20 H new ATOM 0 HB3 LEU A 15 -15.011 1.893 28.799 1.00 0.20 H new ATOM 0 HG LEU A 15 -13.209 2.986 27.601 1.00 0.25 H new ATOM 0 HD11 LEU A 15 -13.587 5.067 26.301 1.00 0.30 H new ATOM 0 HD12 LEU A 15 -14.549 3.721 25.644 1.00 0.30 H new ATOM 0 HD13 LEU A 15 -15.330 4.967 26.647 1.00 0.30 H new ATOM 0 HD21 LEU A 15 -13.111 5.184 28.749 1.00 0.47 H new ATOM 0 HD22 LEU A 15 -14.854 5.081 29.094 1.00 0.47 H new ATOM 0 HD23 LEU A 15 -13.730 3.921 29.840 1.00 0.47 H new ATOM 235 N GLY A 16 -14.356 -0.102 26.151 1.00 0.16 N ATOM 236 CA GLY A 16 -13.138 -0.777 25.618 1.00 0.15 C ATOM 237 C GLY A 16 -12.031 -0.756 26.676 1.00 0.14 C ATOM 238 O GLY A 16 -10.902 -0.391 26.403 1.00 0.14 O ATOM 0 H GLY A 16 -15.085 -0.722 26.503 1.00 0.16 H new ATOM 0 HA2 GLY A 16 -13.372 -1.805 25.343 1.00 0.15 H new ATOM 0 HA3 GLY A 16 -12.799 -0.274 24.713 1.00 0.15 H new ATOM 242 N ARG A 17 -12.353 -1.093 27.894 1.00 0.13 N ATOM 243 CA ARG A 17 -11.330 -1.043 28.974 1.00 0.12 C ATOM 244 C ARG A 17 -11.046 -2.455 29.492 1.00 0.12 C ATOM 245 O ARG A 17 -11.874 -3.340 29.399 1.00 0.12 O ATOM 246 CB ARG A 17 -11.957 -0.179 30.068 1.00 0.13 C ATOM 247 CG ARG A 17 -12.102 1.257 29.559 1.00 0.14 C ATOM 248 CD ARG A 17 -12.676 2.141 30.668 1.00 0.16 C ATOM 249 NE ARG A 17 -14.086 1.693 30.824 1.00 0.15 N ATOM 250 CZ ARG A 17 -14.945 2.450 31.457 1.00 0.17 C ATOM 251 NH1 ARG A 17 -14.557 3.578 31.991 1.00 0.19 N ATOM 252 NH2 ARG A 17 -16.193 2.081 31.560 1.00 0.17 N ATOM 0 H ARG A 17 -13.280 -1.401 28.187 1.00 0.13 H new ATOM 0 HA ARG A 17 -10.379 -0.635 28.631 1.00 0.12 H new ATOM 0 HB2 ARG A 17 -12.932 -0.578 30.348 1.00 0.13 H new ATOM 0 HB3 ARG A 17 -11.336 -0.198 30.963 1.00 0.13 H new ATOM 0 HG2 ARG A 17 -11.132 1.640 29.240 1.00 0.14 H new ATOM 0 HG3 ARG A 17 -12.756 1.280 28.687 1.00 0.14 H new ATOM 0 HD2 ARG A 17 -12.118 2.021 31.597 1.00 0.16 H new ATOM 0 HD3 ARG A 17 -12.624 3.196 30.399 1.00 0.16 H new ATOM 0 HE ARG A 17 -14.383 0.797 30.438 1.00 0.15 H new ATOM 0 HH11 ARG A 17 -13.583 3.870 31.915 1.00 0.19 H new ATOM 0 HH12 ARG A 17 -15.229 4.167 32.484 1.00 0.19 H new ATOM 0 HH21 ARG A 17 -16.500 1.201 31.146 1.00 0.17 H new ATOM 0 HH22 ARG A 17 -16.861 2.673 32.054 1.00 0.17 H new ATOM 266 N VAL A 18 -9.879 -2.674 30.030 1.00 0.12 N ATOM 267 CA VAL A 18 -9.537 -4.030 30.546 1.00 0.12 C ATOM 268 C VAL A 18 -9.123 -3.937 32.015 1.00 0.13 C ATOM 269 O VAL A 18 -8.718 -2.894 32.487 1.00 0.12 O ATOM 270 CB VAL A 18 -8.362 -4.497 29.687 1.00 0.13 C ATOM 271 CG1 VAL A 18 -8.749 -4.423 28.209 1.00 0.14 C ATOM 272 CG2 VAL A 18 -7.153 -3.595 29.942 1.00 0.13 C ATOM 0 H VAL A 18 -9.146 -1.972 30.135 1.00 0.12 H new ATOM 0 HA VAL A 18 -10.378 -4.721 30.491 1.00 0.12 H new ATOM 0 HB VAL A 18 -8.110 -5.525 29.946 1.00 0.13 H new ATOM 0 HG11 VAL A 18 -7.911 -4.756 27.596 1.00 0.14 H new ATOM 0 HG12 VAL A 18 -9.610 -5.065 28.026 1.00 0.14 H new ATOM 0 HG13 VAL A 18 -9.002 -3.395 27.950 1.00 0.14 H new ATOM 0 HG21 VAL A 18 -6.315 -3.928 29.330 1.00 0.13 H new ATOM 0 HG22 VAL A 18 -7.405 -2.567 29.684 1.00 0.13 H new ATOM 0 HG23 VAL A 18 -6.876 -3.647 30.995 1.00 0.13 H new ATOM 282 N VAL A 19 -9.298 -4.993 32.760 1.00 0.15 N ATOM 283 CA VAL A 19 -9.000 -4.925 34.218 1.00 0.15 C ATOM 284 C VAL A 19 -7.776 -5.776 34.557 1.00 0.17 C ATOM 285 O VAL A 19 -7.682 -6.926 34.176 1.00 0.19 O ATOM 286 CB VAL A 19 -10.247 -5.490 34.898 1.00 0.18 C ATOM 287 CG1 VAL A 19 -10.149 -5.271 36.409 1.00 0.19 C ATOM 288 CG2 VAL A 19 -11.488 -4.778 34.358 1.00 0.19 C ATOM 0 H VAL A 19 -9.633 -5.896 32.424 1.00 0.15 H new ATOM 0 HA VAL A 19 -8.775 -3.910 34.544 1.00 0.15 H new ATOM 0 HB VAL A 19 -10.322 -6.558 34.691 1.00 0.18 H new ATOM 0 HG11 VAL A 19 -11.038 -5.674 36.893 1.00 0.19 H new ATOM 0 HG12 VAL A 19 -9.265 -5.779 36.794 1.00 0.19 H new ATOM 0 HG13 VAL A 19 -10.074 -4.204 36.618 1.00 0.19 H new ATOM 0 HG21 VAL A 19 -12.378 -5.180 34.842 1.00 0.19 H new ATOM 0 HG22 VAL A 19 -11.414 -3.710 34.565 1.00 0.19 H new ATOM 0 HG23 VAL A 19 -11.558 -4.935 33.282 1.00 0.19 H new ATOM 298 N ILE A 20 -6.884 -5.252 35.353 1.00 0.17 N ATOM 299 CA ILE A 20 -5.726 -6.068 35.810 1.00 0.19 C ATOM 300 C ILE A 20 -6.146 -6.930 37.006 1.00 0.20 C ATOM 301 O ILE A 20 -6.762 -6.442 37.926 1.00 0.19 O ATOM 302 CB ILE A 20 -4.666 -5.035 36.214 1.00 0.19 C ATOM 303 CG1 ILE A 20 -3.873 -4.614 34.975 1.00 0.24 C ATOM 304 CG2 ILE A 20 -3.710 -5.634 37.249 1.00 0.20 C ATOM 305 CD1 ILE A 20 -4.833 -4.075 33.913 1.00 1.53 C ATOM 0 H ILE A 20 -6.908 -4.295 35.706 1.00 0.17 H new ATOM 0 HA ILE A 20 -5.352 -6.751 35.047 1.00 0.19 H new ATOM 0 HB ILE A 20 -5.162 -4.168 36.650 1.00 0.19 H new ATOM 0 HG12 ILE A 20 -3.142 -3.850 35.240 1.00 0.24 H new ATOM 0 HG13 ILE A 20 -3.317 -5.464 34.580 1.00 0.24 H new ATOM 0 HG21 ILE A 20 -2.963 -4.891 37.527 1.00 0.20 H new ATOM 0 HG22 ILE A 20 -4.272 -5.932 38.134 1.00 0.20 H new ATOM 0 HG23 ILE A 20 -3.213 -6.506 36.824 1.00 0.20 H new ATOM 0 HD11 ILE A 20 -4.268 -3.775 33.030 1.00 1.53 H new ATOM 0 HD12 ILE A 20 -5.547 -4.852 33.640 1.00 1.53 H new ATOM 0 HD13 ILE A 20 -5.369 -3.213 34.311 1.00 1.53 H new ATOM 317 N PRO A 21 -5.759 -8.175 36.972 1.00 0.23 N ATOM 318 CA PRO A 21 -6.062 -9.093 38.099 1.00 0.24 C ATOM 319 C PRO A 21 -5.474 -8.538 39.399 1.00 0.22 C ATOM 320 O PRO A 21 -4.414 -7.950 39.408 1.00 0.20 O ATOM 321 CB PRO A 21 -5.385 -10.409 37.708 1.00 0.29 C ATOM 322 CG PRO A 21 -4.486 -10.085 36.553 1.00 0.29 C ATOM 323 CD PRO A 21 -5.015 -8.837 35.902 1.00 0.26 C ATOM 0 HA PRO A 21 -7.131 -9.219 38.271 1.00 0.24 H new ATOM 0 HB2 PRO A 21 -4.816 -10.818 38.543 1.00 0.29 H new ATOM 0 HB3 PRO A 21 -6.124 -11.160 37.428 1.00 0.29 H new ATOM 0 HG2 PRO A 21 -3.462 -9.934 36.895 1.00 0.29 H new ATOM 0 HG3 PRO A 21 -4.466 -10.910 35.840 1.00 0.29 H new ATOM 0 HD2 PRO A 21 -4.207 -8.208 35.528 1.00 0.26 H new ATOM 0 HD3 PRO A 21 -5.657 -9.070 35.053 1.00 0.26 H new ATOM 331 N ILE A 22 -6.162 -8.700 40.496 1.00 0.23 N ATOM 332 CA ILE A 22 -5.644 -8.149 41.783 1.00 0.22 C ATOM 333 C ILE A 22 -4.236 -8.674 42.058 1.00 0.21 C ATOM 334 O ILE A 22 -3.406 -7.983 42.612 1.00 0.18 O ATOM 335 CB ILE A 22 -6.621 -8.646 42.848 1.00 0.27 C ATOM 336 CG1 ILE A 22 -6.365 -7.904 44.163 1.00 0.30 C ATOM 337 CG2 ILE A 22 -6.421 -10.147 43.064 1.00 0.31 C ATOM 338 CD1 ILE A 22 -6.679 -6.419 43.982 1.00 1.07 C ATOM 0 H ILE A 22 -7.056 -9.187 40.558 1.00 0.23 H new ATOM 0 HA ILE A 22 -5.576 -7.061 41.768 1.00 0.22 H new ATOM 0 HB ILE A 22 -7.643 -8.459 42.518 1.00 0.27 H new ATOM 0 HG12 ILE A 22 -6.985 -8.323 44.956 1.00 0.30 H new ATOM 0 HG13 ILE A 22 -5.327 -8.032 44.469 1.00 0.30 H new ATOM 0 HG21 ILE A 22 -7.118 -10.501 43.824 1.00 0.31 H new ATOM 0 HG22 ILE A 22 -6.603 -10.677 42.129 1.00 0.31 H new ATOM 0 HG23 ILE A 22 -5.399 -10.334 43.394 1.00 0.31 H new ATOM 0 HD11 ILE A 22 -6.497 -5.892 44.918 1.00 1.07 H new ATOM 0 HD12 ILE A 22 -6.041 -6.005 43.202 1.00 1.07 H new ATOM 0 HD13 ILE A 22 -7.724 -6.300 43.697 1.00 1.07 H new ATOM 350 N GLU A 23 -3.949 -9.876 41.652 1.00 0.25 N ATOM 351 CA GLU A 23 -2.579 -10.416 41.871 1.00 0.27 C ATOM 352 C GLU A 23 -1.546 -9.502 41.206 1.00 0.25 C ATOM 353 O GLU A 23 -0.466 -9.283 41.718 1.00 0.24 O ATOM 354 CB GLU A 23 -2.585 -11.789 41.196 1.00 0.33 C ATOM 355 CG GLU A 23 -1.260 -12.502 41.474 1.00 1.20 C ATOM 356 CD GLU A 23 -1.225 -13.830 40.715 1.00 1.53 C ATOM 357 OE1 GLU A 23 -2.182 -14.115 40.014 1.00 2.06 O ATOM 358 OE2 GLU A 23 -0.242 -14.540 40.848 1.00 2.03 O ATOM 0 H GLU A 23 -4.598 -10.506 41.181 1.00 0.25 H new ATOM 0 HA GLU A 23 -2.321 -10.480 42.928 1.00 0.27 H new ATOM 0 HB2 GLU A 23 -3.417 -12.386 41.570 1.00 0.33 H new ATOM 0 HB3 GLU A 23 -2.731 -11.677 40.122 1.00 0.33 H new ATOM 0 HG2 GLU A 23 -0.425 -11.873 41.166 1.00 1.20 H new ATOM 0 HG3 GLU A 23 -1.148 -12.679 42.544 1.00 1.20 H new ATOM 365 N LEU A 24 -1.891 -8.938 40.082 1.00 0.24 N ATOM 366 CA LEU A 24 -0.955 -8.014 39.385 1.00 0.23 C ATOM 367 C LEU A 24 -1.047 -6.607 39.975 1.00 0.20 C ATOM 368 O LEU A 24 -0.068 -5.896 40.045 1.00 0.20 O ATOM 369 CB LEU A 24 -1.402 -8.018 37.923 1.00 0.26 C ATOM 370 CG LEU A 24 -1.192 -9.412 37.329 1.00 0.31 C ATOM 371 CD1 LEU A 24 -1.481 -9.377 35.827 1.00 0.33 C ATOM 372 CD2 LEU A 24 0.257 -9.847 37.558 1.00 0.35 C ATOM 0 H LEU A 24 -2.786 -9.079 39.614 1.00 0.24 H new ATOM 0 HA LEU A 24 0.083 -8.328 39.493 1.00 0.23 H new ATOM 0 HB2 LEU A 24 -2.452 -7.735 37.852 1.00 0.26 H new ATOM 0 HB3 LEU A 24 -0.834 -7.280 37.356 1.00 0.26 H new ATOM 0 HG LEU A 24 -1.867 -10.119 37.812 1.00 0.31 H new ATOM 0 HD11 LEU A 24 -1.331 -10.371 35.404 1.00 0.33 H new ATOM 0 HD12 LEU A 24 -2.512 -9.064 35.662 1.00 0.33 H new ATOM 0 HD13 LEU A 24 -0.806 -8.671 35.343 1.00 0.33 H new ATOM 0 HD21 LEU A 24 0.410 -10.840 37.136 1.00 0.35 H new ATOM 0 HD22 LEU A 24 0.930 -9.139 37.074 1.00 0.35 H new ATOM 0 HD23 LEU A 24 0.465 -9.872 38.628 1.00 0.35 H new ATOM 384 N ARG A 25 -2.187 -6.228 40.486 1.00 0.17 N ATOM 385 CA ARG A 25 -2.272 -4.900 41.159 1.00 0.15 C ATOM 386 C ARG A 25 -1.248 -4.848 42.290 1.00 0.14 C ATOM 387 O ARG A 25 -0.576 -3.855 42.489 1.00 0.15 O ATOM 388 CB ARG A 25 -3.688 -4.803 41.738 1.00 0.14 C ATOM 389 CG ARG A 25 -4.736 -4.864 40.624 1.00 0.17 C ATOM 390 CD ARG A 25 -6.111 -4.529 41.217 1.00 0.18 C ATOM 391 NE ARG A 25 -7.103 -5.075 40.255 1.00 0.21 N ATOM 392 CZ ARG A 25 -8.331 -5.304 40.637 1.00 0.23 C ATOM 393 NH1 ARG A 25 -8.697 -5.044 41.863 1.00 0.23 N ATOM 394 NH2 ARG A 25 -9.194 -5.794 39.790 1.00 0.27 N ATOM 0 H ARG A 25 -3.051 -6.770 40.468 1.00 0.17 H new ATOM 0 HA ARG A 25 -2.070 -4.080 40.470 1.00 0.15 H new ATOM 0 HB2 ARG A 25 -3.854 -5.617 42.444 1.00 0.14 H new ATOM 0 HB3 ARG A 25 -3.795 -3.872 42.294 1.00 0.14 H new ATOM 0 HG2 ARG A 25 -4.485 -4.159 39.831 1.00 0.17 H new ATOM 0 HG3 ARG A 25 -4.751 -5.857 40.174 1.00 0.17 H new ATOM 0 HD2 ARG A 25 -6.233 -4.977 42.203 1.00 0.18 H new ATOM 0 HD3 ARG A 25 -6.234 -3.453 41.339 1.00 0.18 H new ATOM 0 HE ARG A 25 -6.824 -5.272 39.294 1.00 0.21 H new ATOM 0 HH11 ARG A 25 -8.023 -4.661 42.526 1.00 0.23 H new ATOM 0 HH12 ARG A 25 -9.657 -5.224 42.158 1.00 0.23 H new ATOM 0 HH21 ARG A 25 -8.909 -5.997 38.832 1.00 0.27 H new ATOM 0 HH22 ARG A 25 -10.153 -5.974 40.086 1.00 0.27 H new ATOM 408 N ARG A 26 -1.158 -5.897 43.057 1.00 0.13 N ATOM 409 CA ARG A 26 -0.211 -5.896 44.211 1.00 0.13 C ATOM 410 C ARG A 26 1.237 -6.018 43.724 1.00 0.15 C ATOM 411 O ARG A 26 2.108 -5.284 44.144 1.00 0.16 O ATOM 412 CB ARG A 26 -0.599 -7.122 45.037 1.00 0.14 C ATOM 413 CG ARG A 26 -2.020 -6.946 45.576 1.00 1.19 C ATOM 414 CD ARG A 26 -2.371 -8.125 46.486 1.00 1.55 C ATOM 415 NE ARG A 26 -3.825 -7.970 46.770 1.00 2.39 N ATOM 416 CZ ARG A 26 -4.400 -8.713 47.678 1.00 3.03 C ATOM 417 NH1 ARG A 