USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1040 hydrogens (0 hets) HEADER METAL BINDING PROTEIN 21-JUN-01 1JFK TITLE MINIMUM ENERGY REPRESENTATIVE STRUCTURE OF A CALCIUM BOUND TITLE 2 EF-HAND PROTEIN FROM ENTAMOEBA HISTOLYTICA COMPND MOL_ID: 1; COMPND 2 MOLECULE: CALCIUM-BINDING PROTEIN; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: EHCABP; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ENTAMOEBA HISTOLYTICA; SOURCE 3 ORGANISM_TAXID: 5759; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 5 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET-3C KEYWDS EF-HAND, HELIX-LOOP-HELIX, CALCIUM BINDING PROTEIN, KEYWDS 2 ENTAMOEBA HISTOLYTICA, METAL BINDING PROTEIN EXPDTA SOLUTION NMR AUTHOR H.S.ATREYA,S.C.SAHU,A.BHATTACHARYA,K.V.R.CHARY,G.GOVIL REVDAT 4 24-FEB-09 1JFK 1 VERSN REVDAT 3 01-APR-03 1JFK 1 JRNL REVDAT 2 25-DEC-02 1JFK 1 REMARK REVDAT 1 19-DEC-01 1JFK 0 JRNL AUTH H.S.ATREYA,S.C.SAHU,A.BHATTACHARYA,K.V.CHARY, JRNL AUTH 2 G.GOVIL JRNL TITL NMR DERIVED SOLUTION STRUCTURE OF AN EF-HAND JRNL TITL 2 CALCIUM-BINDING PROTEIN FROM ENTAMOEBA HISTOLYTICA. JRNL REF BIOCHEMISTRY V. 40 14392 2001 JRNL REFN ISSN 0006-2960 JRNL PMID 11724551 JRNL DOI 10.1021/BI0114978 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : DYANA 1.5 REMARK 3 AUTHORS : GUENTERT, MUMENTHALER AND WUTHRICH REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: 1265 NOE-DERIVED DISTANCE REMARK 3 CONSTRAINTS AND 200 DIHEDRAL ANGLE CONSTRAINTS REMARK 4 REMARK 4 1JFK COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 26-JUN-01. REMARK 100 THE RCSB ID CODE IS RCSB013711. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 308 REMARK 210 PH : 6.0 REMARK 210 IONIC STRENGTH : 30MM CACL2 REMARK 210 PRESSURE : 1ATM REMARK 210 SAMPLE CONTENTS : 3MM EHCABP, 30MM DEUTERATED REMARK 210 TRIS BUFFER, 30MM CACL2; 3MM REMARK 210 EHCABP, 30MM DEUTERATED TRIS REMARK 210 BUFFER, 30MM CACL2 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, HNHA, REMARK 210 2D NOESY, 3D_13C-SEPARATED_ REMARK 210 NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : UNITYPLUS REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : DYANA 1.5 REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: THE STRUCTURE WAS DETERMINED USING TRIPLE RESONANCE NMR REMARK 210 SPECTROSCOPY REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 LYS A 29 -79.65 -78.07 REMARK 500 ALA A 31 54.13 -141.02 REMARK 500 ILE A 32 52.95 -94.87 REMARK 500 SER A 64 -68.53 -178.13 REMARK 500 ILE A 65 -77.74 -144.11 REMARK 500 LEU A 70 93.33 -163.44 REMARK 500 ASP A 85 93.63 -53.76 REMARK 500 ALA A 118 49.22 -89.82 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A 147 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASP A 14 OD2 REMARK 620 2 ASP A 10 OD1 64.8 REMARK 620 3 ASN A 12 OD1 80.7 72.5 REMARK 620 4 ALA A 16 O 95.1 102.8 174.7 REMARK 620 5 GLU A 21 OE1 169.0 123.5 108.1 76.4 REMARK 620 6 GLU A 21 OE2 143.2 88.9 66.6 116.3 47.6 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A 159 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASP A 48 OD2 REMARK 620 2 ASN A 50 ND2 86.0 REMARK 620 3 ASP A 46 OD1 71.4 103.3 REMARK 620 4 ASP A 48 OD1 39.5 65.9 50.3 REMARK 620 5 GLU A 52 O 134.9 50.5 104.1 102.2 REMARK 620 6 GLU A 57 OE1 110.3 120.8 136.0 149.7 103.1 REMARK 620 7 GLU A 57 OE2 97.6 167.9 88.9 123.5 127.4 47.1 REMARK 620 8 ASN A 50 OD1 86.5 42.1 63.5 48.5 54.6 156.8 149.3 REMARK 620 N 1 2 3 4 5 6 7 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A 171 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU A 96 OE2 REMARK 620 2 LYS A 91 O 121.9 REMARK 620 3 GLU A 96 OE1 47.7 93.2 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A 183 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASN A 119 OD1 REMARK 620 2 GLU A 128 OE1 129.6 REMARK 620 3 GLU A 128 OE2 83.5 47.7 REMARK 620 4 ASP A 121 OD2 94.6 121.8 152.5 REMARK 620 5 TYR A 123 O 127.6 102.9 145.9 51.2 REMARK 620 6 ASP A 117 OD2 75.8 143.9 132.7 72.4 57.8 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 147 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 159 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 171 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 183 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1JFJ RELATED DB: PDB REMARK 900 1JFJ CONTAINS SAME HOLO PROTEIN (THE CALCIUM IONS ARE NOT REMARK 900 SHOWN EXPLICILTY IN THE STRUCTURES). REMARK 900 RELATED ID: 4271 RELATED DB: BMRB REMARK 900 4271 CONTAINS ASSIGNED CHEMICAL SHIFT LISTS DBREF 1JFK A 1 134 UNP P38505 CALBP_ENTHI 1 134 SEQADV 1JFK GLU A 131 UNP P38505 UNK 131 CONFLICT SEQRES 1 A 134 MET ALA GLU ALA LEU PHE LYS GLU ILE ASP VAL ASN GLY SEQRES 2 A 134 ASP GLY ALA VAL SER TYR GLU GLU VAL LYS ALA PHE VAL SEQRES 3 A 134 SER LYS LYS ARG ALA ILE LYS ASN GLU GLN LEU LEU GLN SEQRES 4 A 134 LEU ILE PHE LYS SER ILE ASP ALA ASP GLY ASN GLY GLU SEQRES 5 A 134 ILE ASP GLN ASN GLU PHE ALA LYS PHE TYR GLY SER ILE SEQRES 6 A 134 GLN GLY GLN ASP LEU SER ASP ASP LYS ILE GLY LEU LYS SEQRES 7 A 134 VAL LEU TYR LYS LEU MET ASP VAL ASP GLY ASP GLY LYS SEQRES 8 A 134 LEU THR LYS GLU GLU VAL THR SER PHE PHE LYS LYS HIS SEQRES 9 A 134 GLY ILE GLU LYS VAL ALA GLU GLN VAL MET LYS ALA ASP SEQRES 10 A 134 ALA ASN GLY ASP GLY TYR ILE THR LEU GLU GLU PHE LEU SEQRES 11 A 134 GLU PHE SER LEU HET CA A 147 1 HET CA A 159 1 HET CA A 171 1 HET CA A 183 1 HETNAM CA CALCIUM ION FORMUL 2 CA 4(CA 2+) HELIX 1 1 MET A 1 ASP A 10 1 10 HELIX 2 2 TYR A 19 LYS A 28 1 10 HELIX 3 3 LYS A 33 ASP A 46 1 14 HELIX 4 4 GLN A 55 SER A 64 1 10 HELIX 5 5 LEU A 70 ASP A 85 1 16 HELIX 6 6 LYS A 94 LYS A 102 1 9 HELIX 7 7 GLU A 107 ASP A 117 1 11 HELIX 8 8 LEU A 126 LEU A 134 1 9 SHEET 1 A 2 ALA A 16 SER A 18 0 SHEET 2 A 2 GLU A 52 ASP A 54 -1 N ILE A 53 O VAL A 17 SHEET 1 B 2 LYS A 91 THR A 93 0 SHEET 2 B 2 TYR A 123 THR A 125 -1 N ILE A 124 O LEU A 92 LINK CA CA A 147 OD2 ASP A 14 1555 1555 3.04 LINK CA CA A 147 OD1 ASP A 10 1555 1555 2.78 LINK CA CA A 147 OD1 ASN A 12 1555 1555 2.80 LINK CA CA A 147 O ALA A 16 1555 1555 2.79 LINK CA CA A 147 OE1 GLU A 21 1555 1555 2.74 LINK CA CA A 147 OE2 GLU A 21 1555 1555 2.78 LINK CA CA A 159 OD2 ASP A 48 1555 1555 3.40 LINK CA CA A 159 ND2 ASN A 50 1555 1555 3.32 LINK CA CA A 159 OD1 ASP A 46 1555 1555 2.69 LINK CA CA A 159 OD1 ASP A 48 1555 1555 3.16 LINK CA CA A 159 O GLU A 52 1555 1555 2.81 LINK CA CA A 159 OE1 GLU A 57 1555 1555 2.77 LINK CA CA A 159 OE2 GLU A 57 1555 1555 2.81 LINK CA CA A 159 OD1 ASN A 50 1555 1555 2.81 LINK CA CA A 171 OE2 GLU A 96 1555 1555 2.80 LINK CA CA A 171 O LYS A 91 1555 1555 2.79 LINK CA CA A 171 OE1 GLU A 96 1555 1555 2.70 LINK CA CA A 183 OD1 ASN A 119 1555 1555 2.67 LINK CA CA A 183 OE1 GLU A 128 1555 1555 2.72 LINK CA CA A 183 OE2 GLU A 128 1555 1555 2.79 LINK CA CA A 183 OD2 ASP A 121 1555 1555 3.15 LINK CA CA A 183 O TYR A 123 1555 1555 2.69 LINK CA CA A 183 OD2 ASP A 117 1555 1555 3.40 SITE *** AC1 5 ASP A 10 ASN A 12 ASP A 14 ALA A 16 SITE *** AC1 5 GLU A 21 SITE *** AC2 6 ASP A 46 ASP A 48 ASN A 50 GLU A 52 SITE *** AC2 6 ILE A 53 GLU A 57 SITE *** AC3 4 ASP A 87 ASP A 89 LYS A 91 GLU A 96 SITE *** AC4 6 ASP A 117 ASN A 119 ASP A 121 TYR A 123 SITE *** AC4 6 ILE A 124 GLU A 128 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 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -111:sc= 1.23 (180deg=-0.622) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= -0.264 X(o=-0.26,f=-0.41) USER MOD Single : A 18 SER OG : rot 180:sc= 0.252 USER MOD Single : A 19 TYR OH : rot 180:sc=-0.000774 USER MOD Single : A 23 LYS NZ :NH3+ 163:sc= -0.0143 (180deg=-0.358) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.0528) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -0.57 X(o=-0.57,f=-0.57) USER MOD Single : A 36 GLN : amide:sc=-0.00198 K(o=-0.002,f=-0.53) USER MOD Single : A 39 GLN : amide:sc= -0.0304 K(o=-0.03,f=0.48) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 160:sc= -2.5! USER MOD Single : A 50 ASN : amide:sc= -3.32! C(o=-3.3!,f=-12!) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 ASN : amide:sc= -0.0227 X(o=-0.023,f=-0.18) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -140:sc= -1.44 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 68 GLN : amide:sc= -0.0502 X(o=-0.05,f=-0.48) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 162:sc= -0.0144 (180deg=-0.228) USER MOD Single : A 78 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00847) USER MOD Single : A 81 TYR OH : rot -177:sc= -0.0731 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.349 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -160:sc= -0.987 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.454 X(o=-0.45,f=-0.24) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 GLN : amide:sc= -0.4 X(o=-0.4,f=-0.0019) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -0.229 X(o=-0.23,f=-0.33) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.331 USER MOD Single : A 133 SER OG : rot -130:sc= -0.239 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA MET A 1 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C MET A 1 3.328 -0.868 -1.131 1.00 0.00 C ATOM 4 O MET A 1 4.435 -0.404 -1.399 1.00 0.00 O ATOM 5 CB MET A 1 2.475 1.433 -1.600 1.00 0.00 C ATOM 6 CG MET A 1 3.179 2.112 -0.424 1.00 0.00 C ATOM 7 SD MET A 1 1.986 2.965 0.593 1.00 0.00 S ATOM 8 CE MET A 1 3.081 3.982 1.569 1.00 0.00 C ATOM 0 H1 MET A 1 0.430 -0.513 -0.133 1.00 0.00 H new ATOM 0 H2 MET A 1 1.885 -0.466 0.742 1.00 0.00 H new ATOM 0 H3 MET A 1 1.123 0.980 0.284 1.00 0.00 H new ATOM 0 HA MET A 1 1.437 -0.413 -2.028 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.134 1.425 -2.468 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.590 2.005 -1.878 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.710 1.369 0.170 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.924 2.817 -0.793 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.495 4.585 2.263 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.766 3.345 2.129 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.651 4.638 0.911 1.00 0.00 H new ATOM 18 N ALA A 2 3.113 -2.114 -0.734 1.00 0.00 N ATOM 19 CA ALA A 2 4.212 -3.051 -0.581 1.00 0.00 C ATOM 20 C ALA A 2 4.758 -3.420 -1.962 1.00 0.00 C ATOM 21 O ALA A 2 5.947 -3.251 -2.229 1.00 0.00 O ATOM 22 CB ALA A 2 3.735 -4.275 0.203 1.00 0.00 C ATOM 0 H ALA A 2 2.193 -2.496 -0.514 1.00 0.00 H new ATOM 0 HA ALA A 2 5.026 -2.598 -0.015 1.00 0.00 H new ATOM 0 HB1 ALA A 2 4.560 -4.978 0.318 1.00 0.00 H new ATOM 0 HB2 ALA A 2 3.385 -3.963 1.187 1.00 0.00 H new ATOM 0 HB3 ALA A 2 2.920 -4.757 -0.336 1.00 0.00 H new ATOM 28 N GLU A 3 3.863 -3.917 -2.803 1.00 0.00 N ATOM 29 CA GLU A 3 4.240 -4.311 -4.150 1.00 0.00 C ATOM 30 C GLU A 3 4.710 -3.093 -4.948 1.00 0.00 C ATOM 31 O GLU A 3 5.740 -3.145 -5.617 1.00 0.00 O ATOM 32 CB GLU A 3 3.082 -5.018 -4.858 1.00 0.00 C ATOM 33 CG GLU A 3 3.229 -6.538 -4.766 1.00 0.00 C ATOM 34 CD GLU A 3 2.743 -7.055 -3.411 1.00 0.00 C ATOM 35 OE1 GLU A 3 3.425 -6.750 -2.409 1.00 0.00 O ATOM 36 OE2 GLU A 3 1.699 -7.743 -3.407 1.00 0.00 O ATOM 0 H GLU A 3 2.878 -4.056 -2.578 1.00 0.00 H new ATOM 0 HA GLU A 3 5.067 -5.017 -4.083 1.00 0.00 H new ATOM 0 HB2 GLU A 3 2.136 -4.713 -4.410 1.00 0.00 H new ATOM 0 HB3 GLU A 3 3.051 -4.715 -5.905 1.00 0.00 H new ATOM 0 HG2 GLU A 3 2.659 -7.011 -5.565 1.00 0.00 H new ATOM 0 HG3 GLU A 3 4.273 -6.815 -4.912 1.00 0.00 H new ATOM 43 N ALA A 4 3.931 -2.026 -4.850 1.00 0.00 N ATOM 44 CA ALA A 4 4.254 -0.797 -5.555 1.00 0.00 C ATOM 45 C ALA A 4 5.717 -0.434 -5.293 1.00 0.00 C ATOM 46 O ALA A 4 6.373 0.168 -6.142 1.00 0.00 O ATOM 47 CB ALA A 4 3.292 0.310 -5.119 1.00 0.00 C ATOM 0 H ALA A 4 3.077 -1.987 -4.293 1.00 0.00 H new ATOM 0 HA ALA A 4 4.134 -0.928 -6.630 1.00 0.00 H new ATOM 0 HB1 ALA A 4 3.534 1.232 -5.648 1.00 0.00 H new ATOM 0 HB2 ALA A 4 2.269 0.016 -5.353 1.00 0.00 H new ATOM 0 HB3 ALA A 4 3.387 0.472 -4.045 1.00 0.00 H new ATOM 53 N LEU A 5 6.187 -0.816 -4.114 1.00 0.00 N ATOM 54 CA LEU A 5 7.560 -0.539 -3.730 1.00 0.00 C ATOM 55 C LEU A 5 8.498 -1.478 -4.491 1.00 0.00 C ATOM 56 O LEU A 5 9.494 -1.038 -5.064 1.00 0.00 O ATOM 57 CB LEU A 5 7.717 -0.612 -2.210 1.00 0.00 C ATOM 58 CG LEU A 5 7.831 0.729 -1.482 1.00 0.00 C ATOM 59 CD1 LEU A 5 6.478 1.441 -1.431 1.00 0.00 C ATOM 60 CD2 LEU A 5 8.435 0.547 -0.089 1.00 0.00 C ATOM 0 H LEU A 5 5.641 -1.315 -3.412 1.00 0.00 H new ATOM 0 HA LEU A 5 7.834 0.479 -4.007 1.00 0.00 H new ATOM 0 HB2 LEU A 5 6.863 -1.153 -1.802 1.00 0.00 H new ATOM 0 HB3 LEU A 5 8.605 -1.202 -1.984 1.00 0.00 H new ATOM 0 HG LEU A 5 8.511 1.368 -2.046 1.00 0.00 H new ATOM 0 HD11 LEU A 5 6.586 2.391 -0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 5 6.124 1.623 -2.446 1.00 0.00 H new ATOM 0 HD13 LEU A 5 5.758 0.816 -0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 5 8.505 1.515 0.407 1.00 0.00 H new ATOM 0 HD22 LEU A 5 7.801 -0.117 0.499 1.00 0.00 H new ATOM 0 HD23 LEU A 5 9.431 0.112 -0.178 1.00 0.00 H new ATOM 72 N PHE A 6 8.146 -2.756 -4.473 1.00 0.00 N ATOM 73 CA PHE A 6 8.944 -3.761 -5.154 1.00 0.00 C ATOM 74 C PHE A 6 9.099 -3.425 -6.638 1.00 0.00 C ATOM 75 O PHE A 6 10.201 -3.492 -7.181 1.00 0.00 O ATOM 76 CB PHE A 6 8.198 -5.090 -5.019 1.00 0.00 C ATOM 77 CG PHE A 6 8.466 -6.073 -6.161 1.00 0.00 C ATOM 78 CD1 PHE A 6 7.721 -6.014 -7.298 1.00 0.00 C ATOM 79 CD2 PHE A 6 9.449 -7.005 -6.040 1.00 0.00 C ATOM 80 CE1 PHE A 6 7.970 -6.925 -8.358 1.00 0.00 C ATOM 81 CE2 PHE A 6 9.698 -7.916 -7.100 1.00 0.00 C ATOM 82 CZ PHE A 6 8.953 -7.857 -8.236 1.00 0.00 C ATOM 0 H PHE A 6 7.319 -3.118 -3.998 1.00 0.00 H new ATOM 0 HA PHE A 6 9.940 -3.807 -4.714 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.480 -5.559 -4.076 1.00 0.00 H new ATOM 0 HB3 PHE A 6 7.128 -4.891 -4.969 1.00 0.00 H new ATOM 0 HD1 PHE A 6 6.940 -5.274 -7.394 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.040 -7.052 -5.137 1.00 0.00 H new ATOM 0 HE1 PHE A 6 7.379 -6.878 -9.261 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.479 -8.656 -7.004 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.142 -8.551 -9.042 1.00 0.00 H new ATOM 92 N LYS A 7 7.980 -3.071 -7.252 1.00 0.00 N ATOM 93 CA LYS A 7 7.978 -2.725 -8.663 1.00 0.00 C ATOM 94 C LYS A 7 8.676 -1.376 -8.854 1.00 0.00 C ATOM 95 O LYS A 7 9.418 -1.188 -9.816 1.00 0.00 O ATOM 96 CB LYS A 7 6.554 -2.764 -9.223 1.00 0.00 C ATOM 97 CG LYS A 7 5.666 -1.725 -8.535 1.00 0.00 C ATOM 98 CD LYS A 7 5.567 -0.449 -9.372 1.00 0.00 C ATOM 99 CE LYS A 7 4.376 0.405 -8.933 1.00 0.00 C ATOM 100 NZ LYS A 7 4.344 1.678 -9.686 1.00 0.00 N ATOM 0 H LYS A 7 7.068 -3.016 -6.798 1.00 0.00 H new ATOM 0 HA LYS A 7 8.542 -3.461 -9.236 1.00 0.00 H new ATOM 0 HB2 LYS A 7 6.576 -2.575 -10.296 1.00 0.00 H new ATOM 0 HB3 LYS A 7 6.131 -3.759 -9.083 1.00 0.00 H new ATOM 0 HG2 LYS A 7 4.670 -2.139 -8.378 1.00 0.00 H new ATOM 0 HG3 LYS A 7 6.072 -1.489 -7.551 1.00 0.00 H new ATOM 0 HD2 LYS A 7 6.487 0.127 -9.274 1.00 0.00 H new ATOM 0 HD3 LYS A 7 5.464 -0.708 -10.426 1.00 0.00 H new ATOM 0 HE2 LYS A 7 3.448 -0.144 -9.096 1.00 0.00 H new ATOM 0 HE3 LYS A 7 4.442 0.610 -7.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 3.529 2.245 -9.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 5.222 2.208 -9.