USER MOD reduce.3.24.130724 H: found=0, std=0, add=1310, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1308 hydrogens (0 hets) HEADER CELL INVASION 30-OCT-03 1R9K TITLE REPRESENTATIVE SOLUTION STRUCTURE OF THE CATALYTIC DOMAIN OF SOPE2 COMPND MOL_ID: 1; COMPND 2 MOLECULE: TYPEIII-SECRETED PROTEIN EFFECTOR: INVASION-ASSOCIATED COMPND 3 PROTEIN; COMPND 4 CHAIN: A; COMPND 5 FRAGMENT: SOPE2 GEF DOMAIN; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; SOURCE 3 ORGANISM_TAXID: 99287; SOURCE 4 STRAIN: LT2; SOURCE 5 GENE: SOPE2; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PGEX-2T KEYWDS SALMONELLA, INVASION, TYPE III, GEF, SOPE, CELL INVASION EXPDTA SOLUTION NMR AUTHOR C.WILLIAMS,E.E.GALYOV,S.BAGBY REVDAT 4 21-MAR-12 1R9K 1 SCALE1 SCALE2 SCALE3 REVDAT 3 13-JUL-11 1R9K 1 VERSN REVDAT 2 24-FEB-09 1R9K 1 VERSN REVDAT 1 28-SEP-04 1R9K 0 JRNL AUTH C.WILLIAMS,E.E.GALYOV,S.BAGBY JRNL TITL SOLUTION STRUCTURE, BACKBONE DYNAMICS, AND INTERACTION WITH JRNL TITL 2 CDC42 OF SALMONELLA GUANINE NUCLEOTIDE EXCHANGE FACTOR JRNL TITL 3 SOPE2(,). JRNL REF BIOCHEMISTRY V. 43 11998 2004 JRNL REFN ISSN 0006-2960 JRNL PMID 15379540 JRNL DOI 10.1021/BI0490744 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH C WILLIAMS REMARK 1 TITL BIOCHEMICAL AND STRUCTURAL ANALYSIS OF SALMONELLA AND REMARK 1 TITL 2 BURKHOLDERIA VIRULENCE PROTEINS REMARK 1 REF TO BE PUBLISHED 2003 REMARK 1 REFN REMARK 1 REFERENCE 2 REMARK 1 AUTH C WILLIAMS,E.E.GALYOV,S.BAGBY REMARK 1 TITL ASSIGNMENT OF THE 1H,13C AND 15N RESONANCES OF THE CATALYTIC REMARK 1 TITL 2 DOMAIN OF GUANINE NUCELOTIDE EXCHANGE FACTOR SOPE2 FROM REMARK 1 TITL 3 SALMONELLA DUBLIN REMARK 1 REF J.BIOMOL.NMR V. 26 379 2003 REMARK 1 REFN ISSN 0925-2738 REMARK 1 DOI 10.1023/A:1024057108445 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : XPLOR-NIH 2.06 REMARK 3 AUTHORS : SCHWIETERS ET AL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REMARK 3 HE STRUCTURES ARE BASED ON A TOTAL OF 3065 RESTRAINTS, 2682 ARE NOE REMARK 3 -DERIVED REMARK 3 DISTANCE CONSTRAINTS, 249 DIHEDRAL ANGLE RESTRAINTS,134 DISTANCE REMARK 3 RESTRAINTS REMARK 3 FROM HYDROGEN BONDS. REMARK 4 REMARK 4 1R9K COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 24-NOV-03. REMARK 100 THE RCSB ID CODE IS RCSB020606. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298; 298; 298 REMARK 210 PH : 7; 7; 7 REMARK 210 IONIC STRENGTH : 0; 0; 0 REMARK 210 PRESSURE : AMBIENT; AMBIENT; AMBIENT REMARK 210 SAMPLE CONTENTS : 1MM SOPE2 U-15N,13C; 20MM HEPES REMARK 210 BUFFER; 90% H2O, 10% D2O; 1MM REMARK 210 SOPE2 UNLABELLED; 20MM TRIS REMARK 210 BUFFER; 99.6% D2O; 1MM SOPE2 U- REMARK 210 15N; 20MM HEPES BUFFER; 90% H2O, REMARK 210 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY; 2D TOCSY; 3D_13C- REMARK 210 SEPARATED_NOESY; 3D_15N- REMARK 210 SEPARATED_NOESY; HNHA REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : INOVA REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE 2.1, SPARKY 3.1, XPLOR- REMARK 210 NIH 2.06 REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH ACCEPTABLE REMARK 210 COVALENT GEOMETRY,STRUCTURES WITH REMARK 210 THE LEAST RESTRAINT VIOLATIONS, REMARK 210 STRUCTURES WITH THE LOWEST ENERGY 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 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 GLY A 69 REMARK 465 ASN A 70 REMARK 465 ALA A 71 REMARK 465 SER A 72 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 HZ2 LYS A 90 OG SER A 93 1.29 REMARK 500 O VAL A 83 H MET A 87 1.30 REMARK 500 HZ2 LYS A 203 OE1 GLN A 225 1.31 REMARK 500 HZ3 LYS A 133 OG SER A 240 1.31 REMARK 500 HZ3 LYS A 158 OG1 THR A 163 1.33 REMARK 500 O LEU A 212 HZ3 LYS A 215 1.35 REMARK 500 O ASN A 121 H GLN A 125 1.36 REMARK 500 HZ2 LYS A 133 O LEU A 236 1.36 REMARK 500 OG SER A 120 HZ2 LYS A 123 1.36 REMARK 500 O VAL A 205 H VAL A 209 1.38 REMARK 500 O ILE A 137 H LEU A 141 1.38 REMARK 500 HZ1 LYS A 102 OD1 ASP A 103 1.39 REMARK 500 O MET A 206 HG1 THR A 210 1.39 REMARK 500 HZ3 LYS A 97 OE2 GLU A 208 1.39 REMARK 500 O TYR A 106 HG1 THR A 110 1.40 REMARK 500 OD1 ASP A 95 HZ2 LYS A 97 1.41 REMARK 500 O VAL A 195 HZ2 LYS A 198 1.41 REMARK 500 HZ1 LYS A 207 OE1 GLU A 208 1.41 REMARK 500 O GLU A 229 H ASN A 233 1.42 REMARK 500 HZ1 LYS A 81 OD1 ASP A 85 1.42 REMARK 500 O GLN A 225 H GLU A 229 1.43 REMARK 500 OE2 GLU A 202 HZ3 LYS A 203 1.44 REMARK 500 O LEU A 129 HG SER A 132 1.45 REMARK 500 HZ3 LYS A 234 OD1 ASN A 238 1.46 REMARK 500 O ALA A 117 H ASN A 121 1.46 REMARK 500 O ILE A 177 HG SER A 181 1.47 REMARK 500 HZ2 LYS A 142 OE1 GLU A 146 1.47 REMARK 500 OE1 GLU A 156 HZ1 LYS A 158 1.47 REMARK 500 HZ1 LYS A 142 OE2 GLU A 143 1.49 REMARK 500 O VAL A 173 H ILE A 177 1.49 REMARK 500 O GLY A 74 HE ARG A 75 1.50 REMARK 500 O ASN A 99 H ASP A 103 1.53 REMARK 500 O ALA A 105 H GLN A 109 1.54 REMARK 500 O GLN A 223 HG1 THR A 227 1.55 REMARK 500 OD1 ASN A 92 HZ3 LYS A 207 1.55 REMARK 500 HD21 ASN A 190 OE1 GLN A 193 1.55 REMARK 500 O SER A 179 H LYS A 183 1.55 REMARK 500 O GLU A 146 H ASN A 150 1.56 REMARK 500 OE2 GLU A 73 HZ2 LYS A 81 1.56 REMARK 500 H LYS A 158 O VAL A 161 1.57 REMARK 500 O ILE A 228 H ILE A 231 1.58 REMARK 500 O GLU A 156 H THR A 163 1.59 REMARK 500 O PRO A 221 H GLN A 225 1.60 REMARK 500 O ASN A 238 H SER A 240 1.60 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 VAL A 77 -40.69 -134.64 REMARK 500 LEU A 78 28.82 36.79 REMARK 500 THR A 79 -176.61 -69.58 REMARK 500 SER A 80 75.57 46.41 REMARK 500 LYS A 81 91.22 79.04 REMARK 500 THR A 82 -60.01 -101.11 REMARK 500 VAL A 135 -150.03 -82.82 REMARK 500 LYS A 158 -132.50 -139.42 REMARK 500 ASN A 159 76.87 -63.30 REMARK 500 ASN A 170 102.49 71.32 REMARK 500 THR A 217 35.15 -148.80 REMARK 500 GLN A 237 -90.39 -68.57 REMARK 500 ALA A 239 -51.67 69.15 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 75 0.31 SIDE CHAIN REMARK 500 ARG A 108 0.31 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 5701 RELATED DB: BMRB REMARK 900 CHEMICAL SHIFTS DBREF 1R9K A 69 240 UNP Q9KIZ2 Q9KIZ2_SALTY 69 240 SEQRES 1 A 172 GLY ASN ALA SER GLU GLY ARG ALA VAL LEU THR SER LYS SEQRES 2 A 172 THR VAL LYS ASP PHE MET LEU GLN LYS LEU ASN SER LEU SEQRES 3 A 172 ASP ILE LYS GLY ASN ALA SER LYS ASP PRO ALA TYR ALA SEQRES 4 A 172 ARG GLN THR CYS GLU ALA ILE LEU SER ALA VAL TYR SER SEQRES 5 A 172 ASN ASN LYS ASP GLN CYS CYS LYS LEU LEU ILE SER LYS SEQRES 6 A 172 GLY VAL SER ILE THR PRO PHE LEU LYS GLU ILE GLY GLU SEQRES 7 A 172 ALA ALA GLN ASN ALA GLY LEU PRO GLY GLU ILE LYS ASN SEQRES 8 A 172 GLY VAL PHE THR PRO GLY GLY ALA GLY ALA ASN PRO PHE SEQRES 9 A 172 VAL VAL PRO LEU ILE ALA SER ALA SER ILE LYS TYR PRO SEQRES 10 A 172 HIS MET PHE ILE ASN HIS ASN GLN GLN VAL SER PHE LYS SEQRES 11 A 172 ALA TYR ALA GLU LYS ILE VAL MET LYS GLU VAL THR PRO SEQRES 12 A 172 LEU PHE ASN LYS GLY THR MET PRO THR PRO GLN GLN PHE SEQRES 13 A 172 GLN LEU THR ILE GLU ASN ILE ALA ASN LYS TYR LEU GLN SEQRES 14 A 172 ASN ALA SER HELIX 1 1 THR A 82 ASP A 95 1 14 HELIX 2 2 ASP A 95 ASP A 103 1 9 HELIX 3 3 ASP A 103 GLY A 134 1 32 HELIX 4 4 SER A 136 ALA A 151 1 16 HELIX 5 5 PHE A 172 TYR A 184 1 13 HELIX 6 6 TYR A 184 ILE A 189 1 6 HELIX 7 7 ASN A 192 THR A 210 1 19 HELIX 8 8 PRO A 211 ASN A 214 5 4 HELIX 9 9 THR A 220 GLN A 237 1 18 SHEET 1 A 2 GLU A 156 ILE A 157 0 SHEET 2 A 2 PHE A 162 THR A 163 -1 O THR A 163 N GLU A 156 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 Set 1.1: A 234 LYS NZ :NH3+ -170:sc= 1.27 (180deg=0.501) USER MOD Set 1.2: A 238 ASN : amide:sc= 0.496 K(o=1.8,f=-16!) USER MOD Set 2.1: A 220 THR OG1 : rot -129:sc= -1! USER MOD Set 2.2: A 223 GLN : amide:sc= 0.6 K(o=-0.4,f=-2.3) USER MOD Set 3.1: A 203 LYS NZ :NH3+ -147:sc= 0.796! (180deg=-2.49!) USER MOD Set 3.2: A 225 GLN : amide:sc= 1.12 K(o=1.9,f=-20!) USER MOD Set 4.1: A 191 HIS : no HE2:sc= -3.12! C(o=-2.9!,f=-1.3!) USER MOD Set 4.2: A 192 ASN : amide:sc= 0.227 K(o=-2.9,f=-1.3) USER MOD Set 5.1: A 190 ASN : amide:sc= 0.835 K(o=-1.6,f=-5.5) USER MOD Set 5.2: A 193 GLN : amide:sc= -2.48! C(o=-1.6!,f=-6.5!) USER MOD Set 6.1: A 158 LYS NZ :NH3+ 159:sc= 1.14! (180deg=0.863) USER MOD Set 6.2: A 163 THR OG1 : rot -115:sc= 0.971 USER MOD Set 7.1: A 133 LYS NZ :NH3+ 135:sc= 0.244! (180deg=-4.78!) USER MOD Set 7.2: A 240 SER OG : rot 180:sc= 0.946 USER MOD Set 8.1: A 122 ASN : amide:sc= -12.9! C(o=-13!,f=-22!) USER MOD Set 8.2: A 125 GLN : amide:sc= -0.142 K(o=-13,f=-16) USER MOD Set 9.1: A 120 SER OG : rot 170:sc= 0.79 USER MOD Set 9.2: A 123 LYS NZ :NH3+ -163:sc= 0.616 (180deg=0) USER MOD Set10.1: A 111 CYS SG : rot 109:sc= -4.29! USER MOD Set10.2: A 215 LYS NZ :NH3+ 148:sc= 1.35! (180deg=-2.34!) USER MOD Set11.1: A 99 ASN : amide:sc= -0.674 K(o=-1.3,f=-0.69) USER MOD Set11.2: A 106 TYR OH : rot -115:sc= -0.6! USER MOD Set12.1: A 92 ASN : amide:sc= -1.02 K(o=0.9,f=-15!) USER MOD Set12.2: A 207 LYS NZ :NH3+ 160:sc= 1.92 (180deg=-0.133) USER MOD Set13.1: A 90 LYS NZ :NH3+ -140:sc= 0.25! (180deg=-0.0438) USER MOD Set13.2: A 93 SER OG : rot 110:sc= 1.09 USER MOD Set14.1: A 87 MET CE :methyl -120:sc= -2.18 (180deg=-4.28!) USER MOD Set14.2: A 200 TYR OH : rot -162:sc= 1.59 USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.0998 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 168:sc= 1.56 (180deg=1.41) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.186! USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 GLN : amide:sc= -1.92 X(o=-1.9,f=-2.2!) USER MOD Single : A 97 LYS NZ :NH3+ -153:sc= 1.78 (180deg=0.779) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 176:sc= 0.8 (180deg=0.691) USER MOD Single : A 109 GLN : amide:sc= -1.54! C(o=-1.5!,f=-7.4!) USER MOD Single : A 110 THR OG1 : rot 94:sc= 0.715 USER MOD Single : A 116 SER OG : rot -56:sc= -1.75! USER MOD Single : A 119 TYR OH : rot -143:sc= -1.32 USER MOD Single : A 121 ASN : amide:sc= -3.06! K(o=-3.1!,f=-1.3) USER MOD Single : A 126 CYS SG : rot 73:sc= -6.33! USER MOD Single : A 127 CYS SG : rot 180:sc= -4.08! USER MOD Single : A 128 LYS NZ :NH3+ 150:sc= -0.147 (180deg=-0.651) USER MOD Single : A 132 SER OG : rot -103:sc= 0.814 USER MOD Single : A 136 SER OG : rot 180:sc= -0.0185 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ -161:sc= 2.72 (180deg=2!) USER MOD Single : A 149 GLN : amide:sc= 0.446 K(o=0.45,f=-0.077) USER MOD Single : A 150 ASN : amide:sc= -3.64! K(o=-3.6!,f=-1.5) USER MOD Single : A 159 ASN : amide:sc= 0 X(o=0,f=-0.09) USER MOD Single : A 170 ASN : amide:sc= -2.72 K(o=-2.7,f=-12!) USER MOD Single : A 179 SER OG : rot -78:sc= -0.267 USER MOD Single : A 181 SER OG : rot -9:sc= 0.757 USER MOD Single : A 183 LYS NZ :NH3+ 129:sc= 1.44 (180deg=0.356) USER MOD Single : A 184 TYR OH : rot 180:sc= 0 USER MOD Single : A 186 HIS : no HD1:sc=-0.000533 X(o=-0.00053,f=-0.066) USER MOD Single : A 187 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 194 GLN : amide:sc= -5.2! C(o=-5.2!,f=-2.4!) USER MOD Single : A 196 SER OG : rot 180:sc= 0 USER MOD Single : A 198 LYS NZ :NH3+ -151:sc= 0.772 (180deg=-0.938!) USER MOD Single : A 206 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 210 THR OG1 : rot 79:sc= 0.878 USER MOD Single : A 214 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 217 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 MET CE :methyl -166:sc= -1.11 (180deg=-1.47) USER MOD Single : A 222 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 227 THR OG1 : rot 106:sc= 1.22 USER MOD Single : A 230 ASN : amide:sc= 0.345 X(o=0.34,f=0) USER MOD Single : A 233 ASN : amide:sc= 0.165 X(o=0.16,f=0) USER MOD Single : A 235 TYR OH : rot 180:sc= -0.758 USER MOD Single : A 237 GLN : amide:sc= 0.209 K(o=0.21,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 73 147.532 6.967 -9.691 1.00 0.60 N ATOM 2 CA GLU A 73 148.810 7.188 -10.434 1.00 0.64 C ATOM 3 C GLU A 73 148.560 8.068 -11.671 1.00 0.59 C ATOM 4 O GLU A 73 147.465 8.553 -11.883 1.00 0.64 O ATOM 5 CB GLU A 73 149.287 5.785 -10.843 1.00 0.69 C ATOM 6 CG GLU A 73 150.110 5.164 -9.702 1.00 0.85 C ATOM 7 CD GLU A 73 149.179 4.457 -8.712 1.00 0.82 C ATOM 8 OE1 GLU A 73 148.400 5.142 -8.068 1.00 0.89 O ATOM 9 OE2 GLU A 73 149.248 3.242 -8.619 1.00 0.88 O ATOM 0 HA GLU A 73 149.556 7.703 -9.829 1.00 0.64 H new ATOM 0 HB2 GLU A 73 148.430 5.152 -11.073 1.00 0.69 H new ATOM 0 HB3 GLU A 73 149.891 5.845 -11.749 1.00 0.69 H new ATOM 0 HG2 GLU A 73 150.831 4.454 -10.107 1.00 0.85 H new ATOM 0 HG3 GLU A 73 150.679 5.939 -9.189 1.00 0.85 H new ATOM 15 N GLY A 74 149.565 8.280 -12.487 1.00 0.65 N ATOM 16 CA GLY A 74 149.384 9.130 -13.705 1.00 0.68 C ATOM 17 C GLY A 74 150.177 8.534 -14.869 1.00 0.71 C ATOM 18 O GLY A 74 151.390 8.427 -14.811 1.00 0.80 O ATOM 0 H GLY A 74 150.503 7.900 -12.361 1.00 0.65 H new ATOM 0 HA2 GLY A 74 148.327 9.190 -13.965 1.00 0.68 H new ATOM 0 HA3 GLY A 74 149.722 10.147 -13.505 1.00 0.68 H new ATOM 22 N ARG A 75 149.508 8.137 -15.921 1.00 0.71 N ATOM 23 CA ARG A 75 150.230 7.541 -17.088 1.00 0.78 C ATOM 24 C ARG A 75 149.305 7.436 -18.308 1.00 0.81 C ATOM 25 O ARG A 75 148.102 7.569 -18.197 1.00 0.80 O ATOM 26 CB ARG A 75 150.645 6.142 -16.623 1.00 0.77 C ATOM 27 CG ARG A 75 152.159 5.978 -16.785 1.00 0.96 C ATOM 28 CD ARG A 75 152.731 5.285 -15.549 1.00 0.93 C ATOM 29 