26 -3.702 -9.595 48.342 1.00 3.19 N ATOM 418 NH2 ARG A 26 -5.674 -8.573 47.922 1.00 3.95 N ATOM 0 H ARG A 26 -1.697 -6.755 42.937 1.00 0.13 H new ATOM 0 HA ARG A 26 -0.270 -4.972 44.787 1.00 0.13 H new ATOM 0 HB2 ARG A 26 -0.540 -8.021 44.423 1.00 0.14 H new ATOM 0 HB3 ARG A 26 0.101 -7.254 45.862 1.00 0.14 H new ATOM 0 HG2 ARG A 26 -2.097 -6.010 46.130 1.00 1.19 H new ATOM 0 HG3 ARG A 26 -2.729 -6.887 44.750 1.00 1.19 H new ATOM 0 HD2 ARG A 26 -2.163 -9.077 45.997 1.00 1.55 H new ATOM 0 HD3 ARG A 26 -1.784 -8.103 47.405 1.00 1.55 H new ATOM 0 HE ARG A 26 -4.373 -7.282 46.254 1.00 2.39 H new ATOM 0 HH11 ARG A 26 -2.706 -9.705 48.152 1.00 3.19 H new ATOM 0 HH12 ARG A 26 -4.153 -10.174 49.050 1.00 3.19 H new ATOM 0 HH21 ARG A 26 -6.220 -7.884 47.404 1.00 3.95 H new ATOM 0 HH22 ARG A 26 -6.124 -9.152 48.631 1.00 3.95 H new ATOM 432 N THR A 27 1.504 -6.956 42.857 1.00 0.17 N ATOM 433 CA THR A 27 2.900 -7.154 42.370 1.00 0.20 C ATOM 434 C THR A 27 3.394 -5.927 41.597 1.00 0.20 C ATOM 435 O THR A 27 4.574 -5.639 41.567 1.00 0.23 O ATOM 436 CB THR A 27 2.828 -8.372 41.448 1.00 0.23 C ATOM 437 OG1 THR A 27 2.254 -9.464 42.151 1.00 0.23 O ATOM 438 CG2 THR A 27 4.236 -8.746 40.981 1.00 0.27 C ATOM 0 H THR A 27 0.814 -7.596 42.463 1.00 0.17 H new ATOM 0 HA THR A 27 3.598 -7.299 43.195 1.00 0.20 H new ATOM 0 HB THR A 27 2.212 -8.135 40.581 1.00 0.23 H new ATOM 0 HG1 THR A 27 1.284 -9.471 42.009 1.00 0.23 H new ATOM 0 HG21 THR A 27 4.183 -9.614 40.324 1.00 0.27 H new ATOM 0 HG22 THR A 27 4.674 -7.908 40.440 1.00 0.27 H new ATOM 0 HG23 THR A 27 4.855 -8.983 41.846 1.00 0.27 H new ATOM 446 N LEU A 28 2.515 -5.232 40.932 1.00 0.19 N ATOM 447 CA LEU A 28 2.958 -4.066 40.114 1.00 0.19 C ATOM 448 C LEU A 28 2.998 -2.792 40.963 1.00 0.19 C ATOM 449 O LEU A 28 3.436 -1.752 40.511 1.00 0.20 O ATOM 450 CB LEU A 28 1.913 -3.946 39.002 1.00 0.19 C ATOM 451 CG LEU A 28 2.392 -2.935 37.960 1.00 0.21 C ATOM 452 CD1 LEU A 28 3.551 -3.536 37.160 1.00 0.24 C ATOM 453 CD2 LEU A 28 1.240 -2.599 37.010 1.00 0.21 C ATOM 0 H LEU A 28 1.512 -5.419 40.918 1.00 0.19 H new ATOM 0 HA LEU A 28 3.964 -4.202 39.717 1.00 0.19 H new ATOM 0 HB2 LEU A 28 1.751 -4.917 38.534 1.00 0.19 H new ATOM 0 HB3 LEU A 28 0.957 -3.629 39.419 1.00 0.19 H new ATOM 0 HG LEU A 28 2.728 -2.028 38.462 1.00 0.21 H new ATOM 0 HD11 LEU A 28 3.893 -2.815 36.417 1.00 0.24 H new ATOM 0 HD12 LEU A 28 4.372 -3.778 37.835 1.00 0.24 H new ATOM 0 HD13 LEU A 28 3.215 -4.443 36.658 1.00 0.24 H new ATOM 0 HD21 LEU A 28 1.580 -1.878 36.266 1.00 0.21 H new ATOM 0 HD22 LEU A 28 0.905 -3.507 36.509 1.00 0.21 H new ATOM 0 HD23 LEU A 28 0.413 -2.172 37.578 1.00 0.21 H new ATOM 465 N GLY A 29 2.569 -2.862 42.194 1.00 0.17 N ATOM 466 CA GLY A 29 2.610 -1.652 43.062 1.00 0.18 C ATOM 467 C GLY A 29 1.666 -0.586 42.506 1.00 0.17 C ATOM 468 O GLY A 29 2.009 0.576 42.421 1.00 0.17 O ATOM 0 H GLY A 29 2.193 -3.702 42.634 1.00 0.17 H new ATOM 0 HA2 GLY A 29 2.320 -1.913 44.080 1.00 0.18 H new ATOM 0 HA3 GLY A 29 3.627 -1.262 43.110 1.00 0.18 H new ATOM 472 N ILE A 30 0.493 -0.975 42.099 1.00 0.15 N ATOM 473 CA ILE A 30 -0.458 0.016 41.514 1.00 0.14 C ATOM 474 C ILE A 30 -1.704 0.151 42.391 1.00 0.15 C ATOM 475 O ILE A 30 -2.217 -0.813 42.921 1.00 0.16 O ATOM 476 CB ILE A 30 -0.827 -0.538 40.141 1.00 0.13 C ATOM 477 CG1 ILE A 30 0.442 -0.710 39.304 1.00 0.13 C ATOM 478 CG2 ILE A 30 -1.774 0.434 39.435 1.00 0.13 C ATOM 479 CD1 ILE A 30 1.245 0.595 39.323 1.00 0.14 C ATOM 0 H ILE A 30 0.149 -1.934 42.144 1.00 0.15 H new ATOM 0 HA ILE A 30 -0.014 1.009 41.445 1.00 0.14 H new ATOM 0 HB ILE A 30 -1.320 -1.503 40.260 1.00 0.13 H new ATOM 0 HG12 ILE A 30 1.045 -1.527 39.701 1.00 0.13 H new ATOM 0 HG13 ILE A 30 0.182 -0.975 38.279 1.00 0.13 H new ATOM 0 HG21 ILE A 30 -2.037 0.038 38.454 1.00 0.13 H new ATOM 0 HG22 ILE A 30 -2.678 0.558 40.031 1.00 0.13 H new ATOM 0 HG23 ILE A 30 -1.282 1.399 39.316 1.00 0.13 H new ATOM 0 HD11 ILE A 30 2.150 0.474 38.727 1.00 0.14 H new ATOM 0 HD12 ILE A 30 0.640 1.400 38.906 1.00 0.14 H new ATOM 0 HD13 ILE A 30 1.517 0.840 40.350 1.00 0.14 H new ATOM 491 N ALA A 31 -2.167 1.354 42.569 1.00 0.14 N ATOM 492 CA ALA A 31 -3.354 1.590 43.439 1.00 0.15 C ATOM 493 C ALA A 31 -4.252 2.664 42.820 1.00 0.15 C ATOM 494 O ALA A 31 -3.866 3.358 41.902 1.00 0.13 O ATOM 495 CB ALA A 31 -2.779 2.085 44.765 1.00 0.16 C ATOM 0 H ALA A 31 -1.771 2.193 42.146 1.00 0.14 H new ATOM 0 HA ALA A 31 -3.960 0.693 43.563 1.00 0.15 H new ATOM 0 HB1 ALA A 31 -3.592 2.282 45.463 1.00 0.16 H new ATOM 0 HB2 ALA A 31 -2.119 1.324 45.182 1.00 0.16 H new ATOM 0 HB3 ALA A 31 -2.215 3.002 44.597 1.00 0.16 H new ATOM 501 N GLU A 32 -5.453 2.800 43.308 1.00 0.16 N ATOM 502 CA GLU A 32 -6.376 3.822 42.736 1.00 0.16 C ATOM 503 C GLU A 32 -5.711 5.203 42.724 1.00 0.16 C ATOM 504 O GLU A 32 -4.975 5.555 43.622 1.00 0.17 O ATOM 505 CB GLU A 32 -7.588 3.823 43.668 1.00 0.19 C ATOM 506 CG GLU A 32 -8.664 4.752 43.106 1.00 0.19 C ATOM 507 CD GLU A 32 -9.829 4.841 44.093 1.00 0.22 C ATOM 508 OE1 GLU A 32 -9.750 4.205 45.131 1.00 1.07 O ATOM 509 OE2 GLU A 32 -10.780 5.545 43.795 1.00 0.99 O ATOM 0 H GLU A 32 -5.836 2.249 44.077 1.00 0.16 H new ATOM 0 HA GLU A 32 -6.648 3.596 41.705 1.00 0.16 H new ATOM 0 HB2 GLU A 32 -7.983 2.812 43.770 1.00 0.19 H new ATOM 0 HB3 GLU A 32 -7.293 4.152 44.665 1.00 0.19 H new ATOM 0 HG2 GLU A 32 -8.247 5.743 42.929 1.00 0.19 H new ATOM 0 HG3 GLU A 32 -9.016 4.378 42.145 1.00 0.19 H new ATOM 516 N LYS A 33 -6.018 6.002 41.734 1.00 0.16 N ATOM 517 CA LYS A 33 -5.476 7.397 41.663 1.00 0.17 C ATOM 518 C LYS A 33 -3.998 7.397 41.252 1.00 0.15 C ATOM 519 O LYS A 33 -3.431 8.433 40.970 1.00 0.16 O ATOM 520 CB LYS A 33 -5.640 7.978 43.072 1.00 0.20 C ATOM 521 CG LYS A 33 -5.545 9.504 43.006 1.00 0.60 C ATOM 522 CD LYS A 33 -5.647 10.083 44.419 1.00 0.76 C ATOM 523 CE LYS A 33 -5.726 11.610 44.341 1.00 1.42 C ATOM 524 NZ LYS A 33 -6.971 11.968 45.076 1.00 2.03 N ATOM 0 H LYS A 33 -6.630 5.745 40.960 1.00 0.16 H new ATOM 0 HA LYS A 33 -6.005 7.988 40.915 1.00 0.17 H new ATOM 0 HB2 LYS A 33 -6.601 7.680 43.491 1.00 0.20 H new ATOM 0 HB3 LYS A 33 -4.868 7.583 43.733 1.00 0.20 H new ATOM 0 HG2 LYS A 33 -4.602 9.801 42.547 1.00 0.60 H new ATOM 0 HG3 LYS A 33 -6.343 9.902 42.380 1.00 0.60 H new ATOM 0 HD2 LYS A 33 -6.529 9.688 44.922 1.00 0.76 H new ATOM 0 HD3 LYS A 33 -4.782 9.783 45.010 1.00 0.76 H new ATOM 0 HE2 LYS A 33 -4.851 12.075 44.796 1.00 1.42 H new ATOM 0 HE3 LYS A 33 -5.766 11.951 43.307 1.00 1.42 H new ATOM 0 HZ1 LYS A 33 -7.095 13.001 45.067 1.00 2.03 H new ATOM 0 HZ2 LYS A 33 -7.788 11.517 44.616 1.00 2.03 H new ATOM 0 HZ3 LYS A 33 -6.901 11.637 46.059 1.00 2.03 H new ATOM 538 N ASP A 34 -3.396 6.246 41.115 1.00 0.14 N ATOM 539 CA ASP A 34 -1.995 6.203 40.605 1.00 0.13 C ATOM 540 C ASP A 34 -1.984 6.402 39.088 1.00 0.13 C ATOM 541 O ASP A 34 -3.015 6.390 38.447 1.00 0.13 O ATOM 542 CB ASP A 34 -1.475 4.817 40.971 1.00 0.12 C ATOM 543 CG ASP A 34 -1.217 4.757 42.476 1.00 0.14 C ATOM 544 OD1 ASP A 34 -1.307 5.791 43.116 1.00 0.15 O ATOM 545 OD2 ASP A 34 -0.933 3.677 42.961 1.00 0.14 O ATOM 0 H ASP A 34 -3.810 5.340 41.332 1.00 0.14 H new ATOM 0 HA ASP A 34 -1.375 6.990 41.035 1.00 0.13 H new ATOM 0 HB2 ASP A 34 -2.201 4.056 40.684 1.00 0.12 H new ATOM 0 HB3 ASP A 34 -0.557 4.604 40.424 1.00 0.12 H new ATOM 550 N ALA A 35 -0.836 6.647 38.517 1.00 0.13 N ATOM 551 CA ALA A 35 -0.781 6.920 37.052 1.00 0.13 C ATOM 552 C ALA A 35 -0.221 5.710 36.296 1.00 0.12 C ATOM 553 O ALA A 35 0.840 5.206 36.607 1.00 0.11 O ATOM 554 CB ALA A 35 0.154 8.121 36.911 1.00 0.16 C ATOM 0 H ALA A 35 0.063 6.670 38.999 1.00 0.13 H new ATOM 0 HA ALA A 35 -1.769 7.116 36.635 1.00 0.13 H new ATOM 0 HB1 ALA A 35 0.249 8.387 35.858 1.00 0.16 H new ATOM 0 HB2 ALA A 35 -0.255 8.967 37.464 1.00 0.16 H new ATOM 0 HB3 ALA A 35 1.136 7.867 37.311 1.00 0.16 H new ATOM 560 N LEU A 36 -0.886 5.301 35.249 1.00 0.12 N ATOM 561 CA LEU A 36 -0.354 4.194 34.400 1.00 0.12 C ATOM 562 C LEU A 36 0.133 4.762 33.067 1.00 0.15 C ATOM 563 O LEU A 36 -0.540 5.566 32.456 1.00 0.17 O ATOM 564 CB LEU A 36 -1.546 3.270 34.157 1.00 0.13 C ATOM 565 CG LEU A 36 -2.258 2.972 35.474 1.00 0.12 C ATOM 566 CD1 LEU A 36 -3.660 2.442 35.172 1.00 0.15 C ATOM 567 CD2 LEU A 36 -1.471 1.915 36.253 1.00 0.14 C ATOM 0 H LEU A 36 -1.779 5.687 34.943 1.00 0.12 H new ATOM 0 HA LEU A 36 0.481 3.676 34.872 1.00 0.12 H new ATOM 0 HB2 LEU A 36 -2.240 3.736 33.457 1.00 0.13 H new ATOM 0 HB3 LEU A 36 -1.208 2.340 33.699 1.00 0.13 H new ATOM 0 HG LEU A 36 -2.327 3.882 36.070 1.00 0.12 H new ATOM 0 HD11 LEU A 36 -4.177 2.226 36.107 1.00 0.15 H new ATOM 0 HD12 LEU A 36 -4.220 3.192 34.613 1.00 0.15 H new ATOM 0 HD13 LEU A 36 -3.584 1.530 34.580 1.00 0.15 H new ATOM 0 HD21 LEU A 36 -1.980 1.702 37.193 1.00 0.14 H new ATOM 0 HD22 LEU A 36 -1.405 1.002 35.662 1.00 0.14 H new ATOM 0 HD23 LEU A 36 -0.468 2.287 36.459 1.00 0.14 H new ATOM 579 N GLU A 37 1.211 4.254 32.538 1.00 0.15 N ATOM 580 CA GLU A 37 1.619 4.677 31.170 1.00 0.18 C ATOM 581 C GLU A 37 1.336 3.552 30.174 1.00 0.18 C ATOM 582 O GLU A 37 1.467 2.385 30.487 1.00 0.17 O ATOM 583 CB GLU A 37 3.118 4.961 31.261 1.00 0.19 C ATOM 584 CG GLU A 37 3.613 5.524 29.927 1.00 0.23 C ATOM 585 CD GLU A 37 5.129 5.715 29.984 1.00 0.26 C ATOM 586 OE1 GLU A 37 5.709 5.393 31.009 1.00 1.13 O ATOM 587 OE2 GLU A 37 5.686 6.180 29.003 1.00 1.08 O ATOM 0 H GLU A 37 1.821 3.572 32.988 1.00 0.15 H new ATOM 0 HA GLU A 37 1.071 5.554 30.826 1.00 0.18 H new ATOM 0 HB2 GLU A 37 3.316 5.671 32.064 1.00 0.19 H new ATOM 0 HB3 GLU A 37 3.658 4.046 31.505 1.00 0.19 H new ATOM 0 HG2 GLU A 37 3.352 4.846 29.115 1.00 0.23 H new ATOM 0 HG3 GLU A 37 3.124 6.475 29.718 1.00 0.23 H new ATOM 594 N ILE A 38 0.840 3.893 29.020 1.00 0.21 N ATOM 595 CA ILE A 38 0.416 2.850 28.046 1.00 0.23 C ATOM 596 C ILE A 38 1.328 2.860 26.819 1.00 0.22 C ATOM 597 O ILE A 38 1.655 3.902 26.279 1.00 0.22 O ATOM 598 CB ILE A 38 -1.011 3.232 27.655 1.00 0.27 C ATOM 599 CG1 ILE A 38 -1.880 3.310 28.912 1.00 0.28 C ATOM 600 CG2 ILE A 38 -1.582 2.176 26.707 1.00 0.30 C ATOM 601 CD1 ILE A 38 -3.276 3.813 28.538 1.00 0.86 C ATOM 0 H ILE A 38 0.709 4.855 28.707 1.00 0.21 H new ATOM 0 HA ILE A 38 0.471 1.847 28.469 1.00 0.23 H new ATOM 0 HB ILE A 38 -1.003 4.201 27.156 1.00 0.27 H new ATOM 0 HG12 ILE A 38 -1.949 2.328 29.380 1.00 0.28 H new ATOM 0 HG13 ILE A 38 -1.424 3.980 29.641 1.00 0.28 H new ATOM 0 HG21 ILE A 38 -2.600 2.449 26.429 1.00 0.30 H new ATOM 0 HG22 ILE A 38 -0.964 2.119 25.811 1.00 0.30 H new ATOM 0 HG23 ILE A 38 -1.590 1.206 27.205 1.00 0.30 H new ATOM 0 HD11 ILE A 38 -3.895 3.868 29.434 1.00 0.86 H new ATOM 0 HD12 ILE A 38 -3.198 4.803 28.089 1.00 0.86 H new ATOM 0 HD13 ILE A 38 -3.731 3.126 