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 4.259 1.478 -10.703 1.00 0.00 H new ATOM 114 N GLU A 8 8.413 -0.473 -7.921 1.00 0.00 N ATOM 115 CA GLU A 8 9.006 0.852 -7.974 1.00 0.00 C ATOM 116 C GLU A 8 10.531 0.748 -8.052 1.00 0.00 C ATOM 117 O GLU A 8 11.143 1.247 -8.995 1.00 0.00 O ATOM 118 CB GLU A 8 8.575 1.695 -6.772 1.00 0.00 C ATOM 119 CG GLU A 8 9.500 2.900 -6.587 1.00 0.00 C ATOM 120 CD GLU A 8 8.823 3.987 -5.751 1.00 0.00 C ATOM 121 OE1 GLU A 8 8.014 4.736 -6.340 1.00 0.00 O ATOM 122 OE2 GLU A 8 9.129 4.045 -4.540 1.00 0.00 O ATOM 0 H GLU A 8 7.797 -0.633 -7.124 1.00 0.00 H new ATOM 0 HA GLU A 8 8.648 1.353 -8.874 1.00 0.00 H new ATOM 0 HB2 GLU A 8 7.550 2.037 -6.912 1.00 0.00 H new ATOM 0 HB3 GLU A 8 8.586 1.082 -5.871 1.00 0.00 H new ATOM 0 HG2 GLU A 8 10.423 2.584 -6.100 1.00 0.00 H new ATOM 0 HG3 GLU A 8 9.776 3.304 -7.561 1.00 0.00 H new ATOM 129 N ILE A 9 11.100 0.097 -7.048 1.00 0.00 N ATOM 130 CA ILE A 9 12.541 -0.079 -6.992 1.00 0.00 C ATOM 131 C ILE A 9 13.032 -0.659 -8.320 1.00 0.00 C ATOM 132 O ILE A 9 14.110 -0.304 -8.795 1.00 0.00 O ATOM 133 CB ILE A 9 12.931 -0.918 -5.773 1.00 0.00 C ATOM 134 CG1 ILE A 9 14.167 -0.340 -5.082 1.00 0.00 C ATOM 135 CG2 ILE A 9 13.123 -2.387 -6.157 1.00 0.00 C ATOM 136 CD1 ILE A 9 15.311 -0.144 -6.078 1.00 0.00 C ATOM 0 H ILE A 9 10.589 -0.315 -6.267 1.00 0.00 H new ATOM 0 HA ILE A 9 13.037 0.883 -6.861 1.00 0.00 H new ATOM 0 HB ILE A 9 12.112 -0.877 -5.055 1.00 0.00 H new ATOM 0 HG12 ILE A 9 13.916 0.614 -4.619 1.00 0.00 H new ATOM 0 HG13 ILE A 9 14.487 -1.008 -4.282 1.00 0.00 H new ATOM 0 HG21 ILE A 9 13.400 -2.961 -5.273 1.00 0.00 H new ATOM 0 HG22 ILE A 9 12.193 -2.780 -6.569 1.00 0.00 H new ATOM 0 HG23 ILE A 9 13.913 -2.468 -6.904 1.00 0.00 H new ATOM 0 HD11 ILE A 9 16.177 0.268 -5.561 1.00 0.00 H new ATOM 0 HD12 ILE A 9 15.576 -1.104 -6.521 1.00 0.00 H new ATOM 0 HD13 ILE A 9 14.996 0.544 -6.863 1.00 0.00 H new ATOM 148 N ASP A 10 12.219 -1.541 -8.881 1.00 0.00 N ATOM 149 CA ASP A 10 12.557 -2.173 -10.145 1.00 0.00 C ATOM 150 C ASP A 10 12.399 -1.157 -11.277 1.00 0.00 C ATOM 151 O ASP A 10 11.449 -1.233 -12.056 1.00 0.00 O ATOM 152 CB ASP A 10 11.629 -3.354 -10.436 1.00 0.00 C ATOM 153 CG ASP A 10 11.740 -3.931 -11.849 1.00 0.00 C ATOM 154 OD1 ASP A 10 12.621 -3.447 -12.591 1.00 0.00 O ATOM 155 OD2 ASP A 10 10.941 -4.843 -12.154 1.00 0.00 O ATOM 0 H ASP A 10 11.326 -1.833 -8.483 1.00 0.00 H new ATOM 0 HA ASP A 10 13.585 -2.530 -10.079 1.00 0.00 H new ATOM 0 HB2 ASP A 10 11.839 -4.147 -9.718 1.00 0.00 H new ATOM 0 HB3 ASP A 10 10.599 -3.037 -10.269 1.00 0.00 H new ATOM 160 N VAL A 11 13.343 -0.229 -11.333 1.00 0.00 N ATOM 161 CA VAL A 11 13.320 0.801 -12.357 1.00 0.00 C ATOM 162 C VAL A 11 13.134 0.148 -13.728 1.00 0.00 C ATOM 163 O VAL A 11 12.421 0.676 -14.580 1.00 0.00 O ATOM 164 CB VAL A 11 14.586 1.656 -12.269 1.00 0.00 C ATOM 165 CG1 VAL A 11 14.718 2.568 -13.489 1.00 0.00 C ATOM 166 CG2 VAL A 11 14.611 2.467 -10.972 1.00 0.00 C ATOM 0 H VAL A 11 14.129 -0.169 -10.685 1.00 0.00 H new ATOM 0 HA VAL A 11 12.478 1.475 -12.201 1.00 0.00 H new ATOM 0 HB VAL A 11 15.444 0.984 -12.260 1.00 0.00 H new ATOM 0 HG11 VAL A 11 15.626 3.164 -13.401 1.00 0.00 H new ATOM 0 HG12 VAL A 11 14.769 1.961 -14.393 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.853 3.229 -13.544 1.00 0.00 H new ATOM 0 HG21 VAL A 11 15.521 3.066 -10.935 1.00 0.00 H new ATOM 0 HG22 VAL A 11 13.742 3.125 -10.937 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.587 1.789 -10.119 1.00 0.00 H new ATOM 176 N ASN A 12 13.788 -0.992 -13.898 1.00 0.00 N ATOM 177 CA ASN A 12 13.704 -1.723 -15.151 1.00 0.00 C ATOM 178 C ASN A 12 12.233 -1.920 -15.524 1.00 0.00 C ATOM 179 O ASN A 12 11.872 -1.847 -16.697 1.00 0.00 O ATOM 180 CB ASN A 12 14.349 -3.105 -15.026 1.00 0.00 C ATOM 181 CG ASN A 12 15.686 -3.022 -14.287 1.00 0.00 C ATOM 182 OD1 ASN A 12 15.859 -3.553 -13.203 1.00 0.00 O ATOM 183 ND2 ASN A 12 16.618 -2.326 -14.932 1.00 0.00 N ATOM 0 H ASN A 12 14.378 -1.427 -13.189 1.00 0.00 H new ATOM 0 HA ASN A 12 14.229 -1.147 -15.913 1.00 0.00 H new ATOM 0 HB2 ASN A 12 13.676 -3.777 -14.493 1.00 0.00 H new ATOM 0 HB3 ASN A 12 14.504 -3.529 -16.018 1.00 0.00 H new ATOM 0 HD21 ASN A 12 17.544 -2.211 -14.521 1.00 0.00 H new ATOM 0 HD22 ASN A 12 16.406 -1.907 -15.838 1.00 0.00 H new ATOM 190 N GLY A 13 11.425 -2.165 -14.503 1.00 0.00 N ATOM 191 CA GLY A 13 10.001 -2.372 -14.709 1.00 0.00 C ATOM 192 C GLY A 13 9.740 -3.686 -15.449 1.00 0.00 C ATOM 193 O GLY A 13 9.189 -3.685 -16.548 1.00 0.00 O ATOM 0 H GLY A 13 11.729 -2.225 -13.531 1.00 0.00 H new ATOM 0 HA2 GLY A 13 9.489 -2.384 -13.747 1.00 0.00 H new ATOM 0 HA3 GLY A 13 9.588 -1.541 -15.280 1.00 0.00 H new ATOM 197 N ASP A 14 10.149 -4.776 -14.815 1.00 0.00 N ATOM 198 CA ASP A 14 9.966 -6.094 -15.399 1.00 0.00 C ATOM 199 C ASP A 14 9.014 -6.908 -14.520 1.00 0.00 C ATOM 200 O ASP A 14 8.137 -7.605 -15.029 1.00 0.00 O ATOM 201 CB ASP A 14 11.294 -6.848 -15.483 1.00 0.00 C ATOM 202 CG ASP A 14 12.189 -6.720 -14.249 1.00 0.00 C ATOM 203 OD1 ASP A 14 11.861 -7.379 -13.238 1.00 0.00 O ATOM 204 OD2 ASP A 14 13.182 -5.967 -14.344 1.00 0.00 O ATOM 0 H ASP A 14 10.606 -4.773 -13.903 1.00 0.00 H new ATOM 0 HA ASP A 14 9.561 -5.966 -16.403 1.00 0.00 H new ATOM 0 HB2 ASP A 14 11.085 -7.904 -15.654 1.00 0.00 H new ATOM 0 HB3 ASP A 14 11.845 -6.488 -16.352 1.00 0.00 H new ATOM 209 N GLY A 15 9.219 -6.794 -13.217 1.00 0.00 N ATOM 210 CA GLY A 15 8.391 -7.511 -12.263 1.00 0.00 C ATOM 211 C GLY A 15 9.215 -8.537 -11.482 1.00 0.00 C ATOM 212 O GLY A 15 8.729 -9.623 -11.171 1.00 0.00 O ATOM 0 H GLY A 15 9.947 -6.215 -12.799 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.933 -6.804 -11.571 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.579 -8.015 -12.788 1.00 0.00 H new ATOM 216 N ALA A 16 10.450 -8.155 -11.188 1.00 0.00 N ATOM 217 CA ALA A 16 11.346 -9.028 -10.449 1.00 0.00 C ATOM 218 C ALA A 16 12.419 -8.183 -9.758 1.00 0.00 C ATOM 219 O ALA A 16 12.739 -7.087 -10.214 1.00 0.00 O ATOM 220 CB ALA A 16 11.945 -10.067 -11.399 1.00 0.00 C ATOM 0 H ALA A 16 10.850 -7.254 -11.448 1.00 0.00 H new ATOM 0 HA ALA A 16 10.803 -9.569 -9.675 1.00 0.00 H new ATOM 0 HB1 ALA A 16 12.617 -10.722 -10.845 1.00 0.00 H new ATOM 0 HB2 ALA A 16 11.144 -10.659 -11.842 1.00 0.00 H new ATOM 0 HB3 ALA A 16 12.501 -9.561 -12.188 1.00 0.00 H new ATOM 226 N VAL A 17 12.944 -8.727 -8.670 1.00 0.00 N ATOM 227 CA VAL A 17 13.974 -8.037 -7.912 1.00 0.00 C ATOM 228 C VAL A 17 15.240 -8.895 -7.881 1.00 0.00 C ATOM 229 O VAL A 17 15.194 -10.087 -8.183 1.00 0.00 O ATOM 230 CB VAL A 17 13.452 -7.690 -6.516 1.00 0.00 C ATOM 231 CG1 VAL A 17 14.605 -7.540 -5.521 1.00 0.00 C ATOM 232 CG2 VAL A 17 12.590 -6.426 -6.551 1.00 0.00 C ATOM 0 H VAL A 17 12.676 -9.637 -8.295 1.00 0.00 H new ATOM 0 HA VAL A 17 14.233 -7.093 -8.391 1.00 0.00 H new ATOM 0 HB VAL A 17 12.824 -8.515 -6.179 1.00 0.00 H new ATOM 0 HG11 VAL A 17 14.207 -7.293 -4.537 1.00 0.00 H new ATOM 0 HG12 VAL A 17 15.160 -8.476 -5.464 1.00 0.00 H new ATOM 0 HG13 VAL A 17 15.271 -6.743 -5.853 1.00 0.00 H new ATOM 0 HG21 VAL A 17 12.232 -6.202 -5.546 1.00 0.00 H new ATOM 0 HG22 VAL A 17 13.185 -5.590 -6.919 1.00 0.00 H new ATOM 0 HG23 VAL A 17 11.738 -6.585 -7.213 1.00 0.00 H new ATOM 242 N SER A 18 16.341 -8.256 -7.512 1.00 0.00 N ATOM 243 CA SER A 18 17.617 -8.947 -7.438 1.00 0.00 C ATOM 244 C SER A 18 18.254 -8.723 -6.065 1.00 0.00 C ATOM 245 O SER A 18 17.662 -8.080 -5.199 1.00 0.00 O ATOM 246 CB SER A 18 18.563 -8.476 -8.544 1.00 0.00 C ATOM 247 OG SER A 18 19.159 -7.218 -8.238 1.00 0.00 O ATOM 0 H SER A 18 16.376 -7.268 -7.261 1.00 0.00 H new ATOM 0 HA SER A 18 17.438 -10.013 -7.579 1.00 0.00 H new ATOM 0 HB2 SER A 18 19.345 -9.221 -8.694 1.00 0.00 H new ATOM 0 HB3 SER A 18 18.013 -8.398 -9.482 1.00 0.00 H new ATOM 0 HG SER A 18 19.757 -6.953 -8.968 1.00 0.00 H new ATOM 253 N TYR A 19 19.451 -9.267 -5.907 1.00 0.00 N ATOM 254 CA TYR A 19 20.175 -9.136 -4.654 1.00 0.00 C ATOM 255 C TYR A 19 20.605 -7.686 -4.419 1.00 0.00 C ATOM 256 O TYR A 19 20.572 -7.200 -3.290 1.00 0.00 O ATOM 257 CB TYR A 19 21.423 -10.010 -4.793 1.00 0.00 C ATOM 258 CG TYR A 19 22.467 -9.781 -3.699 1.00 0.00 C ATOM 259 CD1 TYR A 19 22.139 -9.997 -2.376 1.00 0.00 C ATOM 260 CD2 TYR A 19 23.738 -9.360 -4.035 1.00 0.00 C ATOM 261 CE1 TYR A 19 23.123 -9.782 -1.346 1.00 0.00 C ATOM 262 CE2 TYR A 19 24.721 -9.145 -3.005 1.00 0.00 C ATOM 263 CZ TYR A 19 24.365 -9.367 -1.712 1.00 0.00 C ATOM 264 OH TYR A 19 25.294 -9.164 -0.739 1.00 0.00 O ATOM 0 H TYR A 19 19.939 -9.800 -6.627 1.00 0.00 H new ATOM 0 HA TYR A 19 19.547 -9.436 -3.815 1.00 0.00 H new ATOM 0 HB2 TYR A 19 21.123 -11.058 -4.782 1.00 0.00 H new ATOM 0 HB3 TYR A 19 21.881 -9.820 -5.764 1.00 0.00 H new ATOM 0 HD1 TYR A 19 21.145 -10.327 -2.113 1.00 0.00 H new ATOM 0 HD2 TYR A 19 23.995 -9.192 -5.070 1.00 0.00 H new ATOM 0 HE1 TYR A 19 22.880 -9.947 -0.307 1.00 0.00 H new ATOM 0 HE2 TYR A 19 25.719 -8.815 -3.254 1.00 0.00 H new ATOM 0 HH TYR A 19 26.135 -8.870 -1.146 1.00 0.00 H new ATOM 274 N GLU A 20 20.999 -7.036 -5.504 1.00 0.00 N ATOM 275 CA GLU A 20 21.436 -5.652 -5.431 1.00 0.00 C ATOM 276 C GLU A 20 20.231 -4.725 -5.258 1.00 0.00 C ATOM 277 O GLU A 20 20.279 -3.779 -4.473 1.00 0.00 O ATOM 278 CB GLU A 20 22.251 -5.268 -6.667 1.00 0.00 C ATOM 279 CG GLU A 20 23.413 -4.345 -6.293 1.00 0.00 C ATOM 280 CD GLU A 20 24.240 -3.977 -7.526 1.00 0.00 C ATOM 281 OE1 GLU A 20 25.042 -4.838 -7.949 1.00 0.00 O ATOM 282 OE2 GLU A 20 24.053 -2.844 -8.017 1.00 0.00 O ATOM 0 H GLU A 20 21.025 -7.442 -6.439 1.00 0.00 H new ATOM 0 HA GLU A 20 22.084 -5.541 -4.562 1.00 0.00 H new ATOM 0 HB2 GLU A 20 22.636 -6.168 -7.147 1.00 0.00 H new ATOM 0 HB3 GLU A 20 21.606 -4.771 -7.392 1.00 0.00 H new ATOM 0 HG2 GLU A 20 23.027 -3.439 -5.826 1.00 0.00 H new ATOM 0 HG3 GLU A 20 24.050 -4.836 -5.557 1.00 0.00 H new ATOM 289 N GLU A 21 19.180 -5.027 -6.006 1.00 0.00 N ATOM 290 CA GLU A 21 17.965 -4.232 -5.945 1.00 0.00 C ATOM 291 C GLU A 21 17.362 -4.290 -4.540 1.00 0.00 C ATOM 292 O GLU A 21 16.946 -3.268 -3.997 1.00 0.00 O ATOM 293 CB GLU A 21 16.954 -4.694 -6.996 1.00 0.00 C ATOM 294 CG GLU A 21 16.722 -3.609 -8.049 1.00 0.00 C ATOM 295 CD GLU A 21 15.862 -4.137 -9.200 1.00 0.00 C ATOM 296 OE1 GLU A 21 15.436 -5.308 -9.099 1.00 0.00 O ATOM 297 OE2 GLU A 21 15.650 -3.357 -10.153 1.00 0.00 O ATOM 0 H GLU A 21 19.145 -5.811 -6.657 1.00 0.00 H new ATOM 0 HA GLU A 21 18.221 -3.196 -6.166 1.00 0.00 H new ATOM 0 HB2 GLU A 21 17.315 -5.602 -7.478 1.00 0.00 H new ATOM 0 HB3 GLU A 21 16.010 -4.944 -6.512 1.00 0.00 H new ATOM 0 HG2 GLU A 21 16.233 -2.750 -7.590 1.00 0.00 H new ATOM 0 HG3 GLU A 21 17.680 -3.262 -8.436 1.00 0.00 H new ATOM 304 N VAL A 22 17.334 -5.496 -3.993 1.00 0.00 N ATOM 305 CA VAL A 22 16.788 -5.701 -2.662 1.00 0.00 C ATOM 306 C VAL A 22 17.695 -5.021 -1.634 1.00 0.00 C ATOM 307 O VAL A 22 17.211 -4.387 -0.697 1.00 0.00 O ATOM 308 CB VAL A 22 16.601 -7.196 -2.397 1.00 0.00 C ATOM 309 CG1 VAL A 22 17.951 -7.897 -2.231 1.00 0.00 C ATOM 310 CG2 VAL A 22 15.707 -7.430 -1.178 1.00 0.00 C ATOM 0 H VAL A 22 17.680 -6.341 -4.447 1.00 0.00 H new ATOM 0 HA VAL A 22 15.802 -5.244 -2.579 1.00 0.00 H new ATOM 0 HB VAL A 22 16.103 -7.630 -3.264 1.00 0.00 H new ATOM 0 HG11 VAL A 22 17.789 -8.959 -2.044 1.00 0.00 H new ATOM 0 HG12 VAL A 22 18.539 -7.775 -3.141 1.00 0.00 H new ATOM 0 HG13 VAL A 22 18.488 -7.458 -1.390 1.00 0.00 H new ATOM 0 HG21 VAL A 22 15.591 -8.501 -1.012 1.00 0.00 H new ATOM 0 HG22 VAL A 22 16.163 -6.974 -0.299 1.00 0.00 H new ATOM 0 HG23 VAL A 22 14.729 -6.982 -1.353 1.00 0.00 H new ATOM 320 N LYS A 23 18.994 -5.177 -1.843 1.00 0.00 N ATOM 321 CA LYS A 23 19.972 -4.586 -0.946 1.00 0.00 C ATOM 322 C LYS A 23 19.723 -3.080 -0.847 1.00 0.00 C ATOM 323 O LYS A 23 19.768 -2.509 0.242 1.00 0.00 O ATOM 324 CB LYS A 23 21.392 -4.947 -1.388 1.00 0.00 C ATOM 325 CG LYS A 23 21.857 -6.248 -0.732 1.00 0.00 C ATOM 326 CD LYS A 23 23.384 -6.311 -0.660 1.00 0.00 C ATOM 327 CE LYS A 23 24.004 -6.187 -2.053 1.00 0.00 C ATOM 328 NZ LYS A 23 24.512 -4.815 -2.274 1.00 0.00 N ATOM 0 H LYS A 23 19.392 -5.704 -2.620 1.00 0.00 H new ATOM 0 HA LYS A 23 19.862 -4.994 0.059 1.00 0.00 H new ATOM 0 HB2 LYS A 23 21.424 -5.051 -2.473 1.00 0.00 H new ATOM 0 HB3 LYS A 23 22.075 -4.139 -1.125 1.00 0.00 H new ATOM 0 HG2 LYS A 23 21.439 -6.323 0.272 1.00 0.00 H new ATOM 0 HG3 LYS A 23 21.481 -7.100 -1.299 1.00 0.00 H new ATOM 0 HD2 LYS A 23 23.755 -5.510 -0.020 1.00 0.00 H new ATOM 0 HD3 LYS A 23 23.692 -7.252 -0.204 1.00 0.00 H new ATOM 0 HE2 LYS A 23 24.818 -6.904 -2.160 1.00 0.00 H new ATOM 0 HE3 LYS A 23 23.261 -6.432 -2.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 25.171 -4.814 -3.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 23.715 -4.179 -2.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 25.007 -4.486 -1.420 1.00 0.00 H new ATOM 342 N ALA A 24 19.466 -2.478 -1.999 1.00 0.00 N ATOM 343 CA ALA A 24 19.209 -1.049 -2.056 1.00 0.00 C ATOM 344 C ALA A 24 17.877 -0.746 -1.367 1.00 0.00 C ATOM 345 O ALA A 24 17.767 0.224 -0.620 1.00 0.00 O ATOM 346 CB ALA A 24 19.231 -0.584 -3.514 1.00 0.00 C ATOM 0 H ALA A 24 19.430 -2.954 -2.900 1.00 0.00 H new ATOM 0 HA ALA A 24 19.986 -0.498 -1.526 1.00 0.00 H new ATOM 0 HB1 ALA A 24 19.038 0.488 -3.557 1.00 0.00 H new ATOM 0 HB2 ALA A 24 20.208 -0.795 -3.948 1.00 0.00 H new ATOM 0 HB3 ALA A 24 18.462 -1.114 -4.076 1.00 0.00 H new ATOM 352 N PHE A 25 16.898 -1.595 -1.644 1.00 0.00 N ATOM 353 CA PHE A 25 15.578 -1.431 -1.060 1.00 0.00 C ATOM 354 C PHE A 25 15.664 -1.288 0.461 1.00 0.00 C ATOM 355 O PHE A 25 15.250 -0.273 1.018 1.00 0.00 O ATOM 356 CB PHE A 25 14.779 -2.691 -1.398 1.00 0.00 C ATOM 357 CG PHE A 25 13.276 -2.562 -1.143 1.00 0.00 C ATOM 358 CD1 PHE A 25 12.772 -2.822 0.093 1.00 0.00 C ATOM 359 CD2 PHE A 25 12.444 -2.189 -2.152 1.00 0.00 C ATOM 360 CE1 PHE A 25 11.377 -2.702 0.330 1.00 0.00 C ATOM 361 CE2 PHE A 25 11.049 -2.069 -1.915 1.00 0.00 C ATOM 362 CZ PHE A 25 10.545 -2.329 -0.679 1.00 0.00 C ATOM 0 H PHE A 25 16.993 -2.398 -2.265 1.00 0.00 H new ATOM 0 HA PHE A 25 15.106 -0.532 -1.456 1.00 0.00 H new ATOM 0 HB2 PHE A 25 14.939 -2.940 -2.447 1.00 0.00 H new ATOM 0 HB3 PHE A 25 15.167 -3.523 -0.810 1.00 0.00 H new ATOM 0 HD1 PHE A 25 13.432 -3.120 0.894 1.00 0.00 H new ATOM 0 HD2 PHE A 25 12.844 -1.984 -3.134 1.00 0.00 H new ATOM 0 HE1 PHE A 25 10.977 -2.907 1.312 1.00 0.00 H new ATOM 0 HE2 PHE A 25 10.389 -1.771 -2.716 1.00 0.00 H new ATOM 0 HZ PHE A 25 9.484 -2.239 -0.499 1.00 0.00 H new ATOM 372 N VAL A 26 16.206 -2.321 1.090 1.00 0.00 N ATOM 373 CA VAL A 26 16.352 -2.324 2.535 1.00 0.00 C ATOM 374 C VAL A 26 17.288 -1.187 2.951 1.00 0.00 C ATOM 375 O VAL A 26 17.037 -0.503 3.942 1.00 0.00 O ATOM 376 CB VAL A 26 16.832 -3.698 3.010 1.00 0.00 C ATOM 377 CG1 VAL A 26 18.356 -3.806 2.921 1.00 0.00 C ATOM 378 CG2 VAL A 26 16.343 -3.989 4.430 1.00 0.00 C ATOM 0 H VAL A 26 16.549 -3.161 0.625 1.00 0.00 H new ATOM 0 HA VAL A 26 15.390 -2.146 3.016 1.00 0.00 H new ATOM 0 HB VAL A 26 16.403 -4.451 2.348 1.00 0.00 H new ATOM 0 HG11 VAL A 26 18.672 -4.791 3.264 1.00 0.00 H new ATOM 0 HG12 VAL A 26 18.671 -3.664 1.887 1.00 0.00 H new ATOM 0 HG13 VAL A 26 18.812 -3.040 3.548 1.00 0.00 H new ATOM 0 HG21 VAL A 26 16.698 -4.971 4.743 1.00 0.00 H new ATOM 0 HG22 VAL A 26 16.729 -3.230 5.110 1.00 0.00 H new ATOM 0 HG23 VAL A 26 15.253 -3.974 4.450 1.00 0.00 H new ATOM 388 N SER A 27 18.347 -1.021 2.173 1.00 0.00 N ATOM 389 CA SER A 27 19.322 0.021 2.449 1.00 0.00 C ATOM 390 C SER A 27 18.611 1.359 2.659 1.00 0.00 C ATOM 391 O SER A 27 18.971 2.124 3.553 1.00 0.00 O ATOM 392 CB SER A 27 20.342 0.134 1.314 1.00 0.00 C ATOM 393 OG SER A 27 21.305 1.155 1.563 1.00 0.00 O ATOM 0 H SER A 27 18.552 -1.590 1.352 1.00 0.00 H new ATOM 0 HA SER A 27 19.860 -0.244 3.359 1.00 0.00 H new ATOM 0 HB2 SER A 27 20.851 -0.822 1.187 1.00 0.00 H new ATOM 0 HB3 SER A 27 19.823 0.345 0.379 1.00 0.00 H new ATOM 0 HG SER A 27 21.939 1.195 0.817 1.00 0.00 H new ATOM 399 N LYS A 28 17.615 1.602 1.820 1.00 0.00 N ATOM 400 CA LYS A 28 16.850 2.835 1.903 1.00 0.00 C ATOM 401 C LYS A 28 16.434 3.076 3.355 1.00 0.00 C ATOM 402 O LYS A 28 16.290 4.221 3.782 1.00 0.00 O ATOM 403 CB LYS A 28 15.675 2.804 0.924 1.00 0.00 C ATOM 404 CG LYS A 28 15.792 3.926 -0.110 1.00 0.00 C ATOM 405 CD LYS A 28 14.798 3.722 -1.255 1.00 0.00 C ATOM 406 CE LYS A 28 13.832 4.904 -1.360 1.00 0.00 C ATOM 407 NZ LYS A 28 12.893 4.708 -2.487 1.00 0.00 N ATOM 0 H LYS A 28 17.320 0.966 1.079 1.00 0.00 H new ATOM 0 HA LYS A 28 17.464 3.684 1.602 1.00 0.00 H new ATOM 0 HB2 LYS A 28 15.645 1.839 0.417 1.00 0.00 H new ATOM 0 HB3 LYS A 28 14.738 2.906 1.472 1.00 0.00 H new ATOM 0 HG2 LYS A 28 15.608 4.888 0.369 1.00 0.00 H new ATOM 0 HG3 LYS A 28 16.807 3.956 -0.506 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.339 3.605 -2.194 1.00 0.00 H new ATOM 0 HD3 LYS A 28 14.236 2.802 -1.094 1.00 0.00 H new ATOM 0 HE2 LYS A 28 13.275 5.010 -0.429 1.00 0.00 H new ATOM 0 HE3 LYS A 28 14.393 5.828 -1.