NE ARG A 75 152.642 6.303 -14.459 1.00 0.95 N ATOM 30 CZ ARG A 75 153.141 6.044 -13.296 1.00 1.13 C ATOM 31 NH1 ARG A 75 152.503 5.269 -12.475 1.00 1.23 N ATOM 32 NH2 ARG A 75 154.282 6.558 -12.957 1.00 1.50 N ATOM 0 H ARG A 75 148.495 8.199 -16.023 1.00 0.71 H new ATOM 0 HA ARG A 75 151.081 8.151 -17.390 1.00 0.78 H new ATOM 0 HB2 ARG A 75 150.362 5.995 -15.581 1.00 0.77 H new ATOM 0 HB3 ARG A 75 150.122 5.384 -17.205 1.00 0.77 H new ATOM 0 HG2 ARG A 75 152.379 5.393 -17.678 1.00 0.96 H new ATOM 0 HG3 ARG A 75 152.629 6.952 -16.919 1.00 0.96 H new ATOM 0 HD2 ARG A 75 152.162 4.389 -15.300 1.00 0.93 H new ATOM 0 HD3 ARG A 75 153.762 4.972 -15.714 1.00 0.93 H new ATOM 0 HE ARG A 75 152.188 7.200 -14.633 1.00 0.95 H new ATOM 0 HH11 ARG A 75 151.607 4.864 -12.748 1.00 1.23 H new ATOM 0 HH12 ARG A 75 152.897 5.064 -11.557 1.00 1.23 H new ATOM 0 HH21 ARG A 75 154.782 7.164 -13.608 1.00 1.50 H new ATOM 0 HH22 ARG A 75 154.680 6.356 -12.040 1.00 1.50 H new ATOM 46 N ALA A 76 149.857 7.172 -19.468 1.00 0.92 N ATOM 47 CA ALA A 76 149.013 7.032 -20.695 1.00 1.00 C ATOM 48 C ALA A 76 148.585 5.569 -20.893 1.00 0.94 C ATOM 49 O ALA A 76 148.266 5.139 -21.984 1.00 1.07 O ATOM 50 CB ALA A 76 149.911 7.486 -21.839 1.00 1.17 C ATOM 0 H ALA A 76 150.858 7.047 -19.617 1.00 0.92 H new ATOM 0 HA ALA A 76 148.096 7.619 -20.633 1.00 1.00 H new ATOM 0 HB1 ALA A 76 149.366 7.414 -22.780 1.00 1.17 H new ATOM 0 HB2 ALA A 76 150.216 8.520 -21.674 1.00 1.17 H new ATOM 0 HB3 ALA A 76 150.795 6.850 -21.882 1.00 1.17 H new ATOM 56 N VAL A 77 148.583 4.816 -19.835 1.00 0.79 N ATOM 57 CA VAL A 77 148.185 3.373 -19.903 1.00 0.75 C ATOM 58 C VAL A 77 147.237 3.045 -18.749 1.00 0.63 C ATOM 59 O VAL A 77 146.278 2.319 -18.907 1.00 0.65 O ATOM 60 CB VAL A 77 149.481 2.588 -19.725 1.00 0.76 C ATOM 61 CG1 VAL A 77 149.221 1.106 -20.002 1.00 0.80 C ATOM 62 CG2 VAL A 77 150.555 3.099 -20.691 1.00 0.93 C ATOM 0 H VAL A 77 148.844 5.139 -18.904 1.00 0.79 H new ATOM 0 HA VAL A 77 147.680 3.134 -20.839 1.00 0.75 H new ATOM 0 HB VAL A 77 149.832 2.721 -18.702 1.00 0.76 H new ATOM 0 HG11 VAL A 77 150.146 0.544 -19.875 1.00 0.80 H new ATOM 0 HG12 VAL A 77 148.471 0.732 -19.305 1.00 0.80 H new ATOM 0 HG13 VAL A 77 148.860 0.985 -21.023 1.00 0.80 H new ATOM 0 HG21 VAL A 77 151.473 2.528 -20.550 1.00 0.93 H new ATOM 0 HG22 VAL A 77 150.208 2.980 -21.717 1.00 0.93 H new ATOM 0 HG23 VAL A 77 150.750 4.153 -20.494 1.00 0.93 H new ATOM 72 N LEU A 78 147.535 3.581 -17.587 1.00 0.55 N ATOM 73 CA LEU A 78 146.725 3.356 -16.344 1.00 0.47 C ATOM 74 C LEU A 78 146.157 1.924 -16.222 1.00 0.47 C ATOM 75 O LEU A 78 145.137 1.720 -15.604 1.00 0.49 O ATOM 76 CB LEU A 78 145.598 4.417 -16.347 1.00 0.50 C ATOM 77 CG LEU A 78 144.866 4.483 -17.699 1.00 0.55 C ATOM 78 CD1 LEU A 78 143.858 3.338 -17.809 1.00 0.59 C ATOM 79 CD2 LEU A 78 144.118 5.812 -17.799 1.00 0.63 C ATOM 0 H LEU A 78 148.341 4.190 -17.445 1.00 0.55 H new ATOM 0 HA LEU A 78 147.370 3.462 -15.472 1.00 0.47 H new ATOM 0 HB2 LEU A 78 144.882 4.186 -15.559 1.00 0.50 H new ATOM 0 HB3 LEU A 78 146.021 5.395 -16.117 1.00 0.50 H new ATOM 0 HG LEU A 78 145.596 4.398 -18.504 1.00 0.55 H new ATOM 0 HD11 LEU A 78 143.346 3.395 -18.770 1.00 0.59 H new ATOM 0 HD12 LEU A 78 144.381 2.385 -17.732 1.00 0.59 H new ATOM 0 HD13 LEU A 78 143.128 3.417 -17.004 1.00 0.59 H new ATOM 0 HD21 LEU A 78 143.597 5.865 -18.755 1.00 0.63 H new ATOM 0 HD22 LEU A 78 143.395 5.884 -16.987 1.00 0.63 H new ATOM 0 HD23 LEU A 78 144.828 6.636 -17.727 1.00 0.63 H new ATOM 91 N THR A 79 146.817 0.936 -16.781 1.00 0.52 N ATOM 92 CA THR A 79 146.315 -0.480 -16.672 1.00 0.56 C ATOM 93 C THR A 79 146.457 -0.988 -15.230 1.00 0.53 C ATOM 94 O THR A 79 146.860 -0.249 -14.357 1.00 0.53 O ATOM 95 CB THR A 79 147.185 -1.310 -17.620 1.00 0.64 C ATOM 96 OG1 THR A 79 146.688 -2.640 -17.650 1.00 0.71 O ATOM 97 CG2 THR A 79 148.638 -1.325 -17.133 1.00 0.65 C ATOM 0 H THR A 79 147.683 1.045 -17.309 1.00 0.52 H new ATOM 0 HA THR A 79 145.260 -0.551 -16.935 1.00 0.56 H new ATOM 0 HB THR A 79 147.152 -0.870 -18.617 1.00 0.64 H new ATOM 0 HG1 THR A 79 147.237 -3.181 -18.256 1.00 0.71 H new ATOM 0 HG21 THR A 79 149.245 -1.919 -17.817 1.00 0.65 H new ATOM 0 HG22 THR A 79 149.021 -0.305 -17.100 1.00 0.65 H new ATOM 0 HG23 THR A 79 148.683 -1.762 -16.135 1.00 0.65 H new ATOM 105 N SER A 80 146.125 -2.242 -14.970 1.00 0.58 N ATOM 106 CA SER A 80 146.229 -2.779 -13.563 1.00 0.58 C ATOM 107 C SER A 80 145.600 -1.752 -12.613 1.00 0.50 C ATOM 108 O SER A 80 146.293 -0.983 -11.972 1.00 0.49 O ATOM 109 CB SER A 80 147.730 -2.938 -13.295 1.00 0.63 C ATOM 110 OG SER A 80 147.954 -4.155 -12.585 1.00 1.03 O ATOM 0 H SER A 80 145.790 -2.910 -15.664 1.00 0.58 H new ATOM 0 HA SER A 80 145.713 -3.729 -13.421 1.00 0.58 H new ATOM 0 HB2 SER A 80 148.281 -2.945 -14.236 1.00 0.63 H new ATOM 0 HB3 SER A 80 148.100 -2.092 -12.716 1.00 0.63 H new ATOM 0 HG SER A 80 148.913 -4.262 -12.413 1.00 1.03 H new ATOM 116 N LYS A 81 144.285 -1.693 -12.596 1.00 0.51 N ATOM 117 CA LYS A 81 143.551 -0.664 -11.787 1.00 0.46 C ATOM 118 C LYS A 81 143.612 0.639 -12.595 1.00 0.38 C ATOM 119 O LYS A 81 144.543 1.414 -12.533 1.00 0.33 O ATOM 120 CB LYS A 81 144.231 -0.584 -10.398 1.00 0.49 C ATOM 121 CG LYS A 81 144.576 0.864 -10.030 1.00 0.45 C ATOM 122 CD LYS A 81 145.019 0.938 -8.567 1.00 0.54 C ATOM 123 CE LYS A 81 146.546 1.014 -8.508 1.00 0.62 C ATOM 124 NZ LYS A 81 146.852 2.452 -8.266 1.00 0.66 N ATOM 0 H LYS A 81 143.680 -2.327 -13.119 1.00 0.51 H new ATOM 0 HA LYS A 81 142.502 -0.897 -11.604 1.00 0.46 H new ATOM 0 HB2 LYS A 81 143.569 -1.006 -9.642 1.00 0.49 H new ATOM 0 HB3 LYS A 81 145.139 -1.187 -10.400 1.00 0.49 H new ATOM 0 HG2 LYS A 81 145.370 1.234 -10.679 1.00 0.45 H new ATOM 0 HG3 LYS A 81 143.709 1.505 -10.190 1.00 0.45 H new ATOM 0 HD2 LYS A 81 144.580 1.812 -8.085 1.00 0.54 H new ATOM 0 HD3 LYS A 81 144.665 0.063 -8.022 1.00 0.54 H new ATOM 0 HE2 LYS A 81 146.942 0.387 -7.709 1.00 0.62 H new ATOM 0 HE3 LYS A 81 146.995 0.666 -9.439 1.00 0.62 H new ATOM 0 HZ1 LYS A 81 147.855 2.555 -8.012 1.00 0.66 H new ATOM 0 HZ2 LYS A 81 146.655 2.999 -9.128 1.00 0.66 H new ATOM 0 HZ3 LYS A 81 146.260 2.807 -7.488 1.00 0.66 H new ATOM 138 N THR A 82 142.620 0.828 -13.407 1.00 0.39 N ATOM 139 CA THR A 82 142.549 2.012 -14.289 1.00 0.36 C ATOM 140 C THR A 82 141.603 3.014 -13.681 1.00 0.32 C ATOM 141 O THR A 82 141.955 4.119 -13.310 1.00 0.31 O ATOM 142 CB THR A 82 141.942 1.462 -15.577 1.00 0.46 C ATOM 143 OG1 THR A 82 140.724 0.790 -15.261 1.00 0.52 O ATOM 144 CG2 THR A 82 142.890 0.471 -16.234 1.00 0.53 C ATOM 0 H THR A 82 141.830 0.189 -13.498 1.00 0.39 H new ATOM 0 HA THR A 82 143.511 2.500 -14.443 1.00 0.36 H new ATOM 0 HB THR A 82 141.761 2.289 -16.264 1.00 0.46 H new ATOM 0 HG1 THR A 82 140.324 0.434 -16.082 1.00 0.52 H new ATOM 0 HG21 THR A 82 142.440 0.090 -17.151 1.00 0.53 H new ATOM 0 HG22 THR A 82 143.830 0.969 -16.471 1.00 0.53 H new ATOM 0 HG23 THR A 82 143.081 -0.357 -15.552 1.00 0.53 H new ATOM 152 N VAL A 83 140.408 2.570 -13.528 1.00 0.35 N ATOM 153 CA VAL A 83 139.364 3.367 -12.884 1.00 0.33 C ATOM 154 C VAL A 83 139.693 3.319 -11.425 1.00 0.29 C ATOM 155 O VAL A 83 139.810 4.297 -10.718 1.00 0.27 O ATOM 156 CB VAL A 83 138.125 2.551 -13.104 1.00 0.38 C ATOM 157 CG1 VAL A 83 137.049 3.099 -12.212 1.00 0.39 C ATOM 158 CG2 VAL A 83 137.693 2.587 -14.561 1.00 0.46 C ATOM 0 H VAL A 83 140.101 1.648 -13.837 1.00 0.35 H new ATOM 0 HA VAL A 83 139.266 4.393 -13.239 1.00 0.33 H new ATOM 0 HB VAL A 83 138.321 1.507 -12.860 1.00 0.38 H new ATOM 0 HG11 VAL A 83 136.134 2.524 -12.351 1.00 0.39 H new ATOM 0 HG12 VAL A 83 137.368 3.029 -11.172 1.00 0.39 H new ATOM 0 HG13 VAL A 83 136.863 4.143 -12.465 1.00 0.39 H new ATOM 0 HG21 VAL A 83 136.792 1.986 -14.688 1.00 0.46 H new ATOM 0 HG22 VAL A 83 137.487 3.616 -14.854 1.00 0.46 H new ATOM 0 HG23 VAL A 83 138.489 2.184 -15.187 1.00 0.46 H new ATOM 168 N LYS A 84 139.917 2.125 -11.005 1.00 0.32 N ATOM 169 CA LYS A 84 140.325 1.888 -9.624 1.00 0.33 C ATOM 170 C LYS A 84 141.384 2.912 -9.277 1.00 0.29 C ATOM 171 O LYS A 84 141.440 3.418 -8.192 1.00 0.30 O ATOM 172 CB LYS A 84 140.950 0.503 -9.696 1.00 0.38 C ATOM 173 CG LYS A 84 140.454 -0.370 -8.547 1.00 0.54 C ATOM 174 CD LYS A 84 141.557 -1.342 -8.129 1.00 0.82 C ATOM 175 CE LYS A 84 140.957 -2.470 -7.284 1.00 1.28 C ATOM 176 NZ LYS A 84 141.854 -3.639 -7.526 1.00 1.52 N ATOM 0 H LYS A 84 139.831 1.285 -11.578 1.00 0.32 H new ATOM 0 HA LYS A 84 139.524 1.957 -8.888 1.00 0.33 H new ATOM 0 HB2 LYS A 84 140.702 0.035 -10.649 1.00 0.38 H new ATOM 0 HB3 LYS A 84 142.036 0.586 -9.655 1.00 0.38 H new ATOM 0 HG2 LYS A 84 140.165 0.254 -7.701 1.00 0.54 H new ATOM 0 HG3 LYS A 84 139.566 -0.922 -8.854 1.00 0.54 H new ATOM 0 HD2 LYS A 84 142.045 -1.756 -9.012 1.00 0.82 H new ATOM 0 HD3 LYS A 84 142.323 -0.815 -7.559 1.00 0.82 H new ATOM 0 HE2 LYS A 84 140.930 -2.203 -6.228 1.00 1.28 H new ATOM 0 HE3 LYS A 84 139.932 -2.688 -7.584 1.00 1.28 H new ATOM 0 HZ1 LYS A 84 141.513 -4.457 -6.982 1.00 1.52 H new ATOM 0 HZ2 LYS A 84 141.854 -3.873 -8.539 1.00 1.52 H new ATOM 0 HZ3 LYS A 84 142.821 -3.403 -7.225 1.00 1.52 H new ATOM 190 N ASP A 85 142.181 3.253 -10.251 1.00 0.27 N ATOM 191 CA ASP A 85 143.252 4.258 -10.041 1.00 0.26 C ATOM 192 C ASP A 85 142.683 5.649 -10.055 1.00 0.25 C ATOM 193 O ASP A 85 142.914 6.445 -9.165 1.00 0.28 O ATOM 194 CB ASP A 85 144.196 4.074 -11.213 1.00 0.28 C ATOM 195 CG ASP A 85 145.565 4.628 -10.842 1.00 0.31 C ATOM 196 OD1 ASP A 85 146.299 3.929 -10.166 1.00 0.41 O ATOM 197 OD2 ASP A 85 145.851 5.753 -11.218 1.00 0.38 O ATOM 0 H ASP A 85 142.132 2.871 -11.195 1.00 0.27 H new ATOM 0 HA ASP A 85 143.749 4.126 -9.080 1.00 0.26 H new ATOM 0 HB2 ASP A 85 144.275 3.018 -11.470 1.00 0.28 H new ATOM 0 HB3 ASP A 85 143.808 4.588 -12.093 1.00 0.28 H new ATOM 202 N PHE A 86 141.910 5.936 -11.042 1.00 0.25 N ATOM 203 CA PHE A 86 141.292 7.267 -11.110 1.00 0.26 C ATOM 204 C PHE A 86 140.265 7.378 -9.982 1.00 0.23 C ATOM 205 O PHE A 86 140.040 8.433 -9.416 1.00 0.25 O ATOM 206 CB PHE A 86 140.649 7.318 -12.493 1.00 0.31 C ATOM 207 CG PHE A 86 139.269 7.901 -12.387 1.00 0.33 C ATOM 208 CD1 PHE A 86 139.093 9.269 -12.161 1.00 0.36 C ATOM 209 CD2 PHE A 86 138.171 7.060 -12.504 1.00 0.34 C ATOM 210 CE1 PHE A 86 137.801 9.796 -12.058 1.00 0.39 C ATOM 211 CE2 PHE A 86 136.882 7.584 -12.406 1.00 0.38 C ATOM 212 CZ PHE A 86 136.696 8.949 -12.184 1.00 0.39 C ATOM 0 H PHE A 86 141.678 5.304 -11.808 1.00 0.25 H new ATOM 0 HA PHE A 86 141.988 8.096 -10.983 1.00 0.26 H new ATOM 0 HB2 PHE A 86 141.258 7.921 -13.166 1.00 0.31 H new ATOM 0 HB3 PHE A 86 140.599 6.316 -12.919 1.00 0.31 H new ATOM 0 HD1 PHE A 86 139.952 9.917 -12.066 1.00 0.36 H new ATOM 0 HD2 PHE A 86 138.314 6.003 -12.670 1.00 0.34 H new ATOM 0 HE1 PHE A 86 137.658 10.852 -11.882 1.00 0.39 H new ATOM 0 HE2 PHE A 86 136.026 6.932 -12.502 1.00 0.38 H new ATOM 0 HZ PHE A 86 135.697 9.352 -12.109 1.00 0.39 H new ATOM 222 N MET A 87 139.688 6.264 -9.633 1.00 0.22 N ATOM 223 CA MET A 87 138.706 6.212 -8.539 1.00 0.23 C ATOM 224 C MET A 87 139.480 6.393 -7.263 1.00 0.23 C ATOM 225 O MET A 87 139.042 7.040 -6.333 1.00 0.28 O ATOM 226 CB MET A 87 138.096 4.809 -8.641 1.00 0.27 C ATOM 227 CG MET A 87 137.217 4.521 -7.420 1.00 0.38 C ATOM 228 SD MET A 87 136.496 2.866 -7.570 1.00 0.54 S ATOM 229 CE MET A 87 135.494 3.173 -9.047 1.00 0.69 C ATOM 0 H MET A 87 139.868 5.365 -10.080 1.00 0.22 H new ATOM 0 HA MET A 87 137.923 6.970 -8.577 1.00 0.23 H new ATOM 0 HB2 MET A 87 137.503 4.728 -9.552 1.00 0.27 H new ATOM 0 HB3 MET A 87 138.889 4.064 -8.710 1.00 0.27 H new ATOM 0 HG2 MET A 87 137.810 4.590 -6.508 1.00 0.38 H new ATOM 0 HG3 MET A 87 136.427 5.268 -7.343 1.00 0.38 H new ATOM 0 HE1 MET A 87 134.443 3.000 -8.816 1.00 0.69 H new ATOM 0 HE2 MET A 87 135.629 4.205 -9.370 1.00 0.69 H new ATOM 0 HE3 MET A 87 135.806 2.499 -9.845 1.00 0.69 H new ATOM 239 N LEU A 88 140.662 5.850 -7.243 1.00 0.24 N ATOM 240 CA LEU A 88 141.535 6.002 -6.057 1.00 0.28 C ATOM 241 C LEU A 88 141.995 7.455 -5.932 1.00 0.30 C ATOM 242 O LEU A 88 142.018 8.019 -4.859 1.00 0.35 O ATOM 243 CB LEU A 88 142.737 5.113 -6.365 1.00 0.32 C ATOM 244 CG LEU A 88 142.930 4.054 -5.288 1.00 0.39 C ATOM 245 CD1 LEU A 88 143.347 4.722 -3.978 1.00 0.52 C ATOM 246 CD2 LEU A 88 141.625 3.285 -5.081 1.00 0.42 C ATOM 0 H LEU A 88 141.061 5.303 -8.006 1.00 0.24 H new ATOM 0 HA LEU A 88 141.032 5.735 -5.128 1.00 0.28 H new ATOM 0 HB2 LEU A 88 142.597 4.630 -7.332 1.00 0.32 H new ATOM 0 HB3 LEU A 88 143.635 5.725 -6.441 1.00 0.32 H new ATOM 0 HG LEU A 88 143.710 3.360 -5.602 1.00 0.39 H new ATOM 0 HD11 LEU A 88 143.484 3.961 -3.209 1.00 0.52 H new ATOM 0 HD12 LEU A 88 144.283 5.261 -4.126 1.00 0.52 H new ATOM 0 HD13 LEU A 88 142.572 5.420 -3.663 1.00 0.52 H new ATOM 0 HD21 LEU A 88 141.767 2.528 -4.310 1.00 0.42 H new ATOM 0 HD22 LEU A 88 140.841 3.976 -4.771 1.00 0.42 H new ATOM 0 HD23 LEU A 88 141.335 2.802 -6.014 1.00 0.42 H new ATOM 258 N GLN A 89 142.336 8.067 -7.031 1.00 0.29 N ATOM 259 CA GLN A 89 142.780 9.490 -6.986 1.00 0.34 C ATOM 260 C GLN A 89 141.593 10.324 -6.584 1.00 0.32 C ATOM 261 O GLN A 89 141.680 11.179 -5.727 