27.824 1.00 0.86 H new ATOM 613 N TYR A 39 1.756 1.701 26.403 1.00 0.21 N ATOM 614 CA TYR A 39 2.677 1.591 25.237 1.00 0.20 C ATOM 615 C TYR A 39 1.985 0.856 24.087 1.00 0.18 C ATOM 616 O TYR A 39 1.121 0.031 24.305 1.00 0.17 O ATOM 617 CB TYR A 39 3.840 0.749 25.754 1.00 0.22 C ATOM 618 CG TYR A 39 4.770 1.591 26.584 1.00 0.25 C ATOM 619 CD1 TYR A 39 4.333 2.159 27.787 1.00 0.28 C ATOM 620 CD2 TYR A 39 6.078 1.789 26.150 1.00 0.28 C ATOM 621 CE1 TYR A 39 5.212 2.934 28.554 1.00 0.31 C ATOM 622 CE2 TYR A 39 6.960 2.561 26.912 1.00 0.32 C ATOM 623 CZ TYR A 39 6.528 3.136 28.115 1.00 0.33 C ATOM 624 OH TYR A 39 7.397 3.903 28.863 1.00 0.37 O ATOM 0 H TYR A 39 1.502 0.810 26.829 1.00 0.21 H new ATOM 0 HA TYR A 39 2.990 2.565 24.861 1.00 0.20 H new ATOM 0 HB2 TYR A 39 3.460 -0.080 26.351 1.00 0.22 H new ATOM 0 HB3 TYR A 39 4.384 0.315 24.915 1.00 0.22 H new ATOM 0 HD1 TYR A 39 3.319 2.000 28.123 1.00 0.28 H new ATOM 0 HD2 TYR A 39 6.412 1.346 25.223 1.00 0.28 H new ATOM 0 HE1 TYR A 39 4.877 3.375 29.481 1.00 0.31 H new ATOM 0 HE2 TYR A 39 7.974 2.714 26.574 1.00 0.32 H new ATOM 0 HH TYR A 39 8.268 3.940 28.416 1.00 0.37 H new ATOM 634 N VAL A 40 2.449 1.038 22.882 1.00 0.18 N ATOM 635 CA VAL A 40 1.905 0.223 21.757 1.00 0.16 C ATOM 636 C VAL A 40 3.040 -0.398 20.938 1.00 0.16 C ATOM 637 O VAL A 40 3.856 0.295 20.363 1.00 0.22 O ATOM 638 CB VAL A 40 1.109 1.206 20.900 1.00 0.19 C ATOM 639 CG1 VAL A 40 0.567 0.482 19.667 1.00 0.20 C ATOM 640 CG2 VAL A 40 -0.058 1.762 21.719 1.00 0.20 C ATOM 0 H VAL A 40 3.174 1.709 22.628 1.00 0.18 H new ATOM 0 HA VAL A 40 1.290 -0.602 22.116 1.00 0.16 H new ATOM 0 HB VAL A 40 1.756 2.024 20.585 1.00 0.19 H new ATOM 0 HG11 VAL A 40 -0.001 1.182 19.054 1.00 0.20 H new ATOM 0 HG12 VAL A 40 1.398 0.082 19.085 1.00 0.20 H new ATOM 0 HG13 VAL A 40 -0.082 -0.335 19.981 1.00 0.20 H new ATOM 0 HG21 VAL A 40 -0.628 2.464 21.110 1.00 0.20 H new ATOM 0 HG22 VAL A 40 -0.706 0.943 22.031 1.00 0.20 H new ATOM 0 HG23 VAL A 40 0.328 2.276 22.600 1.00 0.20 H new ATOM 650 N ASP A 41 3.060 -1.699 20.830 1.00 0.14 N ATOM 651 CA ASP A 41 4.094 -2.364 19.987 1.00 0.15 C ATOM 652 C ASP A 41 3.521 -3.638 19.355 1.00 0.17 C ATOM 653 O ASP A 41 2.800 -4.379 19.987 1.00 0.21 O ATOM 654 CB ASP A 41 5.231 -2.708 20.949 1.00 0.21 C ATOM 655 CG ASP A 41 4.824 -3.895 21.824 1.00 0.35 C ATOM 656 OD1 ASP A 41 3.649 -4.003 22.131 1.00 1.07 O ATOM 657 OD2 ASP A 41 5.694 -4.677 22.167 1.00 1.21 O ATOM 0 H ASP A 41 2.404 -2.330 21.290 1.00 0.14 H new ATOM 0 HA ASP A 41 4.432 -1.727 19.170 1.00 0.15 H new ATOM 0 HB2 ASP A 41 6.134 -2.950 20.388 1.00 0.21 H new ATOM 0 HB3 ASP A 41 5.465 -1.846 21.574 1.00 0.21 H new ATOM 662 N ASP A 42 3.923 -3.954 18.156 1.00 0.30 N ATOM 663 CA ASP A 42 3.495 -5.242 17.536 1.00 0.44 C ATOM 664 C ASP A 42 2.002 -5.504 17.780 1.00 0.36 C ATOM 665 O ASP A 42 1.603 -6.607 18.096 1.00 0.38 O ATOM 666 CB ASP A 42 4.346 -6.303 18.228 1.00 0.56 C ATOM 667 CG ASP A 42 3.951 -7.691 17.720 1.00 0.69 C ATOM 668 OD1 ASP A 42 3.162 -7.757 16.791 1.00 1.21 O ATOM 669 OD2 ASP A 42 4.444 -8.664 18.266 1.00 1.38 O ATOM 0 H ASP A 42 4.531 -3.376 17.576 1.00 0.30 H new ATOM 0 HA ASP A 42 3.630 -5.239 16.454 1.00 0.44 H new ATOM 0 HB2 ASP A 42 5.403 -6.120 18.032 1.00 0.56 H new ATOM 0 HB3 ASP A 42 4.208 -6.247 19.308 1.00 0.56 H new ATOM 674 N GLU A 43 1.169 -4.521 17.564 1.00 0.32 N ATOM 675 CA GLU A 43 -0.304 -4.737 17.699 1.00 0.32 C ATOM 676 C GLU A 43 -0.651 -5.224 19.108 1.00 0.26 C ATOM 677 O GLU A 43 -1.761 -5.639 19.377 1.00 0.30 O ATOM 678 CB GLU A 43 -0.648 -5.807 16.660 1.00 0.41 C ATOM 679 CG GLU A 43 -0.304 -5.290 15.262 1.00 1.23 C ATOM 680 CD GLU A 43 -0.717 -6.329 14.217 1.00 1.53 C ATOM 681 OE1 GLU A 43 -1.075 -7.427 14.611 1.00 2.03 O ATOM 682 OE2 GLU A 43 -0.668 -6.009 13.041 1.00 2.12 O ATOM 0 H GLU A 43 1.444 -3.575 17.299 1.00 0.32 H new ATOM 0 HA GLU A 43 -0.867 -3.817 17.539 1.00 0.32 H new ATOM 0 HB2 GLU A 43 -0.093 -6.722 16.868 1.00 0.41 H new ATOM 0 HB3 GLU A 43 -1.708 -6.057 16.717 1.00 0.41 H new ATOM 0 HG2 GLU A 43 -0.817 -4.347 15.075 1.00 1.23 H new ATOM 0 HG3 GLU A 43 0.765 -5.091 15.189 1.00 1.23 H new ATOM 689 N LYS A 44 0.264 -5.102 20.025 1.00 0.20 N ATOM 690 CA LYS A 44 -0.034 -5.473 21.438 1.00 0.24 C ATOM 691 C LYS A 44 0.152 -4.258 22.348 1.00 0.19 C ATOM 692 O LYS A 44 0.952 -3.388 22.077 1.00 0.21 O ATOM 693 CB LYS A 44 0.979 -6.563 21.792 1.00 0.40 C ATOM 694 CG LYS A 44 0.694 -7.819 20.969 1.00 0.95 C ATOM 695 CD LYS A 44 1.622 -8.947 21.427 1.00 0.86 C ATOM 696 CE LYS A 44 1.373 -10.193 20.575 1.00 1.81 C ATOM 697 NZ LYS A 44 2.532 -10.258 19.641 1.00 1.80 N ATOM 0 H LYS A 44 1.210 -4.760 19.858 1.00 0.20 H new ATOM 0 HA LYS A 44 -1.060 -5.818 21.564 1.00 0.24 H new ATOM 0 HB2 LYS A 44 1.991 -6.210 21.595 1.00 0.40 H new ATOM 0 HB3 LYS A 44 0.923 -6.793 22.856 1.00 0.40 H new ATOM 0 HG2 LYS A 44 -0.347 -8.118 21.090 1.00 0.95 H new ATOM 0 HG3 LYS A 44 0.846 -7.615 19.909 1.00 0.95 H new ATOM 0 HD2 LYS A 44 2.662 -8.635 21.338 1.00 0.86 H new ATOM 0 HD3 LYS A 44 1.446 -9.172 22.479 1.00 0.86 H new ATOM 0 HE2 LYS A 44 1.313 -11.089 21.193 1.00 1.81 H new ATOM 0 HE3 LYS A 44 0.431 -10.118 20.031 1.00 1.81 H new ATOM 0 HZ1 LYS A 44 2.214 -10.613 18.717 1.00 1.80 H new ATOM 0 HZ2 LYS A 44 2.938 -9.308 19.525 1.00 1.80 H new ATOM 0 HZ3 LYS A 44 3.254 -10.899 20.028 1.00 1.80 H new ATOM 711 N ILE A 45 -0.604 -4.174 23.406 1.00 0.18 N ATOM 712 CA ILE A 45 -0.488 -2.991 24.307 1.00 0.20 C ATOM 713 C ILE A 45 0.379 -3.333 25.522 1.00 0.15 C ATOM 714 O ILE A 45 0.133 -4.298 26.216 1.00 0.13 O ATOM 715 CB ILE A 45 -1.922 -2.697 24.744 1.00 0.25 C ATOM 716 CG1 ILE A 45 -2.802 -2.510 23.507 1.00 0.32 C ATOM 717 CG2 ILE A 45 -1.947 -1.419 25.584 1.00 0.31 C ATOM 718 CD1 ILE A 45 -4.272 -2.521 23.923 1.00 0.39 C ATOM 0 H ILE A 45 -1.295 -4.870 23.686 1.00 0.18 H new ATOM 0 HA ILE A 45 -0.022 -2.138 23.815 1.00 0.20 H new ATOM 0 HB ILE A 45 -2.300 -3.530 25.338 1.00 0.25 H new ATOM 0 HG12 ILE A 45 -2.559 -1.569 23.014 1.00 0.32 H new ATOM 0 HG13 ILE A 45 -2.610 -3.306 22.787 1.00 0.32 H new ATOM 0 HG21 ILE A 45 -2.970 -1.209 25.896 1.00 0.31 H new ATOM 0 HG22 ILE A 45 -1.319 -1.550 26.465 1.00 0.31 H new ATOM 0 HG23 ILE A 45 -1.570 -0.586 24.990 1.00 0.31 H new ATOM 0 HD11 ILE A 45 -4.900 -2.388 23.042 1.00 0.39 H new ATOM 0 HD12 ILE A 45 -4.509 -3.473 24.397 1.00 0.39 H new ATOM 0 HD13 ILE A 45 -4.457 -1.710 24.627 1.00 0.39 H new ATOM 730 N ILE A 46 1.355 -2.516 25.814 1.00 0.21 N ATOM 731 CA ILE A 46 2.198 -2.753 27.022 1.00 0.22 C ATOM 732 C ILE A 46 1.898 -1.697 28.089 1.00 0.20 C ATOM 733 O ILE A 46 2.143 -0.526 27.902 1.00 0.27 O ATOM 734 CB ILE A 46 3.641 -2.627 26.522 1.00 0.34 C ATOM 735 CG1 ILE A 46 3.999 -3.869 25.705 1.00 0.48 C ATOM 736 CG2 ILE A 46 4.599 -2.498 27.710 1.00 0.34 C ATOM 737 CD1 ILE A 46 5.074 -3.505 24.684 1.00 1.11 C ATOM 0 H ILE A 46 1.606 -1.693 25.267 1.00 0.21 H new ATOM 0 HA ILE A 46 2.009 -3.724 27.480 1.00 0.22 H new ATOM 0 HB ILE A 46 3.731 -1.737 25.899 1.00 0.34 H new ATOM 0 HG12 ILE A 46 4.358 -4.661 26.363 1.00 0.48 H new ATOM 0 HG13 ILE A 46 3.114 -4.253 25.198 1.00 0.48 H new ATOM 0 HG21 ILE A 46 5.622 -2.409 27.344 1.00 0.34 H new ATOM 0 HG22 ILE A 46 4.342 -1.611 28.290 1.00 0.34 H new ATOM 0 HG23 ILE A 46 4.515 -3.382 28.343 1.00 0.34 H new ATOM 0 HD11 ILE A 46 5.333 -4.387 24.098 1.00 1.11 H new ATOM 0 HD12 ILE A 46 4.697 -2.727 24.020 1.00 1.11 H new ATOM 0 HD13 ILE A 46 5.960 -3.141 25.203 1.00 1.11 H new ATOM 749 N LEU A 47 1.377 -2.105 29.212 1.00 0.15 N ATOM 750 CA LEU A 47 1.076 -1.119 30.290 1.00 0.13 C ATOM 751 C LEU A 47 2.067 -1.283 31.442 1.00 0.14 C ATOM 752 O LEU A 47 2.344 -2.380 31.884 1.00 0.16 O ATOM 753 CB LEU A 47 -0.337 -1.450 30.760 1.00 0.13 C ATOM 754 CG LEU A 47 -1.309 -1.364 29.582 1.00 0.13 C ATOM 755 CD1 LEU A 47 -1.189 -2.622 28.721 1.00 0.14 C ATOM 756 CD2 LEU A 47 -2.740 -1.246 30.112 1.00 0.15 C ATOM 0 H LEU A 47 1.147 -3.074 29.431 1.00 0.15 H new ATOM 0 HA LEU A 47 1.155 -0.091 29.936 1.00 0.13 H new ATOM 0 HB2 LEU A 47 -0.361 -2.451 31.191 1.00 0.13 H new ATOM 0 HB3 LEU A 47 -0.641 -0.757 31.545 1.00 0.13 H new ATOM 0 HG LEU A 47 -1.068 -0.489 28.978 1.00 0.13 H new ATOM 0 HD11 LEU A 47 -1.883 -2.557 27.883 1.00 0.14 H new ATOM 0 HD12 LEU A 47 -0.170 -2.708 28.343 1.00 0.14 H new ATOM 0 HD13 LEU A 47 -1.428 -3.499 29.323 1.00 0.14 H new ATOM 0 HD21 LEU A 47 -3.434 -1.185 29.274 1.00 0.15 H new ATOM 0 HD22 LEU A 47 -2.977 -2.121 30.717 1.00 0.15 H new ATOM 0 HD23 LEU A 47 -2.829 -0.348 30.723 1.00 0.15 H new ATOM 768 N LYS A 48 2.603 -0.201 31.924 1.00 0.15 N ATOM 769 CA LYS A 48 3.583 -0.284 33.046 1.00 0.17 C ATOM 770 C LYS A 48 3.408 0.905 33.992 1.00 0.15 C ATOM 771 O LYS A 48 2.785 1.890 33.653 1.00 0.15 O ATOM 772 CB LYS A 48 4.961 -0.246 32.384 1.00 0.22 C ATOM 773 CG LYS A 48 5.193 1.121 31.734 1.00 0.27 C ATOM 774 CD LYS A 48 6.576 1.138 31.083 1.00 0.35 C ATOM 775 CE LYS A 48 7.097 2.575 31.028 1.00 1.42 C ATOM 776 NZ LYS A 48 7.409 2.926 32.441 1.00 2.11 N ATOM 0 H LYS A 48 2.406 0.743 31.590 1.00 0.15 H new ATOM 0 HA LYS A 48 3.446 -1.186 33.642 1.00 0.17 H new ATOM 0 HB2 LYS A 48 5.735 -0.441 33.126 1.00 0.22 H new ATOM 0 HB3 LYS A 48 5.034 -1.032 31.633 1.00 0.22 H new ATOM 0 HG2 LYS A 48 4.424 1.318 30.987 1.00 0.27 H new ATOM 0 HG3 LYS A 48 5.120 1.910 32.482 1.00 0.27 H new ATOM 0 HD2 LYS A 48 7.264 0.512 31.651 1.00 0.35 H new ATOM 0 HD3 LYS A 48 6.521 0.721 30.077 1.00 0.35 H new ATOM 0 HE2 LYS A 48 7.983 2.650 30.398 1.00 1.42 H new ATOM 0 HE3 LYS A 48 6.350 3.250 30.609 1.00 1.42 H new ATOM 0 HZ1 LYS A 48 8.093 3.709 32.461 1.00 2.11 H new ATOM 0 HZ2 LYS A 48 6.537 3.216 32.927 1.00 2.11 H new ATOM 0 HZ3 LYS A 48 7.815 2.099 32.923 1.00 2.11 H new ATOM 790 N LYS A 49 3.991 0.845 35.157 1.00 0.16 N ATOM 791 CA LYS A 49 3.895 2.002 36.092 1.00 0.17 C ATOM 792 C LYS A 49 4.393 3.272 35.404 1.00 0.18 C ATOM 793 O LYS A 49 5.219 3.226 34.514 1.00 0.20 O ATOM 794 CB LYS A 49 4.795 1.645 37.272 1.00 0.22 C ATOM 795 CG LYS A 49 4.700 2.737 38.339 1.00 0.26 C ATOM 796 CD LYS A 49 5.544 2.341 39.552 1.00 0.76 C ATOM 797 CE LYS A 49 7.027 2.371 39.175 1.00 0.99 C ATOM 798 NZ LYS A 49 7.751 2.054 40.438 1.00 1.61 N ATOM 0 H LYS A 49 4.528 0.049 35.501 1.00 0.16 H new ATOM 0 HA LYS A 49 2.870 2.189 36.411 1.00 0.17 H new ATOM 0 HB2 LYS A 49 4.496 0.685 37.693 1.00 0.22 H new ATOM 0 HB3 LYS A 49 5.827 1.539 36.936 1.00 0.22 H new ATOM 0 HG2 LYS A 49 5.049 3.687 37.934 1.00 0.26 H new ATOM 0 HG3 LYS A 49 3.661 2.880 38.637 1.00 0.26 H new ATOM 0 HD2 LYS A 49 5.354 3.025 40.379 1.00 0.76 H new ATOM 0 HD3 LYS A 49 5.265 1.344 39.893 1.00 0.76 H new ATOM 0 HE2 LYS A 49 7.252 1.641 38.397 1.00 0.99 H new ATOM 0 