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 12.245 5.519 -2.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 13.428 4.630 -3.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 12.345 3.837 -2.335 1.00 0.00 H new ATOM 421 N LYS A 29 16.253 1.978 4.075 1.00 0.00 N ATOM 422 CA LYS A 29 15.857 2.056 5.471 1.00 0.00 C ATOM 423 C LYS A 29 17.077 2.409 6.324 1.00 0.00 C ATOM 424 O LYS A 29 17.254 3.562 6.713 1.00 0.00 O ATOM 425 CB LYS A 29 15.158 0.765 5.902 1.00 0.00 C ATOM 426 CG LYS A 29 13.873 1.068 6.674 1.00 0.00 C ATOM 427 CD LYS A 29 12.683 0.316 6.076 1.00 0.00 C ATOM 428 CE LYS A 29 11.969 -0.518 7.142 1.00 0.00 C ATOM 429 NZ LYS A 29 12.823 -1.646 7.576 1.00 0.00 N ATOM 0 H LYS A 29 16.373 1.030 3.718 1.00 0.00 H new ATOM 0 HA LYS A 29 15.126 2.851 5.616 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.925 0.163 5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.830 0.174 6.525 1.00 0.00 H new ATOM 0 HG2 LYS A 29 13.998 0.786 7.719 1.00 0.00 H new ATOM 0 HG3 LYS A 29 13.677 2.140 6.654 1.00 0.00 H new ATOM 0 HD2 LYS A 29 11.983 1.027 5.636 1.00 0.00 H new ATOM 0 HD3 LYS A 29 13.026 -0.333 5.271 1.00 0.00 H new ATOM 0 HE2 LYS A 29 11.723 0.110 7.998 1.00 0.00 H new ATOM 0 HE3 LYS A 29 11.028 -0.899 6.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.247 -2.338 8.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 13.244 -2.104 6.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.580 -1.291 8.195 1.00 0.00 H new ATOM 443 N ARG A 30 17.886 1.394 6.591 1.00 0.00 N ATOM 444 CA ARG A 30 19.084 1.583 7.391 1.00 0.00 C ATOM 445 C ARG A 30 20.279 0.893 6.729 1.00 0.00 C ATOM 446 O ARG A 30 20.179 0.421 5.598 1.00 0.00 O ATOM 447 CB ARG A 30 18.898 1.023 8.802 1.00 0.00 C ATOM 448 CG ARG A 30 17.586 1.513 9.418 1.00 0.00 C ATOM 449 CD ARG A 30 17.499 1.133 10.898 1.00 0.00 C ATOM 450 NE ARG A 30 17.661 2.339 11.740 1.00 0.00 N ATOM 451 CZ ARG A 30 17.265 2.422 13.018 1.00 0.00 C ATOM 452 NH1 ARG A 30 16.682 1.369 13.608 1.00 0.00 N ATOM 453 NH2 ARG A 30 17.453 3.556 13.705 1.00 0.00 N ATOM 0 H ARG A 30 17.735 0.438 6.268 1.00 0.00 H new ATOM 0 HA ARG A 30 19.271 2.655 7.460 1.00 0.00 H new ATOM 0 HB2 ARG A 30 18.903 -0.066 8.768 1.00 0.00 H new ATOM 0 HB3 ARG A 30 19.735 1.327 9.431 1.00 0.00 H new ATOM 0 HG2 ARG A 30 17.512 2.595 9.312 1.00 0.00 H new ATOM 0 HG3 ARG A 30 16.743 1.082 8.878 1.00 0.00 H new ATOM 0 HD2 ARG A 30 16.538 0.661 11.105 1.00 0.00 H new ATOM 0 HD3 ARG A 30 18.272 0.403 11.141 1.00 0.00 H new ATOM 0 HE ARG A 30 18.102 3.158 11.322 1.00 0.00 H new ATOM 0 HH11 ARG A 30 16.540 0.505 13.085 1.00 0.00 H new ATOM 0 HH12 ARG A 30 16.380 1.432 14.580 1.00 0.00 H new ATOM 0 HH21 ARG A 30 17.898 4.357 13.256 1.00 0.00 H new ATOM 0 HH22 ARG A 30 17.152 3.619 14.677 1.00 0.00 H new ATOM 467 N ALA A 31 21.381 0.856 7.463 1.00 0.00 N ATOM 468 CA ALA A 31 22.594 0.231 6.962 1.00 0.00 C ATOM 469 C ALA A 31 23.280 -0.527 8.100 1.00 0.00 C ATOM 470 O ALA A 31 24.458 -0.305 8.377 1.00 0.00 O ATOM 471 CB ALA A 31 23.499 1.297 6.342 1.00 0.00 C ATOM 0 H ALA A 31 21.460 1.249 8.401 1.00 0.00 H new ATOM 0 HA ALA A 31 22.359 -0.491 6.180 1.00 0.00 H new ATOM 0 HB1 ALA A 31 24.409 0.828 5.966 1.00 0.00 H new ATOM 0 HB2 ALA A 31 22.976 1.785 5.520 1.00 0.00 H new ATOM 0 HB3 ALA A 31 23.758 2.038 7.098 1.00 0.00 H new ATOM 477 N ILE A 32 22.514 -1.406 8.730 1.00 0.00 N ATOM 478 CA ILE A 32 23.034 -2.197 9.832 1.00 0.00 C ATOM 479 C ILE A 32 23.516 -3.549 9.300 1.00 0.00 C ATOM 480 O ILE A 32 23.115 -4.597 9.804 1.00 0.00 O ATOM 481 CB ILE A 32 21.993 -2.311 10.947 1.00 0.00 C ATOM 482 CG1 ILE A 32 20.760 -3.080 10.470 1.00 0.00 C ATOM 483 CG2 ILE A 32 21.631 -0.932 11.501 1.00 0.00 C ATOM 484 CD1 ILE A 32 20.366 -4.164 11.476 1.00 0.00 C ATOM 0 H ILE A 32 21.537 -1.588 8.498 1.00 0.00 H new ATOM 0 HA ILE A 32 23.896 -1.705 10.281 1.00 0.00 H new ATOM 0 HB ILE A 32 22.430 -2.882 11.766 1.00 0.00 H new ATOM 0 HG12 ILE A 32 19.928 -2.390 10.330 1.00 0.00 H new ATOM 0 HG13 ILE A 32 20.963 -3.535 9.501 1.00 0.00 H new ATOM 0 HG21 ILE A 32 20.889 -1.041 12.292 1.00 0.00 H new ATOM 0 HG22 ILE A 32 22.525 -0.456 11.904 1.00 0.00 H new ATOM 0 HG23 ILE A 32 21.221 -0.315 10.702 1.00 0.00 H new ATOM 0 HD11 ILE A 32 19.487 -4.696 11.112 1.00 0.00 H new ATOM 0 HD12 ILE A 32 21.191 -4.866 11.596 1.00 0.00 H new ATOM 0 HD13 ILE A 32 20.140 -3.703 12.437 1.00 0.00 H new ATOM 496 N LYS A 33 24.370 -3.481 8.289 1.00 0.00 N ATOM 497 CA LYS A 33 24.910 -4.686 7.684 1.00 0.00 C ATOM 498 C LYS A 33 23.802 -5.407 6.915 1.00 0.00 C ATOM 499 O LYS A 33 23.711 -6.633 6.953 1.00 0.00 O ATOM 500 CB LYS A 33 25.592 -5.557 8.741 1.00 0.00 C ATOM 501 CG LYS A 33 27.114 -5.420 8.666 1.00 0.00 C ATOM 502 CD LYS A 33 27.781 -6.037 9.897 1.00 0.00 C ATOM 503 CE LYS A 33 28.047 -4.976 10.967 1.00 0.00 C ATOM 504 NZ LYS A 33 28.335 -5.616 12.270 1.00 0.00 N ATOM 0 H LYS A 33 24.701 -2.610 7.874 1.00 0.00 H new ATOM 0 HA LYS A 33 25.687 -4.434 6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 33 25.246 -5.269 9.734 1.00 0.00 H new ATOM 0 HB3 LYS A 33 25.310 -6.600 8.596 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.483 -5.909 7.764 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.385 -4.367 8.591 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.143 -6.820 10.307 1.00 0.00 H new ATOM 0 HD3 LYS A 33 28.719 -6.510 9.608 1.00 0.00 H new ATOM 0 HE2 LYS A 33 28.889 -4.352 10.668 1.00 0.00 H new ATOM 0 HE3 LYS A 33 27.181 -4.320 11.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 28.513 -4.882 12.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 27.520 -6.193 12.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 29.174 -6.223 12.180 1.00 0.00 H new ATOM 518 N ASN A 34 22.986 -4.615 6.235 1.00 0.00 N ATOM 519 CA ASN A 34 21.887 -5.162 5.458 1.00 0.00 C ATOM 520 C ASN A 34 22.445 -6.084 4.372 1.00 0.00 C ATOM 521 O ASN A 34 21.786 -7.039 3.964 1.00 0.00 O ATOM 522 CB ASN A 34 21.090 -4.051 4.771 1.00 0.00 C ATOM 523 CG ASN A 34 21.909 -3.399 3.655 1.00 0.00 C ATOM 524 OD1 ASN A 34 21.874 -3.806 2.506 1.00 0.00 O ATOM 525 ND2 ASN A 34 22.644 -2.366 4.057 1.00 0.00 N ATOM 0 H ASN A 34 23.064 -3.598 6.206 1.00 0.00 H new ATOM 0 HA ASN A 34 21.233 -5.707 6.138 1.00 0.00 H new ATOM 0 HB2 ASN A 34 20.168 -4.461 4.358 1.00 0.00 H new ATOM 0 HB3 ASN A 34 20.803 -3.297 5.504 1.00 0.00 H new ATOM 0 HD21 ASN A 34 23.225 -1.862 3.387 1.00 0.00 H new ATOM 0 HD22 ASN A 34 22.627 -2.078 5.035 1.00 0.00 H new ATOM 532 N GLU A 35 23.654 -5.765 3.933 1.00 0.00 N ATOM 533 CA GLU A 35 24.308 -6.552 2.902 1.00 0.00 C ATOM 534 C GLU A 35 24.370 -8.024 3.317 1.00 0.00 C ATOM 535 O GLU A 35 23.910 -8.898 2.584 1.00 0.00 O ATOM 536 CB GLU A 35 25.707 -6.008 2.602 1.00 0.00 C ATOM 537 CG GLU A 35 26.563 -5.967 3.869 1.00 0.00 C ATOM 538 CD GLU A 35 27.724 -4.983 3.714 1.00 0.00 C ATOM 539 OE1 GLU A 35 28.463 -5.129 2.717 1.00 0.00 O ATOM 540 OE2 GLU A 35 27.847 -4.107 4.597 1.00 0.00 O ATOM 0 H GLU A 35 24.198 -4.972 4.273 1.00 0.00 H new ATOM 0 HA GLU A 35 23.720 -6.477 1.987 1.00 0.00 H new ATOM 0 HB2 GLU A 35 26.191 -6.633 1.852 1.00 0.00 H new ATOM 0 HB3 GLU A 35 25.629 -5.006 2.179 1.00 0.00 H new ATOM 0 HG2 GLU A 35 25.946 -5.677 4.720 1.00 0.00 H new ATOM 0 HG3 GLU A 35 26.951 -6.963 4.082 1.00 0.00 H new ATOM 547 N GLN A 36 24.941 -8.252 4.490 1.00 0.00 N ATOM 548 CA GLN A 36 25.068 -9.602 5.011 1.00 0.00 C ATOM 549 C GLN A 36 23.701 -10.134 5.445 1.00 0.00 C ATOM 550 O GLN A 36 23.225 -11.137 4.916 1.00 0.00 O ATOM 551 CB GLN A 36 26.069 -9.652 6.167 1.00 0.00 C ATOM 552 CG GLN A 36 26.604 -11.071 6.368 1.00 0.00 C ATOM 553 CD GLN A 36 27.751 -11.086 7.381 1.00 0.00 C ATOM 554 OE1 GLN A 36 28.605 -10.216 7.404 1.00 0.00 O ATOM 555 NE2 GLN A 36 27.722 -12.122 8.215 1.00 0.00 N ATOM 0 H GLN A 36 25.321 -7.524 5.095 1.00 0.00 H new ATOM 0 HA GLN A 36 25.450 -10.243 4.216 1.00 0.00 H new ATOM 0 HB2 GLN A 36 26.897 -8.973 5.965 1.00 0.00 H new ATOM 0 HB3 GLN A 36 25.590 -9.307 7.083 1.00 0.00 H new ATOM 0 HG2 GLN A 36 25.800 -11.721 6.714 1.00 0.00 H new ATOM 0 HG3 GLN A 36 26.950 -11.471 5.415 1.00 0.00 H new ATOM 0 HE21 GLN A 36 26.978 -12.815 8.141 1.00 0.00 H new ATOM 0 HE22 GLN A 36 28.444 -12.223 8.928 1.00 0.00 H new ATOM 564 N LEU A 37 23.109 -9.439 6.405 1.00 0.00 N ATOM 565 CA LEU A 37 21.806 -9.829 6.917 1.00 0.00 C ATOM 566 C LEU A 37 20.920 -10.280 5.754 1.00 0.00 C ATOM 567 O LEU A 37 20.404 -11.396 5.759 1.00 0.00 O ATOM 568 CB LEU A 37 21.199 -8.700 7.751 1.00 0.00 C ATOM 569 CG LEU A 37 20.576 -9.113 9.087 1.00 0.00 C ATOM 570 CD1 LEU A 37 19.222 -9.793 8.873 1.00 0.00 C ATOM 571 CD2 LEU A 37 21.537 -9.990 9.892 1.00 0.00 C ATOM 0 H LEU A 37 23.508 -8.608 6.842 1.00 0.00 H new ATOM 0 HA LEU A 37 21.901 -10.678 7.594 1.00 0.00 H new ATOM 0 HB2 LEU A 37 21.977 -7.962 7.948 1.00 0.00 H new ATOM 0 HB3 LEU A 37 20.434 -8.205 7.153 1.00 0.00 H new ATOM 0 HG LEU A 37 20.395 -8.212 9.673 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.801 -10.077 9.838 1.00 0.00 H new ATOM 0 HD12 LEU A 37 18.544 -9.104 8.370 1.00 0.00 H new ATOM 0 HD13 LEU A 37 19.355 -10.684 8.259 1.00 0.00 H new ATOM 0 HD21 LEU A 37 21.070 -10.269 10.836 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.772 -10.890 9.323 1.00 0.00 H new ATOM 0 HD23 LEU A 37 22.455 -9.437 10.091 1.00 0.00 H new ATOM 583 N LEU A 38 20.772 -9.388 4.785 1.00 0.00 N ATOM 584 CA LEU A 38 19.957 -9.681 3.618 1.00 0.00 C ATOM 585 C LEU A 38 20.465 -10.963 2.955 1.00 0.00 C ATOM 586 O LEU A 38 19.710 -11.919 2.787 1.00 0.00 O ATOM 587 CB LEU A 38 19.919 -8.475 2.676 1.00 0.00 C ATOM 588 CG LEU A 38 19.051 -8.629 1.425 1.00 0.00 C ATOM 589 CD1 LEU A 38 18.265 -7.348 1.142 1.00 0.00 C ATOM 590 CD2 LEU A 38 19.894 -9.061 0.223 1.00 0.00 C ATOM 0 H LEU A 38 21.202 -8.463 4.784 1.00 0.00 H new ATOM 0 HA LEU A 38 18.923 -9.862 3.911 1.00 0.00 H new ATOM 0 HB2 LEU A 38 19.563 -7.611 3.237 1.00 0.00 H new ATOM 0 HB3 LEU A 38 20.939 -8.252 2.362 1.00 0.00 H new ATOM 0 HG LEU A 38 18.323 -9.419 1.609 1.00 0.00 H new ATOM 0 HD11 LEU A 38 17.657 -7.484 0.248 1.00 0.00 H new ATOM 0 HD12 LEU A 38 17.618 -7.123 1.990 1.00 0.00 H new ATOM 0 HD13 LEU A 38 18.959 -6.522 0.986 1.00 0.00 H new ATOM 0 HD21 LEU A 38 19.253 -9.163 -0.653 1.00 0.00 H new ATOM 0 HD22 LEU A 38 20.660 -8.310 0.027 1.00 0.00 H new ATOM 0 HD23 LEU A 38 20.370 -10.018 0.438 1.00 0.00 H new ATOM 602 N GLN A 39 21.740 -10.941 2.597 1.00 0.00 N ATOM 603 CA GLN A 39 22.357 -12.090 1.956 1.00 0.00 C ATOM 604 C GLN A 39 21.838 -13.388 2.579 1.00 0.00 C ATOM 605 O GLN A 39 21.562 -14.354 1.870 1.00 0.00 O ATOM 606 CB GLN A 39 23.882 -12.013 2.043 1.00 0.00 C ATOM 607 CG GLN A 39 24.538 -12.880 0.966 1.00 0.00 C ATOM 608 CD GLN A 39 24.978 -14.228 1.541 1.00 0.00 C ATOM 609 OE1 GLN A 39 24.194 -15.150 1.700 1.00 0.00 O ATOM 610 NE2 GLN A 39 26.271 -14.291 1.842 1.00 0.00 N ATOM 0 H GLN A 39 22.363 -10.146 2.738 1.00 0.00 H new ATOM 0 HA GLN A 39 22.085 -12.082 0.901 1.00 0.00 H new ATOM 0 HB2 GLN A 39 24.204 -10.978 1.928 1.00 0.00 H new ATOM 0 HB3 GLN A 39 24.210 -12.341 3.029 1.00 0.00 H new ATOM 0 HG2 GLN A 39 23.837 -13.041 0.147 1.00 0.00 H new ATOM 0 HG3 GLN A 39 25.400 -12.359 0.550 1.00 0.00 H new ATOM 0 HE21 GLN A 39 26.872 -13.482 1.684 1.00 0.00 H new ATOM 0 HE22 GLN A 39 26.663 -15.148 2.231 1.00 0.00 H new ATOM 619 N LEU A 40 21.720 -13.367 3.899 1.00 0.00 N ATOM 620 CA LEU A 40 21.239 -14.530 4.625 1.00 0.00 C ATOM 621 C LEU A 40 19.768 -14.769 4.279 1.00 0.00 C ATOM 622 O LEU A 40 19.404 -15.848 3.814 1.00 0.00 O ATOM 623 CB LEU A 40 21.500 -14.371 6.125 1.00 0.00 C ATOM 624 CG LEU A 40 20.853 -15.419 7.033 1.00 0.00 C ATOM 625 CD1 LEU A 40 21.701 -16.690 7.094 1.00 0.00 C ATOM 626 CD2 LEU A 40 20.580 -14.844 8.425 1.00 0.00 C ATOM 0 H LEU A 40 21.949 -12.563 4.484 1.00 0.00 H new ATOM 0 HA LEU A 40 21.787 -15.422 4.322 1.00 0.00 H new ATOM 0 HB2 LEU A 40 22.577 -14.391 6.290 1.00 0.00 H new ATOM 0 HB3 LEU A 40 21.149 -13.386 6.432 1.00 0.00 H new ATOM 0 HG LEU A 40 19.890 -15.695 6.604 1.00 0.00 H new ATOM 0 HD11 LEU A 40 21.219 -17.418 7.746 1.00 0.00 H new ATOM 0 HD12 LEU A 40 21.801 -17.109 6.093 1.00 0.00 H new ATOM 0 HD13 LEU A 40 22.689 -16.450 7.487 1.00 0.00 H new ATOM 0 HD21 LEU A 40 20.120 -15.609 9.051 1.00 0.00 H new ATOM 0 HD22 LEU A 40 21.519 -14.522 8.876 1.00 0.00 H new ATOM 0 HD23 LEU A 40 19.907 -13.991 8.341 1.00 0.00 H new ATOM 638 N ILE A 41 18.962 -13.745 4.520 1.00 0.00 N ATOM 639 CA ILE A 41 17.539 -13.831 4.239 1.00 0.00 C ATOM 640 C ILE A 41 17.335 -14.294 2.795 1.00 0.00 C ATOM 641 O ILE A 41 16.740 -15.343 2.554 1.00 0.00 O ATOM 642 CB ILE A 41 16.849 -12.504 4.562 1.00 0.00 C ATOM 643 CG1 ILE A 41 16.821 -12.254 6.072 1.00 0.00 C ATOM 644 CG2 ILE A 41 15.449 -12.450 3.946 1.00 0.00 C ATOM 645 CD1 ILE A 41 16.535 -10.783 6.378 1.00 0.00 C ATOM 0 H ILE A 41 19.267 -12.852 4.907 1.00 0.00 H new ATOM 0 HA ILE A 41 17.068 -14.575 4.882 1.00 0.00 H new ATOM 0 HB ILE A 41 17.430 -11.698 4.113 1.00 0.00 H new ATOM 0 HG12 ILE A 41 16.058 -12.880 6.534 1.00 0.00 H new ATOM 0 HG13 ILE A 41 17.777 -12.541 6.510 1.00 0.00 H new ATOM 0 HG21 ILE A 41 14.980 -11.497 4.191 1.00 0.00 H new ATOM 0 HG22 ILE A 41 15.524 -12.550 2.863 1.00 0.00 H new ATOM 0 HG23 ILE A 41 14.844 -13.264 4.345 1.00 0.00 H new ATOM 0 HD11 ILE A 41 16.520 -10.632 7.457 1.00 0.00 H new ATOM 0 HD12 ILE A 41 17.313 -10.161 5.935 1.00 0.00 H new ATOM 0 HD13 ILE A 41 15.567 -10.506 5.960 1.00 0.00 H new ATOM 657 N PHE A 42 17.841 -13.490 1.872 1.00 0.00 N ATOM 658 CA PHE A 42 17.722 -13.804 0.458 1.00 0.00 C ATOM 659 C PHE A 42 17.999 -15.287 0.201 1.00 0.00 C ATOM 660 O PHE A 42 17.144 -16.000 -0.322 1.00 0.00 O ATOM 661 CB PHE A 42 18.771 -12.967 -0.276 1.00 0.00 C ATOM 662 CG PHE A 42 18.556 -12.886 -1.788 1.00 0.00 C ATOM 663 CD1 PHE A 42 19.063 -13.852 -2.600 1.00 0.00 C ATOM 664 CD2 PHE A 42 17.856 -11.849 -2.321 1.00 0.00 C ATOM 665 CE1 PHE A 42 18.863 -13.777 -4.004 1.00 0.00 C ATOM 666 CE2 PHE A 42 17.656 -11.774 -3.725 1.00 0.00 C ATOM 667 CZ PHE A 42 18.163 -12.739 -4.537 1.00 0.00 C ATOM 0 H PHE A 42 18.335 -12.621 2.076 1.00 0.00 H new ATOM 0 HA PHE A 42 16.712 -13.585 0.112 1.00 0.00 H new ATOM 0 HB2 PHE A 42 18.768 -11.958 0.136 1.00 0.00 H new ATOM 0 HB3 PHE A 42 19.758 -13.388 -0.082 1.00 0.00 H new ATOM 0 HD1 PHE A 42 19.618 -14.676 -2.177 1.00 0.00 H new ATOM 0 HD2 PHE A 42 17.452 -11.082 -1.676 1.00 0.00 H new ATOM 0 HE1 PHE A 42 19.266 -14.544 -4.649 1.00 0.00 H new ATOM 0 HE2 PHE A 42 17.101 -10.950 -4.148 1.00 0.00 H new ATOM 0 HZ PHE A 42 18.010 -12.682 -5.605 1.00 0.00 H new ATOM 677 N LYS A 43 19.197 -15.707 0.581 1.00 0.00 N ATOM 678 CA LYS A 43 19.597 -17.092 0.398 1.00 0.00 C ATOM 679 C LYS A 43 18.562 -18.008 1.055 1.00 0.00 C ATOM 680 O LYS A 43 18.356 -19.136 0.611 1.00 0.00 O ATOM 681 CB LYS A 43 21.023 -17.309 0.908 1.00 0.00 C ATOM 682 CG LYS A 43 21.798 -18.251 -0.017 1.00 0.00 C ATOM 683 CD LYS A 43 22.675 -19.211 0.789 1.00 0.00 C ATOM 684 CE LYS A 43 21.989 -20.569 0.958 1.00 0.00 C ATOM 685 NZ LYS A 43 21.297 -20.641 2.264 1.00 0.00 N ATOM 0 H LYS A 43 19.903 -15.113 1.015 1.00 0.00 H new ATOM 0 HA LYS A 43 19.620 -17.346 -0.662 1.00 0.00 H new ATOM 0 HB2 LYS A 43 21.539 -16.351 0.974 1.00 0.00 H new ATOM 0 HB3 LYS A 43 20.994 -17.725 1.915 1.00 0.00 H new ATOM 0 HG2 LYS A 43 21.100 -18.819 -0.631 1.00 0.00 H new ATOM 0 HG3 LYS A 43 22.420 -17.669 -0.697 1.00 0.00 H new ATOM 0 HD2 LYS A 43 23.633 -19.343 0.286 1.00 0.00 H new ATOM 0 HD3 LYS A 43 22.886 -18.782 1.768 1.00 0.00 H new ATOM 0 HE2 LYS A 43 21.273 -20.724 0.151 1.00 0.00 H new ATOM 0 HE3 LYS A 43 22.727 -21.368 0.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 20.837 -21.569 2.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 21.988 -20.514 3.