1.00 0.35 O ATOM 262 CB GLN A 89 143.234 9.852 -8.398 1.00 0.40 C ATOM 263 CG GLN A 89 144.322 8.882 -8.878 1.00 0.47 C ATOM 264 CD GLN A 89 145.566 9.660 -9.311 1.00 0.76 C ATOM 265 OE1 GLN A 89 146.671 9.271 -8.996 1.00 1.14 O ATOM 266 NE2 GLN A 89 145.441 10.735 -10.035 1.00 0.95 N ATOM 0 H GLN A 89 142.327 7.644 -7.959 1.00 0.29 H new ATOM 0 HA GLN A 89 143.592 9.658 -6.278 1.00 0.34 H new ATOM 0 HB2 GLN A 89 142.384 9.820 -9.079 1.00 0.40 H new ATOM 0 HB3 GLN A 89 143.616 10.873 -8.413 1.00 0.40 H new ATOM 0 HG2 GLN A 89 144.578 8.187 -8.079 1.00 0.47 H new ATOM 0 HG3 GLN A 89 143.948 8.287 -9.711 1.00 0.47 H new ATOM 0 HE21 GLN A 89 144.514 11.065 -10.302 1.00 0.95 H new ATOM 0 HE22 GLN A 89 146.271 11.247 -10.335 1.00 0.95 H new ATOM 275 N LYS A 90 140.467 10.032 -7.165 1.00 0.29 N ATOM 276 CA LYS A 90 139.245 10.754 -6.790 1.00 0.28 C ATOM 277 C LYS A 90 139.021 10.522 -5.319 1.00 0.25 C ATOM 278 O LYS A 90 138.936 11.430 -4.553 1.00 0.28 O ATOM 279 CB LYS A 90 138.131 10.116 -7.613 1.00 0.27 C ATOM 280 CG LYS A 90 137.236 11.203 -8.230 1.00 0.36 C ATOM 281 CD LYS A 90 138.099 12.295 -8.881 1.00 0.41 C ATOM 282 CE LYS A 90 138.162 13.524 -7.959 1.00 0.44 C ATOM 283 NZ LYS A 90 139.517 14.122 -8.177 1.00 0.45 N ATOM 0 H LYS A 90 140.349 9.320 -7.886 1.00 0.29 H new ATOM 0 HA LYS A 90 139.292 11.827 -6.973 1.00 0.28 H new ATOM 0 HB2 LYS A 90 138.560 9.498 -8.401 1.00 0.27 H new ATOM 0 HB3 LYS A 90 137.534 9.458 -6.982 1.00 0.27 H new ATOM 0 HG2 LYS A 90 136.574 10.760 -8.975 1.00 0.36 H new ATOM 0 HG3 LYS A 90 136.601 11.642 -7.460 1.00 0.36 H new ATOM 0 HD2 LYS A 90 139.104 11.916 -9.066 1.00 0.41 H new ATOM 0 HD3 LYS A 90 137.680 12.575 -9.848 1.00 0.41 H new ATOM 0 HE2 LYS A 90 137.375 14.238 -8.203 1.00 0.44 H new ATOM 0 HE3 LYS A 90 138.022 13.239 -6.916 1.00 0.44 H new ATOM 0 HZ1 LYS A 90 139.906 14.441 -7.267 1.00 0.45 H new ATOM 0 HZ2 LYS A 90 140.149 13.408 -8.593 1.00 0.45 H new ATOM 0 HZ3 LYS A 90 139.439 14.933 -8.823 1.00 0.45 H new ATOM 297 N LEU A 91 138.975 9.288 -4.942 1.00 0.23 N ATOM 298 CA LEU A 91 138.797 8.913 -3.508 1.00 0.24 C ATOM 299 C LEU A 91 139.637 9.807 -2.607 1.00 0.26 C ATOM 300 O LEU A 91 139.164 10.351 -1.629 1.00 0.29 O ATOM 301 CB LEU A 91 139.329 7.490 -3.463 1.00 0.25 C ATOM 302 CG LEU A 91 139.367 6.969 -2.032 1.00 0.35 C ATOM 303 CD1 LEU A 91 138.016 6.359 -1.671 1.00 0.58 C ATOM 304 CD2 LEU A 91 140.455 5.903 -1.937 1.00 0.38 C ATOM 0 H LEU A 91 139.055 8.495 -5.578 1.00 0.23 H new ATOM 0 HA LEU A 91 137.767 9.012 -3.166 1.00 0.24 H new ATOM 0 HB2 LEU A 91 138.699 6.843 -4.073 1.00 0.25 H new ATOM 0 HB3 LEU A 91 140.330 7.458 -3.893 1.00 0.25 H new ATOM 0 HG LEU A 91 139.580 7.785 -1.341 1.00 0.35 H new ATOM 0 HD11 LEU A 91 138.047 5.987 -0.647 1.00 0.58 H new ATOM 0 HD12 LEU A 91 137.239 7.118 -1.758 1.00 0.58 H new ATOM 0 HD13 LEU A 91 137.796 5.535 -2.350 1.00 0.58 H new ATOM 0 HD21 LEU A 91 140.498 5.517 -0.919 1.00 0.38 H new ATOM 0 HD22 LEU A 91 140.227 5.088 -2.625 1.00 0.38 H new ATOM 0 HD23 LEU A 91 141.418 6.341 -2.200 1.00 0.38 H new ATOM 316 N ASN A 92 140.878 9.957 -2.947 1.00 0.28 N ATOM 317 CA ASN A 92 141.786 10.818 -2.129 1.00 0.32 C ATOM 318 C ASN A 92 141.476 12.288 -2.370 1.00 0.33 C ATOM 319 O ASN A 92 141.420 13.088 -1.456 1.00 0.37 O ATOM 320 CB ASN A 92 143.204 10.537 -2.623 1.00 0.39 C ATOM 321 CG ASN A 92 143.531 9.052 -2.536 1.00 0.41 C ATOM 322 OD1 ASN A 92 143.236 8.389 -1.555 1.00 0.45 O ATOM 323 ND2 ASN A 92 144.152 8.505 -3.533 1.00 0.43 N ATOM 0 H ASN A 92 141.313 9.521 -3.760 1.00 0.28 H new ATOM 0 HA ASN A 92 141.665 10.605 -1.067 1.00 0.32 H new ATOM 0 HB2 ASN A 92 143.307 10.875 -3.654 1.00 0.39 H new ATOM 0 HB3 ASN A 92 143.919 11.105 -2.028 1.00 0.39 H new ATOM 0 HD21 ASN A 92 144.397 7.515 -3.500 1.00 0.43 H new ATOM 0 HD22 ASN A 92 144.396 9.064 -4.350 1.00 0.43 H new ATOM 330 N SER A 93 141.300 12.648 -3.610 1.00 0.33 N ATOM 331 CA SER A 93 141.026 14.071 -3.941 1.00 0.38 C ATOM 332 C SER A 93 139.569 14.444 -3.653 1.00 0.35 C ATOM 333 O SER A 93 139.207 15.605 -3.617 1.00 0.43 O ATOM 334 CB SER A 93 141.391 14.187 -5.425 1.00 0.44 C ATOM 335 OG SER A 93 140.387 14.923 -6.134 1.00 0.46 O ATOM 0 H SER A 93 141.334 12.016 -4.410 1.00 0.33 H new ATOM 0 HA SER A 93 141.603 14.767 -3.333 1.00 0.38 H new ATOM 0 HB2 SER A 93 142.356 14.683 -5.530 1.00 0.44 H new ATOM 0 HB3 SER A 93 141.495 13.192 -5.859 1.00 0.44 H new ATOM 0 HG SER A 93 140.747 15.795 -6.400 1.00 0.46 H new ATOM 341 N LEU A 94 138.759 13.470 -3.399 1.00 0.30 N ATOM 342 CA LEU A 94 137.354 13.701 -3.047 1.00 0.31 C ATOM 343 C LEU A 94 137.334 14.184 -1.593 1.00 0.28 C ATOM 344 O LEU A 94 136.446 14.897 -1.165 1.00 0.33 O ATOM 345 CB LEU A 94 136.728 12.312 -3.252 1.00 0.33 C ATOM 346 CG LEU A 94 135.617 12.046 -2.242 1.00 0.41 C ATOM 347 CD1 LEU A 94 134.329 12.725 -2.704 1.00 0.65 C ATOM 348 CD2 LEU A 94 135.396 10.541 -2.155 1.00 0.47 C ATOM 0 H LEU A 94 139.029 12.487 -3.423 1.00 0.30 H new ATOM 0 HA LEU A 94 136.814 14.450 -3.625 1.00 0.31 H new ATOM 0 HB2 LEU A 94 136.328 12.238 -4.263 1.00 0.33 H new ATOM 0 HB3 LEU A 94 137.498 11.547 -3.157 1.00 0.33 H new ATOM 0 HG LEU A 94 135.896 12.443 -1.266 1.00 0.41 H new ATOM 0 HD11 LEU A 94 133.537 12.533 -1.980 1.00 0.65 H new ATOM 0 HD12 LEU A 94 134.493 13.799 -2.786 1.00 0.65 H new ATOM 0 HD13 LEU A 94 134.037 12.328 -3.676 1.00 0.65 H new ATOM 0 HD21 LEU A 94 134.604 10.331 -1.436 1.00 0.47 H new ATOM 0 HD22 LEU A 94 135.109 10.158 -3.134 1.00 0.47 H new ATOM 0 HD23 LEU A 94 136.317 10.056 -1.832 1.00 0.47 H new ATOM 360 N ASP A 95 138.369 13.820 -0.866 1.00 0.26 N ATOM 361 CA ASP A 95 138.545 14.241 0.542 1.00 0.27 C ATOM 362 C ASP A 95 137.245 14.113 1.310 1.00 0.25 C ATOM 363 O ASP A 95 136.688 15.065 1.823 1.00 0.28 O ATOM 364 CB ASP A 95 139.032 15.668 0.407 1.00 0.30 C ATOM 365 CG ASP A 95 139.591 16.195 1.730 1.00 0.33 C ATOM 366 OD1 ASP A 95 139.834 15.393 2.624 1.00 0.36 O ATOM 367 OD2 ASP A 95 139.790 17.390 1.821 1.00 0.38 O ATOM 0 H ASP A 95 139.120 13.226 -1.217 1.00 0.26 H new ATOM 0 HA ASP A 95 139.244 13.629 1.112 1.00 0.27 H new ATOM 0 HB2 ASP A 95 139.803 15.720 -0.362 1.00 0.30 H new ATOM 0 HB3 ASP A 95 138.211 16.305 0.078 1.00 0.30 H new ATOM 372 N ILE A 96 136.797 12.904 1.405 1.00 0.26 N ATOM 373 CA ILE A 96 135.570 12.576 2.134 1.00 0.28 C ATOM 374 C ILE A 96 135.576 13.271 3.503 1.00 0.27 C ATOM 375 O ILE A 96 134.579 13.756 3.989 1.00 0.34 O ATOM 376 CB ILE A 96 135.727 11.069 2.273 1.00 0.31 C ATOM 377 CG1 ILE A 96 135.263 10.380 0.988 1.00 0.39 C ATOM 378 CG2 ILE A 96 134.928 10.552 3.458 1.00 0.38 C ATOM 379 CD1 ILE A 96 135.667 8.904 1.020 1.00 0.52 C ATOM 0 H ILE A 96 137.259 12.097 0.985 1.00 0.26 H new ATOM 0 HA ILE A 96 134.640 12.885 1.657 1.00 0.28 H new ATOM 0 HB ILE A 96 136.780 10.843 2.444 1.00 0.31 H new ATOM 0 HG12 ILE A 96 134.181 10.469 0.886 1.00 0.39 H new ATOM 0 HG13 ILE A 96 135.706 10.870 0.121 1.00 0.39 H new ATOM 0 HG21 ILE A 96 135.054 9.472 3.539 1.00 0.38 H new ATOM 0 HG22 ILE A 96 135.283 11.028 4.372 1.00 0.38 H new ATOM 0 HG23 ILE A 96 133.873 10.784 3.314 1.00 0.38 H new ATOM 0 HD11 ILE A 96 135.335 8.416 0.104 1.00 0.52 H new ATOM 0 HD12 ILE A 96 136.751 8.825 1.101 1.00 0.52 H new ATOM 0 HD13 ILE A 96 135.203 8.418 1.878 1.00 0.52 H new ATOM 391 N LYS A 97 136.713 13.327 4.117 1.00 0.26 N ATOM 392 CA LYS A 97 136.820 13.982 5.444 1.00 0.28 C ATOM 393 C LYS A 97 136.867 15.481 5.297 1.00 0.27 C ATOM 394 O LYS A 97 136.342 16.224 6.100 1.00 0.29 O ATOM 395 CB LYS A 97 138.133 13.455 5.993 1.00 0.33 C ATOM 396 CG LYS A 97 139.310 13.918 5.127 1.00 0.35 C ATOM 397 CD LYS A 97 140.509 12.993 5.348 1.00 0.48 C ATOM 398 CE LYS A 97 141.742 13.565 4.640 1.00 0.54 C ATOM 399 NZ LYS A 97 141.398 13.567 3.188 1.00 0.47 N ATOM 0 H LYS A 97 137.586 12.943 3.755 1.00 0.26 H new ATOM 0 HA LYS A 97 135.971 13.770 6.093 1.00 0.28 H new ATOM 0 HB2 LYS A 97 138.270 13.803 7.017 1.00 0.33 H new ATOM 0 HB3 LYS A 97 138.107 12.366 6.027 1.00 0.33 H new ATOM 0 HG2 LYS A 97 139.024 13.913 4.075 1.00 0.35 H new ATOM 0 HG3 LYS A 97 139.578 14.944 5.380 1.00 0.35 H new ATOM 0 HD2 LYS A 97 140.707 12.887 6.415 1.00 0.48 H new ATOM 0 HD3 LYS A 97 140.287 11.997 4.965 1.00 0.48 H new ATOM 0 HE2 LYS A 97 141.966 14.572 4.992 1.00 0.54 H new ATOM 0 HE3 LYS A 97 142.625 12.956 4.834 1.00 0.54 H new ATOM 0 HZ1 LYS A 97 142.269 13.495 2.625 1.00 0.47 H new ATOM 0 HZ2 LYS A 97 140.781 12.757 2.976 1.00 0.47 H new ATOM 0 HZ3 LYS A 97 140.904 14.451 2.949 1.00 0.47 H new ATOM 413 N GLY A 98 137.476 15.904 4.262 1.00 0.28 N ATOM 414 CA GLY A 98 137.571 17.359 3.979 1.00 0.31 C ATOM 415 C GLY A 98 136.162 17.899 3.852 1.00 0.28 C ATOM 416 O GLY A 98 135.830 18.945 4.383 1.00 0.30 O ATOM 0 H GLY A 98 137.928 15.303 3.573 1.00 0.28 H new ATOM 0 HA2 GLY A 98 138.105 17.870 4.780 1.00 0.31 H new ATOM 0 HA3 GLY A 98 138.131 17.534 3.060 1.00 0.31 H new ATOM 420 N ASN A 99 135.310 17.157 3.195 1.00 0.25 N ATOM 421 CA ASN A 99 133.907 17.587 3.084 1.00 0.25 C ATOM 422 C ASN A 99 133.308 17.461 4.479 1.00 0.24 C ATOM 423 O ASN A 99 132.636 18.345 4.950 1.00 0.28 O ATOM 424 CB ASN A 99 133.222 16.634 2.099 1.00 0.27 C ATOM 425 CG ASN A 99 134.156 16.206 0.959 1.00 0.27 C ATOM 426 OD1 ASN A 99 134.132 15.062 0.546 1.00 0.44 O ATOM 427 ND2 ASN A 99 134.968 17.068 0.419 1.00 0.31 N ATOM 0 H ASN A 99 135.535 16.275 2.735 1.00 0.25 H new ATOM 0 HA ASN A 99 133.791 18.610 2.727 1.00 0.25 H new ATOM 0 HB2 ASN A 99 132.876 15.750 2.634 1.00 0.27 H new ATOM 0 HB3 ASN A 99 132.340 17.119 1.681 1.00 0.27 H new ATOM 0 HD21 ASN A 99 135.579 16.783 -0.346 1.00 0.31 H new ATOM 0 HD22 ASN A 99 134.993 18.029 0.761 1.00 0.31 H new ATOM 434 N ALA A 100 133.613 16.385 5.173 1.00 0.23 N ATOM 435 CA ALA A 100 133.119 16.237 6.566 1.00 0.26 C ATOM 436 C ALA A 100 133.662 17.401 7.412 1.00 0.28 C ATOM 437 O ALA A 100 133.089 17.763 8.420 1.00 0.33 O ATOM 438 CB ALA A 100 133.687 14.899 7.052 1.00 0.30 C ATOM 0 H ALA A 100 134.181 15.611 4.828 1.00 0.23 H new ATOM 0 HA ALA A 100 132.032 16.254 6.639 1.00 0.26 H new ATOM 0 HB1 ALA A 100 133.365 14.718 8.077 1.00 0.30 H new ATOM 0 HB2 ALA A 100 133.325 14.096 6.411 1.00 0.30 H new ATOM 0 HB3 ALA A 100 134.776 14.931 7.014 1.00 0.30 H new ATOM 444 N SER A 101 134.763 17.999 6.998 1.00 0.29 N ATOM 445 CA SER A 101 135.328 19.143 7.766 1.00 0.34 C ATOM 446 C SER A 101 134.577 20.431 7.408 1.00 0.34 C ATOM 447 O SER A 101 134.322 21.264 8.256 1.00 0.39 O ATOM 448 CB SER A 101 136.791 19.234 7.334 1.00 0.37 C ATOM 449 OG SER A 101 137.517 19.992 8.295 1.00 0.51 O ATOM 0 H SER A 101 135.287 17.738 6.162 1.00 0.29 H new ATOM 0 HA SER A 101 135.236 19.006 8.843 1.00 0.34 H new ATOM 0 HB2 SER A 101 137.218 18.235 7.243 1.00 0.37 H new ATOM 0 HB3 SER A 101 136.864 19.703 6.353 1.00 0.37 H new ATOM 0 HG SER A 101 138.457 20.051 8.023 1.00 0.51 H new ATOM 455 N LYS A 102 134.214 20.596 6.157 1.00 0.33 N ATOM 456 CA LYS A 102 133.469 21.822 5.747 1.00 0.36 C ATOM 457 C LYS A 102 131.960 21.592 5.879 1.00 0.35 C ATOM 458 O LYS A 102 131.188 22.505 6.105 1.00 0.40 O ATOM 459 CB LYS A 102 133.888 22.068 4.289 1.00 0.39 C ATOM 460 CG LYS A 102 132.815 22.884 3.558 1.00 0.45 C ATOM 461 CD LYS A 102 133.248 23.127 2.106 1.00 0.50 C ATOM 462 CE LYS A 102 133.230 21.808 1.322 1.00 0.51 C ATOM 463 NZ LYS A 102 131.802 21.598 0.939 1.00 0.45 N ATOM 0 H LYS A 102 134.403 19.933 5.405 1.00 0.33 H new ATOM 0 HA LYS A 102 133.696 22.686 6.372 1.00 0.36 H new ATOM 0 HB2 LYS A 102 134.840 22.599 4.261 1.00 0.39 H new ATOM 0 HB3 LYS A 102 134.039 21.115 3.781 1.00 0.39 H new ATOM 0 HG2 LYS A 102 131.863 22.353 3.580 1.00 0.45 H new ATOM 0 HG3 LYS A 102 132.660 23.836 4.065 1.00 0.45 H new ATOM 0 HD2 LYS A 102 132.580 23.848 1.635 1.00 0.50 H new ATOM 0 HD3 LYS A 102 134.249 23.558 2.084 1.00 0.50 H new ATOM 0 HE2 LYS A 102 133.869 21.865 0.441 1.00 0.51 H new ATOM 0 HE3 LYS A 102 133.599 20.983 1.931 1.00 0.51 H new ATOM 0 HZ1 LYS A 102 131.724 20.750 0.342 1.00 0.45 H new ATOM 0 HZ2 LYS A 102 131.227 21.472 1.797 1.00 0.45 H new ATOM 0 HZ3 LYS A 102 131.459 22.426 0.411 1.00 0.45 H new ATOM 477 N ASP A 103 131.557 20.374 5.739 1.00 0.31 N ATOM 478 CA ASP A 103 130.124 20.015 5.843 1.00 0.31 C ATOM 479 C ASP A 103 129.859 19.100 7.039 1.00 0.30 C ATOM 480 O ASP A 103 130.110 17.906 6.991 1.00 0.30 O ATOM 481 CB ASP A 103 129.797 19.284 4.560 1.00 0.31 C ATOM 482 CG ASP A 103 129.528 20.285 3.439 1.00 0.42 C ATOM 483 OD1 ASP A 103 130.480 20.696 2.793 1.00 0.54 O ATOM 484 OD2 ASP A 103 128.376 20.622 3.241 1.00 0.59 O ATOM 0 H ASP A 103 132.177 19.586 5.551 1.00 0.31 H new ATOM 0 HA ASP A 103 129.511 20.905 5.988 1.00 0.31 H new ATOM 0 HB2 ASP A 103 130.625 18.631 4.284 1.00 0.31 H new ATOM 0 HB3 ASP A 103 128.924 18.648 4.707 1.00 0.31 H new ATOM 489 N PRO A 104 129.306 19.688 8.061 1.00 0.33 N ATOM 490 CA PRO A 104 128.943 18.922 9.276 1.00 0.34 C ATOM 491 C PRO A 104 127.746 18.017 8.972 1.00 0.32 C ATOM 492 O PRO A 104 127.366 17.176 9.762 1.00 0.34 O ATOM 493 CB PRO A 104 128.583 20.006 10.274 1.00 0.40 C ATOM 494 CG PRO A 104 128.154 21.166 9.438 1.00 0.42 C ATOM 495 CD PRO A 104 128.976 21.107 8.185 1.00 0.39 C