HE3 LYS A 49 7.317 3.348 38.788 1.00 0.99 H new ATOM 0 HZ1 LYS A 49 8.776 2.056 40.261 1.00 1.61 H new ATOM 0 HZ2 LYS A 49 7.523 2.769 41.158 1.00 1.61 H new ATOM 0 HZ3 LYS A 49 7.460 1.115 40.779 1.00 1.61 H new ATOM 812 N TYR A 50 3.833 4.395 35.748 1.00 0.18 N ATOM 813 CA TYR A 50 4.203 5.656 35.043 1.00 0.20 C ATOM 814 C TYR A 50 5.169 6.485 35.892 1.00 0.27 C ATOM 815 O TYR A 50 4.847 6.904 36.986 1.00 0.30 O ATOM 816 CB TYR A 50 2.884 6.402 34.853 1.00 0.19 C ATOM 817 CG TYR A 50 3.144 7.722 34.166 1.00 0.21 C ATOM 818 CD1 TYR A 50 4.230 7.856 33.293 1.00 0.23 C ATOM 819 CD2 TYR A 50 2.302 8.813 34.407 1.00 0.28 C ATOM 820 CE1 TYR A 50 4.471 9.081 32.661 1.00 0.26 C ATOM 821 CE2 TYR A 50 2.542 10.037 33.776 1.00 0.33 C ATOM 822 CZ TYR A 50 3.628 10.173 32.902 1.00 0.30 C ATOM 823 OH TYR A 50 3.867 11.381 32.279 1.00 0.34 O ATOM 0 H TYR A 50 3.136 4.497 36.485 1.00 0.18 H new ATOM 0 HA TYR A 50 4.707 5.462 34.096 1.00 0.20 H new ATOM 0 HB2 TYR A 50 2.196 5.800 34.259 1.00 0.19 H new ATOM 0 HB3 TYR A 50 2.407 6.571 35.819 1.00 0.19 H new ATOM 0 HD1 TYR A 50 4.881 7.015 33.107 1.00 0.23 H new ATOM 0 HD2 TYR A 50 1.465 8.709 35.082 1.00 0.28 H new ATOM 0 HE1 TYR A 50 5.308 9.184 31.987 1.00 0.26 H new ATOM 0 HE2 TYR A 50 1.890 10.878 33.962 1.00 0.33 H new ATOM 0 HH TYR A 50 3.188 12.031 32.555 1.00 0.34 H new ATOM 833 N LYS A 51 6.301 6.825 35.340 1.00 0.36 N ATOM 834 CA LYS A 51 7.229 7.750 36.048 1.00 0.44 C ATOM 835 C LYS A 51 7.064 9.167 35.489 1.00 0.45 C ATOM 836 O LYS A 51 7.189 9.379 34.299 1.00 0.50 O ATOM 837 CB LYS A 51 8.630 7.214 35.751 1.00 0.58 C ATOM 838 CG LYS A 51 9.437 7.148 37.049 1.00 1.56 C ATOM 839 CD LYS A 51 10.911 7.429 36.748 1.00 1.98 C ATOM 840 CE LYS A 51 11.728 7.298 38.035 1.00 2.81 C ATOM 841 NZ LYS A 51 12.941 8.132 37.806 1.00 3.28 N ATOM 0 H LYS A 51 6.623 6.502 34.428 1.00 0.36 H new ATOM 0 HA LYS A 51 7.037 7.798 37.120 1.00 0.44 H new ATOM 0 HB2 LYS A 51 8.564 6.224 35.301 1.00 0.58 H new ATOM 0 HB3 LYS A 51 9.133 7.859 35.030 1.00 0.58 H new ATOM 0 HG2 LYS A 51 9.056 7.877 37.764 1.00 1.56 H new ATOM 0 HG3 LYS A 51 9.329 6.165 37.507 1.00 1.56 H new ATOM 0 HD2 LYS A 51 11.280 6.730 35.998 1.00 1.98 H new ATOM 0 HD3 LYS A 51 11.024 8.431 36.333 1.00 1.98 H new ATOM 0 HE2 LYS A 51 11.164 7.650 38.899 1.00 2.81 H new ATOM 0 HE3 LYS A 51 11.994 6.259 38.230 1.00 2.81 H new ATOM 0 HZ1 LYS A 51 13.553 8.093 38.646 1.00 3.28 H new ATOM 0 HZ2 LYS A 51 13.461 7.769 36.982 1.00 3.28 H new ATOM 0 HZ3 LYS A 51 12.657 9.117 37.630 1.00 3.28 H new ATOM 855 N PRO A 52 6.756 10.086 36.361 1.00 0.45 N ATOM 856 CA PRO A 52 6.535 11.488 35.931 1.00 0.50 C ATOM 857 C PRO A 52 7.807 12.058 35.298 1.00 0.62 C ATOM 858 O PRO A 52 8.909 11.746 35.705 1.00 0.68 O ATOM 859 CB PRO A 52 6.190 12.229 37.225 1.00 0.54 C ATOM 860 CG PRO A 52 6.609 11.320 38.339 1.00 0.60 C ATOM 861 CD PRO A 52 6.589 9.914 37.804 1.00 0.47 C ATOM 0 HA PRO A 52 5.750 11.580 35.180 1.00 0.50 H new ATOM 0 HB2 PRO A 52 6.714 13.183 37.281 1.00 0.54 H new ATOM 0 HB3 PRO A 52 5.123 12.447 37.278 1.00 0.54 H new ATOM 0 HG2 PRO A 52 7.606 11.582 38.693 1.00 0.60 H new ATOM 0 HG3 PRO A 52 5.933 11.417 39.189 1.00 0.60 H new ATOM 0 HD2 PRO A 52 7.392 9.312 38.230 1.00 0.47 H new ATOM 0 HD3 PRO A 52 5.652 9.409 38.041 1.00 0.47 H new ATOM 869 N ASN A 53 7.664 12.889 34.302 1.00 0.69 N ATOM 870 CA ASN A 53 8.865 13.475 33.641 1.00 0.83 C ATOM 871 C ASN A 53 8.838 15.002 33.751 1.00 1.09 C ATOM 872 O ASN A 53 7.780 15.536 34.043 1.00 1.89 O ATOM 873 CB ASN A 53 8.764 13.041 32.179 1.00 1.30 C ATOM 874 CG ASN A 53 8.865 11.517 32.090 1.00 1.83 C ATOM 875 OD1 ASN A 53 9.317 10.871 33.015 1.00 2.37 O ATOM 876 ND2 ASN A 53 8.462 10.910 31.007 1.00 2.54 N ATOM 877 OXT ASN A 53 9.874 15.610 33.542 1.00 1.46 O ATOM 0 H ASN A 53 6.768 13.188 33.917 1.00 0.69 H new ATOM 0 HA ASN A 53 9.794 13.140 34.102 1.00 0.83 H new ATOM 0 HB2 ASN A 53 7.819 13.379 31.753 1.00 1.30 H new ATOM 0 HB3 ASN A 53 9.560 13.503 31.596 1.00 1.30 H new ATOM 0 HD21 ASN A 53 8.527 9.894 30.938 1.00 2.54 H new ATOM 0 HD22 ASN A 53 8.083 11.451 30.230 1.00 2.54 H new TER 884 ASN A 53 ATOM 885 N PHE B 2 12.319 -1.295 18.014 1.00 8.23 N ATOM 886 CA PHE B 2 12.207 -0.880 16.586 1.00 7.85 C ATOM 887 C PHE B 2 11.099 0.164 16.424 1.00 7.16 C ATOM 888 O PHE B 2 11.195 1.064 15.613 1.00 7.11 O ATOM 889 CB PHE B 2 11.853 -2.160 15.828 1.00 8.16 C ATOM 890 CG PHE B 2 13.010 -3.127 15.906 1.00 8.51 C ATOM 891 CD1 PHE B 2 14.077 -3.016 15.007 1.00 8.70 C ATOM 892 CD2 PHE B 2 13.016 -4.136 16.877 1.00 8.95 C ATOM 893 CE1 PHE B 2 15.150 -3.912 15.079 1.00 9.33 C ATOM 894 CE2 PHE B 2 14.088 -5.032 16.949 1.00 9.54 C ATOM 895 CZ PHE B 2 15.156 -4.921 16.050 1.00 9.73 C ATOM 0 HA PHE B 2 13.126 -0.427 16.214 1.00 7.85 H new ATOM 0 HB2 PHE B 2 10.958 -2.612 16.255 1.00 8.16 H new ATOM 0 HB3 PHE B 2 11.628 -1.929 14.787 1.00 8.16 H new ATOM 0 HD1 PHE B 2 14.072 -2.239 14.257 1.00 8.70 H new ATOM 0 HD2 PHE B 2 12.193 -4.223 17.571 1.00 8.95 H new ATOM 0 HE1 PHE B 2 15.973 -3.825 14.386 1.00 9.33 H new ATOM 0 HE2 PHE B 2 14.092 -5.810 17.698 1.00 9.54 H new ATOM 0 HZ PHE B 2 15.983 -5.613 16.106 1.00 9.73 H new ATOM 905 N MET B 3 10.046 0.049 17.186 1.00 6.92 N ATOM 906 CA MET B 3 8.931 1.032 17.070 1.00 6.52 C ATOM 907 C MET B 3 8.815 1.854 18.357 1.00 5.63 C ATOM 908 O MET B 3 9.138 1.390 19.432 1.00 5.79 O ATOM 909 CB MET B 3 7.676 0.184 16.862 1.00 7.10 C ATOM 910 CG MET B 3 7.776 -0.558 15.528 1.00 8.04 C ATOM 911 SD MET B 3 6.214 -1.409 15.192 1.00 8.93 S ATOM 912 CE MET B 3 5.233 0.062 14.806 1.00 9.20 C ATOM 0 H MET B 3 9.909 -0.683 17.884 1.00 6.92 H new ATOM 0 HA MET B 3 9.086 1.738 16.254 1.00 6.52 H new ATOM 0 HB2 MET B 3 7.566 -0.529 17.679 1.00 7.10 H new ATOM 0 HB3 MET B 3 6.790 0.819 16.872 1.00 7.10 H new ATOM 0 HG2 MET B 3 8.000 0.144 14.725 1.00 8.04 H new ATOM 0 HG3 MET B 3 8.595 -1.277 15.560 1.00 8.04 H new ATOM 0 HE1 MET B 3 4.611 -0.134 13.933 1.00 9.20 H new ATOM 0 HE2 MET B 3 4.597 0.309 15.656 1.00 9.20 H new ATOM 0 HE3 MET B 3 5.899 0.899 14.596 1.00 9.20 H new ATOM 922 N LYS B 4 8.355 3.072 18.255 1.00 4.93 N ATOM 923 CA LYS B 4 8.219 3.921 19.473 1.00 4.23 C ATOM 924 C LYS B 4 6.820 3.761 20.075 1.00 3.36 C ATOM 925 O LYS B 4 5.837 3.664 19.368 1.00 3.54 O ATOM 926 CB LYS B 4 8.430 5.354 18.982 1.00 4.37 C ATOM 927 CG LYS B 4 9.856 5.507 18.449 1.00 5.20 C ATOM 928 CD LYS B 4 10.104 6.967 18.065 1.00 5.60 C ATOM 929 CE LYS B 4 11.483 7.097 17.416 1.00 6.69 C ATOM 930 NZ LYS B 4 11.210 7.225 15.958 1.00 7.10 N ATOM 0 H LYS B 4 8.068 3.515 17.382 1.00 4.93 H new ATOM 0 HA LYS B 4 8.933 3.647 20.250 1.00 4.23 H new ATOM 0 HB2 LYS B 4 7.710 5.591 18.198 1.00 4.37 H new ATOM 0 HB3 LYS B 4 8.257 6.058 19.796 1.00 4.37 H new ATOM 0 HG2 LYS B 4 10.574 5.192 19.206 1.00 5.20 H new ATOM 0 HG3 LYS B 4 10.003 4.862 17.583 1.00 5.20 H new ATOM 0 HD2 LYS B 4 9.332 7.309 17.375 1.00 5.60 H new ATOM 0 HD3 LYS B 4 10.045 7.602 18.949 1.00 5.60 H new ATOM 0 HE2 LYS B 4 12.018 7.968 17.796 1.00 6.69 H new ATOM 0 HE3 LYS B 4 12.103 6.225 17.627 1.00 6.69 H new ATOM 0 HZ1 LYS B 4 12.109 7.319 15.443 1.00 7.10 H new ATOM 0 HZ2 LYS B 4 10.706 6.379 15.624 1.00 7.10 H new ATOM 0 HZ3 LYS B 4 10.624 8.067 15.787 1.00 7.10 H new ATOM 944 N SER B 5 6.724 3.728 21.376 1.00 2.84 N ATOM 945 CA SER B 5 5.390 3.569 22.022 1.00 2.20 C ATOM 946 C SER B 5 4.591 4.871 21.916 1.00 1.21 C ATOM 947 O SER B 5 5.142 5.934 21.708 1.00 1.18 O ATOM 948 CB SER B 5 5.694 3.244 23.483 1.00 2.53 C ATOM 949 OG SER B 5 6.155 4.418 24.139 1.00 3.08 O ATOM 0 H SER B 5 7.512 3.804 22.020 1.00 2.84 H new ATOM 0 HA SER B 5 4.792 2.791 21.547 1.00 2.20 H new ATOM 0 HB2 SER B 5 4.799 2.865 23.977 1.00 2.53 H new ATOM 0 HB3 SER B 5 6.448 2.460 23.544 1.00 2.53 H new ATOM 0 HG SER B 5 6.461 4.190 25.042 1.00 3.08 H new ATOM 955 N THR B 6 3.299 4.799 22.083 1.00 0.90 N ATOM 956 CA THR B 6 2.467 6.036 22.020 1.00 0.81 C ATOM 957 C THR B 6 2.826 6.973 23.176 1.00 0.75 C ATOM 958 O THR B 6 2.824 8.179 23.032 1.00 1.02 O ATOM 959 CB THR B 6 1.023 5.550 22.153 1.00 1.71 C ATOM 960 OG1 THR B 6 0.848 4.930 23.420 1.00 2.04 O ATOM 961 CG2 THR B 6 0.717 4.544 21.043 1.00 2.06 C ATOM 0 H THR B 6 2.783 3.937 22.260 1.00 0.90 H new ATOM 0 HA THR B 6 2.626 6.594 21.097 1.00 0.81 H new ATOM 0 HB THR B 6 0.344 6.399 22.067 1.00 1.71 H new ATOM 0 HG1 THR B 6 -0.077 4.620 23.507 1.00 2.04 H new ATOM 0 HG21 THR B 6 -0.312 4.198 21.139 1.00 2.06 H new ATOM 0 HG22 THR B 6 0.851 5.021 20.072 1.00 2.06 H new ATOM 0 HG23 THR B 6 1.394 3.694 21.125 1.00 2.06 H new ATOM 969 N GLY B 7 3.166 6.428 24.312 1.00 0.48 N ATOM 970 CA GLY B 7 3.562 7.291 25.461 1.00 0.58 C ATOM 971 C GLY B 7 2.335 8.033 25.991 1.00 0.55 C ATOM 972 O GLY B 7 2.379 9.220 26.245 1.00 0.73 O ATOM 0 H GLY B 7 3.187 5.425 24.494 1.00 0.48 H new ATOM 0 HA2 GLY B 7 4.001 6.683 26.252 1.00 0.58 H new ATOM 0 HA3 GLY B 7 4.324 8.005 25.147 1.00 0.58 H new ATOM 976 N ILE B 8 1.241 7.344 26.175 1.00 0.37 N ATOM 977 CA ILE B 8 0.019 8.021 26.705 1.00 0.40 C ATOM 978 C ILE B 8 -0.346 7.445 28.072 1.00 0.31 C ATOM 979 O ILE B 8 -0.260 6.259 28.291 1.00 0.26 O ATOM 980 CB ILE B 8 -1.080 7.719 25.688 1.00 0.45 C ATOM 981 CG1 ILE B 8 -0.620 8.153 24.295 1.00 0.53 C ATOM 982 CG2 ILE B 8 -2.348 8.488 26.065 1.00 0.54 C ATOM 983 CD1 ILE B 8 -1.666 7.736 23.259 1.00 1.29 C ATOM 0 H ILE B 8 1.139 6.347 25.983 1.00 0.37 H new ATOM 0 HA ILE B 8 0.166 9.093 26.836 1.00 0.40 H new ATOM 0 HB ILE B 8 -1.288 6.649 25.686 1.00 0.45 H new ATOM 0 HG12 ILE B 8 -0.476 9.233 24.268 1.00 0.53 H new ATOM 0 HG13 ILE B 8 0.342 7.698 24.060 1.00 0.53 H new ATOM 0 HG21 ILE B 8 -3.133 8.273 25.340 1.00 0.54 H new ATOM 0 HG22 ILE B 8 -2.678 8.182 27.058 1.00 0.54 H new ATOM 0 HG23 ILE B 8 -2.138 9.558 26.066 1.00 0.54 H new ATOM 0 HD11 ILE B 8 -1.338 8.045 22.266 1.00 1.29 H new ATOM 0 HD12 ILE B 8 -1.787 6.653 23.280 1.00 1.29 H new ATOM 0 HD13 ILE B 8 -2.618 8.212 23.491 1.00 1.29 H new ATOM 995 N VAL B 9 -0.661 8.280 29.021 1.00 0.32 N ATOM 996 CA VAL B 9 -0.919 7.770 30.399 1.00 0.27 C ATOM 997 C VAL B 9 -2.364 8.051 30.825 1.00 0.26 C ATOM 998 O VAL B 9 -2.925 9.084 30.520 1.00 0.31 O ATOM 999 CB VAL B 9 0.065 8.523 31.294 1.00 0.29 C ATOM 1000 CG1 VAL B 9 -0.148 8.108 32.750 1.00 0.26 C ATOM 1001 CG2 VAL B 9 1.497 8.181 30.874 1.00 0.31 C ATOM 0 H VAL B 9 -0.751 9.289 28.905 1.00 0.32 H new ATOM 0 HA VAL B 9 -0.785 6.690 30.463 1.00 0.27 H new ATOM 0 HB VAL B 9 -0.100 9.596 31.194 1.00 0.29 H new ATOM 0 HG11 VAL B 9 0.554 8.645 33.388 1.00 0.26 H new ATOM 0 HG12 VAL B 9 -1.168 8.347 33.051 1.00 0.26 H new ATOM 0 HG13 VAL B 9 0.018 7.035 32.851 1.00 0.26 H new ATOM 0 HG21 VAL B 9 2.201 8.717 31.511 1.00 0.31 H new ATOM 0 HG22 