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 20.579 -19.891 2.318 1.00 0.00 H new ATOM 699 N SER A 44 17.940 -17.488 2.103 1.00 0.00 N ATOM 700 CA SER A 44 16.932 -18.245 2.826 1.00 0.00 C ATOM 701 C SER A 44 15.714 -18.483 1.931 1.00 0.00 C ATOM 702 O SER A 44 15.289 -19.622 1.745 1.00 0.00 O ATOM 703 CB SER A 44 16.515 -17.523 4.109 1.00 0.00 C ATOM 704 OG SER A 44 16.261 -18.433 5.175 1.00 0.00 O ATOM 0 H SER A 44 18.114 -16.552 2.469 1.00 0.00 H new ATOM 0 HA SER A 44 17.363 -19.206 3.106 1.00 0.00 H new ATOM 0 HB2 SER A 44 17.300 -16.828 4.405 1.00 0.00 H new ATOM 0 HB3 SER A 44 15.620 -16.931 3.917 1.00 0.00 H new ATOM 0 HG SER A 44 16.315 -17.958 6.030 1.00 0.00 H new ATOM 710 N ILE A 45 15.187 -17.390 1.401 1.00 0.00 N ATOM 711 CA ILE A 45 14.026 -17.465 0.530 1.00 0.00 C ATOM 712 C ILE A 45 14.433 -18.099 -0.801 1.00 0.00 C ATOM 713 O ILE A 45 13.704 -18.926 -1.348 1.00 0.00 O ATOM 714 CB ILE A 45 13.377 -16.087 0.382 1.00 0.00 C ATOM 715 CG1 ILE A 45 11.921 -16.213 -0.072 1.00 0.00 C ATOM 716 CG2 ILE A 45 14.194 -15.194 -0.554 1.00 0.00 C ATOM 717 CD1 ILE A 45 10.986 -16.379 1.127 1.00 0.00 C ATOM 0 H ILE A 45 15.542 -16.447 1.558 1.00 0.00 H new ATOM 0 HA ILE A 45 13.261 -18.106 0.969 1.00 0.00 H new ATOM 0 HB ILE A 45 13.369 -15.606 1.360 1.00 0.00 H new ATOM 0 HG12 ILE A 45 11.636 -15.328 -0.641 1.00 0.00 H new ATOM 0 HG13 ILE A 45 11.817 -17.068 -0.740 1.00 0.00 H new ATOM 0 HG21 ILE A 45 13.711 -14.221 -0.642 1.00 0.00 H new ATOM 0 HG22 ILE A 45 15.198 -15.066 -0.150 1.00 0.00 H new ATOM 0 HG23 ILE A 45 14.256 -15.659 -1.538 1.00 0.00 H new ATOM 0 HD11 ILE A 45 9.957 -16.466 0.777 1.00 0.00 H new ATOM 0 HD12 ILE A 45 11.259 -17.278 1.679 1.00 0.00 H new ATOM 0 HD13 ILE A 45 11.074 -15.511 1.780 1.00 0.00 H new ATOM 729 N ASP A 46 15.596 -17.688 -1.285 1.00 0.00 N ATOM 730 CA ASP A 46 16.109 -18.206 -2.542 1.00 0.00 C ATOM 731 C ASP A 46 16.507 -19.672 -2.360 1.00 0.00 C ATOM 732 O ASP A 46 17.520 -19.970 -1.730 1.00 0.00 O ATOM 733 CB ASP A 46 17.349 -17.432 -2.992 1.00 0.00 C ATOM 734 CG ASP A 46 17.632 -17.480 -4.495 1.00 0.00 C ATOM 735 OD1 ASP A 46 16.830 -18.126 -5.203 1.00 0.00 O ATOM 736 OD2 ASP A 46 18.645 -16.871 -4.901 1.00 0.00 O ATOM 0 H ASP A 46 16.198 -17.002 -0.829 1.00 0.00 H new ATOM 0 HA ASP A 46 15.327 -18.102 -3.294 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.237 -16.390 -2.692 1.00 0.00 H new ATOM 0 HB3 ASP A 46 18.216 -17.825 -2.462 1.00 0.00 H new ATOM 741 N ALA A 47 15.688 -20.549 -2.924 1.00 0.00 N ATOM 742 CA ALA A 47 15.942 -21.976 -2.832 1.00 0.00 C ATOM 743 C ALA A 47 16.901 -22.393 -3.949 1.00 0.00 C ATOM 744 O ALA A 47 17.834 -23.159 -3.718 1.00 0.00 O ATOM 745 CB ALA A 47 14.615 -22.736 -2.889 1.00 0.00 C ATOM 0 H ALA A 47 14.848 -20.298 -3.446 1.00 0.00 H new ATOM 0 HA ALA A 47 16.417 -22.220 -1.882 1.00 0.00 H new ATOM 0 HB1 ALA A 47 14.806 -23.807 -2.820 1.00 0.00 H new ATOM 0 HB2 ALA A 47 13.982 -22.426 -2.058 1.00 0.00 H new ATOM 0 HB3 ALA A 47 14.111 -22.517 -3.830 1.00 0.00 H new ATOM 751 N ASP A 48 16.637 -21.868 -5.137 1.00 0.00 N ATOM 752 CA ASP A 48 17.465 -22.176 -6.291 1.00 0.00 C ATOM 753 C ASP A 48 18.838 -21.523 -6.118 1.00 0.00 C ATOM 754 O ASP A 48 19.853 -22.213 -6.050 1.00 0.00 O ATOM 755 CB ASP A 48 16.841 -21.630 -7.577 1.00 0.00 C ATOM 756 CG ASP A 48 16.124 -20.287 -7.429 1.00 0.00 C ATOM 757 OD1 ASP A 48 16.835 -19.259 -7.458 1.00 0.00 O ATOM 758 OD2 ASP A 48 14.883 -20.318 -7.291 1.00 0.00 O ATOM 0 H ASP A 48 15.862 -21.232 -5.325 1.00 0.00 H new ATOM 0 HA ASP A 48 17.552 -23.260 -6.364 1.00 0.00 H new ATOM 0 HB2 ASP A 48 17.625 -21.525 -8.327 1.00 0.00 H new ATOM 0 HB3 ASP A 48 16.131 -22.364 -7.958 1.00 0.00 H new ATOM 763 N GLY A 49 18.824 -20.200 -6.050 1.00 0.00 N ATOM 764 CA GLY A 49 20.055 -19.446 -5.885 1.00 0.00 C ATOM 765 C GLY A 49 20.440 -18.734 -7.184 1.00 0.00 C ATOM 766 O GLY A 49 21.619 -18.651 -7.525 1.00 0.00 O ATOM 0 H GLY A 49 17.979 -19.631 -6.106 1.00 0.00 H new ATOM 0 HA2 GLY A 49 19.933 -18.714 -5.087 1.00 0.00 H new ATOM 0 HA3 GLY A 49 20.859 -20.117 -5.582 1.00 0.00 H new ATOM 770 N ASN A 50 19.423 -18.239 -7.874 1.00 0.00 N ATOM 771 CA ASN A 50 19.640 -17.537 -9.128 1.00 0.00 C ATOM 772 C ASN A 50 20.207 -16.146 -8.837 1.00 0.00 C ATOM 773 O ASN A 50 20.646 -15.448 -9.749 1.00 0.00 O ATOM 774 CB ASN A 50 18.328 -17.363 -9.895 1.00 0.00 C ATOM 775 CG ASN A 50 17.206 -16.899 -8.965 1.00 0.00 C ATOM 776 OD1 ASN A 50 17.346 -16.858 -7.754 1.00 0.00 O ATOM 777 ND2 ASN A 50 16.088 -16.553 -9.596 1.00 0.00 N ATOM 0 H ASN A 50 18.446 -18.310 -7.589 1.00 0.00 H new ATOM 0 HA ASN A 50 20.333 -18.125 -9.729 1.00 0.00 H new ATOM 0 HB2 ASN A 50 18.465 -16.637 -10.696 1.00 0.00 H new ATOM 0 HB3 ASN A 50 18.049 -18.306 -10.364 1.00 0.00 H new ATOM 0 HD21 ASN A 50 15.281 -16.230 -9.063 1.00 0.00 H new ATOM 0 HD22 ASN A 50 16.038 -16.611 -10.613 1.00 0.00 H new ATOM 784 N GLY A 51 20.178 -15.785 -7.562 1.00 0.00 N ATOM 785 CA GLY A 51 20.683 -14.490 -7.140 1.00 0.00 C ATOM 786 C GLY A 51 19.612 -13.407 -7.292 1.00 0.00 C ATOM 787 O GLY A 51 19.791 -12.282 -6.829 1.00 0.00 O ATOM 0 H GLY A 51 19.813 -16.367 -6.808 1.00 0.00 H new ATOM 0 HA2 GLY A 51 21.006 -14.543 -6.100 1.00 0.00 H new ATOM 0 HA3 GLY A 51 21.559 -14.226 -7.733 1.00 0.00 H new ATOM 791 N GLU A 52 18.522 -13.786 -7.943 1.00 0.00 N ATOM 792 CA GLU A 52 17.422 -12.862 -8.162 1.00 0.00 C ATOM 793 C GLU A 52 16.107 -13.479 -7.682 1.00 0.00 C ATOM 794 O GLU A 52 15.945 -14.699 -7.703 1.00 0.00 O ATOM 795 CB GLU A 52 17.332 -12.455 -9.634 1.00 0.00 C ATOM 796 CG GLU A 52 18.567 -11.657 -10.058 1.00 0.00 C ATOM 797 CD GLU A 52 19.340 -12.387 -11.158 1.00 0.00 C ATOM 798 OE1 GLU A 52 18.679 -12.807 -12.133 1.00 0.00 O ATOM 799 OE2 GLU A 52 20.574 -12.508 -11.001 1.00 0.00 O ATOM 0 H GLU A 52 18.377 -14.720 -8.326 1.00 0.00 H new ATOM 0 HA GLU A 52 17.611 -11.959 -7.581 1.00 0.00 H new ATOM 0 HB2 GLU A 52 17.238 -13.345 -10.256 1.00 0.00 H new ATOM 0 HB3 GLU A 52 16.435 -11.857 -9.796 1.00 0.00 H new ATOM 0 HG2 GLU A 52 18.264 -10.672 -10.414 1.00 0.00 H new ATOM 0 HG3 GLU A 52 19.216 -11.499 -9.196 1.00 0.00 H new ATOM 806 N ILE A 53 15.200 -12.609 -7.263 1.00 0.00 N ATOM 807 CA ILE A 53 13.903 -13.054 -6.780 1.00 0.00 C ATOM 808 C ILE A 53 12.802 -12.255 -7.479 1.00 0.00 C ATOM 809 O ILE A 53 13.087 -11.386 -8.301 1.00 0.00 O ATOM 810 CB ILE A 53 13.845 -12.975 -5.253 1.00 0.00 C ATOM 811 CG1 ILE A 53 14.541 -11.712 -4.742 1.00 0.00 C ATOM 812 CG2 ILE A 53 14.419 -14.243 -4.616 1.00 0.00 C ATOM 813 CD1 ILE A 53 13.730 -10.462 -5.086 1.00 0.00 C ATOM 0 H ILE A 53 15.337 -11.598 -7.248 1.00 0.00 H new ATOM 0 HA ILE A 53 13.743 -14.103 -7.029 1.00 0.00 H new ATOM 0 HB ILE A 53 12.799 -12.909 -4.954 1.00 0.00 H new ATOM 0 HG12 ILE A 53 14.674 -11.778 -3.662 1.00 0.00 H new ATOM 0 HG13 ILE A 53 15.535 -11.637 -5.182 1.00 0.00 H new ATOM 0 HG21 ILE A 53 14.366 -14.161 -3.530 1.00 0.00 H new ATOM 0 HG22 ILE A 53 13.842 -15.108 -4.943 1.00 0.00 H new ATOM 0 HG23 ILE A 53 15.459 -14.364 -4.920 1.00 0.00 H new ATOM 0 HD11 ILE A 53 14.247 -9.578 -4.711 1.00 0.00 H new ATOM 0 HD12 ILE A 53 13.619 -10.386 -6.168 1.00 0.00 H new ATOM 0 HD13 ILE A 53 12.745 -10.529 -4.624 1.00 0.00 H new ATOM 825 N ASP A 54 11.566 -12.577 -7.126 1.00 0.00 N ATOM 826 CA ASP A 54 10.420 -11.900 -7.709 1.00 0.00 C ATOM 827 C ASP A 54 9.589 -11.261 -6.595 1.00 0.00 C ATOM 828 O ASP A 54 9.969 -11.311 -5.426 1.00 0.00 O ATOM 829 CB ASP A 54 9.524 -12.885 -8.463 1.00 0.00 C ATOM 830 CG ASP A 54 9.208 -14.179 -7.710 1.00 0.00 C ATOM 831 OD1 ASP A 54 9.383 -14.172 -6.472 1.00 0.00 O ATOM 832 OD2 ASP A 54 8.799 -15.145 -8.389 1.00 0.00 O ATOM 0 H ASP A 54 11.333 -13.298 -6.443 1.00 0.00 H new ATOM 0 HA ASP A 54 10.791 -11.146 -8.403 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.586 -12.386 -8.707 1.00 0.00 H new ATOM 0 HB3 ASP A 54 10.004 -13.140 -9.408 1.00 0.00 H new ATOM 837 N GLN A 55 8.470 -10.677 -6.996 1.00 0.00 N ATOM 838 CA GLN A 55 7.582 -10.029 -6.046 1.00 0.00 C ATOM 839 C GLN A 55 7.135 -11.024 -4.973 1.00 0.00 C ATOM 840 O GLN A 55 6.968 -10.657 -3.811 1.00 0.00 O ATOM 841 CB GLN A 55 6.376 -9.411 -6.756 1.00 0.00 C ATOM 842 CG GLN A 55 5.485 -10.494 -7.367 1.00 0.00 C ATOM 843 CD GLN A 55 4.606 -9.918 -8.479 1.00 0.00 C ATOM 844 OE1 GLN A 55 4.846 -10.115 -9.659 1.00 0.00 O ATOM 845 NE2 GLN A 55 3.579 -9.197 -8.039 1.00 0.00 N ATOM 0 H GLN A 55 8.158 -10.639 -7.966 1.00 0.00 H new ATOM 0 HA GLN A 55 8.129 -9.221 -5.560 1.00 0.00 H new ATOM 0 HB2 GLN A 55 5.798 -8.816 -6.048 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.718 -8.733 -7.538 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.105 -11.297 -7.767 1.00 0.00 H new ATOM 0 HG3 GLN A 55 4.856 -10.933 -6.592 1.00 0.00 H new ATOM 0 HE21 GLN A 55 3.436 -9.072 -7.037 1.00 0.00 H new ATOM 0 HE22 GLN A 55 2.934 -8.769 -8.704 1.00 0.00 H new ATOM 854 N ASN A 56 6.954 -12.265 -5.401 1.00 0.00 N ATOM 855 CA ASN A 56 6.530 -13.316 -4.492 1.00 0.00 C ATOM 856 C ASN A 56 7.597 -13.512 -3.413 1.00 0.00 C ATOM 857 O ASN A 56 7.322 -13.346 -2.226 1.00 0.00 O ATOM 858 CB ASN A 56 6.354 -14.645 -5.230 1.00 0.00 C ATOM 859 CG ASN A 56 4.947 -14.762 -5.820 1.00 0.00 C ATOM 860 OD1 ASN A 56 3.946 -14.621 -5.138 1.00 0.00 O ATOM 861 ND2 ASN A 56 4.928 -15.027 -7.123 1.00 0.00 N ATOM 0 H ASN A 56 7.093 -12.566 -6.366 1.00 0.00 H new ATOM 0 HA ASN A 56 5.578 -13.018 -4.053 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.094 -14.724 -6.026 1.00 0.00 H new ATOM 0 HB3 ASN A 56 6.535 -15.473 -4.544 1.00 0.00 H new ATOM 0 HD21 ASN A 56 4.037 -15.124 -7.611 1.00 0.00 H new ATOM 0 HD22 ASN A 56 5.804 -15.133 -7.635 1.00 0.00 H new ATOM 868 N GLU A 57 8.792 -13.863 -3.865 1.00 0.00 N ATOM 869 CA GLU A 57 9.902 -14.084 -2.953 1.00 0.00 C ATOM 870 C GLU A 57 10.189 -12.814 -2.149 1.00 0.00 C ATOM 871 O GLU A 57 10.641 -12.887 -1.007 1.00 0.00 O ATOM 872 CB GLU A 57 11.149 -14.548 -3.708 1.00 0.00 C ATOM 873 CG GLU A 57 11.152 -16.068 -3.880 1.00 0.00 C ATOM 874 CD GLU A 57 12.298 -16.515 -4.790 1.00 0.00 C ATOM 875 OE1 GLU A 57 12.218 -16.202 -5.998 1.00 0.00 O ATOM 876 OE2 GLU A 57 13.228 -17.159 -4.257 1.00 0.00 O ATOM 0 H GLU A 57 9.016 -14.000 -4.851 1.00 0.00 H new ATOM 0 HA GLU A 57 9.623 -14.876 -2.258 1.00 0.00 H new ATOM 0 HB2 GLU A 57 11.186 -14.068 -4.686 1.00 0.00 H new ATOM 0 HB3 GLU A 57 12.043 -14.238 -3.166 1.00 0.00 H new ATOM 0 HG2 GLU A 57 11.248 -16.548 -2.906 1.00 0.00 H new ATOM 0 HG3 GLU A 57 10.201 -16.392 -4.302 1.00 0.00 H new ATOM 883 N PHE A 58 9.913 -11.680 -2.776 1.00 0.00 N ATOM 884 CA PHE A 58 10.136 -10.396 -2.133 1.00 0.00 C ATOM 885 C PHE A 58 9.124 -10.162 -1.010 1.00 0.00 C ATOM 886 O PHE A 58 9.477 -9.651 0.052 1.00 0.00 O ATOM 887 CB PHE A 58 9.948 -9.321 -3.205 1.00 0.00 C ATOM 888 CG PHE A 58 10.437 -7.932 -2.787 1.00 0.00 C ATOM 889 CD1 PHE A 58 9.621 -7.110 -2.074 1.00 0.00 C ATOM 890 CD2 PHE A 58 11.687 -7.521 -3.128 1.00 0.00 C ATOM 891 CE1 PHE A 58 10.075 -5.822 -1.686 1.00 0.00 C ATOM 892 CE2 PHE A 58 12.141 -6.232 -2.739 1.00 0.00 C ATOM 893 CZ PHE A 58 11.325 -5.410 -2.027 1.00 0.00 C ATOM 0 H PHE A 58 9.537 -11.624 -3.722 1.00 0.00 H new ATOM 0 HA PHE A 58 11.135 -10.366 -1.697 1.00 0.00 H new ATOM 0 HB2 PHE A 58 10.479 -9.625 -4.107 1.00 0.00 H new ATOM 0 HB3 PHE A 58 8.891 -9.260 -3.462 1.00 0.00 H new ATOM 0 HD1 PHE A 58 8.628 -7.437 -1.803 1.00 0.00 H new ATOM 0 HD2 PHE A 58 12.335 -8.174 -3.694 1.00 0.00 H new ATOM 0 HE1 PHE A 58 9.427 -5.169 -1.120 1.00 0.00 H new ATOM 0 HE2 PHE A 58 13.134 -5.905 -3.009 1.00 0.00 H new ATOM 0 HZ PHE A 58 11.670 -4.430 -1.732 1.00 0.00 H new ATOM 903 N ALA A 59 7.886 -10.548 -1.282 1.00 0.00 N ATOM 904 CA ALA A 59 6.821 -10.387 -0.308 1.00 0.00 C ATOM 905 C ALA A 59 7.112 -11.266 0.910 1.00 0.00 C ATOM 906 O ALA A 59 7.009 -10.811 2.048 1.00 0.00 O ATOM 907 CB ALA A 59 5.477 -10.721 -0.960 1.00 0.00 C ATOM 0 H ALA A 59 7.597 -10.972 -2.164 1.00 0.00 H new ATOM 0 HA ALA A 59 6.769 -9.354 0.036 1.00 0.00 H new ATOM 0 HB1 ALA A 59 4.678 -10.600 -0.229 1.00 0.00 H new ATOM 0 HB2 ALA A 59 5.304 -10.050 -1.801 1.00 0.00 H new ATOM 0 HB3 ALA A 59 5.491 -11.751 -1.315 1.00 0.00 H new ATOM 913 N LYS A 60 7.470 -12.510 0.630 1.00 0.00 N ATOM 914 CA LYS A 60 7.777 -13.457 1.688 1.00 0.00 C ATOM 915 C LYS A 60 9.091 -13.055 2.361 1.00 0.00 C ATOM 916 O LYS A 60 9.287 -13.308 3.549 1.00 0.00 O ATOM 917 CB LYS A 60 7.778 -14.887 1.144 1.00 0.00 C ATOM 918 CG LYS A 60 6.382 -15.508 1.229 1.00 0.00 C ATOM 919 CD LYS A 60 6.448 -16.933 1.781 1.00 0.00 C ATOM 920 CE LYS A 60 5.191 -17.268 2.585 1.00 0.00 C ATOM 921 NZ LYS A 60 4.729 -18.640 2.277 1.00 0.00 N ATOM 0 H LYS A 60 7.554 -12.884 -0.315 1.00 0.00 H new ATOM 0 HA LYS A 60 7.004 -13.433 2.456 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.116 -14.885 0.108 1.00 0.00 H new ATOM 0 HB3 LYS A 60 8.485 -15.494 1.709 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.746 -14.896 1.868 1.00 0.00 H new ATOM 0 HG3 LYS A 60 5.924 -15.518 0.240 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.558 -17.640 0.959 1.00 0.00 H new ATOM 0 HD3 LYS A 60 7.329 -17.041 2.414 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.400 -17.179 3.651 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.403 -16.552 2.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.875 -18.851 2.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.511 -18.713 1.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.477 -19.321 2.520 1.00 0.00 H new ATOM 935 N PHE A 61 9.957 -12.435 1.574 1.00 0.00 N ATOM 936 CA PHE A 61 11.246 -11.995 2.079 1.00 0.00 C ATOM 937 C PHE A 61 11.084 -10.821 3.047 1.00 0.00 C ATOM 938 O PHE A 61 11.816 -10.717 4.030 1.00 0.00 O ATOM 939 CB PHE A 61 12.067 -11.535 0.872 1.00 0.00 C ATOM 940 CG PHE A 61 13.270 -10.662 1.233 1.00 0.00 C ATOM 941 CD1 PHE A 61 13.092 -9.347 1.530 1.00 0.00 C ATOM 942 CD2 PHE A 61 14.518 -11.201 1.257 1.00 0.00 C ATOM 943 CE1 PHE A 61 14.208 -8.537 1.866 1.00 0.00 C ATOM 944 CE2 PHE A 61 15.635 -10.391 1.592 1.00 0.00 C ATOM 945 CZ PHE A 61 15.457 -9.076 1.890 1.00 0.00 C ATOM 0 H PHE A 61 9.791 -12.227 0.589 1.00 0.00 H new ATOM 0 HA PHE A 61 11.733 -12.810 2.615 1.00 0.00 H new ATOM 0 HB2 PHE A 61 12.418 -12.412 0.329 1.00 0.00 H new ATOM 0 HB3 PHE A 61 11.418 -10.979 0.195 1.00 0.00 H new ATOM 0 HD1 PHE A 61 12.101 -8.919 1.510 1.00 0.00 H new ATOM 0 HD2 PHE A 61 14.660 -12.245 1.021 1.00 0.00 H new ATOM 0 HE1 PHE A 61 14.066 -7.493 2.103 1.00 0.00 H new ATOM 0 HE2 PHE A 61 16.626 -10.819 1.610 1.00 0.00 H new ATOM 0 HZ PHE A 61 16.307 -8.460 2.146 1.00 0.00 H new ATOM 955 N TYR A 62 10.121 -9.967 2.735 1.00 0.00 N ATOM 956 CA TYR A 62 9.853 -8.805 3.565 1.00 0.00 C ATOM 957 C TYR A 62 9.609 -9.214 5.019 1.00 0.00 C ATOM 958 O TYR A 62 10.095 -8.562 5.942 1.00 0.00 O ATOM 959 CB TYR A 62 8.579 -8.171 3.005 1.00 0.00 C ATOM 960 CG TYR A 62 8.508 -6.653 3.185 1.00 0.00 C ATOM 961 CD1 TYR A 62 8.370 -6.114 4.448 1.00 0.00 C ATOM 962 CD2 TYR A 62 8.581 -5.823 2.084 1.00 0.00 C ATOM 963 CE1 TYR A 62 8.304 -4.685 4.617 1.00 0.00 C ATOM 964 CE2 TYR A 62 8.514 -4.395 2.254 1.00 0.00 C ATOM 965 CZ TYR A 62 8.378 -3.896 3.512 1.00 0.00 C ATOM 966 OH TYR A 62 8.315 -2.547 3.672 1.00 0.00 O ATOM 0 H TYR A 62 9.516 -10.056 1.918 1.00 0.00 H new ATOM 0 HA TYR A 62 10.701 -8.120 3.551 1.00 0.00 H new ATOM 0 HB2 TYR A 62 8.506 -8.404 1.943 1.00 0.00 H new ATOM 0 HB3 TYR A 62 7.716 -8.625 3.491 1.00 0.00 H new ATOM 0 HD1 TYR A 62 8.312 -6.763 5.309 1.00 0.00 H new ATOM 0 HD2 TYR A 62 8.688 -6.245 1.096 1.00 0.00 H new ATOM 0 HE1 TYR A 62 8.198 -4.250 5.600 1.00 0.00 H new ATOM 0 HE2 TYR A 62 8.570 -3.734 1.401 1.00 0.00 H new ATOM 0 HH TYR A 62 8.382 -2.110 2.797 1.00 0.00 H new ATOM 976 N GLY A 63 8.855 -10.292 5.178 1.00 0.00 N ATOM 977 CA GLY A 63 8.540 -10.796 6.504 1.00 0.00 C ATOM 978 C GLY A 63 9.774 -11.419 7.161 1.00 0.00 C ATOM 979 O GLY A 63 10.390 -10.811 8.035 1.00 0.00 O ATOM 0 H GLY A 63 8.453 -10.830 4.410 1.00 0.00 H new ATOM 0 HA2 GLY A 63 8.164 -9.984 7.126 1.00 0.00 H new ATOM 0 HA3 GLY A 63 7.746 -11.539 6.435 1.00 0.00 H new ATOM 983 N SER A 64 10.097 -12.624 6.716 1.00 0.00 N ATOM 984 CA SER A 64 11.246 -13.336 7.249 1.00 0.00 C ATOM 985 C SER A 64 11.413 -14.675 6.528 1.00 0.00 C ATOM 986 O SER A 64 12.372 -14.866 5.781 1.00 0.00 O ATOM 987 CB SER A 64 11.104 -13.560 8.756 1.00 0.00 C ATOM 988 OG SER A 64 12.078 -12.831 9.498 1.00 0.00 O ATOM 0 H SER A 64 9.583 -13.126 5.992 1.00 