ATOM 0 HA PRO A 104 129.733 18.268 9.644 1.00 0.34 H new ATOM 0 HB2 PRO A 104 127.784 19.681 10.940 1.00 0.40 H new ATOM 0 HB3 PRO A 104 129.436 20.265 10.902 1.00 0.40 H new ATOM 0 HG2 PRO A 104 127.090 21.108 9.208 1.00 0.42 H new ATOM 0 HG3 PRO A 104 128.315 22.106 9.965 1.00 0.42 H new ATOM 0 HD2 PRO A 104 128.417 21.466 7.321 1.00 0.39 H new ATOM 0 HD3 PRO A 104 129.872 21.722 8.263 1.00 0.39 H new ATOM 503 N ALA A 105 127.194 18.144 7.798 1.00 0.31 N ATOM 504 CA ALA A 105 126.082 17.260 7.392 1.00 0.32 C ATOM 505 C ALA A 105 126.708 16.163 6.594 1.00 0.30 C ATOM 506 O ALA A 105 126.385 14.999 6.710 1.00 0.32 O ATOM 507 CB ALA A 105 125.172 18.092 6.496 1.00 0.35 C ATOM 0 H ALA A 105 127.474 18.832 7.099 1.00 0.31 H new ATOM 0 HA ALA A 105 125.514 16.855 8.229 1.00 0.32 H new ATOM 0 HB1 ALA A 105 124.330 17.483 6.167 1.00 0.35 H new ATOM 0 HB2 ALA A 105 124.801 18.953 7.053 1.00 0.35 H new ATOM 0 HB3 ALA A 105 125.733 18.436 5.627 1.00 0.35 H new ATOM 513 N TYR A 106 127.654 16.560 5.809 1.00 0.28 N ATOM 514 CA TYR A 106 128.396 15.609 4.998 1.00 0.26 C ATOM 515 C TYR A 106 129.071 14.617 5.916 1.00 0.25 C ATOM 516 O TYR A 106 129.066 13.421 5.700 1.00 0.26 O ATOM 517 CB TYR A 106 129.459 16.442 4.317 1.00 0.27 C ATOM 518 CG TYR A 106 130.259 15.555 3.439 1.00 0.25 C ATOM 519 CD1 TYR A 106 131.222 14.750 4.021 1.00 0.23 C ATOM 520 CD2 TYR A 106 130.058 15.555 2.070 1.00 0.31 C ATOM 521 CE1 TYR A 106 132.011 13.922 3.222 1.00 0.25 C ATOM 522 CE2 TYR A 106 130.835 14.725 1.259 1.00 0.34 C ATOM 523 CZ TYR A 106 131.815 13.908 1.835 1.00 0.29 C ATOM 524 OH TYR A 106 132.600 13.110 1.035 1.00 0.34 O ATOM 0 H TYR A 106 127.943 17.532 5.701 1.00 0.28 H new ATOM 0 HA TYR A 106 127.766 15.068 4.292 1.00 0.26 H new ATOM 0 HB2 TYR A 106 128.999 17.239 3.733 1.00 0.27 H new ATOM 0 HB3 TYR A 106 130.100 16.919 5.059 1.00 0.27 H new ATOM 0 HD1 TYR A 106 131.363 14.763 5.092 1.00 0.23 H new ATOM 0 HD2 TYR A 106 129.305 16.193 1.631 1.00 0.31 H new ATOM 0 HE1 TYR A 106 132.768 13.296 3.670 1.00 0.25 H new ATOM 0 HE2 TYR A 106 130.680 14.713 0.190 1.00 0.34 H new ATOM 0 HH TYR A 106 133.142 13.672 0.443 1.00 0.34 H new ATOM 534 N ALA A 107 129.660 15.132 6.944 1.00 0.25 N ATOM 535 CA ALA A 107 130.367 14.252 7.907 1.00 0.26 C ATOM 536 C ALA A 107 129.372 13.303 8.566 1.00 0.27 C ATOM 537 O ALA A 107 129.663 12.159 8.807 1.00 0.32 O ATOM 538 CB ALA A 107 130.984 15.195 8.944 1.00 0.28 C ATOM 0 H ALA A 107 129.685 16.128 7.164 1.00 0.25 H new ATOM 0 HA ALA A 107 131.128 13.638 7.425 1.00 0.26 H new ATOM 0 HB1 ALA A 107 131.524 14.612 9.690 1.00 0.28 H new ATOM 0 HB2 ALA A 107 131.673 15.879 8.449 1.00 0.28 H new ATOM 0 HB3 ALA A 107 130.194 15.766 9.432 1.00 0.28 H new ATOM 544 N ARG A 108 128.202 13.784 8.866 1.00 0.27 N ATOM 545 CA ARG A 108 127.182 12.929 9.540 1.00 0.30 C ATOM 546 C ARG A 108 126.354 12.095 8.562 1.00 0.30 C ATOM 547 O ARG A 108 125.999 10.967 8.850 1.00 0.36 O ATOM 548 CB ARG A 108 126.294 13.935 10.254 1.00 0.33 C ATOM 549 CG ARG A 108 127.136 14.727 11.254 1.00 0.35 C ATOM 550 CD ARG A 108 126.215 15.582 12.127 1.00 0.41 C ATOM 551 NE ARG A 108 125.428 16.397 11.155 1.00 0.40 N ATOM 552 CZ ARG A 108 124.133 16.422 11.219 1.00 0.49 C ATOM 553 NH1 ARG A 108 123.547 17.247 12.029 1.00 0.64 N ATOM 554 NH2 ARG A 108 123.426 15.629 10.470 1.00 0.51 N ATOM 0 H ARG A 108 127.903 14.740 8.673 1.00 0.27 H new ATOM 0 HA ARG A 108 127.651 12.198 10.199 1.00 0.30 H new ATOM 0 HB2 ARG A 108 125.835 14.610 9.532 1.00 0.33 H new ATOM 0 HB3 ARG A 108 125.483 13.421 10.770 1.00 0.33 H new ATOM 0 HG2 ARG A 108 127.717 14.047 11.876 1.00 0.35 H new ATOM 0 HG3 ARG A 108 127.847 15.362 10.725 1.00 0.35 H new ATOM 0 HD2 ARG A 108 125.564 14.962 12.743 1.00 0.41 H new ATOM 0 HD3 ARG A 108 126.787 16.216 12.805 1.00 0.41 H new ATOM 0 HE ARG A 108 125.911 16.937 10.437 1.00 0.40 H new ATOM 0 HH11 ARG A 108 124.104 17.872 12.612 1.00 0.64 H new ATOM 0 HH12 ARG A 108 122.529 17.271 12.084 1.00 0.64 H new ATOM 0 HH21 ARG A 108 123.890 14.985 9.830 1.00 0.51 H new ATOM 0 HH22 ARG A 108 122.408 15.651 10.523 1.00 0.51 H new ATOM 568 N GLN A 109 126.026 12.633 7.427 1.00 0.29 N ATOM 569 CA GLN A 109 125.185 11.858 6.462 1.00 0.32 C ATOM 570 C GLN A 109 126.025 10.818 5.730 1.00 0.32 C ATOM 571 O GLN A 109 125.556 9.748 5.388 1.00 0.43 O ATOM 572 CB GLN A 109 124.600 12.892 5.484 1.00 0.35 C ATOM 573 CG GLN A 109 123.650 13.881 6.204 1.00 0.40 C ATOM 574 CD GLN A 109 123.235 13.365 7.590 1.00 0.43 C ATOM 575 OE1 GLN A 109 123.615 13.931 8.599 1.00 0.48 O ATOM 576 NE2 GLN A 109 122.465 12.319 7.687 1.00 0.57 N ATOM 0 H GLN A 109 126.297 13.567 7.121 1.00 0.29 H new ATOM 0 HA GLN A 109 124.393 11.309 6.971 1.00 0.32 H new ATOM 0 HB2 GLN A 109 125.411 13.445 5.010 1.00 0.35 H new ATOM 0 HB3 GLN A 109 124.058 12.378 4.690 1.00 0.35 H new ATOM 0 HG2 GLN A 109 124.143 14.848 6.308 1.00 0.40 H new ATOM 0 HG3 GLN A 109 122.761 14.041 5.594 1.00 0.40 H new ATOM 0 HE21 GLN A 109 122.144 11.842 6.844 1.00 0.57 H new ATOM 0 HE22 GLN A 109 122.183 11.977 8.606 1.00 0.57 H new ATOM 585 N THR A 110 127.262 11.118 5.506 1.00 0.25 N ATOM 586 CA THR A 110 128.151 10.156 4.814 1.00 0.25 C ATOM 587 C THR A 110 128.921 9.306 5.848 1.00 0.25 C ATOM 588 O THR A 110 129.695 8.442 5.490 1.00 0.27 O ATOM 589 CB THR A 110 129.093 11.022 3.964 1.00 0.25 C ATOM 590 OG1 THR A 110 128.508 12.295 3.734 1.00 0.27 O ATOM 591 CG2 THR A 110 129.318 10.353 2.618 1.00 0.28 C ATOM 0 H THR A 110 127.703 11.998 5.775 1.00 0.25 H new ATOM 0 HA THR A 110 127.604 9.448 4.191 1.00 0.25 H new ATOM 0 HB THR A 110 130.037 11.137 4.496 1.00 0.25 H new ATOM 0 HG1 THR A 110 128.818 12.926 4.417 1.00 0.27 H new ATOM 0 HG21 THR A 110 129.986 10.967 2.014 1.00 0.28 H new ATOM 0 HG22 THR A 110 129.765 9.371 2.770 1.00 0.28 H new ATOM 0 HG23 THR A 110 128.364 10.241 2.103 1.00 0.28 H new ATOM 599 N CYS A 111 128.668 9.516 7.128 1.00 0.25 N ATOM 600 CA CYS A 111 129.341 8.697 8.193 1.00 0.27 C ATOM 601 C CYS A 111 128.472 7.479 8.464 1.00 0.29 C ATOM 602 O CYS A 111 128.947 6.390 8.709 1.00 0.33 O ATOM 603 CB CYS A 111 129.383 9.574 9.446 1.00 0.28 C ATOM 604 SG CYS A 111 131.090 10.065 9.790 1.00 0.36 S ATOM 0 H CYS A 111 128.021 10.223 7.478 1.00 0.25 H new ATOM 0 HA CYS A 111 130.342 8.377 7.902 1.00 0.27 H new ATOM 0 HB2 CYS A 111 128.762 10.458 9.304 1.00 0.28 H new ATOM 0 HB3 CYS A 111 128.973 9.030 10.297 1.00 0.28 H new ATOM 0 HG CYS A 111 131.240 11.329 9.525 1.00 0.36 H new ATOM 610 N GLU A 112 127.186 7.677 8.407 1.00 0.27 N ATOM 611 CA GLU A 112 126.237 6.568 8.628 1.00 0.29 C ATOM 612 C GLU A 112 125.949 5.881 7.303 1.00 0.27 C ATOM 613 O GLU A 112 125.806 4.677 7.249 1.00 0.29 O ATOM 614 CB GLU A 112 124.977 7.249 9.164 1.00 0.32 C ATOM 615 CG GLU A 112 125.056 7.373 10.691 1.00 0.38 C ATOM 616 CD GLU A 112 124.664 8.792 11.114 1.00 0.42 C ATOM 617 OE1 GLU A 112 123.592 9.231 10.729 1.00 0.58 O ATOM 618 OE2 GLU A 112 125.444 9.416 11.813 1.00 0.53 O ATOM 0 H GLU A 112 126.751 8.579 8.213 1.00 0.27 H new ATOM 0 HA GLU A 112 126.615 5.808 9.312 1.00 0.29 H new ATOM 0 HB2 GLU A 112 124.869 8.237 8.716 1.00 0.32 H new ATOM 0 HB3 GLU A 112 124.095 6.673 8.883 1.00 0.32 H new ATOM 0 HG2 GLU A 112 124.392 6.647 11.159 1.00 0.38 H new ATOM 0 HG3 GLU A 112 126.066 7.147 11.032 1.00 0.38 H new ATOM 625 N ALA A 113 125.859 6.634 6.233 1.00 0.26 N ATOM 626 CA ALA A 113 125.561 6.004 4.920 1.00 0.25 C ATOM 627 C ALA A 113 126.717 5.113 4.432 1.00 0.25 C ATOM 628 O ALA A 113 126.492 4.151 3.726 1.00 0.27 O ATOM 629 CB ALA A 113 125.291 7.142 3.957 1.00 0.27 C ATOM 0 H ALA A 113 125.978 7.647 6.217 1.00 0.26 H new ATOM 0 HA ALA A 113 124.700 5.340 4.997 1.00 0.25 H new ATOM 0 HB1 ALA A 113 125.065 6.738 2.970 1.00 0.27 H new ATOM 0 HB2 ALA A 113 124.442 7.726 4.313 1.00 0.27 H new ATOM 0 HB3 ALA A 113 126.171 7.782 3.894 1.00 0.27 H new ATOM 635 N ILE A 114 127.937 5.394 4.823 1.00 0.25 N ATOM 636 CA ILE A 114 129.090 4.524 4.408 1.00 0.25 C ATOM 637 C ILE A 114 128.877 3.137 4.979 1.00 0.23 C ATOM 638 O ILE A 114 128.919 2.135 4.290 1.00 0.25 O ATOM 639 CB ILE A 114 130.364 5.167 5.007 1.00 0.26 C ATOM 640 CG1 ILE A 114 131.495 4.138 5.130 1.00 0.27 C ATOM 641 CG2 ILE A 114 130.099 5.713 6.415 1.00 0.26 C ATOM 642 CD1 ILE A 114 131.633 3.333 3.850 1.00 0.28 C ATOM 0 H ILE A 114 128.187 6.188 5.412 1.00 0.25 H new ATOM 0 HA ILE A 114 129.178 4.442 3.325 1.00 0.25 H new ATOM 0 HB ILE A 114 130.650 5.973 4.332 1.00 0.26 H new ATOM 0 HG12 ILE A 114 132.434 4.647 5.348 1.00 0.27 H new ATOM 0 HG13 ILE A 114 131.294 3.468 5.966 1.00 0.27 H new ATOM 0 HG21 ILE A 114 131.012 6.159 6.810 1.00 0.26 H new ATOM 0 HG22 ILE A 114 129.316 6.470 6.370 1.00 0.26 H new ATOM 0 HG23 ILE A 114 129.781 4.899 7.067 1.00 0.26 H new ATOM 0 HD11 ILE A 114 132.441 2.610 3.960 1.00 0.28 H new ATOM 0 HD12 ILE A 114 130.700 2.807 3.649 1.00 0.28 H new ATOM 0 HD13 ILE A 114 131.857 4.004 3.021 1.00 0.28 H new ATOM 654 N LEU A 115 128.593 3.094 6.233 1.00 0.22 N ATOM 655 CA LEU A 115 128.316 1.811 6.895 1.00 0.22 C ATOM 656 C LEU A 115 126.893 1.407 6.525 1.00 0.21 C ATOM 657 O LEU A 115 126.513 0.257 6.553 1.00 0.21 O ATOM 658 CB LEU A 115 128.529 2.087 8.381 1.00 0.23 C ATOM 659 CG LEU A 115 130.008 2.433 8.556 1.00 0.24 C ATOM 660 CD1 LEU A 115 130.210 3.446 9.680 1.00 0.29 C ATOM 661 CD2 LEU A 115 130.793 1.167 8.883 1.00 0.27 C ATOM 0 H LEU A 115 128.540 3.911 6.841 1.00 0.22 H new ATOM 0 HA LEU A 115 128.955 0.979 6.599 1.00 0.22 H new ATOM 0 HB2 LEU A 115 127.897 2.909 8.716 1.00 0.23 H new ATOM 0 HB3 LEU A 115 128.262 1.215 8.979 1.00 0.23 H new ATOM 0 HG LEU A 115 130.365 2.871 7.624 1.00 0.24 H new ATOM 0 HD11 LEU A 115 131.272 3.672 9.780 1.00 0.29 H new ATOM 0 HD12 LEU A 115 129.665 4.361 9.448 1.00 0.29 H new ATOM 0 HD13 LEU A 115 129.838 3.030 10.616 1.00 0.29 H new ATOM 0 HD21 LEU A 115 131.847 1.415 9.008 1.00 0.27 H new ATOM 0 HD22 LEU A 115 130.411 0.730 9.806 1.00 0.27 H new ATOM 0 HD23 LEU A 115 130.682 0.450 8.070 1.00 0.27 H new ATOM 673 N SER A 116 126.133 2.343 6.058 1.00 0.21 N ATOM 674 CA SER A 116 124.789 1.977 5.552 1.00 0.21 C ATOM 675 C SER A 116 124.989 1.390 4.153 1.00 0.22 C ATOM 676 O SER A 116 124.149 0.694 3.620 1.00 0.24 O ATOM 677 CB SER A 116 123.944 3.253 5.486 1.00 0.24 C ATOM 678 OG SER A 116 123.868 3.703 4.131 1.00 0.34 O ATOM 0 H SER A 116 126.376 3.332 6.003 1.00 0.21 H new ATOM 0 HA SER A 116 124.284 1.253 6.192 1.00 0.21 H new ATOM 0 HB2 SER A 116 122.944 3.060 5.873 1.00 0.24 H new ATOM 0 HB3 SER A 116 124.385 4.027 6.114 1.00 0.24 H new ATOM 0 HG SER A 116 124.773 3.829 3.777 1.00 0.34 H new ATOM 684 N ALA A 117 126.134 1.645 3.578 1.00 0.22 N ATOM 685 CA ALA A 117 126.438 1.107 2.233 1.00 0.24 C ATOM 686 C ALA A 117 126.770 -0.356 2.388 1.00 0.24 C ATOM 687 O ALA A 117 126.271 -1.200 1.686 1.00 0.27 O ATOM 688 CB ALA A 117 127.643 1.914 1.755 1.00 0.28 C ATOM 0 H ALA A 117 126.875 2.210 3.992 1.00 0.22 H new ATOM 0 HA ALA A 117 125.617 1.187 1.520 1.00 0.24 H new ATOM 0 HB1 ALA A 117 127.935 1.577 0.760 1.00 0.28 H new ATOM 0 HB2 ALA A 117 127.381 2.971 1.718 1.00 0.28 H new ATOM 0 HB3 ALA A 117 128.474 1.770 2.445 1.00 0.28 H new ATOM 694 N VAL A 118 127.551 -0.650 3.372 1.00 0.22 N ATOM 695 CA VAL A 118 127.896 -2.043 3.690 1.00 0.22 C ATOM 696 C VAL A 118 126.638 -2.718 4.143 1.00 0.21 C ATOM 697 O VAL A 118 126.338 -3.838 3.789 1.00 0.24 O ATOM 698 CB VAL A 118 128.944 -1.895 4.774 1.00 0.21 C ATOM 699 CG1 VAL A 118 130.012 -0.961 4.264 1.00 0.25 C ATOM 700 CG2 VAL A 118 128.385 -1.325 6.058 1.00 0.21 C ATOM 0 H VAL A 118 127.978 0.042 3.988 1.00 0.22 H new ATOM 0 HA VAL A 118 128.286 -2.649 2.873 1.00 0.22 H new ATOM 0 HB VAL A 118 129.334 -2.888 5.000 1.00 0.21 H new ATOM 0 HG11 VAL A 118 130.781 -0.836 5.027 1.00 0.25 H new ATOM 0 HG12 VAL A 118 130.460 -1.378 3.362 1.00 0.25 H new ATOM 0 HG13 VAL A 118 129.569 0.008 4.034 1.00 0.25 H new ATOM 0 HG21 VAL A 118 129.182 -1.242 6.797 1.00 0.21 H new ATOM 0 HG22 VAL A 118 127.965 -0.338 5.865 1.00 0.21 H new ATOM 0 HG23 VAL A 118 127.604 -1.983 6.439 1.00 0.21 H new ATOM 710 N TYR A 119 125.866 -1.977 4.849 1.00 0.20 N ATOM 711 CA TYR A 119 124.544 -2.466 5.290 1.00 0.20 C ATOM 712 C TYR A 119 123.778 -2.901 4.045 1.00 0.22 C ATOM 713 O TYR A 119 123.324 -4.021 3.918 1.00 0.25 O ATOM 714 CB TYR A 119 123.859 -1.248 5.907 1.00 0.20 C ATOM 715 CG TYR A 119 122.381 -1.444 5.772 1.00 0.19 C ATOM 716 CD1 TYR A 119 121.798 -2.547 6.386 1.00 0.20 C ATOM 717 CD2 TYR A 119 121.617 -0.582 4.978 1.00 0.22 C ATOM 718 CE1 TYR A 119 120.446 -2.803 6.229 1.00 0.20 C ATOM 719 CE2 TYR A 119 120.250 -0.841 4.807 1.00 0.24 C ATOM 720 CZ TYR A 119 119.661 -1.954 5.437 1.00 0.22 C ATOM 721 OH TYR A 119 118.316 -2.212 5.274 1.00 0.26 O ATOM 0 H TYR A 119 126.094 -1.029 5.150 1.00 0.20 H new ATOM 0 HA TYR A 119 124.599 -3.298 5.992 1.00 0.20 H new ATOM 0 HB2 TYR A 119 124.137 -1.142 6.956 1.00 0.20 H new ATOM 0 HB3 TYR A 119 124.172 -0.335 5.401 1.00 0.20 H new ATOM 0 HD1 TYR A 119 122.403 -3.208 6.989 1.00 0.20 H new ATOM 0 HD2 TYR A 119 122.075 0.273 4.502 1.00 0.22 H new ATOM 0 HE1 TYR A 119 119.997 -3.656 6.716 1.00 0.20 H new ATOM 0 HE2 TYR A 119 119.649 -0.187 4.192 1.00 0.24 H new ATOM 0 HH TYR A 119 118.049 -1.990 4.357 1.00 0.26 H new ATOM 731 N SER A 120 123.650 -1.992 3.122 1.00 0.23 N ATOM 732 CA SER A 120 122.925 -2.309 1.856 1.00 0.28 C ATOM 733 C SER A 120 123.741 -3.301 1.033 1.00 0.29 C ATOM 734 O SER A 120 123.199 -4.243 0.498 1.00 0.31 O ATOM 735 CB SER A 120 122.733 -0.970 1.137 1.00 0.32 C ATOM 736 OG SER A 120 122.085 -1.178 -0.123 1.00 0.45 O ATOM 0 H SER A 120 124.015 -1.042 3.187 1.00 0.23 H new ATOM 0 HA SER A 120 121.958 -2.780 2.030 1.00 0.28 H new ATOM 0 HB2 SER A 120 122.137 -0.298 1.755 1.00 0.32 H new ATOM 0 HB3 SER A 120 123.699 -0.489 0.983 1.00 0.32 H new ATOM 0 HG SER A 120 121.822 -0.314 -0.502 1.00 0.45 H new ATOM 742 N ASN A 121 125.040 -3.149 0.967 1.00 0.29 N ATOM 743 CA ASN A 121 125.854 -4.139 0.228 1.00 0.31 C ATOM 744 C ASN A 121 125.569 -5.476 0.848 1.00 0.31 C ATOM 745 O ASN A 121 125.420 -6.451 0.178 1.00 0.35 O ATOM 746 CB ASN A 121 127.304 -3.755 0.469 1.00 0.30 C ATOM 747 CG ASN A 121 127.693 -2.640 -0.484 1.00 0.33 C ATOM 748 OD1 ASN A 121 128.778 -2.618 -1.019 1.00 0.39 O ATOM 749 ND2 ASN A 121 126.828 -1.716 -0.731 1.00 0.34 N ATOM 0 H ASN A 121 125.562 -2.384 1.393 1.00 0.29 H new ATOM 0 HA ASN A 121 125.640 -4.170 -0.840 1.00 0.31 H new ATOM 0 HB2 ASN A 121 127.440 -3.431 1.501 1.00 0.30 H new ATOM 0 HB3 ASN A 121 127.951 -4.619 0.319 1.00 0.30 H new ATOM 0 HD21 ASN A 121 127.057 -0.963 -1.380 1.00 0.34 H new ATOM 0 HD22 ASN A 121 125.914 -1.738 -0.278 1.00 0.34 H new ATOM 756 N ASN A 122 125.445 -5.506 2.139 1.00 0.28 N ATOM 757 CA ASN A 122 125.123 -6.772 2.808 1.00 0.28 C ATOM 758 C ASN A 122 123.804 -7.276 2.324 1.00 0.31 C ATOM 759 O ASN A 122 123.648 -8.438 2.003 1.00 0.33 O ATOM 760 CB ASN A 122 125.024 -6.425 4.285 1.00 0.26 C ATOM 761 CG ASN A 122 126.175 -7.078 4.978 1.00 0.25 C ATOM 762 OD1 ASN A 122 126.028 -7.603 6.048 1.00 0.29 O ATOM 763 ND2 ASN A 122 127.317 -7.087 4.383 1.00 0.26 N ATOM 0 H ASN A 122 125.555 -4.701 2.756 1.00 0.28 H new ATOM 0 HA ASN A 122 125.869 -7.542 2.612 1.00 0.28 H new ATOM 0 HB2 ASN A 122 125.053 -5.345 4.428 1.00 0.26 H new ATOM 0 HB3 ASN A 122 124.078 -6.776 4.699 1.00 0.26 H new ATOM 0 HD21 ASN A 122 128.116 -7.546 4.820 1.00 0.26 H new ATOM 0 HD22 ASN A 122 127.422 -6.636 3.474 1.00 0.26 H new ATOM 770 N LYS A 123 122.860 -6.402 2.219 1.00 0.31 N ATOM 771 CA LYS A 123 121.547 -6.855 1.738 1.00 0.36 C ATOM 772 C LYS A 123 121.623 -7.099 0.228 1.00 0.40 C ATOM 773 O LYS A 123 120.754 -7.689 -0.369 1.00 0.46 O ATOM 774 CB LYS A 123 120.562 -5.735 2.118 1.00 0.37 C ATOM 775 CG LYS A 123 119.780 -5.251 0.891 1.00 0.43 C ATOM 776 CD LYS A 123 120.459 -4.010 0.321 1.00 0.45 C ATOM 777 CE LYS A 123 119.501 -3.263 -0.601 1.00 0.59 C ATOM 778 NZ LYS A 123 120.381 -2.339 -1.369 1.00 0.63 N ATOM 0 H LYS A 123 122.939 -5.410 2.442 1.00 0.31 H new ATOM 0 HA LYS A 123 121.222 -7.797 2.180 1.00 0.36 H new ATOM 0 HB2 LYS A 123 119.868 -6.098 2.876 1.00 0.37 H new ATOM 0 HB3 LYS A 123 121.107 -4.900 2.559 1.00 0.37 H new ATOM 0 HG2 LYS A 123 119.740 -6.037 0.137 1.00 0.43 H new ATOM 0 HG3 LYS A 123 118.751 -5.022 1.168 1.00 0.43 H new ATOM 0 HD2 LYS A 123 120.779 -3.356 1.132 1.00 0.45 H new ATOM 0 HD3 LYS A 123 121.355 -4.297 -0.229 1.00 0.45 H new ATOM 0 HE2 LYS A 123 118.969 -3.947 -1.262 1.00 0.59 H new ATOM 0 HE3 LYS A 123 118.747 -2.716 -0.034 1.00 0.59 H new ATOM 0 HZ1 LYS A 123 119.803 -1.595 -1.810 1.00 0.63 H new ATOM 0 HZ2 LYS A 123 121.073 -1.904 -0.726 1.00 0.63 H new ATOM 0 HZ3 LYS A 123 120.882 -2.872 -2.108 1.00 0.63 H new ATOM 792 N ASP A 124 122.676 -6.639 -0.370 1.00 0.39 N ATOM 793 CA ASP A 124 122.886 -6.800 -1.820 1.00 0.45 C ATOM 794 C ASP A 124 123.751 -8.018 -2.074 1.00 0.44 C ATOM 795 O ASP A 124 123.511 -8.814 -2.955 1.00 0.50 O ATOM 796 CB ASP A 124 123.650 -5.538 -2.187 1.00 0.46 C ATOM 797 CG ASP A 124 124.022 -5.552 -3.672 1.00 0.55 C ATOM 798 OD1 ASP A 124 123.125 -5.462 -4.491 1.00 0.70 O ATOM 799 OD2 ASP A 124 125.199 -5.666 -3.968 1.00 0.81 O ATOM 0 H ASP A 124 123.426 -6.140 0.108 1.00 0.39 H new ATOM 0 HA ASP A 124 121.966 -6.934 -2.388 1.00 0.45 H new ATOM 0 HB2 ASP A 124 123.043 -4.660 -1.966 1.00 0.46 H new ATOM 0 HB3 ASP A 124 124.552 -5.462 -1.580 1.00 0.46 H new ATOM 804 N GLN A 125 124.763 -8.132 -1.290 1.00 0.39 N ATOM 805 CA GLN A 125 125.714 -9.256 -1.401 1.00 0.38 C ATOM 806 C GLN A 125 125.051 -10.523 -0.866 1.00 0.38 C ATOM 807 O GLN A 125 125.046 -11.565 -1.507 1.00 0.42 O ATOM 808 CB GLN A 125 126.889 -8.808 -0.519 1.00 0.34 C ATOM 809 CG GLN A 125 127.313 -9.938 0.431 1.00 0.34 C ATOM 810 CD GLN A 125 128.355 -9.431 1.424 1.00 0.36 C ATOM 811 OE1 GLN A 125 128.037 -9.140 2.556 1.00 0.65 O ATOM 812 NE2 GLN A 125 129.592 -9.310 1.051 1.00 0.78 N ATOM 0 H GLN A 125 124.982 -7.469 -0.547 1.00 0.39 H new ATOM 0 HA GLN A 125 126.033 -9.483 -2.418 1.00 0.38 H new ATOM 0 HB2 GLN A 125 127.732 -8.518 -1.146 1.00 0.34 H new ATOM 0 HB3 GLN A 125 126.603 -7.929 0.058 1.00 0.34 H new ATOM 0 HG2 GLN A 125 126.443 -10.317 0.968 1.00 0.34 H new ATOM 0 HG3 GLN A 125 127.721 -10.770 -0.142 1.00 0.34 H new ATOM 0 HE21 GLN A 125 129.864 -9.554 0.099 1.00 0.78 H new ATOM 0 HE22 GLN A 125 130.293 -8.971 1.710 1.00 0.78 H new ATOM 821 N CYS A 126 124.466 -10.424 0.303 1.00 0.36 N ATOM 822 CA CYS A 126 123.786 -11.606 0.892 1.00 0.38 C ATOM 823 C CYS A 126 122.567 -11.946 0.041 1.00 0.44 C ATOM 824 O CYS A 126 122.413 -13.058 -0.419 1.00 0.48 O ATOM 825 CB CYS A 126 123.369 -11.179 2.300 1.00 0.38 C ATOM 826 SG CYS A 126 122.857 -12.630 3.250 1.00 0.42 S ATOM 0 H CYS A 126 124.433 -9.576 0.869 1.00 0.36 H new ATOM 0 HA CYS A 126 124.423 -12.490 0.927 1.00 0.38 H new ATOM 0 HB2 CYS A 126 124.199 -10.679 2.800 1.00 0.38 H new ATOM 0 HB3 CYS A 126 122.551 -10.461 2.245 1.00 0.38 H new ATOM 0 HG CYS A 126 123.904 -13.333 3.567 1.00 0.42 H new ATOM 832 N CYS A 127 121.704 -10.986 -0.189 1.00 0.46 N ATOM 833 CA CYS A 127 120.496 -11.268 -1.030 1.00 0.52 C ATOM 834 C CYS A 127 120.893 -11.756 -2.435 1.00 0.54 C ATOM 835 O CYS A 127 120.157 -12.493 -3.061 1.00 0.59 O ATOM 836 CB CYS A 127 119.742 -9.946 -1.134 1.00 0.54 C ATOM 837 SG CYS A 127 118.189 -10.201 -2.030 1.00 0.59 S ATOM 0 H CYS A 127 121.780 -10.032 0.163 1.00 0.46 H new ATOM 0 HA CYS A 127 119.889 -12.055 -0.582 1.00 0.52 H new ATOM 0 HB2 CYS A 127 119.539 -9.553 -0.138 1.00 0.54 H new ATOM 0 HB3 CYS A 127 120.354 -9.206 -1.650 1.00 0.54 H new ATOM 0 HG CYS A 127 117.547 -9.074 -2.116 1.00 0.59 H new ATOM 843 N LYS A 128 122.043 -11.355 -2.938 1.00 0.52 N ATOM 844 CA LYS A 128 122.458 -11.804 -4.313 1.00 0.55 C ATOM 845 C LYS A 128 122.413 -13.324 -4.419 1.00 0.57 C ATOM 846 O LYS A 128 121.725 -13.888 -5.249 1.00 0.63 O ATOM 847 CB LYS A 128 123.895 -11.302 -4.498 1.00 0.53 C ATOM 848 CG LYS A 128 124.295 -11.413 -5.974 1.00 0.62 C ATOM 849 CD LYS A 128 125.024 -10.135 -6.406 1.00 0.73 C ATOM 850 CE LYS A 128 124.041 -8.957 -6.403 1.00 0.80 C ATOM 851 NZ LYS A 128 124.691 -7.901 -5.569 1.00 1.02 N ATOM 0 H LYS A 128 122.706 -10.743 -2.462 1.00 0.52 H new ATOM 0 HA LYS A 128 121.789 -11.411 -5.079 1.00 0.55 H new ATOM 0 HB2 LYS A 128 123.974 -10.267 -4.167 1.00 0.53 H new ATOM 0 HB3 LYS A 128 124.577 -11.887 -3.881 1.00 0.53 H new ATOM 0 HG2 LYS A 128 124.939 -12.279 -6.123 1.00 0.62 H new ATOM 0 HG3 LYS A 128 123.409 -11.565 -6.591 1.00 0.62 H new ATOM 0 HD2 LYS A 128 125.854 -9.931 -5.729 1.00 0.73 H new ATOM 0 HD3 LYS A 128 125.449 -10.265 -7.401 1.00 0.73 H new ATOM 0 HE2 LYS A 128 123.854 -8.599 -7.415 1.00 0.80 H new ATOM 0 HE3 LYS A 128 123.078 -9.250 -5.986 1.00 0.80 H new ATOM 0 HZ1 LYS A 128 124.394 -6.962 -5.904 1.00 1.02 H new ATOM 0 HZ2 LYS A 128 124.408 -8.020 -4.575 1.00 1.02 H new ATOM 0 HZ3 LYS A 128 125.725 -7.985 -5.647 1.00 1.02 H new ATOM 865 N LEU A 129 123.134 -13.981 -3.573 1.00 0.53 N ATOM 866 CA LEU A 129 123.153 -15.463 -3.578 1.00 0.55 C ATOM 867 C LEU A 129 121.897 -16.003 -2.890 1.00 0.57 C ATOM 868 O LEU A 129 121.442 -17.105 -3.143 1.00 0.63 O ATOM 869 CB LEU A 129 124.419 -15.790 -2.795 1.00 0.53 C ATOM 870 CG LEU A 129 124.171 -15.673 -1.289 1.00 0.51 C ATOM 871 CD1 LEU A 129 124.696 -16.918 -0.592 1.00 0.53 C ATOM 872 CD2 LEU A 129 124.893 -14.436 -0.755 1.00 0.48 C ATOM 0 H LEU A 129 123.724 -13.549 -2.862 1.00 0.53 H new ATOM 0 HA LEU A 129 123.156 -15.908 -4.573 1.00 0.55 H new ATOM 0 HB2 LEU A 129 124.751 -16.800 -3.036 1.00 0.53 H new ATOM 0 HB3 LEU A 129 125.220 -15.112 -3.090 1.00 0.53 H new ATOM 0 HG LEU A 129 123.102 -15.579 -1.097 1.00 0.51 H new ATOM 0 HD11 LEU A 129 124.520 -16.836 0.481 1.00 0.53 H new ATOM 0 HD12 LEU A 129 124.179 -17.797 -0.978 1.00 0.53 H new ATOM 0 HD13 LEU A 129 125.766 -17.015 -0.778 1.00 0.53 H new ATOM 0 HD21 LEU A 129 124.719 -14.348 0.318 1.00 0.48 H new ATOM 0 HD22 LEU A 129 125.963 -14.529 -0.943 1.00 0.48 H new ATOM 0 HD23 LEU A 129 124.512 -13.547 -1.258 1.00 0.48 H new ATOM 884 N LEU A 130 121.354 -15.218 -2.011 1.00 0.55 N ATOM 885 CA LEU A 130 120.133 -15.621 -1.260 1.00 0.57 C ATOM 886 C LEU A 130 118.933 -15.710 -2.184 1.00 0.63 C ATOM 887 O LEU A 130 118.105 -16.599 -2.071 1.00 0.68 O ATOM 888 CB LEU A 130 119.940 -14.509 -0.235 1.00 0.53 C ATOM 889 CG LEU A 130 120.725 -14.832 1.029 1.00 0.53 C ATOM 890 CD1 LEU A 130 120.205 -13.972 2.177 1.00 0.50 C ATOM 891 CD2 LEU A 130 120.557 -16.311 1.375 1.00 0.59 C ATOM 0 H LEU A 130 121.711 -14.292 -1.774 1.00 0.55 H new ATOM 0 HA LEU A 130 120.235 -16.604 -0.800 1.00 0.57 H new ATOM 0 HB2 LEU A 130 120.275 -13.558 -0.649 1.00 0.53 H new ATOM 0 HB3 LEU A 130 118.882 -14.399 0.001 1.00 0.53 H new ATOM 0 HG LEU A 130 121.782 -14.622 0.866 1.00 0.53 H new ATOM 0 HD11 LEU A 130 120.764 -14.200 3.084 1.00 0.50 H new ATOM 0 HD12 LEU A 130 120.331 -12.918 1.928 1.00 0.50 H new ATOM 0 HD13 LEU A 130 119.148 -14.183 2.340 1.00 0.50 H new ATOM 0 HD21 LEU A 130 121.120 -16.539 2.280 1.00 0.59 H new ATOM 0 HD22 LEU A 130 119.502 -16.529 1.540 1.00 0.59 H new ATOM 0 HD23 LEU A 130 120.929 -16.922 0.552 1.00 0.59 H new ATOM 903 N ILE A 131 118.863 -14.821 -3.122 1.00 0.66 N ATOM 904 CA ILE A 131 117.748 -14.863 -4.104 1.00 0.73 C ATOM 905 C ILE A 131 117.869 -16.154 -4.916 1.00 0.76 C ATOM 906 O ILE A 131 116.963 -16.547 -5.624 1.00 0.82 O ATOM 907 CB ILE A 131 117.920 -13.611 -4.985 1.00 0.76 C ATOM 908 CG1 ILE A 131 116.541 -13.043 -5.327 1.00 0.83 C ATOM 909 CG2 ILE A 131 118.657 -13.959 -6.285 1.00 0.80 C ATOM 910 CD1 ILE A 131 116.000 -12.269 -4.125 1.00 0.92 C ATOM 0 H ILE A 131 119.531 -14.062 -3.255 1.00 0.66 H new ATOM 0 HA ILE A 131 116.761 -14.860 -3.641 1.00 0.73 H new ATOM 0 HB ILE A 131 118.507 -12.875 -4.435 1.00 0.76 H new ATOM 0 HG12 ILE A 131 116.610 -12.387 -6.195 1.00 0.83 H new ATOM 0 HG13 ILE A 131 115.858 -13.850 -5.591 1.00 0.83 H new ATOM 0 HG21 ILE A 131 118.768 -13.061 -6.892 1.00 0.80 H new ATOM 0 HG22 ILE A 131 119.642 -14.361 -6.048 1.00 0.80 H new ATOM 0 HG23 ILE A 131 118.085 -14.703 -6.839 1.00 0.80 H new ATOM 0 HD11 ILE A 131 115.017 -11.863 -4.366 1.00 0.92 H new ATOM 0 HD12 ILE A 131 115.916 -12.938 -3.269 1.00 0.92 H new ATOM 0 HD13 ILE A 131 116.680 -11.453 -3.882 1.00 0.92 H new ATOM 922 N SER A 132 118.993 -16.823 -4.795 1.00 0.73 N ATOM 923 CA SER A 132 119.197 -18.088 -5.531 1.00 0.76 C ATOM 924 C SER A 132 118.715 -19.270 -4.684 1.00 0.77 C ATOM 925 O SER A 132 118.176 -20.233 -5.196 1.00 0.84 O ATOM 926 CB SER A 132 120.706 -18.142 -5.786 1.00 0.73 C ATOM 927 OG SER A 132 121.348 -18.882 -4.752 1.00 0.70 O ATOM 0 H SER A 132 119.777 -16.535 -4.210 1.00 0.73 H new ATOM 0 HA SER A 132 118.635 -18.140 -6.464 1.00 0.76 H new ATOM 0 HB2 SER A 132 120.904 -18.605 -6.753 1.00 0.73 H new ATOM 0 HB3 SER A 132 121.113 -17.132 -5.828 1.00 0.73 H new ATOM 0 HG SER A 132 121.792 -18.264 -4.135 1.00 0.70 H new ATOM 933 N LYS A 133 118.882 -19.186 -3.386 1.00 0.73 N ATOM 934 CA LYS A 133 118.412 -20.282 -2.491 1.00 0.76 C ATOM 935 C LYS A 133 116.914 -20.121 -2.249 1.00 0.79 C ATOM 936 O LYS A 133 116.214 -21.055 -1.909 1.00 0.85 O ATOM 937 CB LYS A 133 119.171 -20.092 -1.164 1.00 0.73 C ATOM 938 CG LYS A 133 120.588 -19.574 -1.432 1.00 0.71 C ATOM 939 CD LYS A 133 121.540 -20.039 -0.323 1.00 0.71 C ATOM 940 CE LYS A 133 122.978 -20.027 -0.854 1.00 0.71 C ATOM 941 NZ LYS A 133 123.839 -20.441 0.297 1.00 0.66 N ATOM 0 H LYS A 133 119.326 -18.401 -2.909 1.00 0.73 H new ATOM 0 HA LYS A 133 118.590 -21.268 -2.920 1.00 0.76 H new ATOM 0 HB2 LYS A 133 118.634 -19.389 -0.527 1.00 0.73 H new ATOM 0 HB3 LYS A 133 119.218 -21.038 -0.625 1.00 0.73 H new ATOM 0 HG2 LYS A 133 120.939 -19.936 -2.398 1.00 0.71 H new ATOM 0 HG3 LYS A 133 120.582 -18.485 -1.483 1.00 0.71 H new ATOM 0 HD2 LYS A 133 121.455 -19.384 0.544 1.00 0.71 H new ATOM 0 HD3 LYS A 133 121.270 -21.042 0.007 1.00 0.71 H new ATOM 0 HE2 LYS A 133 123.091 -20.713 -1.694 1.00 0.71 H new ATOM 0 HE3 LYS A 133 123.254 -19.036 -1.213 1.00 0.71 H new ATOM 0 HZ1 LYS A 133 124.537 -21.141 -0.026 1.00 0.66 H new ATOM 0 HZ2 LYS A 133 124.333 -19.609 0.678 1.00 0.66 H new ATOM 0 HZ3 LYS A 133 123.246 -20.862 1.041 1.00 0.66 H new ATOM 955 N GLY A 134 116.440 -18.916 -2.395 1.00 0.77 N ATOM 956 CA GLY A 134 114.997 -18.626 -2.145 