VAL B 9 1.660 7.108 30.976 1.00 0.31 H new ATOM 0 HG23 VAL B 9 1.651 8.474 29.836 1.00 0.31 H new ATOM 1011 N ARG B 10 -2.950 7.148 31.561 1.00 0.23 N ATOM 1012 CA ARG B 10 -4.342 7.361 32.056 1.00 0.24 C ATOM 1013 C ARG B 10 -4.395 7.141 33.570 1.00 0.21 C ATOM 1014 O ARG B 10 -3.536 6.502 34.141 1.00 0.20 O ATOM 1015 CB ARG B 10 -5.188 6.314 31.330 1.00 0.27 C ATOM 1016 CG ARG B 10 -6.663 6.517 31.682 1.00 0.32 C ATOM 1017 CD ARG B 10 -7.184 7.781 30.995 1.00 1.06 C ATOM 1018 NE ARG B 10 -8.587 7.927 31.472 1.00 1.33 N ATOM 1019 CZ ARG B 10 -9.259 9.016 31.210 1.00 1.82 C ATOM 1020 NH1 ARG B 10 -8.705 9.982 30.528 1.00 2.39 N ATOM 1021 NH2 ARG B 10 -10.488 9.140 31.631 1.00 2.39 N ATOM 0 H ARG B 10 -2.523 6.266 31.843 1.00 0.23 H new ATOM 0 HA ARG B 10 -4.701 8.372 31.866 1.00 0.24 H new ATOM 0 HB2 ARG B 10 -5.045 6.399 30.253 1.00 0.27 H new ATOM 0 HB3 ARG B 10 -4.869 5.312 31.616 1.00 0.27 H new ATOM 0 HG2 ARG B 10 -7.246 5.652 31.365 1.00 0.32 H new ATOM 0 HG3 ARG B 10 -6.781 6.603 32.762 1.00 0.32 H new ATOM 0 HD2 ARG B 10 -6.584 8.651 31.261 1.00 1.06 H new ATOM 0 HD3 ARG B 10 -7.144 7.686 29.910 1.00 1.06 H new ATOM 0 HE ARG B 10 -9.024 7.175 32.005 1.00 1.33 H new ATOM 0 HH11 ARG B 10 -7.744 9.888 30.198 1.00 2.39 H new ATOM 0 HH12 ARG B 10 -9.233 10.831 30.325 1.00 2.39 H new ATOM 0 HH21 ARG B 10 -10.923 8.387 32.164 1.00 2.39 H new ATOM 0 HH22 ARG B 10 -11.014 9.990 31.427 1.00 2.39 H new ATOM 1035 N LYS B 11 -5.384 7.680 34.229 1.00 0.21 N ATOM 1036 CA LYS B 11 -5.472 7.509 35.709 1.00 0.20 C ATOM 1037 C LYS B 11 -6.116 6.163 36.053 1.00 0.17 C ATOM 1038 O LYS B 11 -6.988 5.683 35.355 1.00 0.17 O ATOM 1039 CB LYS B 11 -6.349 8.663 36.193 1.00 0.24 C ATOM 1040 CG LYS B 11 -6.333 8.708 37.723 1.00 1.16 C ATOM 1041 CD LYS B 11 -7.133 9.919 38.206 1.00 1.38 C ATOM 1042 CE LYS B 11 -8.616 9.712 37.888 1.00 2.38 C ATOM 1043 NZ LYS B 11 -9.232 9.300 39.181 1.00 2.74 N ATOM 0 H LYS B 11 -6.133 8.230 33.809 1.00 0.21 H new ATOM 0 HA LYS B 11 -4.490 7.519 36.182 1.00 0.20 H new ATOM 0 HB2 LYS B 11 -5.984 9.606 35.787 1.00 0.24 H new ATOM 0 HB3 LYS B 11 -7.370 8.534 35.833 1.00 0.24 H new ATOM 0 HG2 LYS B 11 -6.760 7.791 38.129 1.00 1.16 H new ATOM 0 HG3 LYS B 11 -5.307 8.769 38.085 1.00 1.16 H new ATOM 0 HD2 LYS B 11 -6.996 10.054 39.279 1.00 1.38 H new ATOM 0 HD3 LYS B 11 -6.769 10.825 37.721 1.00 1.38 H new ATOM 0 HE2 LYS B 11 -9.070 10.627 37.508 1.00 2.38 H new ATOM 0 HE3 LYS B 11 -8.753 8.947 37.124 1.00 2.38 H new ATOM 0 HZ1 LYS B 11 -10.250 9.139 39.045 1.00 2.74 H new ATOM 0 HZ2 LYS B 11 -8.784 8.423 39.515 1.00 2.74 H new ATOM 0 HZ3 LYS B 11 -9.092 10.050 39.887 1.00 2.74 H new ATOM 1057 N VAL B 12 -5.692 5.550 37.126 1.00 0.15 N ATOM 1058 CA VAL B 12 -6.280 4.235 37.518 1.00 0.13 C ATOM 1059 C VAL B 12 -7.593 4.458 38.269 1.00 0.14 C ATOM 1060 O VAL B 12 -7.651 5.213 39.217 1.00 0.15 O ATOM 1061 CB VAL B 12 -5.251 3.595 38.452 1.00 0.12 C ATOM 1062 CG1 VAL B 12 -5.549 2.101 38.593 1.00 0.14 C ATOM 1063 CG2 VAL B 12 -3.842 3.781 37.887 1.00 0.12 C ATOM 0 H VAL B 12 -4.964 5.902 37.748 1.00 0.15 H new ATOM 0 HA VAL B 12 -6.494 3.608 36.653 1.00 0.13 H new ATOM 0 HB VAL B 12 -5.310 4.075 39.429 1.00 0.12 H new ATOM 0 HG11 VAL B 12 -4.816 1.645 39.258 1.00 0.14 H new ATOM 0 HG12 VAL B 12 -6.548 1.967 39.007 1.00 0.14 H new ATOM 0 HG13 VAL B 12 -5.496 1.625 37.614 1.00 0.14 H new ATOM 0 HG21 VAL B 12 -3.117 3.322 38.559 1.00 0.12 H new ATOM 0 HG22 VAL B 12 -3.778 3.309 36.907 1.00 0.12 H new ATOM 0 HG23 VAL B 12 -3.626 4.845 37.792 1.00 0.12 H new ATOM 1073 N ASP B 13 -8.644 3.796 37.870 1.00 0.14 N ATOM 1074 CA ASP B 13 -9.937 3.973 38.585 1.00 0.15 C ATOM 1075 C ASP B 13 -9.993 3.048 39.809 1.00 0.16 C ATOM 1076 O ASP B 13 -8.999 2.476 40.208 1.00 0.17 O ATOM 1077 CB ASP B 13 -11.021 3.625 37.553 1.00 0.15 C ATOM 1078 CG ASP B 13 -11.358 2.134 37.611 1.00 0.15 C ATOM 1079 OD1 ASP B 13 -10.653 1.356 36.993 1.00 0.13 O ATOM 1080 OD2 ASP B 13 -12.319 1.791 38.278 1.00 0.17 O ATOM 0 H ASP B 13 -8.663 3.145 37.085 1.00 0.14 H new ATOM 0 HA ASP B 13 -10.073 4.986 38.964 1.00 0.15 H new ATOM 0 HB2 ASP B 13 -11.918 4.214 37.746 1.00 0.15 H new ATOM 0 HB3 ASP B 13 -10.677 3.887 36.553 1.00 0.15 H new ATOM 1085 N GLU B 14 -11.108 3.011 40.484 1.00 0.18 N ATOM 1086 CA GLU B 14 -11.173 2.262 41.774 1.00 0.21 C ATOM 1087 C GLU B 14 -10.771 0.792 41.594 1.00 0.20 C ATOM 1088 O GLU B 14 -10.193 0.192 42.478 1.00 0.22 O ATOM 1089 CB GLU B 14 -12.634 2.364 42.212 1.00 0.22 C ATOM 1090 CG GLU B 14 -12.984 3.827 42.491 1.00 1.25 C ATOM 1091 CD GLU B 14 -14.426 3.921 42.992 1.00 1.46 C ATOM 1092 OE1 GLU B 14 -15.118 2.918 42.937 1.00 2.01 O ATOM 1093 OE2 GLU B 14 -14.814 4.995 43.422 1.00 1.90 O ATOM 0 H GLU B 14 -11.976 3.465 40.201 1.00 0.18 H new ATOM 0 HA GLU B 14 -10.484 2.675 42.510 1.00 0.21 H new ATOM 0 HB2 GLU B 14 -13.286 1.965 41.435 1.00 0.22 H new ATOM 0 HB3 GLU B 14 -12.799 1.763 43.106 1.00 0.22 H new ATOM 0 HG2 GLU B 14 -12.302 4.240 43.235 1.00 1.25 H new ATOM 0 HG3 GLU B 14 -12.864 4.420 41.584 1.00 1.25 H new ATOM 1100 N LEU B 15 -11.169 0.172 40.517 1.00 0.18 N ATOM 1101 CA LEU B 15 -10.910 -1.292 40.372 1.00 0.19 C ATOM 1102 C LEU B 15 -9.500 -1.565 39.833 1.00 0.17 C ATOM 1103 O LEU B 15 -9.087 -2.701 39.717 1.00 0.17 O ATOM 1104 CB LEU B 15 -11.962 -1.793 39.384 1.00 0.19 C ATOM 1105 CG LEU B 15 -11.689 -3.263 39.060 1.00 0.24 C ATOM 1106 CD1 LEU B 15 -11.463 -4.042 40.359 1.00 0.29 C ATOM 1107 CD2 LEU B 15 -12.890 -3.851 38.316 1.00 0.47 C ATOM 0 H LEU B 15 -11.658 0.610 39.736 1.00 0.18 H new ATOM 0 HA LEU B 15 -10.971 -1.799 41.335 1.00 0.19 H new ATOM 0 HB2 LEU B 15 -12.960 -1.681 39.809 1.00 0.19 H new ATOM 0 HB3 LEU B 15 -11.935 -1.196 38.472 1.00 0.19 H new ATOM 0 HG LEU B 15 -10.800 -3.337 38.434 1.00 0.24 H new ATOM 0 HD11 LEU B 15 -11.269 -5.089 40.126 1.00 0.29 H new ATOM 0 HD12 LEU B 15 -10.608 -3.624 40.890 1.00 0.29 H new ATOM 0 HD13 LEU B 15 -12.351 -3.969 40.986 1.00 0.29 H new ATOM 0 HD21 LEU B 15 -12.697 -4.898 38.084 1.00 0.47 H new ATOM 0 HD22 LEU B 15 -13.779 -3.776 38.943 1.00 0.47 H new ATOM 0 HD23 LEU B 15 -13.051 -3.298 37.390 1.00 0.47 H new ATOM 1119 N GLY B 16 -8.771 -0.551 39.462 1.00 0.15 N ATOM 1120 CA GLY B 16 -7.415 -0.795 38.889 1.00 0.13 C ATOM 1121 C GLY B 16 -7.544 -1.194 37.416 1.00 0.12 C ATOM 1122 O GLY B 16 -6.973 -2.172 36.969 1.00 0.13 O ATOM 0 H GLY B 16 -9.050 0.428 39.529 1.00 0.15 H new ATOM 0 HA2 GLY B 16 -6.803 0.103 38.981 1.00 0.13 H new ATOM 0 HA3 GLY B 16 -6.910 -1.583 39.447 1.00 0.13 H new ATOM 1126 N ARG B 17 -8.327 -0.471 36.665 1.00 0.12 N ATOM 1127 CA ARG B 17 -8.529 -0.834 35.236 1.00 0.11 C ATOM 1128 C ARG B 17 -7.954 0.259 34.332 1.00 0.11 C ATOM 1129 O ARG B 17 -7.845 1.406 34.719 1.00 0.11 O ATOM 1130 CB ARG B 17 -10.046 -0.936 35.067 1.00 0.12 C ATOM 1131 CG ARG B 17 -10.568 -2.122 35.882 1.00 0.14 C ATOM 1132 CD ARG B 17 -12.076 -2.266 35.672 1.00 0.15 C ATOM 1133 NE ARG B 17 -12.673 -1.092 36.365 1.00 0.15 N ATOM 1134 CZ ARG B 17 -13.949 -1.083 36.653 1.00 0.16 C ATOM 1135 NH1 ARG B 17 -14.710 -2.083 36.294 1.00 0.19 N ATOM 1136 NH2 ARG B 17 -14.468 -0.074 37.299 1.00 0.17 N ATOM 0 H ARG B 17 -8.835 0.355 36.980 1.00 0.12 H new ATOM 0 HA ARG B 17 -8.028 -1.764 34.966 1.00 0.11 H new ATOM 0 HB2 ARG B 17 -10.523 -0.014 35.399 1.00 0.12 H new ATOM 0 HB3 ARG B 17 -10.298 -1.064 34.014 1.00 0.12 H new ATOM 0 HG2 ARG B 17 -10.059 -3.037 35.578 1.00 0.14 H new ATOM 0 HG3 ARG B 17 -10.351 -1.973 36.940 1.00 0.14 H new ATOM 0 HD2 ARG B 17 -12.329 -2.269 34.612 1.00 0.15 H new ATOM 0 HD3 ARG B 17 -12.446 -3.202 36.091 1.00 0.15 H new ATOM 0 HE ARG B 17 -12.088 -0.295 36.615 1.00 0.15 H new ATOM 0 HH11 ARG B 17 -14.309 -2.873 35.788 1.00 0.19 H new ATOM 0 HH12 ARG B 17 -15.705 -2.074 36.520 1.00 0.19 H new ATOM 0 HH21 ARG B 17 -13.878 0.709 37.580 1.00 0.17 H new ATOM 0 HH22 ARG B 17 -15.463 -0.069 37.523 1.00 0.17 H new ATOM 1150 N VAL B 18 -7.579 -0.090 33.133 1.00 0.11 N ATOM 1151 CA VAL B 18 -7.002 0.925 32.206 1.00 0.12 C ATOM 1152 C VAL B 18 -7.801 0.951 30.903 1.00 0.12 C ATOM 1153 O VAL B 18 -8.466 -0.003 30.556 1.00 0.11 O ATOM 1154 CB VAL B 18 -5.569 0.459 31.947 1.00 0.12 C ATOM 1155 CG1 VAL B 18 -4.841 0.282 33.281 1.00 0.14 C ATOM 1156 CG2 VAL B 18 -5.596 -0.877 31.201 1.00 0.13 C ATOM 0 H VAL B 18 -7.647 -1.035 32.754 1.00 0.11 H new ATOM 0 HA VAL B 18 -7.031 1.932 32.622 1.00 0.12 H new ATOM 0 HB VAL B 18 -5.048 1.203 31.344 1.00 0.12 H new ATOM 0 HG11 VAL B 18 -3.819 -0.050 33.097 1.00 0.14 H new ATOM 0 HG12 VAL B 18 -4.823 1.232 33.814 1.00 0.14 H new ATOM 0 HG13 VAL B 18 -5.361 -0.462 33.884 1.00 0.14 H new ATOM 0 HG21 VAL B 18 -4.575 -1.211 31.015 1.00 0.13 H new ATOM 0 HG22 VAL B 18 -6.117 -1.620 31.805 1.00 0.13 H new ATOM 0 HG23 VAL B 18 -6.115 -0.753 30.251 1.00 0.13 H new ATOM 1166 N VAL B 19 -7.808 2.062 30.220 1.00 0.14 N ATOM 1167 CA VAL B 19 -8.647 2.170 28.994 1.00 0.15 C ATOM 1168 C VAL B 19 -7.767 2.253 27.746 1.00 0.16 C ATOM 1169 O VAL B 19 -6.843 3.039 27.677 1.00 0.18 O ATOM 1170 CB VAL B 19 -9.438 3.465 29.174 1.00 0.17 C ATOM 1171 CG1 VAL B 19 -10.499 3.574 28.077 1.00 0.18 C ATOM 1172 CG2 VAL B 19 -10.118 3.459 30.545 1.00 0.18 C ATOM 0 H VAL B 19 -7.271 2.897 30.456 1.00 0.14 H new ATOM 0 HA VAL B 19 -9.296 1.304 28.864 1.00 0.15 H new ATOM 0 HB VAL B 19 -8.761 4.317 29.107 1.00 0.17 H new ATOM 0 HG11 VAL B 19 -11.063 4.498 28.206 1.00 0.18 H new ATOM 0 HG12 VAL B 19 -10.014 3.578 27.101 1.00 0.18 H new ATOM 0 HG13 VAL B 19 -11.177 2.723 28.141 1.00 0.18 H new ATOM 0 HG21 VAL B 19 -10.683 4.382 30.675 1.00 0.18 H new ATOM 0 HG22 VAL B 19 -10.795 2.607 30.612 1.00 0.18 H new ATOM 0 HG23 VAL B 19 -9.361 3.383 31.326 1.00 0.18 H new ATOM 1182 N ILE B 20 -8.108 1.518 26.723 1.00 0.17 N ATOM 1183 CA ILE B 20 -7.359 1.635 25.442 1.00 0.19 C ATOM 1184 C ILE B 20 -7.896 2.827 24.641 1.00 0.19 C ATOM 1185 O ILE B 20 -9.088 2.982 24.499 1.00 0.19 O ATOM 1186 CB ILE B 20 -7.633 0.311 24.716 1.00 0.19 C ATOM 1187 CG1 ILE B 20 -6.633 -0.744 25.198 1.00 0.23 C ATOM 1188 CG2 ILE B 20 -7.483 0.494 23.204 1.00 0.19 C ATOM 1189 CD1 ILE B 20 -6.730 -0.883 26.718 1.00 1.53 C ATOM 0 H ILE B 20 -8.872 0.842 26.720 1.00 0.17 H new ATOM 0 HA ILE B 20 -6.291 1.805 25.582 1.00 0.19 H new ATOM 0 HB ILE B 20 -8.651 -0.010 24.935 1.00 0.19 H new ATOM 0 HG12 ILE B 20 -6.840 -1.702 24.721 1.00 0.23 H new ATOM 0 HG13 ILE B 20 -5.621 -0.458 24.912 1.00 0.23 H new ATOM 0 HG21 ILE B 20 -7.680 -0.453 22.702 1.00 0.19 H new ATOM 0 HG22 ILE B 20 -8.193 1.244 22.856 1.00 0.19 H new ATOM 0 HG23 ILE B 20 -6.469 0.821 22.976 1.00 0.19 H new ATOM 0 HD11 ILE B 20 -6.018 -1.634 27.061 1.00 1.53 H new ATOM 0 HD12 ILE B 20 -6.501 0.074 27.186 1.00 1.53 H new ATOM 0 HD13 