0.00 H new ATOM 0 HA SER A 64 12.134 -12.727 7.081 1.00 0.00 H new ATOM 0 HB2 SER A 64 10.106 -13.260 9.075 1.00 0.00 H new ATOM 0 HB3 SER A 64 11.202 -14.623 8.975 1.00 0.00 H new ATOM 0 HG SER A 64 12.406 -13.383 10.239 1.00 0.00 H new ATOM 994 N ILE A 65 10.466 -15.567 6.776 1.00 0.00 N ATOM 995 CA ILE A 65 10.497 -16.882 6.159 1.00 0.00 C ATOM 996 C ILE A 65 9.067 -17.327 5.845 1.00 0.00 C ATOM 997 O ILE A 65 8.631 -17.261 4.696 1.00 0.00 O ATOM 998 CB ILE A 65 11.268 -17.869 7.038 1.00 0.00 C ATOM 999 CG1 ILE A 65 12.777 -17.721 6.834 1.00 0.00 C ATOM 1000 CG2 ILE A 65 10.795 -19.304 6.798 1.00 0.00 C ATOM 1001 CD1 ILE A 65 13.202 -18.270 5.470 1.00 0.00 C ATOM 0 H ILE A 65 9.672 -15.405 7.396 1.00 0.00 H new ATOM 0 HA ILE A 65 11.036 -16.845 5.212 1.00 0.00 H new ATOM 0 HB ILE A 65 11.059 -17.632 8.081 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.057 -16.670 6.910 1.00 0.00 H new ATOM 0 HG13 ILE A 65 13.308 -18.251 7.625 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.360 -19.985 7.435 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.734 -19.382 7.034 1.00 0.00 H new ATOM 0 HG23 ILE A 65 10.954 -19.570 5.753 1.00 0.00 H new ATOM 0 HD11 ILE A 65 14.279 -18.153 5.350 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.943 -19.327 5.406 1.00 0.00 H new ATOM 0 HD13 ILE A 65 12.687 -17.722 4.681 1.00 0.00 H new ATOM 1013 N GLN A 66 8.377 -17.770 6.885 1.00 0.00 N ATOM 1014 CA GLN A 66 7.005 -18.225 6.734 1.00 0.00 C ATOM 1015 C GLN A 66 6.196 -17.898 7.991 1.00 0.00 C ATOM 1016 O GLN A 66 5.830 -18.795 8.749 1.00 0.00 O ATOM 1017 CB GLN A 66 6.956 -19.723 6.425 1.00 0.00 C ATOM 1018 CG GLN A 66 5.527 -20.171 6.110 1.00 0.00 C ATOM 1019 CD GLN A 66 5.517 -21.556 5.460 1.00 0.00 C ATOM 1020 OE1 GLN A 66 6.254 -22.452 5.837 1.00 0.00 O ATOM 1021 NE2 GLN A 66 4.643 -21.680 4.465 1.00 0.00 N ATOM 0 H GLN A 66 8.742 -17.824 7.836 1.00 0.00 H new ATOM 0 HA GLN A 66 6.558 -17.698 5.891 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.606 -19.945 5.578 1.00 0.00 H new ATOM 0 HB3 GLN A 66 7.338 -20.286 7.276 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.938 -20.192 7.027 1.00 0.00 H new ATOM 0 HG3 GLN A 66 5.054 -19.449 5.444 1.00 0.00 H new ATOM 0 HE21 GLN A 66 4.056 -20.889 4.200 1.00 0.00 H new ATOM 0 HE22 GLN A 66 4.560 -22.566 3.967 1.00 0.00 H new ATOM 1030 N GLY A 67 5.941 -16.611 8.173 1.00 0.00 N ATOM 1031 CA GLY A 67 5.182 -16.154 9.325 1.00 0.00 C ATOM 1032 C GLY A 67 5.374 -14.652 9.547 1.00 0.00 C ATOM 1033 O GLY A 67 6.492 -14.192 9.771 1.00 0.00 O ATOM 0 H GLY A 67 6.246 -15.870 7.542 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.124 -16.371 9.177 1.00 0.00 H new ATOM 0 HA3 GLY A 67 5.499 -16.700 10.214 1.00 0.00 H new ATOM 1037 N GLN A 68 4.265 -13.930 9.478 1.00 0.00 N ATOM 1038 CA GLN A 68 4.297 -12.490 9.669 1.00 0.00 C ATOM 1039 C GLN A 68 2.920 -11.981 10.100 1.00 0.00 C ATOM 1040 O GLN A 68 1.941 -12.135 9.372 1.00 0.00 O ATOM 1041 CB GLN A 68 4.772 -11.779 8.400 1.00 0.00 C ATOM 1042 CG GLN A 68 4.063 -12.334 7.163 1.00 0.00 C ATOM 1043 CD GLN A 68 3.270 -11.238 6.448 1.00 0.00 C ATOM 1044 OE1 GLN A 68 3.700 -10.102 6.328 1.00 0.00 O ATOM 1045 NE2 GLN A 68 2.092 -11.640 5.981 1.00 0.00 N ATOM 0 H GLN A 68 3.339 -14.315 9.293 1.00 0.00 H new ATOM 0 HA GLN A 68 5.011 -12.264 10.461 1.00 0.00 H new ATOM 0 HB2 GLN A 68 4.580 -10.709 8.484 1.00 0.00 H new ATOM 0 HB3 GLN A 68 5.850 -11.902 8.292 1.00 0.00 H new ATOM 0 HG2 GLN A 68 4.797 -12.761 6.480 1.00 0.00 H new ATOM 0 HG3 GLN A 68 3.392 -13.141 7.456 1.00 0.00 H new ATOM 0 HE21 GLN A 68 1.793 -12.606 6.116 1.00 0.00 H new ATOM 0 HE22 GLN A 68 1.488 -10.983 5.488 1.00 0.00 H new ATOM 1054 N ASP A 69 2.889 -11.385 11.283 1.00 0.00 N ATOM 1055 CA ASP A 69 1.648 -10.853 11.820 1.00 0.00 C ATOM 1056 C ASP A 69 1.451 -9.422 11.314 1.00 0.00 C ATOM 1057 O ASP A 69 0.467 -9.130 10.636 1.00 0.00 O ATOM 1058 CB ASP A 69 1.682 -10.813 13.349 1.00 0.00 C ATOM 1059 CG ASP A 69 0.427 -11.352 14.038 1.00 0.00 C ATOM 1060 OD1 ASP A 69 0.177 -12.568 13.891 1.00 0.00 O ATOM 1061 OD2 ASP A 69 -0.254 -10.537 14.696 1.00 0.00 O ATOM 0 H ASP A 69 3.703 -11.259 11.884 1.00 0.00 H new ATOM 0 HA ASP A 69 0.834 -11.501 11.494 1.00 0.00 H new ATOM 0 HB2 ASP A 69 2.542 -11.387 13.693 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.839 -9.782 13.667 1.00 0.00 H new ATOM 1066 N LEU A 70 2.402 -8.568 11.663 1.00 0.00 N ATOM 1067 CA LEU A 70 2.345 -7.176 11.253 1.00 0.00 C ATOM 1068 C LEU A 70 3.726 -6.540 11.428 1.00 0.00 C ATOM 1069 O LEU A 70 4.057 -6.054 12.508 1.00 0.00 O ATOM 1070 CB LEU A 70 1.231 -6.442 12.002 1.00 0.00 C ATOM 1071 CG LEU A 70 -0.136 -6.416 11.315 1.00 0.00 C ATOM 1072 CD1 LEU A 70 -1.205 -7.063 12.197 1.00 0.00 C ATOM 1073 CD2 LEU A 70 -0.517 -4.993 10.904 1.00 0.00 C ATOM 0 H LEU A 70 3.217 -8.814 12.225 1.00 0.00 H new ATOM 0 HA LEU A 70 2.090 -7.101 10.196 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.114 -6.904 12.982 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.550 -5.414 12.171 1.00 0.00 H new ATOM 0 HG LEU A 70 -0.070 -7.008 10.402 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.167 -7.031 11.685 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.934 -8.100 12.396 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -1.277 -6.520 13.139 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.493 -5.004 10.418 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -0.559 -4.358 11.789 1.00 0.00 H new ATOM 0 HD23 LEU A 70 0.229 -4.602 10.212 1.00 0.00 H new ATOM 1085 N SER A 71 4.494 -6.565 10.348 1.00 0.00 N ATOM 1086 CA SER A 71 5.831 -5.998 10.369 1.00 0.00 C ATOM 1087 C SER A 71 5.760 -4.502 10.685 1.00 0.00 C ATOM 1088 O SER A 71 6.632 -3.967 11.368 1.00 0.00 O ATOM 1089 CB SER A 71 6.546 -6.224 9.035 1.00 0.00 C ATOM 1090 OG SER A 71 6.526 -7.595 8.645 1.00 0.00 O ATOM 0 H SER A 71 4.216 -6.969 9.454 1.00 0.00 H new ATOM 0 HA SER A 71 6.404 -6.501 11.148 1.00 0.00 H new ATOM 0 HB2 SER A 71 6.071 -5.620 8.262 1.00 0.00 H new ATOM 0 HB3 SER A 71 7.579 -5.885 9.115 1.00 0.00 H new ATOM 0 HG SER A 71 6.991 -7.698 7.788 1.00 0.00 H new ATOM 1096 N ASP A 72 4.714 -3.871 10.174 1.00 0.00 N ATOM 1097 CA ASP A 72 4.518 -2.448 10.394 1.00 0.00 C ATOM 1098 C ASP A 72 4.426 -2.176 11.896 1.00 0.00 C ATOM 1099 O ASP A 72 4.812 -1.105 12.362 1.00 0.00 O ATOM 1100 CB ASP A 72 3.220 -1.964 9.745 1.00 0.00 C ATOM 1101 CG ASP A 72 3.068 -0.444 9.657 1.00 0.00 C ATOM 1102 OD1 ASP A 72 3.809 0.244 10.392 1.00 0.00 O ATOM 1103 OD2 ASP A 72 2.214 -0.004 8.857 1.00 0.00 O ATOM 0 H ASP A 72 3.993 -4.319 9.608 1.00 0.00 H new ATOM 0 HA ASP A 72 5.362 -1.919 9.951 1.00 0.00 H new ATOM 0 HB2 ASP A 72 3.158 -2.379 8.739 1.00 0.00 H new ATOM 0 HB3 ASP A 72 2.378 -2.366 10.308 1.00 0.00 H new ATOM 1108 N ASP A 73 3.911 -3.164 12.613 1.00 0.00 N ATOM 1109 CA ASP A 73 3.763 -3.045 14.054 1.00 0.00 C ATOM 1110 C ASP A 73 5.139 -3.154 14.714 1.00 0.00 C ATOM 1111 O ASP A 73 5.370 -2.575 15.774 1.00 0.00 O ATOM 1112 CB ASP A 73 2.881 -4.165 14.611 1.00 0.00 C ATOM 1113 CG ASP A 73 2.059 -3.786 15.845 1.00 0.00 C ATOM 1114 OD1 ASP A 73 1.620 -2.617 15.898 1.00 0.00 O ATOM 1115 OD2 ASP A 73 1.889 -4.675 16.708 1.00 0.00 O ATOM 0 H ASP A 73 3.591 -4.051 12.223 1.00 0.00 H new ATOM 0 HA ASP A 73 3.300 -2.081 14.268 1.00 0.00 H new ATOM 0 HB2 ASP A 73 2.200 -4.495 13.827 1.00 0.00 H new ATOM 0 HB3 ASP A 73 3.515 -5.016 14.862 1.00 0.00 H new ATOM 1120 N LYS A 74 6.017 -3.901 14.061 1.00 0.00 N ATOM 1121 CA LYS A 74 7.363 -4.094 14.571 1.00 0.00 C ATOM 1122 C LYS A 74 8.167 -2.807 14.374 1.00 0.00 C ATOM 1123 O LYS A 74 8.706 -2.255 15.332 1.00 0.00 O ATOM 1124 CB LYS A 74 8.008 -5.325 13.932 1.00 0.00 C ATOM 1125 CG LYS A 74 7.579 -6.605 14.654 1.00 0.00 C ATOM 1126 CD LYS A 74 6.757 -7.506 13.729 1.00 0.00 C ATOM 1127 CE LYS A 74 6.012 -8.577 14.529 1.00 0.00 C ATOM 1128 NZ LYS A 74 4.885 -7.975 15.276 1.00 0.00 N ATOM 0 H LYS A 74 5.822 -4.380 13.182 1.00 0.00 H new ATOM 0 HA LYS A 74 7.339 -4.296 15.642 1.00 0.00 H new ATOM 0 HB2 LYS A 74 7.726 -5.384 12.881 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.093 -5.230 13.966 1.00 0.00 H new ATOM 0 HG2 LYS A 74 8.460 -7.143 15.003 1.00 0.00 H new ATOM 0 HG3 LYS A 74 6.991 -6.350 15.536 1.00 0.00 H new ATOM 0 HD2 LYS A 74 6.043 -6.903 13.168 1.00 0.00 H new ATOM 0 HD3 LYS A 74 7.414 -7.982 13.001 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.639 -9.349 13.856 1.00 0.00 H new ATOM 0 HE3 LYS A 74 6.697 -9.064 15.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 4.218 -8.721 15.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 5.248 -7.495 16.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 4.396 -7.286 14.670 1.00 0.00 H new ATOM 1142 N ILE A 75 8.223 -2.367 13.125 1.00 0.00 N ATOM 1143 CA ILE A 75 8.952 -1.156 12.790 1.00 0.00 C ATOM 1144 C ILE A 75 8.378 0.017 13.588 1.00 0.00 C ATOM 1145 O ILE A 75 9.117 0.906 14.009 1.00 0.00 O ATOM 1146 CB ILE A 75 8.949 -0.930 11.277 1.00 0.00 C ATOM 1147 CG1 ILE A 75 10.096 -0.008 10.858 1.00 0.00 C ATOM 1148 CG2 ILE A 75 7.591 -0.407 10.804 1.00 0.00 C ATOM 1149 CD1 ILE A 75 9.673 1.461 10.930 1.00 0.00 C ATOM 0 H ILE A 75 7.775 -2.828 12.333 1.00 0.00 H new ATOM 0 HA ILE A 75 10.000 -1.252 13.073 1.00 0.00 H new ATOM 0 HB ILE A 75 9.113 -1.890 10.788 1.00 0.00 H new ATOM 0 HG12 ILE A 75 10.956 -0.175 11.506 1.00 0.00 H new ATOM 0 HG13 ILE A 75 10.410 -0.250 9.843 1.00 0.00 H new ATOM 0 HG21 ILE A 75 7.616 -0.255 9.725 1.00 0.00 H new ATOM 0 HG22 ILE A 75 6.816 -1.132 11.051 1.00 0.00 H new ATOM 0 HG23 ILE A 75 7.373 0.539 11.299 1.00 0.00 H new ATOM 0 HD11 ILE A 75 10.506 2.095 10.627 1.00 0.00 H new ATOM 0 HD12 ILE A 75 8.828 1.629 10.263 1.00 0.00 H new ATOM 0 HD13 ILE A 75 9.383 1.706 11.952 1.00 0.00 H new ATOM 1161 N GLY A 76 7.067 -0.020 13.773 1.00 0.00 N ATOM 1162 CA GLY A 76 6.386 1.029 14.513 1.00 0.00 C ATOM 1163 C GLY A 76 6.695 0.934 16.009 1.00 0.00 C ATOM 1164 O GLY A 76 6.726 1.947 16.705 1.00 0.00 O ATOM 0 H GLY A 76 6.458 -0.760 13.423 1.00 0.00 H new ATOM 0 HA2 GLY A 76 6.694 2.004 14.136 1.00 0.00 H new ATOM 0 HA3 GLY A 76 5.310 0.951 14.355 1.00 0.00 H new ATOM 1168 N LEU A 77 6.916 -0.293 16.458 1.00 0.00 N ATOM 1169 CA LEU A 77 7.222 -0.533 17.858 1.00 0.00 C ATOM 1170 C LEU A 77 8.593 0.062 18.185 1.00 0.00 C ATOM 1171 O LEU A 77 8.749 0.755 19.189 1.00 0.00 O ATOM 1172 CB LEU A 77 7.104 -2.023 18.184 1.00 0.00 C ATOM 1173 CG LEU A 77 5.885 -2.435 19.011 1.00 0.00 C ATOM 1174 CD1 LEU A 77 5.721 -3.956 19.026 1.00 0.00 C ATOM 1175 CD2 LEU A 77 5.958 -1.852 20.423 1.00 0.00 C ATOM 0 H LEU A 77 6.889 -1.131 15.877 1.00 0.00 H new ATOM 0 HA LEU A 77 6.496 -0.032 18.498 1.00 0.00 H new ATOM 0 HB2 LEU A 77 7.087 -2.579 17.247 1.00 0.00 H new ATOM 0 HB3 LEU A 77 8.002 -2.329 18.720 1.00 0.00 H new ATOM 0 HG LEU A 77 4.995 -2.020 18.537 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.847 -4.222 19.621 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.590 -4.318 18.006 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.609 -4.413 19.462 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.079 -2.160 20.990 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.857 -2.216 20.921 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.990 -0.764 20.366 1.00 0.00 H new ATOM 1187 N LYS A 78 9.552 -0.232 17.319 1.00 0.00 N ATOM 1188 CA LYS A 78 10.905 0.265 17.504 1.00 0.00 C ATOM 1189 C LYS A 78 10.911 1.787 17.343 1.00 0.00 C ATOM 1190 O LYS A 78 11.618 2.488 18.065 1.00 0.00 O ATOM 1191 CB LYS A 78 11.874 -0.456 16.565 1.00 0.00 C ATOM 1192 CG LYS A 78 11.502 -0.212 15.101 1.00 0.00 C ATOM 1193 CD LYS A 78 12.534 -0.839 14.161 1.00 0.00 C ATOM 1194 CE LYS A 78 13.161 0.219 13.251 1.00 0.00 C ATOM 1195 NZ LYS A 78 14.086 -0.412 12.284 1.00 0.00 N ATOM 0 H LYS A 78 9.419 -0.808 16.488 1.00 0.00 H new ATOM 0 HA LYS A 78 11.255 0.049 18.513 1.00 0.00 H new ATOM 0 HB2 LYS A 78 12.891 -0.108 16.749 1.00 0.00 H new ATOM 0 HB3 LYS A 78 11.861 -1.526 16.774 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.517 -0.632 14.898 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.437 0.860 14.912 1.00 0.00 H new ATOM 0 HD2 LYS A 78 13.313 -1.329 14.745 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.058 -1.610 13.555 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.378 0.757 12.716 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.699 0.952 13.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.477 0.316 11.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 14.861 -0.877 12.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.571 -1.119 11.721 1.00 0.00 H new ATOM 1209 N VAL A 79 10.115 2.253 16.392 1.00 0.00 N ATOM 1210 CA VAL A 79 10.020 3.678 16.128 1.00 0.00 C ATOM 1211 C VAL A 79 9.535 4.395 17.389 1.00 0.00 C ATOM 1212 O VAL A 79 10.164 5.349 17.846 1.00 0.00 O ATOM 1213 CB VAL A 79 9.120 3.927 14.915 1.00 0.00 C ATOM 1214 CG1 VAL A 79 8.059 4.984 15.228 1.00 0.00 C ATOM 1215 CG2 VAL A 79 9.946 4.324 13.691 1.00 0.00 C ATOM 0 H VAL A 79 9.530 1.669 15.795 1.00 0.00 H new ATOM 0 HA VAL A 79 10.999 4.086 15.879 1.00 0.00 H new ATOM 0 HB VAL A 79 8.606 2.995 14.682 1.00 0.00 H new ATOM 0 HG11 VAL A 79 7.433 5.142 14.350 1.00 0.00 H new ATOM 0 HG12 VAL A 79 7.440 4.644 16.058 1.00 0.00 H new ATOM 0 HG13 VAL A 79 8.547 5.920 15.499 1.00 0.00 H new ATOM 0 HG21 VAL A 79 9.282 4.495 12.844 1.00 0.00 H new ATOM 0 HG22 VAL A 79 10.501 5.237 13.907 1.00 0.00 H new ATOM 0 HG23 VAL A 79 10.645 3.523 13.448 1.00 0.00 H new ATOM 1225 N LEU A 80 8.420 3.910 17.916 1.00 0.00 N ATOM 1226 CA LEU A 80 7.844 4.492 19.116 1.00 0.00 C ATOM 1227 C LEU A 80 8.873 4.443 20.247 1.00 0.00 C ATOM 1228 O LEU A 80 9.229 5.475 20.813 1.00 0.00 O ATOM 1229 CB LEU A 80 6.519 3.809 19.460 1.00 0.00 C ATOM 1230 CG LEU A 80 5.257 4.648 19.249 1.00 0.00 C ATOM 1231 CD1 LEU A 80 4.170 3.836 18.544 1.00 0.00 C ATOM 1232 CD2 LEU A 80 4.764 5.239 20.572 1.00 0.00 C ATOM 0 H LEU A 80 7.900 3.120 17.533 1.00 0.00 H new ATOM 0 HA LEU A 80 7.602 5.542 18.951 1.00 0.00 H new ATOM 0 HB2 LEU A 80 6.434 2.903 18.860 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.554 3.498 20.504 1.00 0.00 H new ATOM 0 HG LEU A 80 5.508 5.484 18.596 1.00 0.00 H new ATOM 0 HD11 LEU A 80 3.284 4.456 18.407 1.00 0.00 H new ATOM 0 HD12 LEU A 80 4.536 3.505 17.572 1.00 0.00 H new ATOM 0 HD13 LEU A 80 3.914 2.967 19.150 1.00 0.00 H new ATOM 0 HD21 LEU A 80 3.866 5.831 20.394 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.535 4.432 21.268 1.00 0.00 H new ATOM 0 HD23 LEU A 80 5.540 5.876 20.998 1.00 0.00 H new ATOM 1244 N TYR A 81 9.323 3.232 20.542 1.00 0.00 N ATOM 1245 CA TYR A 81 10.304 3.034 21.595 1.00 0.00 C ATOM 1246 C TYR A 81 11.506 3.963 21.407 1.00 0.00 C ATOM 1247 O TYR A 81 12.120 4.395 22.381 1.00 0.00 O ATOM 1248 CB TYR A 81 10.773 1.583 21.469 1.00 0.00 C ATOM 1249 CG TYR A 81 12.143 1.315 22.094 1.00 0.00 C ATOM 1250 CD1 TYR A 81 12.499 1.942 23.271 1.00 0.00 C ATOM 1251 CD2 TYR A 81 13.022 0.445 21.482 1.00 0.00 C ATOM 1252 CE1 TYR A 81 13.789 1.689 23.859 1.00 0.00 C ATOM 1253 CE2 TYR A 81 14.312 0.192 22.070 1.00 0.00 C ATOM 1254 CZ TYR A 81 14.632 0.827 23.230 1.00 0.00 C ATOM 1255 OH TYR A 81 15.850 0.588 23.786 1.00 0.00 O ATOM 0 H TYR A 81 9.026 2.378 20.070 1.00 0.00 H new ATOM 0 HA TYR A 81 9.867 3.249 22.570 1.00 0.00 H new ATOM 0 HB2 TYR A 81 10.037 0.932 21.940 1.00 0.00 H new ATOM 0 HB3 TYR A 81 10.808 1.314 20.413 1.00 0.00 H new ATOM 0 HD1 TYR A 81 11.811 2.622 23.751 1.00 0.00 H new ATOM 0 HD2 TYR A 81 12.742 -0.046 20.562 1.00 0.00 H new ATOM 0 HE1 TYR A 81 14.081 2.173 24.779 1.00 0.00 H new ATOM 0 HE2 TYR A 81 15.009 -0.486 21.601 1.00 0.00 H new ATOM 0 HH TYR A 81 16.363 -0.011 23.204 1.00 0.00 H new ATOM 1265 N LYS A 82 11.804 4.244 20.147 1.00 0.00 N ATOM 1266 CA LYS A 82 12.921 5.114 19.818 1.00 0.00 C ATOM 1267 C LYS A 82 12.535 6.565 20.113 1.00 0.00 C ATOM 1268 O LYS A 82 13.383 7.371 20.493 1.00 0.00 O ATOM 1269 CB LYS A 82 13.377 4.879 18.377 1.00 0.00 C ATOM 1270 CG LYS A 82 14.186 6.069 17.857 1.00 0.00 C ATOM 1271 CD LYS A 82 13.267 7.230 17.470 1.00 0.00 C ATOM 1272 CE LYS A 82 13.718 7.872 16.157 1.00 0.00 C ATOM 1273 NZ LYS A 82 12.987 9.138 15.921 1.00 0.00 N ATOM 0 H LYS A 82 11.292 3.885 19.342 1.00 0.00 H new ATOM 0 HA LYS A 82 13.783 4.880 20.442 1.00 0.00 H new ATOM 0 HB2 LYS A 82 13.982 3.974 18.326 1.00 0.00 H new ATOM 0 HB3 LYS A 82 12.508 4.718 17.738 1.00 0.00 H new ATOM 0 HG2 LYS A 82 14.890 6.397 18.622 1.00 0.00 H new ATOM 0 HG3 LYS A 82 14.775 5.763 16.992 1.00 0.00 H new ATOM 0 HD2 LYS A 82 12.243 6.870 17.370 1.00 0.00 H new ATOM 0 HD3 LYS A 82 13.266 7.978 18.263 1.00 0.00 H new ATOM 0 HE2 LYS A 82 14.790 8.065 16.189 1.00 0.00 H new ATOM 0 HE3 LYS A 82 13.542 7.184 15.