1.00 0.81 C ATOM 957 C GLY A 134 114.831 -18.401 -0.649 1.00 0.77 C ATOM 958 O GLY A 134 113.884 -18.838 -0.028 1.00 0.82 O ATOM 0 H GLY A 134 116.995 -18.109 -2.680 1.00 0.77 H new ATOM 0 HA2 GLY A 134 114.680 -17.745 -2.703 1.00 0.81 H new ATOM 0 HA3 GLY A 134 114.375 -19.456 -2.480 1.00 0.81 H new ATOM 962 N VAL A 135 115.799 -17.752 -0.080 1.00 0.71 N ATOM 963 CA VAL A 135 115.832 -17.489 1.367 1.00 0.68 C ATOM 964 C VAL A 135 114.998 -16.258 1.756 1.00 0.67 C ATOM 965 O VAL A 135 114.025 -15.903 1.120 1.00 0.72 O ATOM 966 CB VAL A 135 117.338 -17.276 1.574 1.00 0.62 C ATOM 967 CG1 VAL A 135 117.705 -15.794 1.552 1.00 0.58 C ATOM 968 CG2 VAL A 135 117.792 -17.922 2.870 1.00 0.64 C ATOM 0 H VAL A 135 116.601 -17.379 -0.588 1.00 0.71 H new ATOM 0 HA VAL A 135 115.401 -18.277 1.984 1.00 0.68 H new ATOM 0 HB VAL A 135 117.858 -17.754 0.744 1.00 0.62 H new ATOM 0 HG11 VAL A 135 118.779 -15.683 1.702 1.00 0.58 H new ATOM 0 HG12 VAL A 135 117.426 -15.364 0.590 1.00 0.58 H new ATOM 0 HG13 VAL A 135 117.172 -15.275 2.349 1.00 0.58 H new ATOM 0 HG21 VAL A 135 118.862 -17.762 3.001 1.00 0.64 H new ATOM 0 HG22 VAL A 135 117.253 -17.477 3.707 1.00 0.64 H new ATOM 0 HG23 VAL A 135 117.587 -18.992 2.834 1.00 0.64 H new ATOM 978 N SER A 136 115.414 -15.608 2.796 1.00 0.62 N ATOM 979 CA SER A 136 114.740 -14.389 3.291 1.00 0.61 C ATOM 980 C SER A 136 115.795 -13.476 3.907 1.00 0.54 C ATOM 981 O SER A 136 116.266 -13.691 5.002 1.00 0.55 O ATOM 982 CB SER A 136 113.724 -14.826 4.354 1.00 0.69 C ATOM 983 OG SER A 136 113.641 -16.247 4.421 1.00 0.81 O ATOM 0 H SER A 136 116.228 -15.885 3.345 1.00 0.62 H new ATOM 0 HA SER A 136 114.230 -13.852 2.491 1.00 0.61 H new ATOM 0 HB2 SER A 136 114.014 -14.428 5.326 1.00 0.69 H new ATOM 0 HB3 SER A 136 112.744 -14.411 4.119 1.00 0.69 H new ATOM 0 HG SER A 136 112.989 -16.505 5.106 1.00 0.81 H new ATOM 989 N ILE A 137 116.185 -12.482 3.186 1.00 0.51 N ATOM 990 CA ILE A 137 117.229 -11.531 3.678 1.00 0.47 C ATOM 991 C ILE A 137 116.656 -10.540 4.704 1.00 0.44 C ATOM 992 O ILE A 137 117.383 -9.880 5.401 1.00 0.42 O ATOM 993 CB ILE A 137 117.709 -10.759 2.446 1.00 0.49 C ATOM 994 CG1 ILE A 137 116.806 -9.542 2.221 1.00 0.51 C ATOM 995 CG2 ILE A 137 117.709 -11.645 1.193 1.00 0.71 C ATOM 996 CD1 ILE A 137 117.404 -8.662 1.127 1.00 0.55 C ATOM 0 H ILE A 137 115.825 -12.273 2.255 1.00 0.51 H new ATOM 0 HA ILE A 137 118.033 -12.076 4.173 1.00 0.47 H new ATOM 0 HB ILE A 137 118.733 -10.433 2.626 1.00 0.49 H new ATOM 0 HG12 ILE A 137 115.805 -9.866 1.936 1.00 0.51 H new ATOM 0 HG13 ILE A 137 116.706 -8.974 3.146 1.00 0.51 H new ATOM 0 HG21 ILE A 137 118.055 -11.065 0.337 1.00 0.71 H new ATOM 0 HG22 ILE A 137 118.374 -12.495 1.348 1.00 0.71 H new ATOM 0 HG23 ILE A 137 116.698 -12.005 1.002 1.00 0.71 H new ATOM 0 HD11 ILE A 137 116.763 -7.796 0.966 1.00 0.55 H new ATOM 0 HD12 ILE A 137 118.396 -8.328 1.431 1.00 0.55 H new ATOM 0 HD13 ILE A 137 117.481 -9.233 0.202 1.00 0.55 H new ATOM 1008 N THR A 138 115.366 -10.432 4.775 1.00 0.47 N ATOM 1009 CA THR A 138 114.703 -9.490 5.726 1.00 0.46 C ATOM 1010 C THR A 138 115.197 -9.771 7.136 1.00 0.44 C ATOM 1011 O THR A 138 115.625 -8.859 7.819 1.00 0.42 O ATOM 1012 CB THR A 138 113.197 -9.754 5.589 1.00 0.51 C ATOM 1013 OG1 THR A 138 112.758 -9.271 4.327 1.00 0.57 O ATOM 1014 CG2 THR A 138 112.433 -9.032 6.701 1.00 0.57 C ATOM 0 H THR A 138 114.719 -10.971 4.199 1.00 0.47 H new ATOM 0 HA THR A 138 114.928 -8.445 5.513 1.00 0.46 H new ATOM 0 HB THR A 138 113.009 -10.825 5.668 1.00 0.51 H new ATOM 0 HG1 THR A 138 111.797 -9.437 4.230 1.00 0.57 H new ATOM 0 HG21 THR A 138 111.366 -9.226 6.594 1.00 0.57 H new ATOM 0 HG22 THR A 138 112.773 -9.395 7.671 1.00 0.57 H new ATOM 0 HG23 THR A 138 112.616 -7.960 6.631 1.00 0.57 H new ATOM 1022 N PRO A 139 115.183 -11.030 7.531 1.00 0.46 N ATOM 1023 CA PRO A 139 115.710 -11.365 8.859 1.00 0.46 C ATOM 1024 C PRO A 139 117.188 -10.991 8.912 1.00 0.43 C ATOM 1025 O PRO A 139 117.675 -10.461 9.884 1.00 0.43 O ATOM 1026 CB PRO A 139 115.473 -12.863 8.988 1.00 0.52 C ATOM 1027 CG PRO A 139 115.359 -13.337 7.586 1.00 0.54 C ATOM 1028 CD PRO A 139 114.699 -12.221 6.827 1.00 0.52 C ATOM 0 HA PRO A 139 115.235 -10.830 9.681 1.00 0.46 H new ATOM 0 HB2 PRO A 139 116.296 -13.353 9.508 1.00 0.52 H new ATOM 0 HB3 PRO A 139 114.567 -13.075 9.555 1.00 0.52 H new ATOM 0 HG2 PRO A 139 116.340 -13.566 7.170 1.00 0.54 H new ATOM 0 HG3 PRO A 139 114.768 -14.251 7.529 1.00 0.54 H new ATOM 0 HD2 PRO A 139 114.989 -12.217 5.776 1.00 0.52 H new ATOM 0 HD3 PRO A 139 113.612 -12.297 6.857 1.00 0.52 H new ATOM 1036 N PHE A 140 117.887 -11.211 7.843 1.00 0.41 N ATOM 1037 CA PHE A 140 119.313 -10.802 7.806 1.00 0.38 C ATOM 1038 C PHE A 140 119.367 -9.274 7.811 1.00 0.34 C ATOM 1039 O PHE A 140 120.135 -8.677 8.544 1.00 0.32 O ATOM 1040 CB PHE A 140 119.901 -11.402 6.518 1.00 0.39 C ATOM 1041 CG PHE A 140 121.061 -10.562 6.029 1.00 0.36 C ATOM 1042 CD1 PHE A 140 122.270 -10.551 6.732 1.00 0.34 C ATOM 1043 CD2 PHE A 140 120.922 -9.785 4.879 1.00 0.36 C ATOM 1044 CE1 PHE A 140 123.335 -9.773 6.290 1.00 0.31 C ATOM 1045 CE2 PHE A 140 121.999 -9.007 4.435 1.00 0.33 C ATOM 1046 CZ PHE A 140 123.205 -9.005 5.148 1.00 0.31 C ATOM 0 H PHE A 140 117.536 -11.655 6.994 1.00 0.41 H new ATOM 0 HA PHE A 140 119.888 -11.155 8.662 1.00 0.38 H new ATOM 0 HB2 PHE A 140 120.235 -12.423 6.704 1.00 0.39 H new ATOM 0 HB3 PHE A 140 119.131 -11.454 5.748 1.00 0.39 H new ATOM 0 HD1 PHE A 140 122.377 -11.150 7.624 1.00 0.34 H new ATOM 0 HD2 PHE A 140 119.990 -9.783 4.334 1.00 0.36 H new ATOM 0 HE1 PHE A 140 124.265 -9.769 6.840 1.00 0.31 H new ATOM 0 HE2 PHE A 140 121.900 -8.408 3.542 1.00 0.33 H new ATOM 0 HZ PHE A 140 124.034 -8.403 4.805 1.00 0.31 H new ATOM 1056 N LEU A 141 118.521 -8.637 7.038 1.00 0.35 N ATOM 1057 CA LEU A 141 118.488 -7.148 7.058 1.00 0.32 C ATOM 1058 C LEU A 141 118.257 -6.712 8.508 1.00 0.30 C ATOM 1059 O LEU A 141 118.884 -5.793 9.002 1.00 0.29 O ATOM 1060 CB LEU A 141 117.310 -6.759 6.164 1.00 0.35 C ATOM 1061 CG LEU A 141 117.397 -5.274 5.824 1.00 0.39 C ATOM 1062 CD1 LEU A 141 117.451 -5.100 4.307 1.00 0.57 C ATOM 1063 CD2 LEU A 141 116.169 -4.548 6.377 1.00 0.53 C ATOM 0 H LEU A 141 117.860 -9.082 6.401 1.00 0.35 H new ATOM 0 HA LEU A 141 119.405 -6.678 6.702 1.00 0.32 H new ATOM 0 HB2 LEU A 141 117.321 -7.353 5.250 1.00 0.35 H new ATOM 0 HB3 LEU A 141 116.369 -6.972 6.671 1.00 0.35 H new ATOM 0 HG LEU A 141 118.298 -4.853 6.271 1.00 0.39 H new ATOM 0 HD11 LEU A 141 117.513 -4.039 4.064 1.00 0.57 H new ATOM 0 HD12 LEU A 141 118.327 -5.614 3.913 1.00 0.57 H new ATOM 0 HD13 LEU A 141 116.551 -5.522 3.860 1.00 0.57 H new ATOM 0 HD21 LEU A 141 116.233 -3.488 6.133 1.00 0.53 H new ATOM 0 HD22 LEU A 141 115.267 -4.969 5.933 1.00 0.53 H new ATOM 0 HD23 LEU A 141 116.131 -4.670 7.460 1.00 0.53 H new ATOM 1075 N LYS A 142 117.401 -7.422 9.206 1.00 0.33 N ATOM 1076 CA LYS A 142 117.153 -7.119 10.640 1.00 0.33 C ATOM 1077 C LYS A 142 118.494 -7.091 11.382 1.00 0.30 C ATOM 1078 O LYS A 142 118.733 -6.256 12.239 1.00 0.30 O ATOM 1079 CB LYS A 142 116.322 -8.302 11.131 1.00 0.39 C ATOM 1080 CG LYS A 142 115.814 -8.027 12.548 1.00 0.42 C ATOM 1081 CD LYS A 142 116.712 -8.746 13.564 1.00 0.43 C ATOM 1082 CE LYS A 142 117.078 -7.792 14.709 1.00 0.45 C ATOM 1083 NZ LYS A 142 118.531 -7.499 14.525 1.00 0.39 N ATOM 0 H LYS A 142 116.862 -8.204 8.834 1.00 0.33 H new ATOM 0 HA LYS A 142 116.657 -6.161 10.799 1.00 0.33 H new ATOM 0 HB2 LYS A 142 115.480 -8.470 10.459 1.00 0.39 H new ATOM 0 HB3 LYS A 142 116.924 -9.210 11.121 1.00 0.39 H new ATOM 0 HG2 LYS A 142 115.813 -6.955 12.743 1.00 0.42 H new ATOM 0 HG3 LYS A 142 114.785 -8.371 12.650 1.00 0.42 H new ATOM 0 HD2 LYS A 142 116.198 -9.622 13.960 1.00 0.43 H new ATOM 0 HD3 LYS A 142 117.618 -9.102 13.073 1.00 0.43 H new ATOM 0 HE2 LYS A 142 116.484 -6.879 14.666 1.00 0.45 H new ATOM 0 HE3 LYS A 142 116.889 -8.251 15.680 1.00 0.45 H new ATOM 0 HZ1 LYS A 142 118.927 -7.133 15.414 1.00 0.39 H new ATOM 0 HZ2 LYS A 142 119.030 -8.371 14.257 1.00 0.39 H new ATOM 0 HZ3 LYS A 142 118.650 -6.788 13.775 1.00 0.39 H new ATOM 1097 N GLU A 143 119.374 -8.012 11.058 1.00 0.30 N ATOM 1098 CA GLU A 143 120.696 -8.058 11.727 1.00 0.28 C ATOM 1099 C GLU A 143 121.556 -6.878 11.291 1.00 0.24 C ATOM 1100 O GLU A 143 122.017 -6.121 12.121 1.00 0.26 O ATOM 1101 CB GLU A 143 121.313 -9.384 11.311 1.00 0.31 C ATOM 1102 CG GLU A 143 121.363 -10.300 12.528 1.00 0.36 C ATOM 1103 CD GLU A 143 119.961 -10.469 13.116 1.00 0.38 C ATOM 1104 OE1 GLU A 143 119.238 -11.322 12.633 1.00 0.48 O ATOM 1105 OE2 GLU A 143 119.634 -9.734 14.039 1.00 0.37 O ATOM 0 H GLU A 143 119.223 -8.734 10.353 1.00 0.30 H new ATOM 0 HA GLU A 143 120.612 -7.986 12.811 1.00 0.28 H new ATOM 0 HB2 GLU A 143 120.724 -9.842 10.516 1.00 0.31 H new ATOM 0 HB3 GLU A 143 122.316 -9.227 10.914 1.00 0.31 H new ATOM 0 HG2 GLU A 143 121.767 -11.272 12.245 1.00 0.36 H new ATOM 0 HG3 GLU A 143 122.033 -9.883 13.280 1.00 0.36 H new ATOM 1112 N ILE A 144 121.775 -6.674 10.011 1.00 0.23 N ATOM 1113 CA ILE A 144 122.590 -5.492 9.631 1.00 0.23 C ATOM 1114 C ILE A 144 121.912 -4.226 10.164 1.00 0.23 C ATOM 1115 O ILE A 144 122.573 -3.283 10.546 1.00 0.25 O ATOM 1116 CB ILE A 144 122.728 -5.518 8.111 1.00 0.30 C ATOM 1117 CG1 ILE A 144 121.406 -5.864 7.408 1.00 0.29 C ATOM 1118 CG2 ILE A 144 123.771 -6.562 7.764 1.00 0.40 C ATOM 1119 CD1 ILE A 144 121.622 -7.010 6.415 1.00 0.37 C ATOM 0 H ILE A 144 121.436 -7.255 9.244 1.00 0.23 H new ATOM 0 HA ILE A 144 123.589 -5.507 10.066 1.00 0.23 H new ATOM 0 HB ILE A 144 123.019 -4.525 7.768 1.00 0.30 H new ATOM 0 HG12 ILE A 144 120.656 -6.149 8.146 1.00 0.29 H new ATOM 0 HG13 ILE A 144 121.023 -4.987 6.886 1.00 0.29 H new ATOM 0 HG21 ILE A 144 123.895 -6.607 6.682 1.00 0.40 H new ATOM 0 HG22 ILE A 144 124.721 -6.295 8.227 1.00 0.40 H new ATOM 0 HG23 ILE A 144 123.448 -7.536 8.133 1.00 0.40 H new ATOM 0 HD11 ILE A 144 120.679 -7.247 5.922 1.00 0.37 H new ATOM 0 HD12 ILE A 144 122.356 -6.710 5.668 1.00 0.37 H new ATOM 0 HD13 ILE A 144 121.984 -7.889 6.947 1.00 0.37 H new ATOM 1131 N GLY A 145 120.601 -4.240 10.272 1.00 0.24 N ATOM 1132 CA GLY A 145 119.865 -3.085 10.856 1.00 0.26 C ATOM 1133 C GLY A 145 120.301 -2.915 12.321 1.00 0.23 C ATOM 1134 O GLY A 145 120.275 -1.843 12.870 1.00 0.25 O ATOM 0 H GLY A 145 120.009 -5.016 9.975 1.00 0.24 H new ATOM 0 HA2 GLY A 145 120.076 -2.177 10.291 1.00 0.26 H new ATOM 0 HA3 GLY A 145 118.790 -3.254 10.799 1.00 0.26 H new ATOM 1138 N GLU A 146 120.747 -3.974 12.930 1.00 0.22 N ATOM 1139 CA GLU A 146 121.241 -3.913 14.338 1.00 0.23 C ATOM 1140 C GLU A 146 122.465 -3.069 14.333 1.00 0.22 C ATOM 1141 O GLU A 146 122.548 -2.009 14.920 1.00 0.24 O ATOM 1142 CB GLU A 146 121.656 -5.335 14.671 1.00 0.25 C ATOM 1143 CG GLU A 146 121.574 -5.574 16.173 1.00 0.31 C ATOM 1144 CD GLU A 146 120.182 -5.221 16.694 1.00 0.36 C ATOM 1145 OE1 GLU A 146 119.247 -5.937 16.361 1.00 0.42 O ATOM 1146 OE2 GLU A 146 120.075 -4.242 17.412 1.00 0.43 O ATOM 0 H GLU A 146 120.792 -4.900 12.505 1.00 0.22 H new ATOM 0 HA GLU A 146 120.504 -3.519 15.038 1.00 0.23 H new ATOM 0 HB2 GLU A 146 121.011 -6.041 14.148 1.00 0.25 H new ATOM 0 HB3 GLU A 146 122.673 -5.515 14.323 1.00 0.25 H new ATOM 0 HG2 GLU A 146 121.798 -6.618 16.394 1.00 0.31 H new ATOM 0 HG3 GLU A 146 122.324 -4.971 16.685 1.00 0.31 H new ATOM 1153 N ALA A 147 123.393 -3.540 13.591 1.00 0.22 N ATOM 1154 CA ALA A 147 124.644 -2.800 13.406 1.00 0.24 C ATOM 1155 C ALA A 147 124.247 -1.407 12.904 1.00 0.23 C ATOM 1156 O ALA A 147 124.758 -0.410 13.349 1.00 0.25 O ATOM 1157 CB ALA A 147 125.424 -3.580 12.341 1.00 0.27 C ATOM 0 H ALA A 147 123.340 -4.428 13.091 1.00 0.22 H new ATOM 0 HA ALA A 147 125.251 -2.694 14.305 1.00 0.24 H new ATOM 0 HB1 ALA A 147 126.375 -3.083 12.150 1.00 0.27 H new ATOM 0 HB2 ALA A 147 125.609 -4.594 12.695 1.00 0.27 H new ATOM 0 HB3 ALA A 147 124.843 -3.618 11.420 1.00 0.27 H new ATOM 1163 N ALA A 148 123.270 -1.366 12.024 1.00 0.22 N ATOM 1164 CA ALA A 148 122.745 -0.096 11.474 1.00 0.23 C ATOM 1165 C ALA A 148 122.006 0.701 12.549 1.00 0.24 C ATOM 1166 O ALA A 148 121.754 1.879 12.398 1.00 0.27 O ATOM 1167 CB ALA A 148 121.772 -0.571 10.389 1.00 0.23 C ATOM 0 H ALA A 148 122.807 -2.198 11.659 1.00 0.22 H new ATOM 0 HA ALA A 148 123.526 0.565 11.099 1.00 0.23 H new ATOM 0 HB1 ALA A 148 121.316 0.293 9.906 1.00 0.23 H new ATOM 0 HB2 ALA A 148 122.313 -1.158 9.647 1.00 0.23 H new ATOM 0 HB3 ALA A 148 120.994 -1.186 10.842 1.00 0.23 H new ATOM 1173 N GLN A 149 121.671 0.068 13.634 1.00 0.24 N ATOM 1174 CA GLN A 149 120.965 0.764 14.724 1.00 0.27 C ATOM 1175 C GLN A 149 121.995 1.174 15.763 1.00 0.31 C ATOM 1176 O GLN A 149 122.017 2.273 16.279 1.00 0.36 O ATOM 1177 CB GLN A 149 120.016 -0.297 15.287 1.00 0.27 C ATOM 1178 CG GLN A 149 119.512 0.140 16.665 1.00 0.30 C ATOM 1179 CD GLN A 149 118.339 -0.742 17.083 1.00 0.32 C ATOM 1180 OE1 GLN A 149 117.231 -0.273 17.225 1.00 0.36 O ATOM 1181 NE2 GLN A 149 118.537 -2.011 17.286 1.00 0.37 N ATOM 0 H GLN A 149 121.863 -0.919 13.809 1.00 0.24 H new ATOM 0 HA GLN A 149 120.428 1.660 14.412 1.00 0.27 H new ATOM 0 HB2 GLN A 149 119.174 -0.441 