ILE B 20 -7.740 -1.189 26.992 1.00 1.53 H new ATOM 1201 N PRO B 21 -6.995 3.605 24.109 1.00 0.22 N ATOM 1202 CA PRO B 21 -7.395 4.761 23.269 1.00 0.24 C ATOM 1203 C PRO B 21 -8.242 4.284 22.086 1.00 0.21 C ATOM 1204 O PRO B 21 -8.014 3.224 21.538 1.00 0.19 O ATOM 1205 CB PRO B 21 -6.069 5.357 22.787 1.00 0.28 C ATOM 1206 CG PRO B 21 -5.016 4.341 23.114 1.00 0.28 C ATOM 1207 CD PRO B 21 -5.544 3.485 24.233 1.00 0.25 C ATOM 0 HA PRO B 21 -7.999 5.489 23.810 1.00 0.24 H new ATOM 0 HB2 PRO B 21 -6.098 5.558 21.716 1.00 0.28 H new ATOM 0 HB3 PRO B 21 -5.864 6.305 23.284 1.00 0.28 H new ATOM 0 HG2 PRO B 21 -4.787 3.731 22.240 1.00 0.28 H new ATOM 0 HG3 PRO B 21 -4.089 4.832 23.411 1.00 0.28 H new ATOM 0 HD2 PRO B 21 -5.218 2.450 24.133 1.00 0.25 H new ATOM 0 HD3 PRO B 21 -5.195 3.836 25.204 1.00 0.25 H new ATOM 1215 N ILE B 22 -9.235 5.040 21.704 1.00 0.23 N ATOM 1216 CA ILE B 22 -10.111 4.600 20.579 1.00 0.21 C ATOM 1217 C ILE B 22 -9.271 4.305 19.335 1.00 0.21 C ATOM 1218 O ILE B 22 -9.576 3.415 18.567 1.00 0.18 O ATOM 1219 CB ILE B 22 -11.050 5.778 20.323 1.00 0.27 C ATOM 1220 CG1 ILE B 22 -12.182 5.335 19.392 1.00 0.30 C ATOM 1221 CG2 ILE B 22 -10.271 6.920 19.668 1.00 0.31 C ATOM 1222 CD1 ILE B 22 -13.035 4.276 20.091 1.00 1.07 C ATOM 0 H ILE B 22 -9.478 5.939 22.119 1.00 0.23 H new ATOM 0 HA ILE B 22 -10.657 3.687 20.816 1.00 0.21 H new ATOM 0 HB ILE B 22 -11.469 6.120 21.269 1.00 0.27 H new ATOM 0 HG12 ILE B 22 -12.799 6.191 19.119 1.00 0.30 H new ATOM 0 HG13 ILE B 22 -11.769 4.932 18.467 1.00 0.30 H new ATOM 0 HG21 ILE B 22 -10.941 7.760 19.486 1.00 0.31 H new ATOM 0 HG22 ILE B 22 -9.464 7.236 20.329 1.00 0.31 H new ATOM 0 HG23 ILE B 22 -9.852 6.578 18.722 1.00 0.31 H new ATOM 0 HD11 ILE B 22 -13.840 3.961 19.427 1.00 1.07 H new ATOM 0 HD12 ILE B 22 -12.414 3.416 20.341 1.00 1.07 H new ATOM 0 HD13 ILE B 22 -13.459 4.695 21.003 1.00 1.07 H new ATOM 1234 N GLU B 23 -8.199 5.020 19.145 1.00 0.25 N ATOM 1235 CA GLU B 23 -7.330 4.745 17.967 1.00 0.26 C ATOM 1236 C GLU B 23 -6.856 3.290 18.002 1.00 0.24 C ATOM 1237 O GLU B 23 -6.745 2.634 16.985 1.00 0.23 O ATOM 1238 CB GLU B 23 -6.146 5.700 18.119 1.00 0.32 C ATOM 1239 CG GLU B 23 -5.249 5.601 16.884 1.00 1.20 C ATOM 1240 CD GLU B 23 -4.010 6.478 17.081 1.00 1.53 C ATOM 1241 OE1 GLU B 23 -3.896 7.078 18.137 1.00 2.06 O ATOM 1242 OE2 GLU B 23 -3.198 6.533 16.173 1.00 2.03 O ATOM 0 H GLU B 23 -7.887 5.779 19.750 1.00 0.25 H new ATOM 0 HA GLU B 23 -7.849 4.891 17.020 1.00 0.26 H new ATOM 0 HB2 GLU B 23 -6.503 6.723 18.241 1.00 0.32 H new ATOM 0 HB3 GLU B 23 -5.578 5.452 19.015 1.00 0.32 H new ATOM 0 HG2 GLU B 23 -4.952 4.565 16.719 1.00 1.20 H new ATOM 0 HG3 GLU B 23 -5.796 5.920 15.997 1.00 1.20 H new ATOM 1249 N LEU B 24 -6.595 2.780 19.174 1.00 0.23 N ATOM 1250 CA LEU B 24 -6.154 1.362 19.295 1.00 0.22 C ATOM 1251 C LEU B 24 -7.357 0.418 19.270 1.00 0.18 C ATOM 1252 O LEU B 24 -7.277 -0.681 18.760 1.00 0.18 O ATOM 1253 CB LEU B 24 -5.428 1.285 20.636 1.00 0.25 C ATOM 1254 CG LEU B 24 -4.170 2.154 20.584 1.00 0.30 C ATOM 1255 CD1 LEU B 24 -3.353 1.949 21.861 1.00 0.32 C ATOM 1256 CD2 LEU B 24 -3.327 1.754 19.371 1.00 0.34 C ATOM 0 H LEU B 24 -6.669 3.286 20.056 1.00 0.23 H new ATOM 0 HA LEU B 24 -5.511 1.061 18.468 1.00 0.22 H new ATOM 0 HB2 LEU B 24 -6.085 1.624 21.437 1.00 0.25 H new ATOM 0 HB3 LEU B 24 -5.161 0.252 20.858 1.00 0.25 H new ATOM 0 HG LEU B 24 -4.456 3.203 20.501 1.00 0.30 H new ATOM 0 HD11 LEU B 24 -2.457 2.568 21.823 1.00 0.32 H new ATOM 0 HD12 LEU B 24 -3.953 2.231 22.726 1.00 0.32 H new ATOM 0 HD13 LEU B 24 -3.066 0.901 21.945 1.00 0.32 H new ATOM 0 HD21 LEU B 24 -2.430 2.372 19.332 1.00 0.34 H new ATOM 0 HD22 LEU B 24 -3.042 0.705 19.456 1.00 0.34 H new ATOM 0 HD23 LEU B 24 -3.908 1.899 18.460 1.00 0.34 H new ATOM 1268 N ARG B 25 -8.495 0.857 19.739 1.00 0.16 N ATOM 1269 CA ARG B 25 -9.702 -0.011 19.638 1.00 0.14 C ATOM 1270 C ARG B 25 -9.941 -0.368 18.171 1.00 0.13 C ATOM 1271 O ARG B 25 -10.259 -1.491 17.836 1.00 0.14 O ATOM 1272 CB ARG B 25 -10.874 0.827 20.160 1.00 0.14 C ATOM 1273 CG ARG B 25 -10.660 1.200 21.629 1.00 0.16 C ATOM 1274 CD ARG B 25 -11.950 1.824 22.175 1.00 0.17 C ATOM 1275 NE ARG B 25 -11.540 2.594 23.380 1.00 0.21 N ATOM 1276 CZ ARG B 25 -12.307 3.544 23.845 1.00 0.23 C ATOM 1277 NH1 ARG B 25 -13.445 3.813 23.264 1.00 0.23 N ATOM 1278 NH2 ARG B 25 -11.935 4.224 24.895 1.00 0.27 N ATOM 0 H ARG B 25 -8.640 1.765 20.181 1.00 0.16 H new ATOM 0 HA ARG B 25 -9.587 -0.934 20.206 1.00 0.14 H new ATOM 0 HB2 ARG B 25 -10.976 1.732 19.561 1.00 0.14 H new ATOM 0 HB3 ARG B 25 -11.803 0.268 20.053 1.00 0.14 H new ATOM 0 HG2 ARG B 25 -10.395 0.315 22.208 1.00 0.16 H new ATOM 0 HG3 ARG B 25 -9.832 1.903 21.723 1.00 0.16 H new ATOM 0 HD2 ARG B 25 -12.416 2.474 21.434 1.00 0.17 H new ATOM 0 HD3 ARG B 25 -12.680 1.056 22.430 1.00 0.17 H new ATOM 0 HE ARG B 25 -10.658 2.380 23.845 1.00 0.21 H new ATOM 0 HH11 ARG B 25 -13.738 3.281 22.445 1.00 0.23 H new ATOM 0 HH12 ARG B 25 -14.041 4.555 23.630 1.00 0.23 H new ATOM 0 HH21 ARG B 25 -11.047 4.013 25.351 1.00 0.27 H new ATOM 0 HH22 ARG B 25 -12.532 4.966 25.260 1.00 0.27 H new ATOM 1292 N ARG B 26 -9.826 0.596 17.298 1.00 0.12 N ATOM 1293 CA ARG B 26 -10.088 0.331 15.855 1.00 0.12 C ATOM 1294 C ARG B 26 -8.944 -0.482 15.239 1.00 0.13 C ATOM 1295 O ARG B 26 -9.165 -1.454 14.546 1.00 0.14 O ATOM 1296 CB ARG B 26 -10.168 1.715 15.211 1.00 0.13 C ATOM 1297 CG ARG B 26 -11.360 2.481 15.790 1.00 1.19 C ATOM 1298 CD ARG B 26 -11.501 3.825 15.073 1.00 1.56 C ATOM 1299 NE ARG B 26 -12.531 4.568 15.850 1.00 2.40 N ATOM 1300 CZ ARG B 26 -13.024 5.686 15.387 1.00 3.04 C ATOM 1301 NH1 ARG B 26 -12.616 6.158 14.239 1.00 3.21 N ATOM 1302 NH2 ARG B 26 -13.927 6.333 16.072 1.00 3.96 N ATOM 0 H ARG B 26 -9.562 1.555 17.522 1.00 0.12 H new ATOM 0 HA ARG B 26 -10.999 -0.248 15.703 1.00 0.12 H new ATOM 0 HB2 ARG B 26 -9.245 2.266 15.393 1.00 0.13 H new ATOM 0 HB3 ARG B 26 -10.274 1.619 14.130 1.00 0.13 H new ATOM 0 HG2 ARG B 26 -12.273 1.897 15.673 1.00 1.19 H new ATOM 0 HG3 ARG B 26 -11.219 2.640 16.859 1.00 1.19 H new ATOM 0 HD2 ARG B 26 -10.554 4.365 15.055 1.00 1.56 H new ATOM 0 HD3 ARG B 26 -11.810 3.689 14.037 1.00 1.56 H new ATOM 0 HE ARG B 26 -12.853 4.203 16.747 1.00 2.40 H new ATOM 0 HH11 ARG B 26 -11.911 5.653 13.702 1.00 3.21 H new ATOM 0 HH12 ARG B 26 -13.003 7.031 13.880 1.00 3.21 H new ATOM 0 HH21 ARG B 26 -14.247 5.966 16.968 1.00 3.96 H new ATOM 0 HH22 ARG B 26 -14.312 7.206 15.711 1.00 3.96 H new ATOM 1316 N THR B 27 -7.726 -0.069 15.459 1.00 0.15 N ATOM 1317 CA THR B 27 -6.568 -0.789 14.853 1.00 0.19 C ATOM 1318 C THR B 27 -6.475 -2.222 15.388 1.00 0.19 C ATOM 1319 O THR B 27 -5.993 -3.112 14.716 1.00 0.21 O ATOM 1320 CB THR B 27 -5.338 0.020 15.266 1.00 0.21 C ATOM 1321 OG1 THR B 27 -5.508 1.372 14.863 1.00 0.22 O ATOM 1322 CG2 THR B 27 -4.093 -0.562 14.596 1.00 0.25 C ATOM 0 H THR B 27 -7.481 0.738 16.033 1.00 0.15 H new ATOM 0 HA THR B 27 -6.662 -0.870 13.770 1.00 0.19 H new ATOM 0 HB THR B 27 -5.218 -0.026 16.348 1.00 0.21 H new ATOM 0 HG1 THR B 27 -5.918 1.882 15.593 1.00 0.22 H new ATOM 0 HG21 THR B 27 -3.217 0.016 14.891 1.00 0.25 H new ATOM 0 HG22 THR B 27 -3.965 -1.599 14.905 1.00 0.25 H new ATOM 0 HG23 THR B 27 -4.208 -0.518 13.513 1.00 0.25 H new ATOM 1330 N LEU B 28 -6.869 -2.441 16.611 1.00 0.17 N ATOM 1331 CA LEU B 28 -6.733 -3.805 17.201 1.00 0.18 C ATOM 1332 C LEU B 28 -7.962 -4.662 16.874 1.00 0.18 C ATOM 1333 O LEU B 28 -8.001 -5.840 17.169 1.00 0.19 O ATOM 1334 CB LEU B 28 -6.618 -3.575 18.708 1.00 0.18 C ATOM 1335 CG LEU B 28 -6.231 -4.884 19.396 1.00 0.21 C ATOM 1336 CD1 LEU B 28 -4.774 -5.221 19.071 1.00 0.23 C ATOM 1337 CD2 LEU B 28 -6.392 -4.730 20.910 1.00 0.20 C ATOM 0 H LEU B 28 -7.278 -1.738 17.227 1.00 0.17 H new ATOM 0 HA LEU B 28 -5.870 -4.339 16.803 1.00 0.18 H new ATOM 0 HB2 LEU B 28 -5.870 -2.809 18.914 1.00 0.18 H new ATOM 0 HB3 LEU B 28 -7.566 -3.210 19.104 1.00 0.18 H new ATOM 0 HG LEU B 28 -6.877 -5.686 19.040 1.00 0.21 H new ATOM 0 HD11 LEU B 28 -4.498 -6.154 19.562 1.00 0.23 H new ATOM 0 HD12 LEU B 28 -4.658 -5.330 17.993 1.00 0.23 H new ATOM 0 HD13 LEU B 28 -4.127 -4.419 19.427 1.00 0.23 H new ATOM 0 HD21 LEU B 28 -6.116 -5.663 21.402 1.00 0.20 H new ATOM 0 HD22 LEU B 28 -5.745 -3.928 21.265 1.00 0.20 H new ATOM 0 HD23 LEU B 28 -7.429 -4.490 21.143 1.00 0.20 H new ATOM 1349 N GLY B 29 -8.958 -4.090 16.253 1.00 0.16 N ATOM 1350 CA GLY B 29 -10.164 -4.890 15.894 1.00 0.17 C ATOM 1351 C GLY B 29 -10.873 -5.348 17.170 1.00 0.16 C ATOM 1352 O GLY B 29 -11.270 -6.490 17.294 1.00 0.16 O ATOM 0 H GLY B 29 -8.989 -3.108 15.980 1.00 0.16 H new ATOM 0 HA2 GLY B 29 -10.841 -4.292 15.284 1.00 0.17 H new ATOM 0 HA3 GLY B 29 -9.875 -5.754 15.296 1.00 0.17 H new ATOM 1356 N ILE B 30 -11.006 -4.479 18.132 1.00 0.14 N ATOM 1357 CA ILE B 30 -11.658 -4.881 19.411 1.00 0.13 C ATOM 1358 C ILE B 30 -12.959 -4.105 19.623 1.00 0.14 C ATOM 1359 O ILE B 30 -13.051 -2.927 19.338 1.00 0.15 O ATOM 1360 CB ILE B 30 -10.647 -4.539 20.504 1.00 0.13 C ATOM 1361 CG1 ILE B 30 -9.341 -5.291 20.241 1.00 0.14 C ATOM 1362 CG2 ILE B 30 -11.208 -4.954 21.865 1.00 0.13 C ATOM 1363 CD1 ILE B 30 -9.643 -6.776 20.025 1.00 0.14 C ATOM 0 H ILE B 30 -10.692 -3.509 18.089 1.00 0.14 H new ATOM 0 HA ILE B 30 -11.921 -5.939 19.415 1.00 0.13 H new ATOM 0 HB ILE B 30 -10.457 -3.466 20.501 1.00 0.13 H new ATOM 0 HG12 ILE B 30 -8.842 -4.879 19.364 1.00 0.14 H new ATOM 0 HG13 ILE B 30 -8.661 -5.166 21.083 1.00 0.14 H new ATOM 0 HG21 ILE B 30 -10.487 -4.710 22.645 1.00 0.13 H new ATOM 0 HG22 ILE B 30 -12.140 -4.421 22.052 1.00 0.13 H new ATOM 0 HG23 ILE B 30 -11.397 -6.027 21.868 1.00 0.13 H new ATOM 0 HD11 ILE B 30 -8.713 -7.313 19.837 1.00 0.14 H new ATOM 0 HD12 ILE B 30 -10.124 -7.183 20.915 1.00 0.14 H new ATOM 0 HD13 ILE B 30 -10.308 -6.891 19.169 1.00 0.14 H new ATOM 1375 N ALA B 31 -13.974 -4.775 20.089 1.00 0.14 N ATOM 1376 CA ALA B 31 -15.293 -4.113 20.291 1.00 0.15 C ATOM 1377 C ALA B 31 -15.938 -4.616 21.585 1.00 0.14 C ATOM 1378 O ALA B 31 -15.508 -5.593 22.166 1.00 0.13 O ATOM 1379 CB ALA B 31 -16.131 -4.527 19.083 1.00 0.15 C ATOM 0 H ALA B 31 -13.947 -5.763 20.341 1.00 0.14 H new ATOM 0 HA ALA B 31 -15.205 -3.030 20.375 1.00 0.15 H new ATOM 0 HB1 ALA B 31 -17.122 -4.079 19.157 1.00 0.15 H new ATOM 0 HB2 ALA B 31 -15.645 -4.186 18.169 1.00 0.15 H new ATOM 0 HB3 ALA B 31 -16.225 -5.613 19.060 1.00 0.15 H new ATOM 1385 N GLU B 32 -16.961 -3.954 22.046 1.00 0.15 N ATOM 1386 CA GLU B 32 -17.623 -4.391 23.308 1.00 0.16 C ATOM 1387 C GLU B 32 -18.018 -5.870 23.225 1.00 0.15 C ATOM 1388 O GLU B 32 -18.414 -6.358 22.187 1.00 0.17 O ATOM 1389 CB GLU B 32 -18.869 -3.513 23.424 1.00 0.18 C ATOM 1390 CG GLU B 32 -19.568 -3.790 