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.305 9.561 15.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 11.966 8.945 15.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 13.175 9.798 16.702 1.00 0.00 H new ATOM 1287 N LEU A 83 11.256 6.853 19.927 1.00 0.00 N ATOM 1288 CA LEU A 83 10.747 8.192 20.168 1.00 0.00 C ATOM 1289 C LEU A 83 10.738 8.466 21.673 1.00 0.00 C ATOM 1290 O LEU A 83 11.235 9.497 22.123 1.00 0.00 O ATOM 1291 CB LEU A 83 9.383 8.376 19.501 1.00 0.00 C ATOM 1292 CG LEU A 83 8.888 9.818 19.372 1.00 0.00 C ATOM 1293 CD1 LEU A 83 8.533 10.148 17.920 1.00 0.00 C ATOM 1294 CD2 LEU A 83 7.719 10.084 20.322 1.00 0.00 C ATOM 0 H LEU A 83 10.556 6.181 19.612 1.00 0.00 H new ATOM 0 HA LEU A 83 11.401 8.935 19.712 1.00 0.00 H new ATOM 0 HB2 LEU A 83 9.426 7.937 18.504 1.00 0.00 H new ATOM 0 HB3 LEU A 83 8.644 7.809 20.067 1.00 0.00 H new ATOM 0 HG LEU A 83 9.699 10.485 19.665 1.00 0.00 H new ATOM 0 HD11 LEU A 83 8.184 11.179 17.856 1.00 0.00 H new ATOM 0 HD12 LEU A 83 9.416 10.024 17.292 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.746 9.477 17.576 1.00 0.00 H new ATOM 0 HD21 LEU A 83 7.387 11.116 20.210 1.00 0.00 H new ATOM 0 HD22 LEU A 83 6.896 9.410 20.084 1.00 0.00 H new ATOM 0 HD23 LEU A 83 8.040 9.916 21.350 1.00 0.00 H new ATOM 1306 N MET A 84 10.166 7.525 22.410 1.00 0.00 N ATOM 1307 CA MET A 84 10.085 7.652 23.855 1.00 0.00 C ATOM 1308 C MET A 84 11.479 7.767 24.474 1.00 0.00 C ATOM 1309 O MET A 84 11.793 8.762 25.127 1.00 0.00 O ATOM 1310 CB MET A 84 9.368 6.431 24.435 1.00 0.00 C ATOM 1311 CG MET A 84 7.852 6.638 24.442 1.00 0.00 C ATOM 1312 SD MET A 84 7.369 7.569 25.887 1.00 0.00 S ATOM 1313 CE MET A 84 6.201 8.701 25.150 1.00 0.00 C ATOM 0 H MET A 84 9.754 6.671 22.033 1.00 0.00 H new ATOM 0 HA MET A 84 9.527 8.558 24.091 1.00 0.00 H new ATOM 0 HB2 MET A 84 9.615 5.547 23.848 1.00 0.00 H new ATOM 0 HB3 MET A 84 9.718 6.247 25.451 1.00 0.00 H new ATOM 0 HG2 MET A 84 7.545 7.166 23.539 1.00 0.00 H new ATOM 0 HG3 MET A 84 7.345 5.673 24.435 1.00 0.00 H new ATOM 0 HE1 MET A 84 5.799 9.361 25.919 1.00 0.00 H new ATOM 0 HE2 MET A 84 6.703 9.296 24.387 1.00 0.00 H new ATOM 0 HE3 MET A 84 5.387 8.138 24.694 1.00 0.00 H new ATOM 1323 N ASP A 85 12.280 6.735 24.248 1.00 0.00 N ATOM 1324 CA ASP A 85 13.633 6.708 24.776 1.00 0.00 C ATOM 1325 C ASP A 85 14.369 7.979 24.346 1.00 0.00 C ATOM 1326 O ASP A 85 14.946 8.029 23.261 1.00 0.00 O ATOM 1327 CB ASP A 85 14.411 5.506 24.236 1.00 0.00 C ATOM 1328 CG ASP A 85 15.892 5.469 24.619 1.00 0.00 C ATOM 1329 OD1 ASP A 85 16.366 6.496 25.151 1.00 0.00 O ATOM 1330 OD2 ASP A 85 16.516 4.415 24.371 1.00 0.00 O ATOM 0 H ASP A 85 12.017 5.912 23.706 1.00 0.00 H new ATOM 0 HA ASP A 85 13.570 6.639 25.862 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.935 4.593 24.595 1.00 0.00 H new ATOM 0 HB3 ASP A 85 14.332 5.500 23.149 1.00 0.00 H new ATOM 1335 N VAL A 86 14.324 8.975 25.219 1.00 0.00 N ATOM 1336 CA VAL A 86 14.979 10.242 24.943 1.00 0.00 C ATOM 1337 C VAL A 86 16.266 10.336 25.767 1.00 0.00 C ATOM 1338 O VAL A 86 17.007 11.311 25.657 1.00 0.00 O ATOM 1339 CB VAL A 86 14.014 11.399 25.209 1.00 0.00 C ATOM 1340 CG1 VAL A 86 13.729 11.543 26.705 1.00 0.00 C ATOM 1341 CG2 VAL A 86 14.552 12.707 24.624 1.00 0.00 C ATOM 0 H VAL A 86 13.844 8.930 26.118 1.00 0.00 H new ATOM 0 HA VAL A 86 15.260 10.306 23.892 1.00 0.00 H new ATOM 0 HB VAL A 86 13.072 11.171 24.710 1.00 0.00 H new ATOM 0 HG11 VAL A 86 13.040 12.373 26.866 1.00 0.00 H new ATOM 0 HG12 VAL A 86 13.282 10.622 27.081 1.00 0.00 H new ATOM 0 HG13 VAL A 86 14.661 11.737 27.236 1.00 0.00 H new ATOM 0 HG21 VAL A 86 13.847 13.513 24.827 1.00 0.00 H new ATOM 0 HG22 VAL A 86 15.513 12.942 25.081 1.00 0.00 H new ATOM 0 HG23 VAL A 86 14.679 12.599 23.547 1.00 0.00 H new ATOM 1351 N ASP A 87 16.491 9.308 26.572 1.00 0.00 N ATOM 1352 CA ASP A 87 17.675 9.263 27.414 1.00 0.00 C ATOM 1353 C ASP A 87 18.885 8.870 26.563 1.00 0.00 C ATOM 1354 O ASP A 87 20.011 9.268 26.858 1.00 0.00 O ATOM 1355 CB ASP A 87 17.521 8.223 28.525 1.00 0.00 C ATOM 1356 CG ASP A 87 17.030 6.850 28.062 1.00 0.00 C ATOM 1357 OD1 ASP A 87 17.894 6.050 27.642 1.00 0.00 O ATOM 1358 OD2 ASP A 87 15.802 6.630 28.140 1.00 0.00 O ATOM 0 H ASP A 87 15.874 8.500 26.659 1.00 0.00 H new ATOM 0 HA ASP A 87 17.811 10.249 27.859 1.00 0.00 H new ATOM 0 HB2 ASP A 87 18.483 8.099 29.022 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.825 8.609 29.269 1.00 0.00 H new ATOM 1363 N GLY A 88 18.611 8.095 25.525 1.00 0.00 N ATOM 1364 CA GLY A 88 19.663 7.644 24.629 1.00 0.00 C ATOM 1365 C GLY A 88 20.444 6.480 25.243 1.00 0.00 C ATOM 1366 O GLY A 88 21.605 6.636 25.619 1.00 0.00 O ATOM 0 H GLY A 88 17.676 7.767 25.284 1.00 0.00 H new ATOM 0 HA2 GLY A 88 19.228 7.334 23.679 1.00 0.00 H new ATOM 0 HA3 GLY A 88 20.342 8.469 24.415 1.00 0.00 H new ATOM 1370 N ASP A 89 19.775 5.339 25.325 1.00 0.00 N ATOM 1371 CA ASP A 89 20.392 4.149 25.886 1.00 0.00 C ATOM 1372 C ASP A 89 20.516 3.082 24.797 1.00 0.00 C ATOM 1373 O ASP A 89 21.527 2.386 24.718 1.00 0.00 O ATOM 1374 CB ASP A 89 19.542 3.571 27.019 1.00 0.00 C ATOM 1375 CG ASP A 89 19.672 4.295 28.360 1.00 0.00 C ATOM 1376 OD1 ASP A 89 20.584 5.144 28.460 1.00 0.00 O ATOM 1377 OD2 ASP A 89 18.857 3.984 29.255 1.00 0.00 O ATOM 0 H ASP A 89 18.812 5.214 25.012 1.00 0.00 H new ATOM 0 HA ASP A 89 21.371 4.428 26.275 1.00 0.00 H new ATOM 0 HB2 ASP A 89 18.496 3.589 26.714 1.00 0.00 H new ATOM 0 HB3 ASP A 89 19.815 2.525 27.160 1.00 0.00 H new ATOM 1382 N GLY A 90 19.474 2.988 23.984 1.00 0.00 N ATOM 1383 CA GLY A 90 19.454 2.017 22.902 1.00 0.00 C ATOM 1384 C GLY A 90 18.929 0.665 23.389 1.00 0.00 C ATOM 1385 O GLY A 90 18.578 -0.195 22.582 1.00 0.00 O ATOM 0 H GLY A 90 18.638 3.568 24.052 1.00 0.00 H new ATOM 0 HA2 GLY A 90 18.826 2.384 22.090 1.00 0.00 H new ATOM 0 HA3 GLY A 90 20.459 1.897 22.498 1.00 0.00 H new ATOM 1389 N LYS A 91 18.891 0.520 24.705 1.00 0.00 N ATOM 1390 CA LYS A 91 18.415 -0.713 25.308 1.00 0.00 C ATOM 1391 C LYS A 91 17.259 -0.397 26.259 1.00 0.00 C ATOM 1392 O LYS A 91 17.078 0.750 26.662 1.00 0.00 O ATOM 1393 CB LYS A 91 19.569 -1.466 25.973 1.00 0.00 C ATOM 1394 CG LYS A 91 20.846 -1.363 25.135 1.00 0.00 C ATOM 1395 CD LYS A 91 21.909 -0.531 25.856 1.00 0.00 C ATOM 1396 CE LYS A 91 22.994 -1.428 26.454 1.00 0.00 C ATOM 1397 NZ LYS A 91 24.011 -0.614 27.156 1.00 0.00 N ATOM 0 H LYS A 91 19.182 1.236 25.371 1.00 0.00 H new ATOM 0 HA LYS A 91 18.026 -1.385 24.543 1.00 0.00 H new ATOM 0 HB2 LYS A 91 19.749 -1.058 26.968 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.298 -2.514 26.102 1.00 0.00 H new ATOM 0 HG2 LYS A 91 21.235 -2.361 24.934 1.00 0.00 H new ATOM 0 HG3 LYS A 91 20.617 -0.910 24.170 1.00 0.00 H new ATOM 0 HD2 LYS A 91 22.359 0.174 25.158 1.00 0.00 H new ATOM 0 HD3 LYS A 91 21.442 0.057 26.646 1.00 0.00 H new ATOM 0 HE2 LYS A 91 22.545 -2.138 27.149 1.00 0.00 H new ATOM 0 HE3 LYS A 91 23.468 -2.011 25.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 24.740 -1.239 27.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 24.451 0.046 26.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 23.557 -0.077 27.922 1.00 0.00 H new ATOM 1411 N LEU A 92 16.505 -1.436 26.589 1.00 0.00 N ATOM 1412 CA LEU A 92 15.371 -1.284 27.485 1.00 0.00 C ATOM 1413 C LEU A 92 15.246 -2.533 28.359 1.00 0.00 C ATOM 1414 O LEU A 92 15.826 -3.572 28.049 1.00 0.00 O ATOM 1415 CB LEU A 92 14.103 -0.957 26.693 1.00 0.00 C ATOM 1416 CG LEU A 92 13.441 -2.133 25.973 1.00 0.00 C ATOM 1417 CD1 LEU A 92 12.364 -2.776 26.849 1.00 0.00 C ATOM 1418 CD2 LEU A 92 12.889 -1.702 24.612 1.00 0.00 C ATOM 0 H LEU A 92 16.657 -2.386 26.252 1.00 0.00 H new ATOM 0 HA LEU A 92 15.526 -0.440 28.157 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.375 -0.518 27.375 1.00 0.00 H new ATOM 0 HB3 LEU A 92 14.347 -0.194 25.953 1.00 0.00 H new ATOM 0 HG LEU A 92 14.201 -2.892 25.788 1.00 0.00 H new ATOM 0 HD11 LEU A 92 11.909 -3.609 26.314 1.00 0.00 H new ATOM 0 HD12 LEU A 92 12.815 -3.141 27.772 1.00 0.00 H new ATOM 0 HD13 LEU A 92 11.599 -2.037 27.087 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.424 -2.557 24.121 1.00 0.00 H new ATOM 0 HD22 LEU A 92 12.147 -0.916 24.753 1.00 0.00 H new ATOM 0 HD23 LEU A 92 13.703 -1.326 23.992 1.00 0.00 H new ATOM 1430 N THR A 93 14.483 -2.391 29.433 1.00 0.00 N ATOM 1431 CA THR A 93 14.274 -3.495 30.354 1.00 0.00 C ATOM 1432 C THR A 93 12.784 -3.824 30.462 1.00 0.00 C ATOM 1433 O THR A 93 11.952 -3.164 29.841 1.00 0.00 O ATOM 1434 CB THR A 93 14.912 -3.121 31.693 1.00 0.00 C ATOM 1435 OG1 THR A 93 14.004 -2.181 32.260 1.00 0.00 O ATOM 1436 CG2 THR A 93 16.210 -2.329 31.523 1.00 0.00 C ATOM 0 H THR A 93 14.002 -1.528 29.686 1.00 0.00 H new ATOM 0 HA THR A 93 14.751 -4.406 29.994 1.00 0.00 H new ATOM 0 HB THR A 93 15.112 -4.027 32.265 1.00 0.00 H new ATOM 0 HG1 THR A 93 14.340 -1.887 33.132 1.00 0.00 H new ATOM 0 HG21 THR A 93 16.621 -2.089 32.504 1.00 0.00 H new ATOM 0 HG22 THR A 93 16.930 -2.926 30.964 1.00 0.00 H new ATOM 0 HG23 THR A 93 16.005 -1.406 30.980 1.00 0.00 H new ATOM 1444 N LYS A 94 12.492 -4.845 31.254 1.00 0.00 N ATOM 1445 CA LYS A 94 11.116 -5.270 31.451 1.00 0.00 C ATOM 1446 C LYS A 94 10.403 -4.269 32.362 1.00 0.00 C ATOM 1447 O LYS A 94 9.194 -4.073 32.249 1.00 0.00 O ATOM 1448 CB LYS A 94 11.069 -6.711 31.965 1.00 0.00 C ATOM 1449 CG LYS A 94 11.551 -6.792 33.415 1.00 0.00 C ATOM 1450 CD LYS A 94 11.986 -8.215 33.769 1.00 0.00 C ATOM 1451 CE LYS A 94 11.722 -8.518 35.245 1.00 0.00 C ATOM 1452 NZ LYS A 94 10.535 -9.390 35.390 1.00 0.00 N ATOM 0 H LYS A 94 13.185 -5.391 31.767 1.00 0.00 H new ATOM 0 HA LYS A 94 10.580 -5.276 30.502 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.051 -7.093 31.895 1.00 0.00 H new ATOM 0 HB3 LYS A 94 11.692 -7.346 31.335 1.00 0.00 H new ATOM 0 HG2 LYS A 94 12.384 -6.105 33.564 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.753 -6.474 34.086 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.448 -8.929 33.146 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.047 -8.339 33.553 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.593 -9.004 35.684 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.566 -7.588 35.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.369 -9.586 36.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 9.703 -8.913 34.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.698 -10.285 34.885 1.00 0.00 H new ATOM 1466 N GLU A 95 11.183 -3.661 33.244 1.00 0.00 N ATOM 1467 CA GLU A 95 10.641 -2.684 34.174 1.00 0.00 C ATOM 1468 C GLU A 95 10.345 -1.369 33.450 1.00 0.00 C ATOM 1469 O GLU A 95 9.364 -0.694 33.758 1.00 0.00 O ATOM 1470 CB GLU A 95 11.593 -2.460 35.351 1.00 0.00 C ATOM 1471 CG GLU A 95 10.855 -1.856 36.546 1.00 0.00 C ATOM 1472 CD GLU A 95 10.606 -2.909 37.627 1.00 0.00 C ATOM 1473 OE1 GLU A 95 10.484 -4.094 37.248 1.00 0.00 O ATOM 1474 OE2 GLU A 95 10.545 -2.507 38.809 1.00 0.00 O ATOM 0 H GLU A 95 12.186 -3.826 33.334 1.00 0.00 H new ATOM 0 HA GLU A 95 9.705 -3.074 34.575 1.00 0.00 H new ATOM 0 HB2 GLU A 95 12.048 -3.407 35.641 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.403 -1.797 35.047 1.00 0.00 H new ATOM 0 HG2 GLU A 95 11.439 -1.035 36.961 1.00 0.00 H new ATOM 0 HG3 GLU A 95 9.905 -1.436 36.216 1.00 0.00 H new ATOM 1481 N GLU A 96 11.211 -1.045 32.502 1.00 0.00 N ATOM 1482 CA GLU A 96 11.055 0.177 31.731 1.00 0.00 C ATOM 1483 C GLU A 96 9.918 0.025 30.719 1.00 0.00 C ATOM 1484 O GLU A 96 9.126 0.946 30.526 1.00 0.00 O ATOM 1485 CB GLU A 96 12.363 0.556 31.033 1.00 0.00 C ATOM 1486 CG GLU A 96 12.213 1.871 30.265 1.00 0.00 C ATOM 1487 CD GLU A 96 13.495 2.209 29.501 1.00 0.00 C ATOM 1488 OE1 GLU A 96 13.597 1.762 28.338 1.00 0.00 O ATOM 1489 OE2 GLU A 96 14.343 2.906 30.098 1.00 0.00 O ATOM 0 H GLU A 96 12.024 -1.607 32.250 1.00 0.00 H new ATOM 0 HA GLU A 96 10.800 0.985 32.416 1.00 0.00 H new ATOM 0 HB2 GLU A 96 13.159 0.651 31.771 1.00 0.00 H new ATOM 0 HB3 GLU A 96 12.657 -0.239 30.347 1.00 0.00 H new ATOM 0 HG2 GLU A 96 11.379 1.796 29.567 1.00 0.00 H new ATOM 0 HG3 GLU A 96 11.976 2.677 30.960 1.00 0.00 H new ATOM 1496 N VAL A 97 9.872 -1.146 30.100 1.00 0.00 N ATOM 1497 CA VAL A 97 8.845 -1.430 29.113 1.00 0.00 C ATOM 1498 C VAL A 97 7.477 -1.455 29.799 1.00 0.00 C ATOM 1499 O VAL A 97 6.514 -0.881 29.292 1.00 0.00 O ATOM 1500 CB VAL A 97 9.170 -2.734 28.380 1.00 0.00 C ATOM 1501 CG1 VAL A 97 8.489 -3.926 29.054 1.00 0.00 C ATOM 1502 CG2 VAL A 97 8.782 -2.643 26.903 1.00 0.00 C ATOM 0 H VAL A 97 10.529 -1.909 30.263 1.00 0.00 H new ATOM 0 HA VAL A 97 8.815 -0.646 28.357 1.00 0.00 H new ATOM 0 HB VAL A 97 10.247 -2.890 28.434 1.00 0.00 H new ATOM 0 HG11 VAL A 97 8.736 -4.840 28.514 1.00 0.00 H new ATOM 0 HG12 VAL A 97 8.836 -4.009 30.084 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.409 -3.780 29.045 1.00 0.00 H new ATOM 0 HG21 VAL A 97 9.023 -3.582 26.405 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.712 -2.452 26.819 1.00 0.00 H new ATOM 0 HG23 VAL A 97 9.334 -1.830 26.431 1.00 0.00 H new ATOM 1512 N THR A 98 7.436 -2.127 30.940 1.00 0.00 N ATOM 1513 CA THR A 98 6.202 -2.234 31.700 1.00 0.00 C ATOM 1514 C THR A 98 5.853 -0.891 32.344 1.00 0.00 C ATOM 1515 O THR A 98 4.680 -0.581 32.545 1.00 0.00 O ATOM 1516 CB THR A 98 6.369 -3.368 32.714 1.00 0.00 C ATOM 1517 OG1 THR A 98 5.033 -3.753 33.028 1.00 0.00 O ATOM 1518 CG2 THR A 98 6.940 -2.882 34.048 1.00 0.00 C ATOM 0 H THR A 98 8.237 -2.602 31.356 1.00 0.00 H new ATOM 0 HA THR A 98 5.359 -2.477 31.053 1.00 0.00 H new ATOM 0 HB THR A 98 7.023 -4.134 32.297 1.00 0.00 H new ATOM 0 HG1 THR A 98 5.024 -4.237 33.880 1.00 0.00 H new ATOM 0 HG21 THR A 98 7.038 -3.726 34.731 1.00 0.00 H new ATOM 0 HG22 THR A 98 7.919 -2.433 33.883 1.00 0.00 H new ATOM 0 HG23 THR A 98 6.270 -2.140 34.482 1.00 0.00 H new ATOM 1526 N SER A 99 6.894 -0.129 32.649 1.00 0.00 N ATOM 1527 CA SER A 99 6.712 1.174 33.265 1.00 0.00 C ATOM 1528 C SER A 99 6.005 2.119 32.292 1.00 0.00 C ATOM 1529 O SER A 99 5.088 2.842 32.678 1.00 0.00 O ATOM 1530 CB SER A 99 8.053 1.768 33.703 1.00 0.00 C ATOM 1531 OG SER A 99 8.075 3.187 33.575 1.00 0.00 O ATOM 0 H SER A 99 7.866 -0.389 32.481 1.00 0.00 H new ATOM 0 HA SER A 99 6.093 1.049 34.153 1.00 0.00 H new ATOM 0 HB2 SER A 99 8.250 1.494 34.740 1.00 0.00 H new ATOM 0 HB3 SER A 99 8.854 1.337 33.102 1.00 0.00 H new ATOM 0 HG SER A 99 8.946 3.528 33.866 1.00 0.00 H new ATOM 1537 N PHE A 100 6.459 2.084 31.047 1.00 0.00 N ATOM 1538 CA PHE A 100 5.882 2.929 30.016 1.00 0.00 C ATOM 1539 C PHE A 100 4.520 2.393 29.567 1.00 0.00 C ATOM 1540 O PHE A 100 3.551 3.146 29.480 1.00 0.00 O ATOM 1541 CB PHE A 100 6.843 2.903 28.826 1.00 0.00 C ATOM 1542 CG PHE A 100 6.186 3.240 27.487 1.00 0.00 C ATOM 1543 CD1 PHE A 100 5.366 4.320 27.384 1.00 0.00 C ATOM 1544 CD2 PHE A 100 6.420 2.459 26.398 1.00 0.00 C ATOM 1545 CE1 PHE A 100 4.755 4.633 26.141 1.00 0.00 C ATOM 1546 CE2 PHE A 100 5.810 2.772 25.155 1.00 0.00 C ATOM 1547 CZ PHE A 100 4.990 3.852 25.053 1.00 0.00 C ATOM 0 H PHE A 100 7.220 1.483 30.730 1.00 0.00 H new ATOM 0 HA PHE A 100 5.737 3.939 30.401 1.00 0.00 H new ATOM 0 HB2 PHE A 100 7.652 3.610 29.010 1.00 0.00 H new ATOM 0 HB3 PHE A 100 7.294 1.913 28.758 1.00 0.00 H new ATOM 0 HD1 PHE A 100 5.179 4.940 28.248 1.00 0.00 H new ATOM 0 HD2 PHE A 100 7.070 1.600 26.479 1.00 0.00 H new ATOM 0 HE1 PHE A 100 4.104 5.491 26.060 1.00 0.00 H new ATOM 0 HE2 PHE A 100 5.997 2.152 24.290 1.00 0.00 H new ATOM 0 HZ PHE A 100 4.525 4.090 24.107 1.00 0.00 H new ATOM 1557 N PHE A 101 4.490 1.097 29.295 1.00 0.00 N ATOM 1558 CA PHE A 101 3.264 0.452 28.858 1.00 0.00 C ATOM 1559 C PHE A 101 2.169 0.580 29.919 1.00 0.00 C ATOM 1560 O PHE A 101 1.007 0.815 29.592 1.00 0.00 O ATOM 1561 CB PHE A 101 3.586 -1.029 28.651 1.00 0.00 C ATOM 1562 CG PHE A 101 4.041 -1.374 27.232 1.00 0.00 C ATOM 1563 CD1 PHE A 101 3.358 -0.887 26.161 1.00 0.00 C ATOM 1564 CD2 PHE A 101 5.128 -2.169 27.040 1.00 0.00 C ATOM 1565 CE1 PHE A 101 3.780 -1.208 24.844 1.00 0.00 C ATOM 1566 CE2 PHE A 101 5.550 -2.489 25.723 1.00 0.00 C ATOM 1567 CZ PHE A 101 4.867 -2.002 24.652 1.00 0.00 C ATOM 0 H PHE A 101 5.296 0.476 29.369 1.00 0.00 H new ATOM 0 HA PHE A 101 2.903 0.921 27.943 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.366 -1.322 29.353 1.00 0.00 H new ATOM 0 HB3 PHE A 101 2.702 -1.620 28.892 1.00 0.00 H new ATOM 0 HD1 PHE A 101 2.495 -0.256 26.313 1.00 0.00 H new ATOM 0 HD2 PHE A 101 5.670 -2.557 27.890 1.00 0.00 H new ATOM 0 HE1 PHE A 101 3.237 -0.821 23.994 1.00 0.00 H new ATOM 0 HE2 PHE A 101 6.414 -3.119 25.571 1.00 0.00 H new ATOM 0 HZ PHE A 101 5.188 -2.246 23.650 1.00 0.00 H new ATOM 1577 N LYS A 102 2.579 0.421 31.169 1.00 0.00 N ATOM 1578 CA LYS A 102 1.647 0.516 32.280 1.00 0.00 C ATOM 1579 C LYS A 102 0.742 1.733 32.078 1.00 0.00 C ATOM 1580 O LYS A 102 -0.429 1.709 32.454 1.00 0.00 O ATOM 1581 CB LYS A 102 2.401 0.524 33.611 1.00 0.00 C ATOM 1582 CG LYS A 102 1.474 0.918 34.763 1.00 0.00 C ATOM 1583 CD LYS A 102 1.679 2.383 35.156 1.00 0.00 C ATOM 1584 CE LYS A 102 2.197 2.498 36.591 1.00 0.00 C ATOM 1585 NZ LYS A 102 3.088 3.672 36.729 1.00 0.00 N ATOM 0 H LYS A 102 3.544 0.227 31.437 1.00 0.00 H new ATOM 0 HA LYS A 102 1.000 -0.361 32.312 1.00 0.00 H new ATOM 0 HB2 LYS A 102 2.823 -0.463 33.800 1.00 0.00 H new ATOM 0 HB3 LYS A 102 3.236 1.222 33.556 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.436 0.758 34.470 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.665 0.277 35.624 1.00 0.00 H new ATOM 0 HD2 LYS A 102 2.386 2.851 34.472 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.738 2.924 35.061 1.00 0.00 H new ATOM 0 HE2 LYS A 102 1.358 2.588 37.281 1.00 0.00 H new ATOM 0 HE3 LYS A 102 2.737 1.591 36.