14.610 1.00 0.27 H new ATOM 0 HB3 GLN A 149 120.531 -1.255 15.364 1.00 0.27 H new ATOM 0 HG2 GLN A 149 120.315 0.066 17.398 1.00 0.30 H new ATOM 0 HG3 GLN A 149 119.203 1.185 16.636 1.00 0.30 H new ATOM 0 HE21 GLN A 149 119.469 -2.407 17.167 1.00 0.37 H new ATOM 0 HE22 GLN A 149 117.760 -2.610 17.564 1.00 0.37 H new ATOM 1190 N ASN A 150 122.848 0.247 16.039 1.00 0.31 N ATOM 1191 CA ASN A 150 123.942 0.429 17.020 1.00 0.36 C ATOM 1192 C ASN A 150 125.039 1.339 16.436 1.00 0.36 C ATOM 1193 O ASN A 150 125.706 2.056 17.156 1.00 0.41 O ATOM 1194 CB ASN A 150 124.399 -1.019 17.240 1.00 0.38 C ATOM 1195 CG ASN A 150 125.871 -1.220 16.884 1.00 0.39 C ATOM 1196 OD1 ASN A 150 126.710 -1.340 17.749 1.00 0.46 O ATOM 1197 ND2 ASN A 150 126.212 -1.273 15.635 1.00 0.36 N ATOM 0 H ASN A 150 122.833 -0.676 15.605 1.00 0.31 H new ATOM 0 HA ASN A 150 123.661 0.922 17.951 1.00 0.36 H new ATOM 0 HB2 ASN A 150 124.238 -1.295 18.282 1.00 0.38 H new ATOM 0 HB3 ASN A 150 123.786 -1.687 16.635 1.00 0.38 H new ATOM 0 HD21 ASN A 150 127.189 -1.416 15.379 1.00 0.36 H new ATOM 0 HD22 ASN A 150 125.504 -1.172 14.908 1.00 0.36 H new ATOM 1204 N ALA A 151 125.214 1.324 15.133 1.00 0.33 N ATOM 1205 CA ALA A 151 126.247 2.195 14.498 1.00 0.34 C ATOM 1206 C ALA A 151 125.783 3.660 14.506 1.00 0.33 C ATOM 1207 O ALA A 151 126.585 4.564 14.377 1.00 0.37 O ATOM 1208 CB ALA A 151 126.388 1.674 13.064 1.00 0.33 C ATOM 0 H ALA A 151 124.683 0.743 14.484 1.00 0.33 H new ATOM 0 HA ALA A 151 127.197 2.164 15.031 1.00 0.34 H new ATOM 0 HB1 ALA A 151 127.133 2.267 12.533 1.00 0.33 H new ATOM 0 HB2 ALA A 151 126.703 0.631 13.085 1.00 0.33 H new ATOM 0 HB3 ALA A 151 125.429 1.753 12.552 1.00 0.33 H new ATOM 1214 N GLY A 152 124.503 3.903 14.684 1.00 0.33 N ATOM 1215 CA GLY A 152 124.011 5.312 14.733 1.00 0.36 C ATOM 1216 C GLY A 152 123.232 5.713 13.472 1.00 0.36 C ATOM 1217 O GLY A 152 123.041 6.885 13.222 1.00 0.42 O ATOM 0 H GLY A 152 123.785 3.188 14.796 1.00 0.33 H new ATOM 0 HA2 GLY A 152 123.371 5.439 15.606 1.00 0.36 H new ATOM 0 HA3 GLY A 152 124.859 5.984 14.860 1.00 0.36 H new ATOM 1221 N LEU A 153 122.763 4.779 12.687 1.00 0.33 N ATOM 1222 CA LEU A 153 121.980 5.167 11.456 1.00 0.34 C ATOM 1223 C LEU A 153 120.614 4.449 11.400 1.00 0.32 C ATOM 1224 O LEU A 153 120.398 3.610 10.557 1.00 0.34 O ATOM 1225 CB LEU A 153 122.853 4.794 10.236 1.00 0.38 C ATOM 1226 CG LEU A 153 123.629 3.488 10.466 1.00 0.36 C ATOM 1227 CD1 LEU A 153 123.568 2.629 9.204 1.00 0.45 C ATOM 1228 CD2 LEU A 153 125.091 3.814 10.762 1.00 0.41 C ATOM 0 H LEU A 153 122.881 3.776 12.834 1.00 0.33 H new ATOM 0 HA LEU A 153 121.760 6.234 11.467 1.00 0.34 H new ATOM 0 HB2 LEU A 153 122.220 4.690 9.355 1.00 0.38 H new ATOM 0 HB3 LEU A 153 123.555 5.602 10.031 1.00 0.38 H new ATOM 0 HG LEU A 153 123.187 2.950 11.305 1.00 0.36 H new ATOM 0 HD11 LEU A 153 124.119 1.703 9.367 1.00 0.45 H new ATOM 0 HD12 LEU A 153 122.529 2.397 8.972 1.00 0.45 H new ATOM 0 HD13 LEU A 153 124.013 3.174 8.371 1.00 0.45 H new ATOM 0 HD21 LEU A 153 125.644 2.889 10.926 1.00 0.41 H new ATOM 0 HD22 LEU A 153 125.523 4.350 9.917 1.00 0.41 H new ATOM 0 HD23 LEU A 153 125.151 4.436 11.655 1.00 0.41 H new ATOM 1240 N PRO A 154 119.728 4.818 12.302 1.00 0.34 N ATOM 1241 CA PRO A 154 118.371 4.223 12.370 1.00 0.35 C ATOM 1242 C PRO A 154 117.338 5.112 11.646 1.00 0.39 C ATOM 1243 O PRO A 154 117.667 6.165 11.132 1.00 0.44 O ATOM 1244 CB PRO A 154 118.106 4.217 13.876 1.00 0.44 C ATOM 1245 CG PRO A 154 118.969 5.318 14.447 1.00 0.50 C ATOM 1246 CD PRO A 154 119.894 5.808 13.353 1.00 0.43 C ATOM 0 HA PRO A 154 118.298 3.244 11.897 1.00 0.35 H new ATOM 0 HB2 PRO A 154 117.052 4.395 14.089 1.00 0.44 H new ATOM 0 HB3 PRO A 154 118.361 3.252 14.315 1.00 0.44 H new ATOM 0 HG2 PRO A 154 118.349 6.135 14.815 1.00 0.50 H new ATOM 0 HG3 PRO A 154 119.545 4.948 15.295 1.00 0.50 H new ATOM 0 HD2 PRO A 154 119.619 6.806 13.012 1.00 0.43 H new ATOM 0 HD3 PRO A 154 120.928 5.861 13.695 1.00 0.43 H new ATOM 1254 N GLY A 155 116.085 4.708 11.619 1.00 0.41 N ATOM 1255 CA GLY A 155 115.048 5.552 10.947 1.00 0.50 C ATOM 1256 C GLY A 155 113.907 4.720 10.336 1.00 0.48 C ATOM 1257 O GLY A 155 112.928 5.272 9.873 1.00 0.56 O ATOM 0 H GLY A 155 115.742 3.839 12.029 1.00 0.41 H new ATOM 0 HA2 GLY A 155 114.633 6.254 11.670 1.00 0.50 H new ATOM 0 HA3 GLY A 155 115.520 6.144 10.163 1.00 0.50 H new ATOM 1261 N GLU A 156 114.009 3.416 10.317 1.00 0.42 N ATOM 1262 CA GLU A 156 112.928 2.591 9.725 1.00 0.43 C ATOM 1263 C GLU A 156 112.771 1.272 10.477 1.00 0.38 C ATOM 1264 O GLU A 156 113.722 0.715 10.991 1.00 0.34 O ATOM 1265 CB GLU A 156 113.376 2.329 8.296 1.00 0.46 C ATOM 1266 CG GLU A 156 112.668 3.287 7.352 1.00 0.60 C ATOM 1267 CD GLU A 156 111.857 2.493 6.323 1.00 0.67 C ATOM 1268 OE1 GLU A 156 112.437 1.640 5.661 1.00 0.63 O ATOM 1269 OE2 GLU A 156 110.666 2.728 6.229 1.00 0.90 O ATOM 0 H GLU A 156 114.800 2.890 10.689 1.00 0.42 H new ATOM 0 HA GLU A 156 111.963 3.095 9.775 1.00 0.43 H new ATOM 0 HB2 GLU A 156 114.456 2.455 8.215 1.00 0.46 H new ATOM 0 HB3 GLU A 156 113.153 1.299 8.018 1.00 0.46 H new ATOM 0 HG2 GLU A 156 112.010 3.948 7.916 1.00 0.60 H new ATOM 0 HG3 GLU A 156 113.397 3.919 6.845 1.00 0.60 H new ATOM 1276 N ILE A 157 111.571 0.779 10.554 1.00 0.42 N ATOM 1277 CA ILE A 157 111.314 -0.483 11.275 1.00 0.42 C ATOM 1278 C ILE A 157 109.945 -1.049 10.847 1.00 0.48 C ATOM 1279 O ILE A 157 109.040 -0.295 10.543 1.00 0.58 O ATOM 1280 CB ILE A 157 111.355 -0.029 12.734 1.00 0.47 C ATOM 1281 CG1 ILE A 157 112.074 -1.092 13.560 1.00 0.51 C ATOM 1282 CG2 ILE A 157 109.945 0.243 13.256 1.00 0.59 C ATOM 1283 CD1 ILE A 157 111.238 -1.500 14.767 1.00 0.62 C ATOM 0 H ILE A 157 110.745 1.209 10.138 1.00 0.42 H new ATOM 0 HA ILE A 157 112.020 -1.290 11.081 1.00 0.42 H new ATOM 0 HB ILE A 157 111.905 0.908 12.816 1.00 0.47 H new ATOM 0 HG12 ILE A 157 112.275 -1.966 12.940 1.00 0.51 H new ATOM 0 HG13 ILE A 157 113.038 -0.709 13.893 1.00 0.51 H new ATOM 0 HG21 ILE A 157 109.998 0.565 14.296 1.00 0.59 H new ATOM 0 HG22 ILE A 157 109.480 1.026 12.657 1.00 0.59 H new ATOM 0 HG23 ILE A 157 109.350 -0.668 13.188 1.00 0.59 H new ATOM 0 HD11 ILE A 157 111.772 -2.258 15.340 1.00 0.62 H new ATOM 0 HD12 ILE A 157 111.059 -0.629 15.397 1.00 0.62 H new ATOM 0 HD13 ILE A 157 110.284 -1.905 14.429 1.00 0.62 H new ATOM 1295 N LYS A 158 109.781 -2.356 10.791 1.00 0.45 N ATOM 1296 CA LYS A 158 108.467 -2.911 10.350 1.00 0.52 C ATOM 1297 C LYS A 158 108.067 -4.133 11.203 1.00 0.57 C ATOM 1298 O LYS A 158 108.124 -4.093 12.418 1.00 0.65 O ATOM 1299 CB LYS A 158 108.676 -3.292 8.871 1.00 0.52 C ATOM 1300 CG LYS A 158 108.978 -2.040 8.036 1.00 0.55 C ATOM 1301 CD LYS A 158 110.453 -2.043 7.611 1.00 0.53 C ATOM 1302 CE LYS A 158 110.902 -0.608 7.316 1.00 0.53 C ATOM 1303 NZ LYS A 158 112.067 -0.738 6.389 1.00 0.48 N ATOM 0 H LYS A 158 110.492 -3.047 11.029 1.00 0.45 H new ATOM 0 HA LYS A 158 107.655 -2.194 10.469 1.00 0.52 H new ATOM 0 HB2 LYS A 158 109.498 -4.002 8.784 1.00 0.52 H new ATOM 0 HB3 LYS A 158 107.785 -3.788 8.487 1.00 0.52 H new ATOM 0 HG2 LYS A 158 108.336 -2.015 7.155 1.00 0.55 H new ATOM 0 HG3 LYS A 158 108.759 -1.143 8.616 1.00 0.55 H new ATOM 0 HD2 LYS A 158 111.069 -2.473 8.400 1.00 0.53 H new ATOM 0 HD3 LYS A 158 110.587 -2.666 6.727 1.00 0.53 H new ATOM 0 HE2 LYS A 158 110.098 -0.031 6.858 1.00 0.53 H new ATOM 0 HE3 LYS A 158 111.185 -0.089 8.232 1.00 0.53 H new ATOM 0 HZ1 LYS A 158 112.201 0.155 5.872 1.00 0.48 H new ATOM 0 HZ2 LYS A 158 112.924 -0.953 6.937 1.00 0.48 H new ATOM 0 HZ3 LYS A 158 111.888 -1.506 5.712 1.00 0.48 H new ATOM 1317 N ASN A 159 107.649 -5.210 10.575 1.00 0.59 N ATOM 1318 CA ASN A 159 107.229 -6.435 11.332 1.00 0.66 C ATOM 1319 C ASN A 159 108.401 -7.035 12.125 1.00 0.67 C ATOM 1320 O ASN A 159 108.985 -8.027 11.731 1.00 0.71 O ATOM 1321 CB ASN A 159 106.769 -7.403 10.250 1.00 0.69 C ATOM 1322 CG ASN A 159 105.357 -7.039 9.799 1.00 0.96 C ATOM 1323 OD1 ASN A 159 105.176 -6.143 9.005 1.00 1.20 O ATOM 1324 ND2 ASN A 159 104.343 -7.698 10.275 1.00 1.28 N ATOM 0 H ASN A 159 107.581 -5.292 9.561 1.00 0.59 H new ATOM 0 HA ASN A 159 106.453 -6.216 12.065 1.00 0.66 H new ATOM 0 HB2 ASN A 159 107.453 -7.367 9.402 1.00 0.69 H new ATOM 0 HB3 ASN A 159 106.787 -8.424 10.631 1.00 0.69 H new ATOM 0 HD21 ASN A 159 103.396 -7.460 9.980 1.00 1.28 H new ATOM 0 HD22 ASN A 159 104.494 -8.453 10.944 1.00 1.28 H new ATOM 1331 N GLY A 160 108.748 -6.437 13.237 1.00 0.69 N ATOM 1332 CA GLY A 160 109.882 -6.961 14.059 1.00 0.75 C ATOM 1333 C GLY A 160 111.191 -6.843 13.285 1.00 0.67 C ATOM 1334 O GLY A 160 112.097 -7.637 13.443 1.00 0.74 O ATOM 0 H GLY A 160 108.293 -5.605 13.612 1.00 0.69 H new ATOM 0 HA2 GLY A 160 109.952 -6.404 14.993 1.00 0.75 H new ATOM 0 HA3 GLY A 160 109.699 -8.003 14.322 1.00 0.75 H new ATOM 1338 N VAL A 161 111.287 -5.850 12.455 1.00 0.56 N ATOM 1339 CA VAL A 161 112.513 -5.632 11.654 1.00 0.49 C ATOM 1340 C VAL A 161 112.839 -4.149 11.590 1.00 0.40 C ATOM 1341 O VAL A 161 111.957 -3.318 11.546 1.00 0.43 O ATOM 1342 CB VAL A 161 112.187 -6.157 10.258 1.00 0.49 C ATOM 1343 CG1 VAL A 161 111.502 -5.074 9.425 1.00 0.44 C ATOM 1344 CG2 VAL A 161 113.486 -6.548 9.568 1.00 0.52 C ATOM 0 H VAL A 161 110.549 -5.165 12.295 1.00 0.56 H new ATOM 0 HA VAL A 161 113.376 -6.138 12.087 1.00 0.49 H new ATOM 0 HB VAL A 161 111.520 -7.014 10.348 1.00 0.49 H new ATOM 0 HG11 VAL A 161 111.277 -5.466 8.433 1.00 0.44 H new ATOM 0 HG12 VAL A 161 110.576 -4.770 9.914 1.00 0.44 H new ATOM 0 HG13 VAL A 161 112.164 -4.213 9.333 1.00 0.44 H new ATOM 0 HG21 VAL A 161 113.268 -6.925 8.569 1.00 0.52 H new ATOM 0 HG22 VAL A 161 114.135 -5.676 9.493 1.00 0.52 H new ATOM 0 HG23 VAL A 161 113.987 -7.324 10.147 1.00 0.52 H new ATOM 1354 N PHE A 162 114.089 -3.812 11.561 1.00 0.43 N ATOM 1355 CA PHE A 162 114.466 -2.385 11.484 1.00 0.36 C ATOM 1356 C PHE A 162 115.336 -2.119 10.250 1.00 0.33 C ATOM 1357 O PHE A 162 116.033 -2.983 9.749 1.00 0.38 O ATOM 1358 CB PHE A 162 115.223 -2.112 12.791 1.00 0.38 C ATOM 1359 CG PHE A 162 116.298 -1.072 12.581 1.00 0.32 C ATOM 1360 CD1 PHE A 162 117.454 -1.416 11.886 1.00 0.31 C ATOM 1361 CD2 PHE A 162 116.147 0.223 13.086 1.00 0.35 C ATOM 1362 CE1 PHE A 162 118.461 -0.475 11.689 1.00 0.28 C ATOM 1363 CE2 PHE A 162 117.164 1.168 12.895 1.00 0.34 C ATOM 1364 CZ PHE A 162 118.326 0.811 12.192 1.00 0.29 C ATOM 0 H PHE A 162 114.870 -4.467 11.587 1.00 0.43 H new ATOM 0 HA PHE A 162 113.603 -1.727 11.378 1.00 0.36 H new ATOM 0 HB2 PHE A 162 114.525 -1.771 13.556 1.00 0.38 H new ATOM 0 HB3 PHE A 162 115.671 -3.036 13.157 1.00 0.38 H new ATOM 0 HD1 PHE A 162 117.570 -2.417 11.498 1.00 0.31 H new ATOM 0 HD2 PHE A 162 115.249 0.494 13.622 1.00 0.35 H new ATOM 0 HE1 PHE A 162 119.352 -0.747 11.142 1.00 0.28 H new ATOM 0 HE2 PHE A 162 117.054 2.168 13.287 1.00 0.34 H new ATOM 0 HZ PHE A 162 119.113 1.536 12.043 1.00 0.29 H new ATOM 1374 N THR A 163 115.305 -0.908 9.790 1.00 0.31 N ATOM 1375 CA THR A 163 116.128 -0.494 8.616 1.00 0.33 C ATOM 1376 C THR A 163 116.846 0.818 8.972 1.00 0.31 C ATOM 1377 O THR A 163 116.259 1.681 9.601 1.00 0.32 O ATOM 1378 CB THR A 163 115.138 -0.268 7.459 1.00 0.38 C ATOM 1379 OG1 THR A 163 114.133 -1.285 7.450 1.00 0.44 O ATOM 1380 CG2 THR A 163 115.888 -0.297 6.129 1.00 0.49 C ATOM 0 H THR A 163 114.730 -0.164 10.185 1.00 0.31 H new ATOM 0 HA THR A 163 116.876 -1.237 8.342 1.00 0.33 H new ATOM 0 HB THR A 163 114.661 0.702 7.598 1.00 0.38 H new ATOM 0 HG1 THR A 163 114.216 -1.820 6.633 1.00 0.44 H new ATOM 0 HG21 THR A 163 115.185 -0.137 5.311 1.00 0.49 H new ATOM 0 HG22 THR A 163 116.642 0.490 6.119 1.00 0.49 H new ATOM 0 HG23 THR A 163 116.373 -1.265 6.006 1.00 0.49 H new ATOM 1388 N PRO A 164 118.090 0.934 8.574 1.00 0.31 N ATOM 1389 CA PRO A 164 118.869 2.165 8.882 1.00 0.31 C ATOM 1390 C PRO A 164 118.273 3.394 8.175 1.00 0.32 C ATOM 1391 O PRO A 164 117.684 3.284 7.116 1.00 0.34 O ATOM 1392 CB PRO A 164 120.271 1.838 8.374 1.00 0.32 C ATOM 1393 CG PRO A 164 120.063 0.778 7.347 1.00 0.34 C ATOM 1394 CD PRO A 164 118.884 -0.035 7.810 1.00 0.34 C ATOM 0 HA PRO A 164 118.861 2.421 9.941 1.00 0.31 H new ATOM 0 HB2 PRO A 164 120.752 2.717 7.944 1.00 0.32 H new ATOM 0 HB3 PRO A 164 120.913 1.486 9.182 1.00 0.32 H new ATOM 0 HG2 PRO A 164 119.872 1.218 6.368 1.00 0.34 H new ATOM 0 HG3 PRO A 164 120.951 0.153 7.248 1.00 0.34 H new ATOM 0 HD2 PRO A 164 118.322 -0.444 6.970 1.00 0.34 H new ATOM 0 HD3 PRO A 164 119.194 -0.878 8.427 1.00 0.34 H new ATOM 1402 N GLY A 165 118.405 4.557 8.774 1.00 0.36 N ATOM 1403 CA GLY A 165 117.827 5.801 8.170 1.00 0.41 C ATOM 1404 C GLY A 165 118.477 6.109 6.817 1.00 0.40 C ATOM 1405 O GLY A 165 117.949 5.768 5.774 1.00 0.47 O ATOM 0 H GLY A 165 118.891 4.697 9.660 1.00 0.36 H new ATOM 0 HA2 GLY A 165 116.751 5.681 8.042 1.00 0.41 H new ATOM 0 HA3 GLY A 165 117.975 6.641 8.848 1.00 0.41 H new ATOM 1409 N GLY A 166 119.614 6.764 6.822 1.00 0.48 N ATOM 1410 CA GLY A 166 120.296 7.108 5.531 1.00 0.57 C ATOM 1411 C GLY A 166 120.911 5.851 4.916 1.00 0.56 C ATOM 1412 O GLY A 166 122.113 5.726 4.819 1.00 0.68 O ATOM 0 H GLY A 166 120.100 7.075 7.663 1.00 0.48 H new ATOM 0 HA2 GLY A 166 