24.756 1.00 0.19 C ATOM 1391 CD GLU B 32 -20.873 -2.996 24.824 1.00 0.22 C ATOM 1392 OE1 GLU B 32 -21.168 -2.296 23.869 1.00 1.06 O ATOM 1393 OE2 GLU B 32 -21.557 -3.102 25.829 1.00 1.00 O ATOM 0 H GLU B 32 -17.368 -3.129 21.605 1.00 0.15 H new ATOM 0 HA GLU B 32 -16.965 -4.289 24.171 1.00 0.16 H new ATOM 0 HB2 GLU B 32 -18.592 -2.461 23.359 1.00 0.18 H new ATOM 0 HB3 GLU B 32 -19.548 -3.716 22.596 1.00 0.18 H new ATOM 0 HG2 GLU B 32 -19.773 -4.856 24.856 1.00 0.19 H new ATOM 0 HG3 GLU B 32 -18.917 -3.511 25.585 1.00 0.19 H new ATOM 1400 N LYS B 33 -17.963 -6.564 24.334 1.00 0.15 N ATOM 1401 CA LYS B 33 -18.393 -7.999 24.374 1.00 0.16 C ATOM 1402 C LYS B 33 -17.349 -8.908 23.713 1.00 0.14 C ATOM 1403 O LYS B 33 -17.429 -10.117 23.802 1.00 0.15 O ATOM 1404 CB LYS B 33 -19.718 -8.059 23.610 1.00 0.19 C ATOM 1405 CG LYS B 33 -20.454 -9.350 23.971 1.00 0.59 C ATOM 1406 CD LYS B 33 -21.750 -9.442 23.162 1.00 0.76 C ATOM 1407 CE LYS B 33 -22.570 -10.641 23.645 1.00 1.41 C ATOM 1408 NZ LYS B 33 -23.898 -10.076 24.012 1.00 2.02 N ATOM 0 H LYS B 33 -17.634 -6.194 25.226 1.00 0.15 H new ATOM 0 HA LYS B 33 -18.502 -8.349 25.401 1.00 0.16 H new ATOM 0 HB2 LYS B 33 -20.334 -7.195 23.859 1.00 0.19 H new ATOM 0 HB3 LYS B 33 -19.534 -8.020 22.536 1.00 0.19 H new ATOM 0 HG2 LYS B 33 -19.821 -10.212 23.763 1.00 0.59 H new ATOM 0 HG3 LYS B 33 -20.677 -9.368 25.038 1.00 0.59 H new ATOM 0 HD2 LYS B 33 -22.327 -8.524 23.274 1.00 0.76 H new ATOM 0 HD3 LYS B 33 -21.522 -9.547 22.101 1.00 0.76 H new ATOM 0 HE2 LYS B 33 -22.664 -11.395 22.864 1.00 1.41 H new ATOM 0 HE3 LYS B 33 -22.097 -11.124 24.500 1.00 1.41 H new ATOM 0 HZ1 LYS B 33 -24.517 -10.839 24.353 1.00 2.02 H new ATOM 0 HZ2 LYS B 33 -23.778 -9.366 24.762 1.00 2.02 H new ATOM 0 HZ3 LYS B 33 -24.328 -9.628 23.177 1.00 2.02 H new ATOM 1422 N ASP B 34 -16.320 -8.347 23.139 1.00 0.13 N ATOM 1423 CA ASP B 34 -15.227 -9.201 22.586 1.00 0.12 C ATOM 1424 C ASP B 34 -14.332 -9.706 23.719 1.00 0.12 C ATOM 1425 O ASP B 34 -14.443 -9.269 24.846 1.00 0.13 O ATOM 1426 CB ASP B 34 -14.443 -8.295 21.642 1.00 0.11 C ATOM 1427 CG ASP B 34 -15.264 -8.051 20.377 1.00 0.13 C ATOM 1428 OD1 ASP B 34 -16.293 -8.688 20.228 1.00 0.14 O ATOM 1429 OD2 ASP B 34 -14.847 -7.233 19.578 1.00 0.13 O ATOM 0 H ASP B 34 -16.188 -7.342 23.029 1.00 0.13 H new ATOM 0 HA ASP B 34 -15.613 -10.079 22.069 1.00 0.12 H new ATOM 0 HB2 ASP B 34 -14.219 -7.348 22.132 1.00 0.11 H new ATOM 0 HB3 ASP B 34 -13.489 -8.756 21.387 1.00 0.11 H new ATOM 1434 N ALA B 35 -13.493 -10.667 23.446 1.00 0.12 N ATOM 1435 CA ALA B 35 -12.649 -11.244 24.531 1.00 0.13 C ATOM 1436 C ALA B 35 -11.201 -10.753 24.414 1.00 0.12 C ATOM 1437 O ALA B 35 -10.578 -10.865 23.377 1.00 0.11 O ATOM 1438 CB ALA B 35 -12.720 -12.756 24.320 1.00 0.15 C ATOM 0 H ALA B 35 -13.355 -11.077 22.522 1.00 0.12 H new ATOM 0 HA ALA B 35 -12.997 -10.948 25.520 1.00 0.13 H new ATOM 0 HB1 ALA B 35 -12.122 -13.258 25.081 1.00 0.15 H new ATOM 0 HB2 ALA B 35 -13.756 -13.086 24.396 1.00 0.15 H new ATOM 0 HB3 ALA B 35 -12.332 -13.004 23.332 1.00 0.15 H new ATOM 1444 N LEU B 36 -10.639 -10.292 25.498 1.00 0.13 N ATOM 1445 CA LEU B 36 -9.203 -9.888 25.491 1.00 0.13 C ATOM 1446 C LEU B 36 -8.380 -10.910 26.276 1.00 0.15 C ATOM 1447 O LEU B 36 -8.767 -11.319 27.350 1.00 0.17 O ATOM 1448 CB LEU B 36 -9.164 -8.542 26.213 1.00 0.13 C ATOM 1449 CG LEU B 36 -10.239 -7.613 25.655 1.00 0.12 C ATOM 1450 CD1 LEU B 36 -10.482 -6.486 26.657 1.00 0.15 C ATOM 1451 CD2 LEU B 36 -9.765 -7.024 24.324 1.00 0.14 C ATOM 0 H LEU B 36 -11.115 -10.177 26.393 1.00 0.13 H new ATOM 0 HA LEU B 36 -8.796 -9.829 24.481 1.00 0.13 H new ATOM 0 HB2 LEU B 36 -9.320 -8.690 27.282 1.00 0.13 H new ATOM 0 HB3 LEU B 36 -8.181 -8.086 26.094 1.00 0.13 H new ATOM 0 HG LEU B 36 -11.162 -8.168 25.491 1.00 0.12 H new ATOM 0 HD11 LEU B 36 -11.249 -5.814 26.270 1.00 0.15 H new ATOM 0 HD12 LEU B 36 -10.814 -6.908 27.606 1.00 0.15 H new ATOM 0 HD13 LEU B 36 -9.557 -5.930 26.811 1.00 0.15 H new ATOM 0 HD21 LEU B 36 -10.533 -6.361 23.926 1.00 0.14 H new ATOM 0 HD22 LEU B 36 -8.845 -6.461 24.482 1.00 0.14 H new ATOM 0 HD23 LEU B 36 -9.579 -7.831 23.615 1.00 0.14 H new ATOM 1463 N GLU B 37 -7.196 -11.219 25.831 1.00 0.16 N ATOM 1464 CA GLU B 37 -6.312 -12.089 26.656 1.00 0.18 C ATOM 1465 C GLU B 37 -5.193 -11.253 27.280 1.00 0.19 C ATOM 1466 O GLU B 37 -4.697 -10.318 26.684 1.00 0.18 O ATOM 1467 CB GLU B 37 -5.747 -13.128 25.689 1.00 0.20 C ATOM 1468 CG GLU B 37 -4.912 -14.149 26.465 1.00 0.24 C ATOM 1469 CD GLU B 37 -4.262 -15.128 25.486 1.00 0.27 C ATOM 1470 OE1 GLU B 37 -4.457 -14.961 24.294 1.00 1.14 O ATOM 1471 OE2 GLU B 37 -3.579 -16.029 25.946 1.00 1.08 O ATOM 0 H GLU B 37 -6.804 -10.911 24.941 1.00 0.16 H new ATOM 0 HA GLU B 37 -6.848 -12.564 27.478 1.00 0.18 H new ATOM 0 HB2 GLU B 37 -6.559 -13.631 25.164 1.00 0.20 H new ATOM 0 HB3 GLU B 37 -5.132 -12.640 24.933 1.00 0.20 H new ATOM 0 HG2 GLU B 37 -4.145 -13.639 27.048 1.00 0.24 H new ATOM 0 HG3 GLU B 37 -5.543 -14.689 27.171 1.00 0.24 H new ATOM 1478 N ILE B 38 -4.880 -11.511 28.518 1.00 0.21 N ATOM 1479 CA ILE B 38 -3.896 -10.658 29.237 1.00 0.23 C ATOM 1480 C ILE B 38 -2.618 -11.445 29.530 1.00 0.22 C ATOM 1481 O ILE B 38 -2.659 -12.584 29.963 1.00 0.22 O ATOM 1482 CB ILE B 38 -4.592 -10.264 30.539 1.00 0.27 C ATOM 1483 CG1 ILE B 38 -5.915 -9.564 30.217 1.00 0.28 C ATOM 1484 CG2 ILE B 38 -3.694 -9.314 31.332 1.00 0.31 C ATOM 1485 CD1 ILE B 38 -6.672 -9.281 31.516 1.00 0.86 C ATOM 0 H ILE B 38 -5.266 -12.280 29.065 1.00 0.21 H new ATOM 0 HA ILE B 38 -3.601 -9.788 28.650 1.00 0.23 H new ATOM 0 HB ILE B 38 -4.787 -11.158 31.131 1.00 0.27 H new ATOM 0 HG12 ILE B 38 -5.725 -8.632 29.684 1.00 0.28 H new ATOM 0 HG13 ILE B 38 -6.519 -10.190 29.560 1.00 0.28 H new ATOM 0 HG21 ILE B 38 -4.191 -9.033 32.261 1.00 0.31 H new ATOM 0 HG22 ILE B 38 -2.751 -9.811 31.561 1.00 0.31 H new ATOM 0 HG23 ILE B 38 -3.498 -8.420 30.741 1.00 0.31 H new ATOM 0 HD11 ILE B 38 -7.614 -8.783 31.287 1.00 0.86 H new ATOM 0 HD12 ILE B 38 -6.874 -10.220 32.031 1.00 0.86 H new ATOM 0 HD13 ILE B 38 -6.068 -8.638 32.157 1.00 0.86 H new ATOM 1497 N TYR B 39 -1.491 -10.843 29.266 1.00 0.22 N ATOM 1498 CA TYR B 39 -0.184 -11.526 29.481 1.00 0.21 C ATOM 1499 C TYR B 39 0.609 -10.811 30.578 1.00 0.18 C ATOM 1500 O TYR B 39 0.461 -9.623 30.781 1.00 0.18 O ATOM 1501 CB TYR B 39 0.543 -11.378 28.148 1.00 0.22 C ATOM 1502 CG TYR B 39 0.027 -12.384 27.154 1.00 0.26 C ATOM 1503 CD1 TYR B 39 -1.302 -12.328 26.713 1.00 0.28 C ATOM 1504 CD2 TYR B 39 0.887 -13.367 26.664 1.00 0.29 C ATOM 1505 CE1 TYR B 39 -1.767 -13.264 25.781 1.00 0.32 C ATOM 1506 CE2 TYR B 39 0.425 -14.302 25.734 1.00 0.32 C ATOM 1507 CZ TYR B 39 -0.902 -14.252 25.292 1.00 0.33 C ATOM 1508 OH TYR B 39 -1.356 -15.179 24.377 1.00 0.37 O ATOM 0 H TYR B 39 -1.420 -9.892 28.905 1.00 0.22 H new ATOM 0 HA TYR B 39 -0.303 -12.565 29.787 1.00 0.21 H new ATOM 0 HB2 TYR B 39 0.403 -10.369 27.760 1.00 0.22 H new ATOM 0 HB3 TYR B 39 1.614 -11.517 28.293 1.00 0.22 H new ATOM 0 HD1 TYR B 39 -1.966 -11.565 27.091 1.00 0.28 H new ATOM 0 HD2 TYR B 39 1.911 -13.405 27.004 1.00 0.29 H new ATOM 0 HE1 TYR B 39 -2.791 -13.224 25.440 1.00 0.32 H new ATOM 0 HE2 TYR B 39 1.092 -15.063 25.356 1.00 0.32 H new ATOM 0 HH TYR B 39 -0.627 -15.791 24.142 1.00 0.37 H new ATOM 1518 N VAL B 40 1.543 -11.484 31.191 1.00 0.18 N ATOM 1519 CA VAL B 40 2.441 -10.783 32.155 1.00 0.17 C ATOM 1520 C VAL B 40 3.909 -11.095 31.849 1.00 0.17 C ATOM 1521 O VAL B 40 4.337 -12.231 31.904 1.00 0.23 O ATOM 1522 CB VAL B 40 2.053 -11.325 33.528 1.00 0.20 C ATOM 1523 CG1 VAL B 40 2.973 -10.720 34.590 1.00 0.20 C ATOM 1524 CG2 VAL B 40 0.603 -10.943 33.833 1.00 0.20 C ATOM 0 H VAL B 40 1.724 -12.480 31.069 1.00 0.18 H new ATOM 0 HA VAL B 40 2.333 -9.700 32.098 1.00 0.17 H new ATOM 0 HB VAL B 40 2.153 -12.410 33.535 1.00 0.20 H new ATOM 0 HG11 VAL B 40 2.698 -11.105 35.572 1.00 0.20 H new ATOM 0 HG12 VAL B 40 4.007 -10.988 34.371 1.00 0.20 H new ATOM 0 HG13 VAL B 40 2.871 -9.635 34.585 1.00 0.20 H new ATOM 0 HG21 VAL B 40 0.324 -11.329 34.813 1.00 0.20 H new ATOM 0 HG22 VAL B 40 0.504 -9.858 33.829 1.00 0.20 H new ATOM 0 HG23 VAL B 40 -0.053 -11.370 33.074 1.00 0.20 H new ATOM 1534 N ASP B 41 4.698 -10.085 31.600 1.00 0.14 N ATOM 1535 CA ASP B 41 6.154 -10.312 31.373 1.00 0.15 C ATOM 1536 C ASP B 41 6.962 -9.114 31.883 1.00 0.17 C ATOM 1537 O ASP B 41 6.571 -7.978 31.714 1.00 0.21 O ATOM 1538 CB ASP B 41 6.304 -10.451 29.856 1.00 0.21 C ATOM 1539 CG ASP B 41 6.161 -9.077 29.198 1.00 0.35 C ATOM 1540 OD1 ASP B 41 5.403 -8.271 29.713 1.00 1.07 O ATOM 1541 OD2 ASP B 41 6.815 -8.852 28.193 1.00 1.22 O ATOM 0 H ASP B 41 4.397 -9.112 31.544 1.00 0.14 H new ATOM 0 HA ASP B 41 6.521 -11.192 31.901 1.00 0.15 H new ATOM 0 HB2 ASP B 41 7.276 -10.882 29.614 1.00 0.21 H new ATOM 0 HB3 ASP B 41 5.548 -11.132 29.467 1.00 0.21 H new ATOM 1546 N ASP B 42 8.131 -9.354 32.409 1.00 0.31 N ATOM 1547 CA ASP B 42 9.015 -8.221 32.816 1.00 0.44 C ATOM 1548 C ASP B 42 8.215 -7.132 33.545 1.00 0.37 C ATOM 1549 O ASP B 42 8.398 -5.955 33.305 1.00 0.38 O ATOM 1550 CB ASP B 42 9.580 -7.682 31.503 1.00 0.56 C ATOM 1551 CG ASP B 42 10.464 -6.467 31.786 1.00 0.69 C ATOM 1552 OD1 ASP B 42 10.697 -6.186 32.950 1.00 1.22 O ATOM 1553 OD2 ASP B 42 10.891 -5.836 30.833 1.00 1.37 O ATOM 0 H ASP B 42 8.514 -10.285 32.575 1.00 0.31 H new ATOM 0 HA ASP B 42 9.796 -8.540 33.507 1.00 0.44 H new ATOM 0 HB2 ASP B 42 10.159 -8.456 30.999 1.00 0.56 H new ATOM 0 HB3 ASP B 42 8.767 -7.405 30.832 1.00 0.56 H new ATOM 1558 N GLU B 43 7.389 -7.510 34.485 1.00 0.32 N ATOM 1559 CA GLU B 43 6.647 -6.490 35.290 1.00 0.32 C ATOM 1560 C GLU B 43 5.805 -5.592 34.379 1.00 0.26 C ATOM 1561 O GLU B 43 5.273 -4.586 34.803 1.00 0.30 O ATOM 1562 CB GLU B 43 7.731 -5.674 35.996 1.00 0.41 C ATOM 1563 CG GLU B 43 8.548 -6.593 36.907 1.00 1.23 C ATOM 1564 CD GLU B 43 9.583 -5.765 37.672 1.00 1.52 C ATOM 1565 OE1 GLU B 43 9.734 -4.598 37.351 1.00 2.02 O ATOM 1566 OE2 GLU B 43 10.208 -6.313 38.565 1.00 2.10 O ATOM 0 H GLU B 43 7.195 -8.481 34.732 1.00 0.32 H new ATOM 0 HA GLU B 43 5.957 -6.951 35.997 1.00 0.32 H new ATOM 0 HB2 GLU B 43 8.382 -5.201 35.261 1.00 0.41 H new ATOM 0 HB3 GLU B 43 7.276 -4.874 36.581 1.00 0.41 H new ATOM 0 HG2 GLU B 43 7.890 -7.108 37.607 1.00 1.23 H new ATOM 0 HG3 GLU B 43 9.046 -7.360 36.315 1.00 1.23 H new ATOM 1573 N LYS B 44 5.616 -5.992 33.152 1.00 0.20 N ATOM 1574 CA LYS B 44 4.733 -5.211 32.240 1.00 0.24 C ATOM 1575 C LYS B 44 3.572 -6.086 31.765 1.00 0.19 C ATOM 1576 O LYS B 44 3.695 -7.288 31.654 1.00 0.21 O ATOM 1577 CB LYS B 44 5.621 -4.817 31.059 1.00 0.40 C ATOM 1578 CG LYS B 44 6.696 -3.835 31.529 1.00 0.95 C ATOM 1579 CD LYS B 44 7.493 -3.341 30.320 1.00 0.86 