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.430 3.735 37.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 3.898 3.570 36.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 2.562 4.537 36.490 1.00 0.00 H new ATOM 1599 N LYS A 103 1.319 2.768 31.485 1.00 0.00 N ATOM 1600 CA LYS A 103 0.578 3.991 31.229 1.00 0.00 C ATOM 1601 C LYS A 103 -0.722 3.652 30.498 1.00 0.00 C ATOM 1602 O LYS A 103 -1.766 4.242 30.773 1.00 0.00 O ATOM 1603 CB LYS A 103 1.455 5.003 30.487 1.00 0.00 C ATOM 1604 CG LYS A 103 0.801 6.386 30.469 1.00 0.00 C ATOM 1605 CD LYS A 103 -0.153 6.527 29.282 1.00 0.00 C ATOM 1606 CE LYS A 103 0.118 7.820 28.511 1.00 0.00 C ATOM 1607 NZ LYS A 103 -1.155 8.476 28.135 1.00 0.00 N ATOM 0 H LYS A 103 2.291 2.785 31.175 1.00 0.00 H new ATOM 0 HA LYS A 103 0.300 4.471 32.167 1.00 0.00 H new ATOM 0 HB2 LYS A 103 2.431 5.065 30.968 1.00 0.00 H new ATOM 0 HB3 LYS A 103 1.624 4.663 29.465 1.00 0.00 H new ATOM 0 HG2 LYS A 103 0.256 6.546 31.399 1.00 0.00 H new ATOM 0 HG3 LYS A 103 1.571 7.155 30.414 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -0.039 5.672 28.616 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -1.184 6.520 29.637 1.00 0.00 H new ATOM 0 HE2 LYS A 103 0.716 8.496 29.122 1.00 0.00 H new ATOM 0 HE3 LYS A 103 0.700 7.601 27.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -0.953 9.352 27.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -1.712 7.835 27.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -1.696 8.702 28.994 1.00 0.00 H new ATOM 1621 N HIS A 104 -0.618 2.702 29.580 1.00 0.00 N ATOM 1622 CA HIS A 104 -1.772 2.277 28.808 1.00 0.00 C ATOM 1623 C HIS A 104 -2.737 1.505 29.710 1.00 0.00 C ATOM 1624 O HIS A 104 -3.920 1.836 29.787 1.00 0.00 O ATOM 1625 CB HIS A 104 -1.339 1.475 27.579 1.00 0.00 C ATOM 1626 CG HIS A 104 -1.686 2.130 26.264 1.00 0.00 C ATOM 1627 ND1 HIS A 104 -1.773 1.426 25.075 1.00 0.00 N ATOM 1628 CD2 HIS A 104 -1.968 3.430 25.963 1.00 0.00 C ATOM 1629 CE1 HIS A 104 -2.092 2.275 24.109 1.00 0.00 C ATOM 1630 NE2 HIS A 104 -2.212 3.516 24.661 1.00 0.00 N ATOM 0 H HIS A 104 0.249 2.215 29.354 1.00 0.00 H new ATOM 0 HA HIS A 104 -2.303 3.151 28.430 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -0.261 1.318 27.622 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -1.806 0.491 27.617 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -1.989 4.250 26.665 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -2.232 2.027 23.067 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -2.450 4.370 24.156 1.00 0.00 H new ATOM 1638 N GLY A 105 -2.197 0.491 30.369 1.00 0.00 N ATOM 1639 CA GLY A 105 -2.995 -0.331 31.263 1.00 0.00 C ATOM 1640 C GLY A 105 -2.900 -1.809 30.880 1.00 0.00 C ATOM 1641 O GLY A 105 -3.523 -2.659 31.514 1.00 0.00 O ATOM 0 H GLY A 105 -1.216 0.220 30.302 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -2.654 -0.195 32.289 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.036 -0.009 31.227 1.00 0.00 H new ATOM 1645 N ILE A 106 -2.115 -2.070 29.846 1.00 0.00 N ATOM 1646 CA ILE A 106 -1.930 -3.431 29.371 1.00 0.00 C ATOM 1647 C ILE A 106 -0.696 -4.037 30.044 1.00 0.00 C ATOM 1648 O ILE A 106 0.410 -3.949 29.515 1.00 0.00 O ATOM 1649 CB ILE A 106 -1.875 -3.463 27.842 1.00 0.00 C ATOM 1650 CG1 ILE A 106 -3.277 -3.597 27.246 1.00 0.00 C ATOM 1651 CG2 ILE A 106 -0.934 -4.565 27.350 1.00 0.00 C ATOM 1652 CD1 ILE A 106 -3.577 -2.444 26.286 1.00 0.00 C ATOM 0 H ILE A 106 -1.599 -1.362 29.323 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.783 -4.051 29.648 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.467 -2.514 27.495 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.362 -4.547 26.718 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -4.017 -3.610 28.047 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -0.913 -4.566 26.260 1.00 0.00 H new ATOM 0 HG22 ILE A 106 0.071 -4.383 27.732 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -1.288 -5.532 27.707 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -4.580 -2.563 25.876 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -3.515 -1.498 26.823 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.850 -2.448 25.474 1.00 0.00 H new ATOM 1664 N GLU A 107 -0.929 -4.641 31.200 1.00 0.00 N ATOM 1665 CA GLU A 107 0.149 -5.262 31.950 1.00 0.00 C ATOM 1666 C GLU A 107 0.580 -6.567 31.278 1.00 0.00 C ATOM 1667 O GLU A 107 1.732 -6.981 31.400 1.00 0.00 O ATOM 1668 CB GLU A 107 -0.263 -5.504 33.404 1.00 0.00 C ATOM 1669 CG GLU A 107 -1.339 -6.587 33.496 1.00 0.00 C ATOM 1670 CD GLU A 107 -1.588 -6.990 34.951 1.00 0.00 C ATOM 1671 OE1 GLU A 107 -0.597 -7.368 35.613 1.00 0.00 O ATOM 1672 OE2 GLU A 107 -2.764 -6.912 35.368 1.00 0.00 O ATOM 0 H GLU A 107 -1.849 -4.713 31.635 1.00 0.00 H new ATOM 0 HA GLU A 107 1.000 -4.581 31.956 1.00 0.00 H new ATOM 0 HB2 GLU A 107 0.608 -5.801 33.988 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.637 -4.577 33.839 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -2.266 -6.223 33.052 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -1.031 -7.460 32.921 1.00 0.00 H new ATOM 1679 N LYS A 108 -0.368 -7.179 30.584 1.00 0.00 N ATOM 1680 CA LYS A 108 -0.101 -8.429 29.892 1.00 0.00 C ATOM 1681 C LYS A 108 1.226 -8.316 29.138 1.00 0.00 C ATOM 1682 O LYS A 108 1.917 -9.313 28.938 1.00 0.00 O ATOM 1683 CB LYS A 108 -1.284 -8.812 29.001 1.00 0.00 C ATOM 1684 CG LYS A 108 -1.528 -7.750 27.927 1.00 0.00 C ATOM 1685 CD LYS A 108 -2.208 -8.358 26.699 1.00 0.00 C ATOM 1686 CE LYS A 108 -1.177 -8.964 25.745 1.00 0.00 C ATOM 1687 NZ LYS A 108 -1.843 -9.511 24.542 1.00 0.00 N ATOM 0 H LYS A 108 -1.322 -6.833 30.486 1.00 0.00 H new ATOM 0 HA LYS A 108 0.006 -9.245 30.607 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -1.091 -9.775 28.528 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -2.180 -8.930 29.611 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -2.150 -6.952 28.334 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.580 -7.298 27.636 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.914 -9.127 27.013 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.782 -7.591 26.180 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -0.452 -8.204 25.453 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -0.623 -9.754 26.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -1.129 -9.918 23.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -2.517 -10.251 24.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -2.351 -8.749 24.050 1.00 0.00 H new ATOM 1701 N VAL A 109 1.541 -7.092 28.740 1.00 0.00 N ATOM 1702 CA VAL A 109 2.772 -6.836 28.012 1.00 0.00 C ATOM 1703 C VAL A 109 3.963 -7.302 28.853 1.00 0.00 C ATOM 1704 O VAL A 109 4.950 -7.800 28.314 1.00 0.00 O ATOM 1705 CB VAL A 109 2.855 -5.357 27.628 1.00 0.00 C ATOM 1706 CG1 VAL A 109 3.553 -4.545 28.720 1.00 0.00 C ATOM 1707 CG2 VAL A 109 3.556 -5.179 26.280 1.00 0.00 C ATOM 0 H VAL A 109 0.965 -6.267 28.908 1.00 0.00 H new ATOM 0 HA VAL A 109 2.789 -7.402 27.081 1.00 0.00 H new ATOM 0 HB VAL A 109 1.837 -4.979 27.529 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.599 -3.498 28.422 1.00 0.00 H new ATOM 0 HG12 VAL A 109 2.994 -4.633 29.652 1.00 0.00 H new ATOM 0 HG13 VAL A 109 4.564 -4.925 28.866 1.00 0.00 H new ATOM 0 HG21 VAL A 109 3.602 -4.119 26.031 1.00 0.00 H new ATOM 0 HG22 VAL A 109 4.567 -5.582 26.340 1.00 0.00 H new ATOM 0 HG23 VAL A 109 2.999 -5.710 25.508 1.00 0.00 H new ATOM 1717 N ALA A 110 3.830 -7.125 30.159 1.00 0.00 N ATOM 1718 CA ALA A 110 4.883 -7.521 31.079 1.00 0.00 C ATOM 1719 C ALA A 110 4.983 -9.048 31.105 1.00 0.00 C ATOM 1720 O ALA A 110 6.072 -9.599 31.251 1.00 0.00 O ATOM 1721 CB ALA A 110 4.601 -6.931 32.462 1.00 0.00 C ATOM 0 H ALA A 110 3.009 -6.713 30.602 1.00 0.00 H new ATOM 0 HA ALA A 110 5.847 -7.133 30.750 1.00 0.00 H new ATOM 0 HB1 ALA A 110 5.391 -7.228 33.152 1.00 0.00 H new ATOM 0 HB2 ALA A 110 4.568 -5.844 32.394 1.00 0.00 H new ATOM 0 HB3 ALA A 110 3.643 -7.301 32.827 1.00 0.00 H new ATOM 1727 N GLU A 111 3.831 -9.687 30.961 1.00 0.00 N ATOM 1728 CA GLU A 111 3.775 -11.139 30.966 1.00 0.00 C ATOM 1729 C GLU A 111 4.396 -11.698 29.684 1.00 0.00 C ATOM 1730 O GLU A 111 5.189 -12.637 29.733 1.00 0.00 O ATOM 1731 CB GLU A 111 2.338 -11.632 31.140 1.00 0.00 C ATOM 1732 CG GLU A 111 2.307 -13.013 31.796 1.00 0.00 C ATOM 1733 CD GLU A 111 2.044 -12.900 33.300 1.00 0.00 C ATOM 1734 OE1 GLU A 111 2.821 -12.177 33.959 1.00 0.00 O ATOM 1735 OE2 GLU A 111 1.072 -13.540 33.755 1.00 0.00 O ATOM 0 H GLU A 111 2.929 -9.226 30.840 1.00 0.00 H new ATOM 0 HA GLU A 111 4.353 -11.503 31.815 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.778 -10.923 31.750 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.845 -11.676 30.169 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.531 -13.622 31.332 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.256 -13.522 31.626 1.00 0.00 H new ATOM 1742 N GLN A 112 4.010 -11.099 28.567 1.00 0.00 N ATOM 1743 CA GLN A 112 4.518 -11.526 27.275 1.00 0.00 C ATOM 1744 C GLN A 112 5.990 -11.134 27.128 1.00 0.00 C ATOM 1745 O GLN A 112 6.758 -11.831 26.466 1.00 0.00 O ATOM 1746 CB GLN A 112 3.680 -10.942 26.136 1.00 0.00 C ATOM 1747 CG GLN A 112 4.222 -9.581 25.697 1.00 0.00 C ATOM 1748 CD GLN A 112 3.324 -8.951 24.630 1.00 0.00 C ATOM 1749 OE1 GLN A 112 3.760 -8.590 23.549 1.00 0.00 O ATOM 1750 NE2 GLN A 112 2.049 -8.840 24.992 1.00 0.00 N ATOM 0 H GLN A 112 3.351 -10.321 28.530 1.00 0.00 H new ATOM 0 HA GLN A 112 4.443 -12.612 27.218 1.00 0.00 H new ATOM 0 HB2 GLN A 112 3.683 -11.628 25.289 1.00 0.00 H new ATOM 0 HB3 GLN A 112 2.644 -10.838 26.459 1.00 0.00 H new ATOM 0 HG2 GLN A 112 4.289 -8.917 26.559 1.00 0.00 H new ATOM 0 HG3 GLN A 112 5.232 -9.697 25.305 1.00 0.00 H new ATOM 0 HE21 GLN A 112 1.750 -9.162 25.912 1.00 0.00 H new ATOM 0 HE22 GLN A 112 1.370 -8.433 24.349 1.00 0.00 H new ATOM 1759 N VAL A 113 6.339 -10.021 27.755 1.00 0.00 N ATOM 1760 CA VAL A 113 7.705 -9.528 27.703 1.00 0.00 C ATOM 1761 C VAL A 113 8.595 -10.411 28.580 1.00 0.00 C ATOM 1762 O VAL A 113 9.745 -10.678 28.234 1.00 0.00 O ATOM 1763 CB VAL A 113 7.745 -8.053 28.104 1.00 0.00 C ATOM 1764 CG1 VAL A 113 9.177 -7.607 28.410 1.00 0.00 C ATOM 1765 CG2 VAL A 113 7.116 -7.173 27.022 1.00 0.00 C ATOM 0 H VAL A 113 5.699 -9.446 28.302 1.00 0.00 H new ATOM 0 HA VAL A 113 8.093 -9.584 26.686 1.00 0.00 H new ATOM 0 HB VAL A 113 7.156 -7.937 29.014 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.178 -6.554 28.693 1.00 0.00 H new ATOM 0 HG12 VAL A 113 9.576 -8.203 29.230 1.00 0.00 H new ATOM 0 HG13 VAL A 113 9.798 -7.746 27.525 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.157 -6.129 27.333 1.00 0.00 H new ATOM 0 HG22 VAL A 113 7.665 -7.296 26.088 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.077 -7.466 26.873 1.00 0.00 H new ATOM 1775 N MET A 114 8.029 -10.840 29.699 1.00 0.00 N ATOM 1776 CA MET A 114 8.757 -11.687 30.628 1.00 0.00 C ATOM 1777 C MET A 114 8.939 -13.096 30.060 1.00 0.00 C ATOM 1778 O MET A 114 9.972 -13.728 30.275 1.00 0.00 O ATOM 1779 CB MET A 114 7.994 -11.765 31.952 1.00 0.00 C ATOM 1780 CG MET A 114 8.863 -12.384 33.050 1.00 0.00 C ATOM 1781 SD MET A 114 8.451 -14.108 33.255 1.00 0.00 S ATOM 1782 CE MET A 114 7.087 -13.968 34.398 1.00 0.00 C ATOM 0 H MET A 114 7.075 -10.617 29.983 1.00 0.00 H new ATOM 0 HA MET A 114 9.743 -11.252 30.791 1.00 0.00 H new ATOM 0 HB2 MET A 114 7.678 -10.766 32.253 1.00 0.00 H new ATOM 0 HB3 MET A 114 7.090 -12.359 31.820 1.00 0.00 H new ATOM 0 HG2 MET A 114 9.917 -12.282 32.792 1.00 0.00 H new ATOM 0 HG3 MET A 114 8.711 -11.851 33.989 1.00 0.00 H new ATOM 0 HE1 MET A 114 6.707 -14.962 34.634 1.00 0.00 H new ATOM 0 HE2 MET A 114 7.427 -13.482 35.313 1.00 0.00 H new ATOM 0 HE3 MET A 114 6.293 -13.374 33.946 1.00 0.00 H new ATOM 1792 N LYS A 115 7.919 -13.547 29.344 1.00 0.00 N ATOM 1793 CA LYS A 115 7.953 -14.869 28.743 1.00 0.00 C ATOM 1794 C LYS A 115 8.872 -14.845 27.520 1.00 0.00 C ATOM 1795 O LYS A 115 9.538 -15.834 27.220 1.00 0.00 O ATOM 1796 CB LYS A 115 6.535 -15.355 28.437 1.00 0.00 C ATOM 1797 CG LYS A 115 6.059 -16.356 29.492 1.00 0.00 C ATOM 1798 CD LYS A 115 6.880 -17.646 29.434 1.00 0.00 C ATOM 1799 CE LYS A 115 6.070 -18.785 28.812 1.00 0.00 C ATOM 1800 NZ LYS A 115 5.301 -19.503 29.853 1.00 0.00 N ATOM 0 H LYS A 115 7.064 -13.020 29.167 1.00 0.00 H new ATOM 0 HA LYS A 115 8.370 -15.594 29.442 1.00 0.00 H new ATOM 0 HB2 LYS A 115 5.854 -14.504 28.404 1.00 0.00 H new ATOM 0 HB3 LYS A 115 6.511 -15.821 27.452 1.00 0.00 H new ATOM 0 HG2 LYS A 115 6.143 -15.912 30.484 1.00 0.00 H new ATOM 0 HG3 LYS A 115 5.005 -16.584 29.333 1.00 0.00 H new ATOM 0 HD2 LYS A 115 7.786 -17.479 28.851 1.00 0.00 H new ATOM 0 HD3 LYS A 115 7.195 -17.926 30.439 1.00 0.00 H new ATOM 0 HE2 LYS A 115 5.390 -18.387 28.059 1.00 0.00 H new ATOM 0 HE3 LYS A 115 6.739 -19.479 28.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 4.757 -20.273 29.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 5.956 -19.900 30.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 4.649 -18.842 30.321 1.00 0.00 H new ATOM 1814 N ALA A 116 8.878 -13.704 26.847 1.00 0.00 N ATOM 1815 CA ALA A 116 9.704 -13.537 25.663 1.00 0.00 C ATOM 1816 C ALA A 116 11.180 -13.593 26.065 1.00 0.00 C ATOM 1817 O ALA A 116 11.990 -14.215 25.380 1.00 0.00 O ATOM 1818 CB ALA A 116 9.339 -12.226 24.965 1.00 0.00 C ATOM 0 H ALA A 116 8.324 -12.886 27.099 1.00 0.00 H new ATOM 0 HA ALA A 116 9.524 -14.344 24.953 1.00 0.00 H new ATOM 0 HB1 ALA A 116 9.959 -12.102 24.077 1.00 0.00 H new ATOM 0 HB2 ALA A 116 8.289 -12.249 24.674 1.00 0.00 H new ATOM 0 HB3 ALA A 116 9.509 -11.392 25.646 1.00 0.00 H new ATOM 1824 N ASP A 117 11.483 -12.934 27.173 1.00 0.00 N ATOM 1825 CA ASP A 117 12.847 -12.900 27.674 1.00 0.00 C ATOM 1826 C ASP A 117 13.097 -14.133 28.545 1.00 0.00 C ATOM 1827 O ASP A 117 13.003 -14.062 29.769 1.00 0.00 O ATOM 1828 CB ASP A 117 13.088 -11.658 28.534 1.00 0.00 C ATOM 1829 CG ASP A 117 14.530 -11.468 29.007 1.00 0.00 C ATOM 1830 OD1 ASP A 117 15.160 -12.497 29.335 1.00 0.00 O ATOM 1831 OD2 ASP A 117 14.971 -10.299 29.031 1.00 0.00 O ATOM 0 H ASP A 117 10.808 -12.419 27.738 1.00 0.00 H new ATOM 0 HA ASP A 117 13.520 -12.881 26.817 1.00 0.00 H new ATOM 0 HB2 ASP A 117 12.789 -10.777 27.965 1.00 0.00 H new ATOM 0 HB3 ASP A 117 12.439 -11.708 29.408 1.00 0.00 H new ATOM 1836 N ALA A 118 13.409 -15.235 27.878 1.00 0.00 N ATOM 1837 CA ALA A 118 13.673 -16.482 28.576 1.00 0.00 C ATOM 1838 C ALA A 118 15.164 -16.570 28.909 1.00 0.00 C ATOM 1839 O ALA A 118 15.804 -17.585 28.642 1.00 0.00 O ATOM 1840 CB ALA A 118 13.196 -17.657 27.720 1.00 0.00 C ATOM 0 H ALA A 118 13.485 -15.290 26.862 1.00 0.00 H new ATOM 0 HA ALA A 118 13.123 -16.519 29.516 1.00 0.00 H new ATOM 0 HB1 ALA A 118 13.394 -18.592 28.243 1.00 0.00 H new ATOM 0 HB2 ALA A 118 12.126 -17.563 27.537 1.00 0.00 H new ATOM 0 HB3 ALA A 118 13.728 -17.654 26.769 1.00 0.00 H new ATOM 1846 N ASN A 119 15.673 -15.492 29.487 1.00 0.00 N ATOM 1847 CA ASN A 119 17.076 -15.435 29.859 1.00 0.00 C ATOM 1848 C ASN A 119 17.192 -15.308 31.379 1.00 0.00 C ATOM 1849 O ASN A 119 17.955 -16.038 32.010 1.00 0.00 O ATOM 1850 CB ASN A 119 17.764 -14.221 29.230 1.00 0.00 C ATOM 1851 CG ASN A 119 17.350 -14.054 27.767 1.00 0.00 C ATOM 1852 OD1 ASN A 119 16.990 -12.979 27.315 1.00 0.00 O ATOM 1853 ND2 ASN A 119 17.422 -15.174 27.053 1.00 0.00 N ATOM 0 H ASN A 119 15.139 -14.651 29.707 1.00 0.00 H new ATOM 0 HA ASN A 119 17.556 -16.347 29.503 1.00 0.00 H new ATOM 0 HB2 ASN A 119 17.506 -13.322 29.790 1.00 0.00 H new ATOM 0 HB3 ASN A 119 18.846 -14.337 29.295 1.00 0.00 H new ATOM 0 HD21 ASN A 119 17.168 -15.166 26.065 1.00 0.00 H new ATOM 0 HD22 ASN A 119 17.732 -16.040 27.493 1.00 0.00 H new ATOM 1860 N GLY A 120 16.422 -14.377 31.924 1.00 0.00 N ATOM 1861 CA GLY A 120 16.429 -14.146 33.358 1.00 0.00 C ATOM 1862 C GLY A 120 17.203 -12.872 33.705 1.00 0.00 C ATOM 1863 O GLY A 120 17.195 -12.429 34.853 1.00 0.00 O ATOM 0 H GLY A 120 15.789 -13.774 31.398 1.00 0.00 H new ATOM 0 HA2 GLY A 120 15.405 -14.064 33.722 1.00 0.00 H new ATOM 0 HA3 GLY A 120 16.880 -14.999 33.865 1.00 0.00 H new ATOM 1867 N ASP A 121 17.854 -12.319 32.692 1.00 0.00 N ATOM 1868 CA ASP A 121 18.631 -11.105 32.875 1.00 0.00 C ATOM 1869 C ASP A 121 17.701 -9.968 33.300 1.00 0.00 C ATOM 1870 O ASP A 121 17.988 -9.251 34.258 1.00 0.00 O ATOM 1871 CB ASP A 121 19.320 -10.691 31.573 1.00 0.00 C ATOM 1872 CG ASP A 121 18.383 -10.499 30.379 1.00 0.00 C ATOM 1873 OD1 ASP A 121 17.300 -11.122 30.401 1.00 0.00 O ATOM 1874 OD2 ASP A 121 18.772 -9.734 29.470 1.00 0.00 O ATOM 0 H ASP A 121 17.859 -12.689 31.742 1.00 0.00 H new ATOM 0 HA ASP A 121 19.386 -11.300 33.637 1.00 0.00 H new ATOM 0 HB2 ASP A 121 19.860 -9.760 31.745 1.00 0.00 H new ATOM 0 HB3 ASP A 121 20.062 -11.447 31.316 1.00 0.00 H new ATOM 1879 N GLY A 122 16.604 -9.838 32.568 1.00 0.00 N ATOM 1880 CA GLY A 122 15.629 -8.800 32.858 1.00 0.00 C ATOM 1881 C GLY A 122 15.914 -7.537 32.043 1.00 0.00 C ATOM 1882 O GLY A 122 15.570 -6.433 32.461 1.00 0.00 O ATOM 0 H GLY A 122 16.369 -10.434 31.775 1.00 0.00 H new ATOM 0 HA2 GLY A 122 14.627 -9.164 32.632 1.00 0.00 H new ATOM 0 HA3 GLY A 122 15.650 -8.563 33.922 1.00 0.00 H new ATOM 1886 N TYR A 123 16.541 -7.743 30.893 1.00 0.00 N ATOM 1887 CA TYR A 123 16.876 -6.635 30.015 1.00 0.00 C ATOM 1888 C TYR A 123 16.911 -7.084 28.553 1.00 0.00 C ATOM 1889 O TYR A 123 17.053 -8.273 28.269 1.00 0.00 O ATOM 1890 CB TYR A 123 18.277 -6.178 30.429 1.00 0.00 C ATOM 1891 CG TYR A 123 18.365 -5.671 31.870 1.00 0.00 C ATOM 1892 CD1 TYR A 123 18.352 -6.568 32.919 1.00 0.00 C ATOM 1893 CD2 TYR A 123 18.459 -4.317 32.121 1.00 0.00 C ATOM 1894 CE1 TYR A 123 18.435 -6.091 34.275 1.00 0.00 C ATOM 1895 CE2 TYR A 123 18.542 -3.840 33.477 1.00 0.00 C ATOM 1896 CZ TYR A 123 18.526 -4.750 34.487 1.00 0.00 C ATOM 1897 OH TYR A 123 18.605 -4.300 35.768 1.00 0.00 O ATOM 0 H TYR A 123 16.825 -8.660 30.550 1.00 0.00 H new ATOM 0 HA TYR A 123 16.134 -5.841 30.100 1.00 0.00 H new ATOM 0 HB2 TYR A 123 18.971 -7.009 30.304 1.00 0.00 H new ATOM 0 HB3 TYR A 123 18.604 -5.386 29.755 1.00 0.00 H new ATOM 0 HD1 TYR A 123 18.280 -7.628 32.723 1.00 0.00 H new ATOM 0 HD2 TYR A 123 18.470 -3.615 31.300 1.00 0.00 H new ATOM 0 HE1 TYR A 123 18.425 -6.782 35.105 1.00 0.00 H new ATOM 0 HE2 TYR A 123 18.615 -2.783 33.687 1.00 0.00 H new ATOM 0 HH TYR A 123 18.666 -3.322 35.768 1.00 0.00 H new ATOM 1907 N ILE A 124 16.778 -6.111 27.665 1.00 0.00 N ATOM 1908 CA ILE A 124 16.793 -6.391 26.239 1.00 0.00 C ATOM 1909 C ILE A 124 17.305 -5.162 25.487 1.00 0.00 C ATOM 1910 O ILE A 124 17.363 -4.067 26.045 1.00 0.00 O ATOM 1911 CB ILE A 124 15.416 -6.868 25.773 1.00 0.00 C ATOM 1912 CG1 ILE A 124 14.430 -5.701 25.690 1.00 0.00 C ATOM 1913 CG2 ILE A 124 14.895 -7.996 26.666 1.00 0.00 C ATOM 1914 CD1 ILE A 124 13.218 -6.067 24.831 1.00 0.00 C ATOM 0 H ILE A 124 16.659 -5.127 27.905 1.00 0.00 H new ATOM 0 HA ILE A 124 17.480 -7.208 26.018 1.00 0.00 H new ATOM 0 HB ILE A 124 15.518 -7.275 24.767 1.00 0.00 H new ATOM 0 HG12 ILE A 124 14.100 -5.427 26.692 1.00 0.00 H new ATOM 0 HG13 ILE A 124 14.929 -4.828 25.269 1.00 0.00 H new ATOM 0 HG21 ILE A 124 13.915 -8.316 26.313 1.00 0.00 H new ATOM 0 HG22 ILE A 124 15.587 -8.838 26.630 1.00 0.00 H new ATOM 0 HG23 ILE A 124 14.812 -7.639 27.692 1.00 0.00 H new ATOM 0 HD11 ILE A 124 12.533 -5.220 24.789 1.00 0.00 H new ATOM 0 HD12 ILE A 124 13.549 -6.317 23.823 1.00 0.00 H new ATOM 0 HD13 ILE A 124 12.708 -6.925 25.269 1.00 0.00 H new ATOM 1926 N THR A 125 17.663 -5.383 24.230 1.00 0.00 N ATOM 1927 CA THR A 125 18.168 -4.306 23.395 1.00 0.00 C ATOM 1928 C THR A 125 17.297 -4.146 22.148 1.00 0.00 C ATOM 1929 O THR A 125 16.341 -4.894 21.953 1.00 0.00 O ATOM 1930 CB THR A 125 19.635 -4.602 23.079 1.00 0.00 C ATOM 1931 OG1 THR A 125 19.577 -5.632 22.095 1.00 0.00 O ATOM 1932 CG2 THR A 125 20.369 -5.251 24.254 1.00 0.00 C ATOM 0 H THR A 125 17.613 -6.292 23.770 1.00 0.00 H new ATOM 0 HA THR A 125 18.119 -3.347 23.912 1.00 0.00 H new ATOM 0 HB THR A 125 20.140 -3.676 22.803 1.00 0.00 H new ATOM 0 HG1 THR A 125 20.487 -5.884 21.831 1.00 0.00 H new ATOM 0 HG21 THR A 125 21.406 -5.440 23.976 1.00 0.00 H new ATOM 0 HG22 THR A 125 20.340 -4.583 25.115 1.00 0.00 H new ATOM 0 HG23 THR A 125 19.885 -6.193 24.510 1.00 0.00 H new ATOM 1940 N LEU A 126 17.660 -3.164 21.334 1.00 0.00 N ATOM 1941 CA LEU A 126 16.924 -2.896 20.111 1.00 0.00 C ATOM 1942 C LEU A 126 17.177 -4.025 19.110 1.00 0.00 C ATOM 1943 O LEU A 126 16.264 -4.451 18.405 1.00 0.00 O ATOM 1944 CB LEU A 126 17.271 -1.507 19.571 1.00 0.00 C ATOM 1945 CG LEU A 126 16.395 -0.995 18.425 1.00 0.00 C ATOM 1946 CD1 LEU A 126 15.307 -0.054 18.945 1.00 0.00 C ATOM 1947 CD2 LEU A 126 17.246 -0.341 17.335 1.00 0.00 C ATOM 0 H LEU A 126 18.454 -2.545 21.498 1.00 0.00 H new ATOM 0 HA LEU A 126 15.852 -2.878 20.308 1.00 0.00 H new ATOM 0 HB2 LEU A 126 17.212 -0.794 20.393 1.00 0.00 H new ATOM 0 HB3 LEU A 126 18.307 -1.519 19.233 1.00 0.00 H new ATOM 0 HG LEU A 126 15.892 -1.849 17.971 1.00 0.00 H new ATOM 0 HD11 LEU A 126 14.699 0.295 18.111 1.00 0.00 H new ATOM 0 HD12 LEU A 126 14.675 -0.586 19.657 1.00 0.00 H new ATOM 0 HD13 LEU A 126 15.770 0.800 19.439 1.00 0.00 H new ATOM 0 HD21 LEU A 126 16.599 0.014 16.533 1.00 0.00 H new ATOM 0 HD22 LEU A 126 17.795 0.500 17.758 1.00 0.00 H new ATOM 0 HD23 LEU A 126 17.951 -1.071 16.937 1.00 0.00 H new ATOM 1959 N GLU A 127 18.422 -4.478 19.080 1.00 0.00 N ATOM 1960 CA GLU A 127 18.807 -5.550 18.178 1.00 0.00 C ATOM 1961 C GLU A 127 18.101 -6.851 18.567 1.00 0.00 C ATOM 1962 O GLU A 127 17.634 -7.590 17.702 1.00 0.00 O ATOM 1963 CB GLU A 127 20.326 -5.734 18.161 1.00 0.00 C ATOM 1964 CG GLU A 127 20.935 -5.150 16.885 1.00 0.00 C ATOM 1965 CD GLU A 127 22.292 -4.505 17.171 1.00 0.00 C ATOM 1966 OE1 GLU A 127 22.314 -3.575 18.007 1.00 0.00 O ATOM 1967 OE2 GLU A 127 23.278 -4.955 16.548 1.00 0.00 O ATOM 0 H GLU A 127 19.177 -4.122 19.666 1.00 0.00 H new ATOM 0 HA GLU A 127 18.496 -5.279 17.169 1.00 0.00 H new ATOM 0 HB2 GLU A 127 20.764 -5.248 19.033 1.00 0.00 H new ATOM 0 HB3 GLU A 127 20.568 -6.794 18.231 1.00 0.00 H new ATOM 0 HG2 GLU A 127 21.052 -5.937 16.140 1.00 0.00 H new ATOM 0 HG3 GLU A 127 20.258 -4.408 16.461 1.00 0.00 H new ATOM 1974 N GLU A 128 18.046 -7.090 19.869 1.00 0.00 N ATOM 1975 CA GLU A 128 17.406 -8.289 20.383 1.00 0.00 C ATOM 1976 C GLU A 128 15.884 -8.160 20.286 1.00 0.00 C ATOM 1977 O GLU A 128 15.185 -9.153 20.092 1.00 0.00 O ATOM 1978 CB GLU A 128 17.842 -8.569 21.822 1.00 0.00 C ATOM 1979 CG GLU A 128 17.115 -9.791 22.387 1.00 0.00 C ATOM 1980 CD GLU A 128 17.706 -10.206 23.736 1.00 0.00 C ATOM 1981 OE1 GLU A 128 18.324 -9.329 24.379 1.00 0.00 O ATOM 1982 OE2 GLU A 128 17.528 -11.390 24.094 1.00 0.00 O ATOM 0 H GLU A 128 18.434 -6.474 20.583 1.00 0.00 H new ATOM 0 HA GLU A 128 17.719 -9.136 19.772 1.00 0.00 H new ATOM 0 HB2 GLU A 128 18.919 -8.735 21.854 1.00 0.00 H new ATOM 0 HB3 GLU A 128 17.635 -7.698 22.444 1.00 0.00 H new ATOM 0 HG2 GLU A 128 16.055 -9.566 22.504 1.00 0.00 H new ATOM 0 HG3 GLU A 128 17.189 -10.620 21.683 1.00 0.00 H new ATOM 1989 N PHE A 129 15.416 -6.929 20.426 1.00 0.00 N ATOM 1990 CA PHE A 129 13.990 -6.658 20.357 1.00 0.00 C ATOM 1991 C PHE A 129 13.454 -6.901 18.944 1.00 0.00 C ATOM 1992 O PHE A 129 12.351 -7.418 18.776 1.00 0.00 O ATOM 1993 CB PHE A 129 13.797 -5.183 20.716 1.00 0.00 C ATOM 1994 CG PHE A 129 12.355 -4.692 20.577 1.00 0.00 C ATOM 1995 CD1 PHE A 129 11.805 -4.537 19.343 1.00 0.00 C ATOM 1996 CD2 PHE A 129 11.622 -4.412 21.688 1.00 0.00 C ATOM 1997 CE1 PHE A 129 10.466 -4.081 19.214 1.00 0.00 C ATOM 1998 CE2 PHE A 129 10.283 -3.957 21.559 1.00 0.00 C ATOM 1999 CZ PHE A 129 9.733 -3.801 20.325 1.00 0.00 C ATOM 0 H PHE A 129 15.999 -6.108 20.587 1.00 0.00 H new ATOM 0 HA PHE A 129 13.452 -7.316 21.039 1.00 0.00 H new ATOM 0 HB2 PHE A 129 14.127 -5.023 21.743 1.00 0.00 H new ATOM 0 HB3 PHE A 129 14.439 -4.577 20.077 1.00 0.00 H new ATOM 0 HD1 PHE A 129 12.386 -4.761 18.461 1.00 0.00 H new ATOM 0 HD2 PHE A 129 12.058 -4.536 22.668 1.00 0.00 H new ATOM 0 HE1 PHE A 129 10.030 -3.957 18.234 1.00 0.00 H new ATOM 0 HE2 PHE A 129 9.701 -3.735 22.441 1.00 0.00 H new ATOM 0 HZ PHE A 129 8.715 -3.455 20.227 1.00 0.00 H new ATOM 2009 N LEU A 130 14.259 -6.516 17.966 1.00 0.00 N ATOM 2010 CA LEU A 130 13.880 -6.686 16.573 1.00 0.00 C ATOM 2011 C LEU A 130 14.018 -8.160 16.188 1.00 0.00 C ATOM 2012 O LEU A 130 13.059 -8.777 15.726 1.00 0.00 O ATOM 2013 CB LEU A 130 14.682 -5.738 15.680 1.00 0.00 C ATOM 2014 CG LEU A 130 14.244 -5.665 14.216 1.00 0.00 C ATOM 2015 CD1 LEU A 130 14.118 -4.211 13.754 1.00 0.00 C ATOM 2016 CD2 LEU A 130 15.186 -6.471 13.320 1.00 0.00 C ATOM 0 H LEU A 130 15.173 -6.087 18.110 1.00 0.00 H new ATOM 0 HA LEU A 130 12.834 -6.415 16.426 1.00 0.00 H new ATOM 0 HB2 LEU A 130 14.627 -4.736 16.106 1.00 0.00 H new ATOM 0 HB3 LEU A 130 15.729 -6.040 15.711 1.00 0.00 H new ATOM 0 HG LEU A 130 13.256 -6.117 14.132 1.00 0.00 H new ATOM 0 HD11 LEU A 130 13.805 -4.187 12.710 1.00 0.00 H new ATOM 0 HD12 LEU A 130 13.377 -3.697 14.367 1.00 0.00 H new ATOM 0 HD13 LEU A 130 15.082 -3.712 13.856 1.00 0.00 H new ATOM 0 HD21 LEU A 130 14.851 -6.402 12.285 1.00 0.00 H new ATOM 0 HD22 LEU A 130 16.197 -6.071 13.402 1.00 0.00 H new ATOM 0 HD23 LEU A 130 15.182 -7.515 13.634 1.00 0.00 H new ATOM 2028 N GLU A 131 15.218 -8.682 16.391 1.00 0.00 N ATOM 2029 CA GLU A 131 15.494 -10.072 16.071 1.00 0.00 C ATOM 2030 C GLU A 131 14.508 -10.990 16.795 1.00 0.00 C ATOM 2031 O GLU A 131 14.181 -12.068 16.303 1.00 0.00 O ATOM 2032 CB GLU A 131 16.939 -10.438 16.416 1.00 0.00 C ATOM 2033 CG GLU A 131 17.527 -11.393 15.375 1.00 0.00 C ATOM 2034 CD GLU A 131 17.653 -12.809 15.941 1.00 0.00 C ATOM 2035 OE1 GLU A 131 18.256 -12.935 17.028 1.00 0.00 O ATOM 2036 OE2 GLU A 131 17.143 -13.735 15.272 1.00 0.00 O ATOM 0 H GLU A 131 16.011 -8.167 16.773 1.00 0.00 H new ATOM 0 HA GLU A 131 15.366 -10.209 14.997 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.545 -9.533 16.468 1.00 0.00 H new ATOM 0 HB3 GLU A 131 16.975 -10.902 17.402 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.892 -11.407 14.489 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.507 -11.035 15.060 1.00 0.00 H new ATOM 2043 N PHE A 132 14.062 -10.528 17.954 1.00 0.00 N ATOM 2044 CA PHE A 132 13.119 -11.294 18.752 1.00 0.00 C ATOM 2045 C PHE A 132 11.831 -11.562 17.971 1.00 0.00 C ATOM 2046 O PHE A 132 11.234 -12.630 18.099 1.00 0.00 O ATOM 2047 CB PHE A 132 12.788 -10.451 19.985 1.00 0.00 C ATOM 2048 CG PHE A 132 11.448 -10.800 20.636 1.00 0.00 C ATOM 2049 CD1 PHE A 132 11.192 -12.078 21.022 1.00 0.00 C ATOM 2050 CD2 PHE A 132 10.513 -9.831 20.828 1.00 0.00 C ATOM 2051 CE1 PHE A 132 9.948 -12.402 21.626 1.00 0.00 C ATOM 2052 CE2 PHE A 132 9.269 -10.155 21.431 1.00 0.00 C ATOM 2053 CZ PHE A 132 9.013 -11.433 21.818 1.00 0.00 C ATOM 0 H PHE A 132 14.336 -9.633 18.360 1.00 0.00 H new ATOM 0 HA PHE A 132 13.555 -12.256 19.022 1.00 0.00 H new ATOM 0 HB2 PHE A 132 13.582 -10.576 20.722 1.00 0.00 H new ATOM 0 HB3 PHE A 132 12.779 -9.399 19.701 1.00 0.00 H new ATOM 0 HD1 PHE A 132 11.935 -12.847 20.869 1.00 0.00 H new ATOM 0 HD2 PHE A 132 10.717 -8.816 20.522 1.00 0.00 H new ATOM 0 HE1 PHE A 132 9.745 -13.417 21.933 1.00 0.00 H new ATOM 0 HE2 PHE A 132 8.526 -9.386 21.582 1.00 0.00 H new ATOM 0 HZ PHE A 132 8.067 -11.679 22.278 1.00 0.00 H new ATOM 2063 N SER A 133 11.440 -10.574 17.180 1.00 0.00 N ATOM 2064 CA SER A 133 10.234 -10.690 16.378 1.00 0.00 C ATOM 2065 C SER A 133 10.480 -11.627 15.194 1.00 0.00 C ATOM 2066 O SER A 133 9.562 -12.298 14.727 1.00 0.00 O ATOM 2067 CB SER A 133 9.767 -9.320 15.884 1.00 0.00 C ATOM 2068 OG SER A 133 9.186 -9.390 14.584 1.00 0.00 O ATOM 0 H SER A 133 11.937 -9.689 17.077 1.00 0.00 H new ATOM 0 HA SER A 133 9.446 -11.108 17.005 1.00 0.00 H new ATOM 0 HB2 SER A 133 9.039 -8.911 16.585 1.00 0.00 H new ATOM 0 HB3 SER A 133 10.613 -8.633 15.866 1.00 0.00 H new ATOM 0 HG SER A 133 9.589 -8.707 14.008 1.00 0.00 H new ATOM 2074 N LEU A 134 11.725 -11.641 14.741 1.00 0.00 N ATOM 2075 CA LEU A 134 12.104 -12.484 13.620 1.00 0.00 C ATOM 2076 C LEU A 134 12.194 -13.938 14.087 1.00 0.00 C ATOM 2077 O LEU A 134 11.608 -14.828 13.473 1.00 0.00 O ATOM 2078 CB LEU A 134 13.390 -11.966 12.971 1.00 0.00 C ATOM 2079 CG LEU A 134 13.212 -11.141 11.695 1.00 0.00 C ATOM 2080 CD1 LEU A 134 13.059 -9.654 12.021 1.00 0.00 C ATOM 2081 CD2 LEU A 134 14.357 -11.397 10.713 1.00 0.00 C ATOM 0 H LEU A 134 12.484 -11.082 15.130 1.00 0.00 H new ATOM 0 HA LEU A 134 11.343 -12.446 12.841 1.00 0.00 H new ATOM 0 HB2 LEU A 134 13.923 -11.358 13.702 1.00 0.00 H new ATOM 0 HB3 LEU A 134 14.027 -12.820 12.742 1.00 0.00 H new ATOM 0 HG LEU A 134 12.291 -11.460 11.207 1.00 0.00 H new ATOM 0 HD11 LEU A 134 12.934 -9.090 11.097 1.00 0.00 H new ATOM 0 HD12 LEU A 134 12.185 -9.509 12.656 1.00 0.00 H new ATOM 0 HD13 LEU A 134 13.949 -9.303 12.543 1.00 0.00 H new ATOM 0 HD21 LEU A 134 14.206 -10.799 9.815 1.00 0.00 H new ATOM 0 HD22 LEU A 134 15.304 -11.122 11.178 1.00 0.00 H new ATOM 0 HD23 LEU A 134 14.378 -12.454 10.446 1.00 0.00 H new TER 2093 LEU A 134 HETATM 2094 CA CA A 147 14.398 -5.351 -11.632 1.00 0.00 CA HETATM 2095 CA CA A 159 14.806 -17.000 -6.571 1.00 0.00 CA HETATM 2096 CA CA A 171 15.920 3.031 27.784 1.00 0.00 CA HETATM 2097 CA CA A 183 17.441 -10.424 26.705 1.00 0.00 CA CONECT 154 2094 CONECT 182 2094 CONECT 204 2094 CONECT 219 2094 CONECT 296 2094 CONECT 297 2094 CONECT 735 2095 CONECT 757 2095 CONECT 758 2095 CONECT 776 2095 CONECT 777 2095 CONECT 794 2095 CONECT 875 2095 CONECT 876 2095 CONECT 1392 2096 CONECT 1488 2096 CONECT 1489 2096 CONECT 1831 2097 CONECT 1852 2097 CONECT 1874 2097 CONECT 1889 2097 CONECT 1981 2097 CONECT 1982 2097 CONECT 2094 154 182 204 219 CONECT 2094 296 297 CONECT 2095 735 757 758 776 CONECT 2095 777 794 875 876 CONECT 2096 1392 1488 1489 CONECT 2097 1831 1852 1874 1889 CONECT 2097 1981 1982 END