C ATOM 1580 CE LYS B 44 8.599 -2.394 30.787 1.00 1.81 C ATOM 1581 NZ LYS B 44 9.854 -3.191 30.693 1.00 1.80 N ATOM 0 H LYS B 44 6.035 -6.826 32.741 1.00 0.20 H new ATOM 0 HA LYS B 44 4.302 -4.338 32.730 1.00 0.24 H new ATOM 0 HB2 LYS B 44 6.087 -5.704 30.630 1.00 0.40 H new ATOM 0 HB3 LYS B 44 5.018 -4.362 30.273 1.00 0.40 H new ATOM 0 HG2 LYS B 44 6.235 -2.992 32.044 1.00 0.95 H new ATOM 0 HG3 LYS B 44 7.361 -4.320 32.244 1.00 0.95 H new ATOM 0 HD2 LYS B 44 7.926 -4.187 29.787 1.00 0.86 H new ATOM 0 HD3 LYS B 44 6.832 -2.828 29.621 1.00 0.86 H new ATOM 0 HE2 LYS B 44 8.648 -1.505 30.159 1.00 1.81 H new ATOM 0 HE3 LYS B 44 8.423 -2.054 31.808 1.00 1.81 H new ATOM 0 HZ1 LYS B 44 10.527 -2.865 31.415 1.00 1.80 H new ATOM 0 HZ2 LYS B 44 9.639 -4.197 30.849 1.00 1.80 H new ATOM 0 HZ3 LYS B 44 10.273 -3.069 29.749 1.00 1.80 H new ATOM 1595 N ILE B 45 2.437 -5.498 31.511 1.00 0.18 N ATOM 1596 CA ILE B 45 1.262 -6.308 31.079 1.00 0.20 C ATOM 1597 C ILE B 45 1.103 -6.241 29.558 1.00 0.16 C ATOM 1598 O ILE B 45 1.044 -5.174 28.981 1.00 0.13 O ATOM 1599 CB ILE B 45 0.066 -5.654 31.768 1.00 0.25 C ATOM 1600 CG1 ILE B 45 0.317 -5.594 33.276 1.00 0.32 C ATOM 1601 CG2 ILE B 45 -1.194 -6.478 31.494 1.00 0.31 C ATOM 1602 CD1 ILE B 45 -0.722 -4.681 33.929 1.00 0.39 C ATOM 0 H ILE B 45 2.271 -4.494 31.583 1.00 0.18 H new ATOM 0 HA ILE B 45 1.365 -7.361 31.341 1.00 0.20 H new ATOM 0 HB ILE B 45 -0.069 -4.644 31.381 1.00 0.25 H new ATOM 0 HG12 ILE B 45 0.259 -6.594 33.705 1.00 0.32 H new ATOM 0 HG13 ILE B 45 1.321 -5.220 33.474 1.00 0.32 H new ATOM 0 HG21 ILE B 45 -2.048 -6.012 31.986 1.00 0.31 H new ATOM 0 HG22 ILE B 45 -1.373 -6.522 30.420 1.00 0.31 H new ATOM 0 HG23 ILE B 45 -1.060 -7.488 31.881 1.00 0.31 H new ATOM 0 HD11 ILE B 45 -0.544 -4.638 35.004 1.00 0.39 H new ATOM 0 HD12 ILE B 45 -0.642 -3.679 33.507 1.00 0.39 H new ATOM 0 HD13 ILE B 45 -1.721 -5.075 33.742 1.00 0.39 H new ATOM 1614 N ILE B 46 0.976 -7.371 28.916 1.00 0.21 N ATOM 1615 CA ILE B 46 0.753 -7.375 27.441 1.00 0.22 C ATOM 1616 C ILE B 46 -0.678 -7.819 27.126 1.00 0.20 C ATOM 1617 O ILE B 46 -1.064 -8.938 27.390 1.00 0.27 O ATOM 1618 CB ILE B 46 1.768 -8.383 26.895 1.00 0.34 C ATOM 1619 CG1 ILE B 46 3.167 -7.770 26.947 1.00 0.48 C ATOM 1620 CG2 ILE B 46 1.418 -8.748 25.450 1.00 0.34 C ATOM 1621 CD1 ILE B 46 4.204 -8.886 27.068 1.00 1.11 C ATOM 0 H ILE B 46 1.017 -8.293 29.350 1.00 0.21 H new ATOM 0 HA ILE B 46 0.881 -6.388 26.996 1.00 0.22 H new ATOM 0 HB ILE B 46 1.742 -9.287 27.504 1.00 0.34 H new ATOM 0 HG12 ILE B 46 3.352 -7.182 26.048 1.00 0.48 H new ATOM 0 HG13 ILE B 46 3.247 -7.090 27.795 1.00 0.48 H new ATOM 0 HG21 ILE B 46 2.145 -9.465 25.070 1.00 0.34 H new ATOM 0 HG22 ILE B 46 0.422 -9.189 25.417 1.00 0.34 H new ATOM 0 HG23 ILE B 46 1.438 -7.850 24.833 1.00 0.34 H new ATOM 0 HD11 ILE B 46 5.203 -8.452 27.105 1.00 1.11 H new ATOM 0 HD12 ILE B 46 4.021 -9.455 27.980 1.00 1.11 H new ATOM 0 HD13 ILE B 46 4.128 -9.548 26.206 1.00 1.11 H new ATOM 1633 N LEU B 47 -1.467 -6.951 26.556 1.00 0.15 N ATOM 1634 CA LEU B 47 -2.868 -7.333 26.218 1.00 0.13 C ATOM 1635 C LEU B 47 -3.016 -7.494 24.705 1.00 0.14 C ATOM 1636 O LEU B 47 -2.567 -6.665 23.938 1.00 0.16 O ATOM 1637 CB LEU B 47 -3.734 -6.176 26.715 1.00 0.12 C ATOM 1638 CG LEU B 47 -3.517 -5.979 28.216 1.00 0.13 C ATOM 1639 CD1 LEU B 47 -2.205 -5.228 28.449 1.00 0.13 C ATOM 1640 CD2 LEU B 47 -4.677 -5.164 28.792 1.00 0.15 C ATOM 0 H LEU B 47 -1.204 -5.997 26.310 1.00 0.15 H new ATOM 0 HA LEU B 47 -3.156 -8.280 26.675 1.00 0.13 H new ATOM 0 HB2 LEU B 47 -3.480 -5.262 26.178 1.00 0.12 H new ATOM 0 HB3 LEU B 47 -4.785 -6.383 26.514 1.00 0.12 H new ATOM 0 HG LEU B 47 -3.471 -6.951 28.708 1.00 0.13 H new ATOM 0 HD11 LEU B 47 -2.051 -5.088 29.519 1.00 0.13 H new ATOM 0 HD12 LEU B 47 -1.377 -5.805 28.036 1.00 0.13 H new ATOM 0 HD13 LEU B 47 -2.250 -4.256 27.959 1.00 0.13 H new ATOM 0 HD21 LEU B 47 -4.526 -5.022 29.862 1.00 0.15 H new ATOM 0 HD22 LEU B 47 -4.719 -4.193 28.299 1.00 0.15 H new ATOM 0 HD23 LEU B 47 -5.614 -5.696 28.626 1.00 0.15 H new ATOM 1652 N LYS B 48 -3.641 -8.553 24.274 1.00 0.15 N ATOM 1653 CA LYS B 48 -3.821 -8.771 22.811 1.00 0.17 C ATOM 1654 C LYS B 48 -5.180 -9.418 22.537 1.00 0.16 C ATOM 1655 O LYS B 48 -5.819 -9.940 23.428 1.00 0.15 O ATOM 1656 CB LYS B 48 -2.684 -9.710 22.403 1.00 0.22 C ATOM 1657 CG LYS B 48 -2.886 -11.083 23.048 1.00 0.28 C ATOM 1658 CD LYS B 48 -1.740 -12.007 22.632 1.00 0.35 C ATOM 1659 CE LYS B 48 -2.212 -13.461 22.687 1.00 1.42 C ATOM 1660 NZ LYS B 48 -3.168 -13.600 21.552 1.00 2.11 N ATOM 0 H LYS B 48 -4.036 -9.279 24.872 1.00 0.15 H new ATOM 0 HA LYS B 48 -3.795 -7.837 22.249 1.00 0.17 H new ATOM 0 HB2 LYS B 48 -2.654 -9.809 21.318 1.00 0.22 H new ATOM 0 HB3 LYS B 48 -1.726 -9.291 22.711 1.00 0.22 H new ATOM 0 HG2 LYS B 48 -2.916 -10.987 24.133 1.00 0.28 H new ATOM 0 HG3 LYS B 48 -3.841 -11.507 22.738 1.00 0.28 H new ATOM 0 HD2 LYS B 48 -1.407 -11.760 21.624 1.00 0.35 H new ATOM 0 HD3 LYS B 48 -0.886 -11.865 23.294 1.00 0.35 H new ATOM 0 HE2 LYS B 48 -1.375 -14.152 22.585 1.00 1.42 H new ATOM 0 HE3 LYS B 48 -2.694 -13.684 23.639 1.00 1.42 H new ATOM 0 HZ1 LYS B 48 -3.210 -14.595 21.253 1.00 2.11 H new ATOM 0 HZ2 LYS B 48 -4.113 -13.289 21.854 1.00 2.11 H new ATOM 0 HZ3 LYS B 48 -2.849 -13.012 20.755 1.00 2.11 H new ATOM 1674 N LYS B 49 -5.607 -9.432 21.304 1.00 0.17 N ATOM 1675 CA LYS B 49 -6.901 -10.096 20.977 1.00 0.18 C ATOM 1676 C LYS B 49 -6.880 -11.546 21.462 1.00 0.19 C ATOM 1677 O LYS B 49 -5.838 -12.164 21.555 1.00 0.21 O ATOM 1678 CB LYS B 49 -7.009 -10.044 19.454 1.00 0.23 C ATOM 1679 CG LYS B 49 -8.355 -10.625 19.018 1.00 0.27 C ATOM 1680 CD LYS B 49 -8.497 -10.504 17.500 1.00 0.76 C ATOM 1681 CE LYS B 49 -7.490 -11.432 16.816 1.00 0.99 C ATOM 1682 NZ LYS B 49 -7.768 -11.295 15.360 1.00 1.60 N ATOM 0 H LYS B 49 -5.119 -9.014 20.512 1.00 0.17 H new ATOM 0 HA LYS B 49 -7.748 -9.606 21.458 1.00 0.18 H new ATOM 0 HB2 LYS B 49 -6.916 -9.015 19.107 1.00 0.23 H new ATOM 0 HB3 LYS B 49 -6.194 -10.608 19.001 1.00 0.23 H new ATOM 0 HG2 LYS B 49 -8.426 -11.670 19.318 1.00 0.27 H new ATOM 0 HG3 LYS B 49 -9.169 -10.095 19.513 1.00 0.27 H new ATOM 0 HD2 LYS B 49 -9.511 -10.765 17.197 1.00 0.76 H new ATOM 0 HD3 LYS B 49 -8.327 -9.473 17.189 1.00 0.76 H new ATOM 0 HE2 LYS B 49 -6.465 -11.144 17.051 1.00 0.99 H new ATOM 0 HE3 LYS B 49 -7.615 -12.463 17.147 1.00 0.99 H new ATOM 0 HZ1 LYS B 49 -7.116 -11.902 14.823 1.00 1.60 H new ATOM 0 HZ2 LYS B 49 -8.748 -11.582 15.165 1.00 1.60 H new ATOM 0 HZ3 LYS B 49 -7.634 -10.305 15.073 1.00 1.60 H new ATOM 1696 N TYR B 50 -8.010 -12.062 21.856 1.00 0.19 N ATOM 1697 CA TYR B 50 -8.036 -13.437 22.432 1.00 0.21 C ATOM 1698 C TYR B 50 -8.543 -14.446 21.399 1.00 0.28 C ATOM 1699 O TYR B 50 -9.654 -14.353 20.917 1.00 0.31 O ATOM 1700 CB TYR B 50 -9.005 -13.348 23.610 1.00 0.19 C ATOM 1701 CG TYR B 50 -9.137 -14.705 24.258 1.00 0.23 C ATOM 1702 CD1 TYR B 50 -8.069 -15.608 24.215 1.00 0.23 C ATOM 1703 CD2 TYR B 50 -10.329 -15.061 24.899 1.00 0.30 C ATOM 1704 CE1 TYR B 50 -8.193 -16.867 24.814 1.00 0.26 C ATOM 1705 CE2 TYR B 50 -10.453 -16.319 25.498 1.00 0.35 C ATOM 1706 CZ TYR B 50 -9.385 -17.223 25.456 1.00 0.31 C ATOM 1707 OH TYR B 50 -9.508 -18.464 26.047 1.00 0.37 O ATOM 0 H TYR B 50 -8.915 -11.594 21.805 1.00 0.19 H new ATOM 0 HA TYR B 50 -7.044 -13.773 22.736 1.00 0.21 H new ATOM 0 HB2 TYR B 50 -8.645 -12.620 24.337 1.00 0.19 H new ATOM 0 HB3 TYR B 50 -9.980 -13.001 23.267 1.00 0.19 H new ATOM 0 HD1 TYR B 50 -7.149 -15.334 23.720 1.00 0.23 H new ATOM 0 HD2 TYR B 50 -11.154 -14.364 24.931 1.00 0.30 H new ATOM 0 HE1 TYR B 50 -7.369 -17.564 24.781 1.00 0.26 H new ATOM 0 HE2 TYR B 50 -11.373 -16.593 25.993 1.00 0.35 H new ATOM 0 HH TYR B 50 -10.398 -18.548 26.449 1.00 0.37 H new ATOM 1717 N LYS B 51 -7.759 -15.447 21.103 1.00 0.37 N ATOM 1718 CA LYS B 51 -8.220 -16.500 20.153 1.00 0.46 C ATOM 1719 C LYS B 51 -8.194 -17.873 20.831 1.00 0.55 C ATOM 1720 O LYS B 51 -7.218 -18.592 20.742 1.00 1.02 O ATOM 1721 CB LYS B 51 -7.222 -16.454 18.996 1.00 0.71 C ATOM 1722 CG LYS B 51 -7.614 -15.337 18.027 1.00 1.49 C ATOM 1723 CD LYS B 51 -6.386 -14.903 17.224 1.00 2.01 C ATOM 1724 CE LYS B 51 -5.322 -14.351 18.175 1.00 2.65 C ATOM 1725 NZ LYS B 51 -4.260 -15.395 18.211 1.00 3.32 N ATOM 0 H LYS B 51 -6.820 -15.581 21.478 1.00 0.37 H new ATOM 0 HA LYS B 51 -9.243 -16.333 19.816 1.00 0.46 H new ATOM 0 HB2 LYS B 51 -6.215 -16.283 19.377 1.00 0.71 H new ATOM 0 HB3 LYS B 51 -7.207 -17.412 18.476 1.00 0.71 H new ATOM 0 HG2 LYS B 51 -8.398 -15.684 17.354 1.00 1.49 H new ATOM 0 HG3 LYS B 51 -8.020 -14.489 18.578 1.00 1.49 H new ATOM 0 HD2 LYS B 51 -5.986 -15.749 16.666 1.00 2.01 H new ATOM 0 HD3 LYS B 51 -6.666 -14.143 16.494 1.00 2.01 H new ATOM 0 HE2 LYS B 51 -4.928 -13.399 17.818 1.00 2.65 H new ATOM 0 HE3 LYS B 51 -5.734 -14.173 19.168 1.00 2.65 H new ATOM 0 HZ1 LYS B 51 -3.766 -15.356 19.125 1.00 3.32 H new ATOM 0 HZ2 LYS B 51 -4.692 -16.333 18.090 1.00 3.32 H new ATOM 0 HZ3 LYS B 51 -3.580 -15.225 17.443 1.00 3.32 H new ATOM 1739 N PRO B 52 -9.268 -18.180 21.506 1.00 0.80 N ATOM 1740 CA PRO B 52 -9.368 -19.469 22.233 1.00 0.87 C ATOM 1741 C PRO B 52 -9.105 -20.640 21.281 1.00 1.22 C ATOM 1742 O PRO B 52 -9.452 -20.598 20.118 1.00 1.66 O ATOM 1743 CB PRO B 52 -10.809 -19.498 22.741 1.00 1.51 C ATOM 1744 CG PRO B 52 -11.278 -18.077 22.705 1.00 2.00 C ATOM 1745 CD PRO B 52 -10.474 -17.362 21.652 1.00 1.53 C ATOM 0 HA PRO B 52 -8.640 -19.558 23.039 1.00 0.87 H new ATOM 0 HB2 PRO B 52 -11.433 -20.133 22.112 1.00 1.51 H new ATOM 0 HB3 PRO B 52 -10.860 -19.902 23.752 1.00 1.51 H new ATOM 0 HG2 PRO B 52 -12.342 -18.030 22.473 1.00 2.00 H new ATOM 0 HG3 PRO B 52 -11.143 -17.604 23.678 1.00 2.00 H new ATOM 0 HD2 PRO B 52 -11.022 -17.289 20.713 1.00 1.53 H new ATOM 0 HD3 PRO B 52 -10.231 -16.345 21.959 1.00 1.53 H new ATOM 1753 N ASN B 53 -8.496 -21.686 21.769 1.00 1.44 N ATOM 1754 CA ASN B 53 -8.213 -22.860 20.893 1.00 2.20 C ATOM 1755 C ASN B 53 -9.521 -23.550 20.495 1.00 2.57 C ATOM 1756 O ASN B 53 -9.900 -23.437 19.340 1.00 3.16 O ATOM 1757 CB ASN B 53 -7.354 -23.793 21.747 1.00 2.70 C ATOM 1758 CG ASN B 53 -6.029 -23.104 22.080 1.00 3.26 C ATOM 1759 OD1 ASN B 53 -5.648 -22.150 21.433 1.00 3.52 O ATOM 1760 ND2 ASN B 53 -5.307 -23.551 23.071 1.00 3.91 N ATOM 1761 OXT ASN B 53 -10.122 -24.178 21.351 1.00 2.76 O ATOM 0 H ASN B 53 -8.182 -21.779 22.735 1.00 1.44 H new ATOM 0 HA ASN B 53 -7.710 -22.574 19.969 1.00 2.20 H new ATOM 0 HB2 ASN B 53 -7.882 -24.053 22.665 1.00 2.70 H new ATOM 0 HB3 ASN B 53 -7.168 -24.724 21.212 1.00 2.70 H new ATOM 0 HD21 ASN B 53 -4.422 -23.099 23.302 1.00 3.91 H new ATOM 0 HD22 ASN B 53 -5.627 -24.353 23.614 1.00 3.91 H new TER 1768 ASN B 53 END