119.580 7.549 4.838 1.00 0.57 H new ATOM 0 HA3 GLY A 166 121.071 7.854 5.707 1.00 0.57 H new ATOM 1416 N ALA A 167 120.088 4.924 4.498 1.00 0.53 N ATOM 1417 CA ALA A 167 120.606 3.668 3.887 1.00 0.56 C ATOM 1418 C ALA A 167 120.460 3.716 2.366 1.00 0.54 C ATOM 1419 O ALA A 167 119.406 3.463 1.815 1.00 0.61 O ATOM 1420 CB ALA A 167 119.741 2.560 4.470 1.00 0.65 C ATOM 0 H ALA A 167 119.072 4.986 4.555 1.00 0.53 H new ATOM 0 HA ALA A 167 121.664 3.515 4.098 1.00 0.56 H new ATOM 0 HB1 ALA A 167 120.061 1.599 4.067 1.00 0.65 H new ATOM 0 HB2 ALA A 167 119.844 2.551 5.555 1.00 0.65 H new ATOM 0 HB3 ALA A 167 118.698 2.735 4.206 1.00 0.65 H new ATOM 1426 N GLY A 168 121.519 4.042 1.695 1.00 0.51 N ATOM 1427 CA GLY A 168 121.484 4.122 0.207 1.00 0.53 C ATOM 1428 C GLY A 168 122.552 3.214 -0.412 1.00 0.51 C ATOM 1429 O GLY A 168 122.804 2.114 0.048 1.00 0.58 O ATOM 0 H GLY A 168 122.423 4.261 2.115 1.00 0.51 H new ATOM 0 HA2 GLY A 168 120.498 3.830 -0.154 1.00 0.53 H new ATOM 0 HA3 GLY A 168 121.647 5.152 -0.110 1.00 0.53 H new ATOM 1433 N ALA A 169 123.173 3.676 -1.464 1.00 0.48 N ATOM 1434 CA ALA A 169 124.221 2.871 -2.145 1.00 0.46 C ATOM 1435 C ALA A 169 125.602 3.539 -1.997 1.00 0.41 C ATOM 1436 O ALA A 169 126.353 3.637 -2.947 1.00 0.45 O ATOM 1437 CB ALA A 169 123.777 2.820 -3.613 1.00 0.54 C ATOM 0 H ALA A 169 122.995 4.588 -1.883 1.00 0.48 H new ATOM 0 HA ALA A 169 124.325 1.873 -1.719 1.00 0.46 H new ATOM 0 HB1 ALA A 169 124.498 2.242 -4.191 1.00 0.54 H new ATOM 0 HB2 ALA A 169 122.796 2.349 -3.680 1.00 0.54 H new ATOM 0 HB3 ALA A 169 123.721 3.833 -4.012 1.00 0.54 H new ATOM 1443 N ASN A 170 125.930 3.986 -0.801 1.00 0.37 N ATOM 1444 CA ASN A 170 127.260 4.646 -0.537 1.00 0.33 C ATOM 1445 C ASN A 170 127.349 6.047 -1.178 1.00 0.34 C ATOM 1446 O ASN A 170 127.575 6.177 -2.367 1.00 0.37 O ATOM 1447 CB ASN A 170 128.314 3.714 -1.139 1.00 0.33 C ATOM 1448 CG ASN A 170 129.673 4.020 -0.517 1.00 0.32 C ATOM 1449 OD1 ASN A 170 130.173 5.119 -0.625 1.00 0.38 O ATOM 1450 ND2 ASN A 170 130.295 3.091 0.137 1.00 0.36 N ATOM 0 H ASN A 170 125.323 3.921 0.016 1.00 0.37 H new ATOM 0 HA ASN A 170 127.407 4.797 0.532 1.00 0.33 H new ATOM 0 HB2 ASN A 170 128.043 2.674 -0.956 1.00 0.33 H new ATOM 0 HB3 ASN A 170 128.358 3.846 -2.220 1.00 0.33 H new ATOM 0 HD21 ASN A 170 131.203 3.285 0.559 1.00 0.36 H new ATOM 0 HD22 ASN A 170 129.877 2.165 0.230 1.00 0.36 H new ATOM 1457 N PRO A 171 127.194 7.059 -0.353 1.00 0.33 N ATOM 1458 CA PRO A 171 127.276 8.469 -0.841 1.00 0.37 C ATOM 1459 C PRO A 171 128.691 8.817 -1.331 1.00 0.36 C ATOM 1460 O PRO A 171 128.873 9.715 -2.131 1.00 0.42 O ATOM 1461 CB PRO A 171 126.883 9.293 0.381 1.00 0.38 C ATOM 1462 CG PRO A 171 127.190 8.408 1.545 1.00 0.33 C ATOM 1463 CD PRO A 171 126.935 6.999 1.091 1.00 0.32 C ATOM 0 HA PRO A 171 126.631 8.657 -1.699 1.00 0.37 H new ATOM 0 HB2 PRO A 171 127.448 10.224 0.430 1.00 0.38 H new ATOM 0 HB3 PRO A 171 125.827 9.562 0.355 1.00 0.38 H new ATOM 0 HG2 PRO A 171 128.225 8.531 1.863 1.00 0.33 H new ATOM 0 HG3 PRO A 171 126.562 8.660 2.399 1.00 0.33 H new ATOM 0 HD2 PRO A 171 127.596 6.290 1.589 1.00 0.32 H new ATOM 0 HD3 PRO A 171 125.913 6.686 1.304 1.00 0.32 H new ATOM 1471 N PHE A 172 129.683 8.095 -0.888 1.00 0.33 N ATOM 1472 CA PHE A 172 131.078 8.358 -1.361 1.00 0.34 C ATOM 1473 C PHE A 172 131.254 7.705 -2.733 1.00 0.34 C ATOM 1474 O PHE A 172 131.749 8.301 -3.670 1.00 0.42 O ATOM 1475 CB PHE A 172 132.008 7.665 -0.355 1.00 0.36 C ATOM 1476 CG PHE A 172 131.975 8.345 0.994 1.00 0.35 C ATOM 1477 CD1 PHE A 172 132.156 9.727 1.100 1.00 0.37 C ATOM 1478 CD2 PHE A 172 131.795 7.575 2.147 1.00 0.39 C ATOM 1479 CE1 PHE A 172 132.160 10.338 2.359 1.00 0.40 C ATOM 1480 CE2 PHE A 172 131.792 8.185 3.405 1.00 0.42 C ATOM 1481 CZ PHE A 172 131.977 9.566 3.513 1.00 0.42 C ATOM 0 H PHE A 172 129.591 7.332 -0.217 1.00 0.33 H new ATOM 0 HA PHE A 172 131.292 9.424 -1.436 1.00 0.34 H new ATOM 0 HB2 PHE A 172 131.712 6.622 -0.244 1.00 0.36 H new ATOM 0 HB3 PHE A 172 133.028 7.668 -0.740 1.00 0.36 H new ATOM 0 HD1 PHE A 172 132.293 10.323 0.210 1.00 0.37 H new ATOM 0 HD2 PHE A 172 131.658 6.507 2.066 1.00 0.39 H new ATOM 0 HE1 PHE A 172 132.304 11.405 2.441 1.00 0.40 H new ATOM 0 HE2 PHE A 172 131.647 7.589 4.294 1.00 0.42 H new ATOM 0 HZ PHE A 172 131.979 10.037 4.485 1.00 0.42 H new ATOM 1491 N VAL A 173 130.848 6.465 -2.834 1.00 0.32 N ATOM 1492 CA VAL A 173 130.977 5.709 -4.113 1.00 0.33 C ATOM 1493 C VAL A 173 130.001 6.230 -5.175 1.00 0.34 C ATOM 1494 O VAL A 173 130.325 6.249 -6.342 1.00 0.36 O ATOM 1495 CB VAL A 173 130.653 4.258 -3.739 1.00 0.40 C ATOM 1496 CG1 VAL A 173 130.399 3.438 -4.999 1.00 0.47 C ATOM 1497 CG2 VAL A 173 131.831 3.647 -2.980 1.00 0.45 C ATOM 0 H VAL A 173 130.426 5.937 -2.070 1.00 0.32 H new ATOM 0 HA VAL A 173 131.971 5.815 -4.548 1.00 0.33 H new ATOM 0 HB VAL A 173 129.762 4.248 -3.112 1.00 0.40 H new ATOM 0 HG11 VAL A 173 130.170 2.409 -4.723 1.00 0.47 H new ATOM 0 HG12 VAL A 173 129.558 3.863 -5.546 1.00 0.47 H new ATOM 0 HG13 VAL A 173 131.288 3.455 -5.630 1.00 0.47 H new ATOM 0 HG21 VAL A 173 131.598 2.616 -2.715 1.00 0.45 H new ATOM 0 HG22 VAL A 173 132.720 3.668 -3.610 1.00 0.45 H new ATOM 0 HG23 VAL A 173 132.016 4.221 -2.072 1.00 0.45 H new ATOM 1507 N VAL A 174 128.814 6.638 -4.797 1.00 0.36 N ATOM 1508 CA VAL A 174 127.834 7.137 -5.819 1.00 0.40 C ATOM 1509 C VAL A 174 128.510 8.090 -6.835 1.00 0.38 C ATOM 1510 O VAL A 174 128.542 7.784 -8.008 1.00 0.43 O ATOM 1511 CB VAL A 174 126.722 7.844 -5.022 1.00 0.43 C ATOM 1512 CG1 VAL A 174 126.027 8.894 -5.895 1.00 0.46 C ATOM 1513 CG2 VAL A 174 125.683 6.811 -4.581 1.00 0.46 C ATOM 0 H VAL A 174 128.481 6.648 -3.833 1.00 0.36 H new ATOM 0 HA VAL A 174 127.430 6.320 -6.416 1.00 0.40 H new ATOM 0 HB VAL A 174 127.168 8.331 -4.155 1.00 0.43 H new ATOM 0 HG11 VAL A 174 125.243 9.386 -5.318 1.00 0.46 H new ATOM 0 HG12 VAL A 174 126.756 9.635 -6.222 1.00 0.46 H new ATOM 0 HG13 VAL A 174 125.587 8.409 -6.766 1.00 0.46 H new ATOM 0 HG21 VAL A 174 124.894 7.307 -4.016 1.00 0.46 H new ATOM 0 HG22 VAL A 174 125.253 6.330 -5.459 1.00 0.46 H new ATOM 0 HG23 VAL A 174 126.161 6.059 -3.953 1.00 0.46 H new ATOM 1523 N PRO A 175 129.037 9.205 -6.368 1.00 0.34 N ATOM 1524 CA PRO A 175 129.686 10.178 -7.287 1.00 0.34 C ATOM 1525 C PRO A 175 131.049 9.683 -7.714 1.00 0.31 C ATOM 1526 O PRO A 175 131.534 9.984 -8.792 1.00 0.35 O ATOM 1527 CB PRO A 175 129.809 11.435 -6.460 1.00 0.34 C ATOM 1528 CG PRO A 175 129.800 10.987 -5.030 1.00 0.31 C ATOM 1529 CD PRO A 175 129.115 9.643 -4.971 1.00 0.31 C ATOM 0 HA PRO A 175 129.118 10.333 -8.204 1.00 0.34 H new ATOM 0 HB2 PRO A 175 130.729 11.970 -6.696 1.00 0.34 H new ATOM 0 HB3 PRO A 175 128.983 12.117 -6.661 1.00 0.34 H new ATOM 0 HG2 PRO A 175 130.818 10.914 -4.646 1.00 0.31 H new ATOM 0 HG3 PRO A 175 129.275 11.711 -4.406 1.00 0.31 H new ATOM 0 HD2 PRO A 175 129.681 8.936 -4.365 1.00 0.31 H new ATOM 0 HD3 PRO A 175 128.124 9.723 -4.525 1.00 0.31 H new ATOM 1537 N LEU A 176 131.638 8.886 -6.892 1.00 0.27 N ATOM 1538 CA LEU A 176 132.950 8.298 -7.233 1.00 0.26 C ATOM 1539 C LEU A 176 132.707 7.424 -8.451 1.00 0.31 C ATOM 1540 O LEU A 176 133.329 7.564 -9.488 1.00 0.34 O ATOM 1541 CB LEU A 176 133.331 7.496 -5.989 1.00 0.27 C ATOM 1542 CG LEU A 176 134.351 6.418 -6.328 1.00 0.29 C ATOM 1543 CD1 LEU A 176 135.347 6.292 -5.174 1.00 0.27 C ATOM 1544 CD2 LEU A 176 133.643 5.083 -6.514 1.00 0.43 C ATOM 0 H LEU A 176 131.264 8.610 -5.984 1.00 0.27 H new ATOM 0 HA LEU A 176 133.748 9.000 -7.476 1.00 0.26 H new ATOM 0 HB2 LEU A 176 133.741 8.165 -5.232 1.00 0.27 H new ATOM 0 HB3 LEU A 176 132.440 7.037 -5.560 1.00 0.27 H new ATOM 0 HG LEU A 176 134.871 6.688 -7.247 1.00 0.29 H new ATOM 0 HD11 LEU A 176 136.081 5.521 -5.409 1.00 0.27 H new ATOM 0 HD12 LEU A 176 135.856 7.245 -5.027 1.00 0.27 H new ATOM 0 HD13 LEU A 176 134.815 6.020 -4.262 1.00 0.27 H new ATOM 0 HD21 LEU A 176 134.376 4.313 -6.757 1.00 0.43 H new ATOM 0 HD22 LEU A 176 133.126 4.814 -5.593 1.00 0.43 H new ATOM 0 HD23 LEU A 176 132.920 5.165 -7.326 1.00 0.43 H new ATOM 1556 N ILE A 177 131.737 6.574 -8.329 1.00 0.35 N ATOM 1557 CA ILE A 177 131.337 5.695 -9.460 1.00 0.42 C ATOM 1558 C ILE A 177 130.627 6.526 -10.534 1.00 0.46 C ATOM 1559 O ILE A 177 130.710 6.223 -11.712 1.00 0.52 O ATOM 1560 CB ILE A 177 130.359 4.671 -8.861 1.00 0.47 C ATOM 1561 CG1 ILE A 177 131.135 3.536 -8.189 1.00 0.47 C ATOM 1562 CG2 ILE A 177 129.468 4.082 -9.962 1.00 0.57 C ATOM 1563 CD1 ILE A 177 131.838 2.691 -9.248 1.00 0.53 C ATOM 0 H ILE A 177 131.191 6.446 -7.477 1.00 0.35 H new ATOM 0 HA ILE A 177 132.196 5.211 -9.925 1.00 0.42 H new ATOM 0 HB ILE A 177 129.738 5.179 -8.123 1.00 0.47 H new ATOM 0 HG12 ILE A 177 131.867 3.946 -7.493 1.00 0.47 H new ATOM 0 HG13 ILE A 177 130.455 2.914 -7.607 1.00 0.47 H new ATOM 0 HG21 ILE A 177 128.780 3.358 -9.525 1.00 0.57 H new ATOM 0 HG22 ILE A 177 128.900 4.882 -10.437 1.00 0.57 H new ATOM 0 HG23 ILE A 177 130.090 3.587 -10.707 1.00 0.57 H new ATOM 0 HD11 ILE A 177 132.389 1.885 -8.763 1.00 0.53 H new ATOM 0 HD12 ILE A 177 131.097 2.268 -9.927 1.00 0.53 H new ATOM 0 HD13 ILE A 177 132.531 3.316 -9.811 1.00 0.53 H new ATOM 1575 N ALA A 178 129.932 7.575 -10.147 1.00 0.44 N ATOM 1576 CA ALA A 178 129.235 8.407 -11.166 1.00 0.50 C ATOM 1577 C ALA A 178 130.283 9.036 -12.057 1.00 0.50 C ATOM 1578 O ALA A 178 130.162 9.058 -13.267 1.00 0.57 O ATOM 1579 CB ALA A 178 128.463 9.476 -10.390 1.00 0.50 C ATOM 0 H ALA A 178 129.822 7.882 -9.180 1.00 0.44 H new ATOM 0 HA ALA A 178 128.554 7.830 -11.791 1.00 0.50 H new ATOM 0 HB1 ALA A 178 127.929 10.119 -11.090 1.00 0.50 H new ATOM 0 HB2 ALA A 178 127.749 8.996 -9.722 1.00 0.50 H new ATOM 0 HB3 ALA A 178 129.160 10.076 -9.805 1.00 0.50 H new ATOM 1585 N SER A 179 131.334 9.513 -11.457 1.00 0.44 N ATOM 1586 CA SER A 179 132.423 10.113 -12.258 1.00 0.44 C ATOM 1587 C SER A 179 133.027 9.037 -13.152 1.00 0.44 C ATOM 1588 O SER A 179 133.112 9.191 -14.345 1.00 0.50 O ATOM 1589 CB SER A 179 133.433 10.683 -11.248 1.00 0.42 C ATOM 1590 OG SER A 179 134.241 9.638 -10.712 1.00 0.46 O ATOM 0 H SER A 179 131.483 9.512 -10.448 1.00 0.44 H new ATOM 0 HA SER A 179 132.082 10.911 -12.917 1.00 0.44 H new ATOM 0 HB2 SER A 179 134.064 11.426 -11.735 1.00 0.42 H new ATOM 0 HB3 SER A 179 132.904 11.192 -10.442 1.00 0.42 H new ATOM 0 HG SER A 179 133.736 9.153 -10.026 1.00 0.46 H new ATOM 1596 N ALA A 180 133.399 7.938 -12.580 1.00 0.42 N ATOM 1597 CA ALA A 180 133.960 6.805 -13.374 1.00 0.43 C ATOM 1598 C ALA A 180 132.941 6.270 -14.388 1.00 0.50 C ATOM 1599 O ALA A 180 133.319 5.738 -15.408 1.00 0.55 O ATOM 1600 CB ALA A 180 134.285 5.752 -12.334 1.00 0.41 C ATOM 0 H ALA A 180 133.340 7.766 -11.576 1.00 0.42 H new ATOM 0 HA ALA A 180 134.829 7.105 -13.960 1.00 0.43 H new ATOM 0 HB1 ALA A 180 134.706 4.874 -12.824 1.00 0.41 H new ATOM 0 HB2 ALA A 180 135.008 6.153 -11.624 1.00 0.41 H new ATOM 0 HB3 ALA A 180 133.375 5.470 -11.805 1.00 0.41 H new ATOM 1606 N SER A 181 131.664 6.442 -14.153 1.00 0.53 N ATOM 1607 CA SER A 181 130.662 5.965 -15.158 1.00 0.61 C ATOM 1608 C SER A 181 130.649 6.979 -16.294 1.00 0.65 C ATOM 1609 O SER A 181 130.468 6.664 -17.453 1.00 0.74 O ATOM 1610 CB SER A 181 129.310 5.927 -14.436 1.00 0.63 C ATOM 1611 OG SER A 181 129.375 5.008 -13.349 1.00 0.60 O ATOM 0 H SER A 181 131.275 6.886 -13.321 1.00 0.53 H new ATOM 0 HA SER A 181 130.889 4.980 -15.565 1.00 0.61 H new ATOM 0 HB2 SER A 181 129.054 6.921 -14.070 1.00 0.63 H new ATOM 0 HB3 SER A 181 128.524 5.630 -15.130 1.00 0.63 H new ATOM 0 HG SER A 181 130.213 4.502 -13.398 1.00 0.60 H new ATOM 1617 N ILE A 182 130.890 8.198 -15.926 1.00 0.62 N ATOM 1618 CA ILE A 182 130.965 9.325 -16.881 1.00 0.66 C ATOM 1619 C ILE A 182 132.350 9.341 -17.532 1.00 0.64 C ATOM 1620 O ILE A 182 132.523 9.681 -18.686 1.00 0.68 O ATOM 1621 CB ILE A 182 130.776 10.522 -15.943 1.00 0.65 C ATOM 1622 CG1 ILE A 182 129.389 11.131 -16.152 1.00 0.74 C ATOM 1623 CG2 ILE A 182 131.852 11.590 -16.180 1.00 0.66 C ATOM 1624 CD1 ILE A 182 128.873 11.677 -14.821 1.00 0.72 C ATOM 0 H ILE A 182 131.045 8.470 -14.955 1.00 0.62 H new ATOM 0 HA ILE A 182 130.246 9.296 -17.700 1.00 0.66 H new ATOM 0 HB ILE A 182 130.870 10.166 -14.917 1.00 0.65 H new ATOM 0 HG12 ILE A 182 129.437 11.930 -16.892 1.00 0.74 H new ATOM 0 HG13 ILE A 182 128.703 10.378 -16.540 1.00 0.74 H new ATOM 0 HG21 ILE A 182 131.691 12.426 -15.500 1.00 0.66 H new ATOM 0 HG22 ILE A 182 132.837 11.160 -16.000 1.00 0.66 H new ATOM 0 HG23 ILE A 182 131.793 11.943 -17.209 1.00 0.66 H new ATOM 0 HD11 ILE A 182 127.884 12.112 -14.965 1.00 0.72 H new ATOM 0 HD12 ILE A 182 128.810 10.866 -14.095 1.00 0.72 H new ATOM 0 HD13 ILE A 182 129.556 12.442 -14.452 1.00 0.72 H new ATOM 1636 N LYS A 183 133.327 8.985 -16.755 1.00 0.59 N ATOM 1637 CA LYS A 183 134.731 8.965 -17.202 1.00 0.58 C ATOM 1638 C LYS A 183 135.032 7.686 -17.967 1.00 0.59 C ATOM 1639 O LYS A 183 135.539 7.704 -19.070 1.00 0.63 O ATOM 1640 CB LYS A 183 135.486 8.987 -15.876 1.00 0.51 C ATOM 1641 CG LYS A 183 136.837 8.325 -16.034 1.00 0.49 C ATOM 1642 CD LYS A 183 137.840 8.942 -15.089 1.00 0.45 C ATOM 1643 CE LYS A 183 138.767 9.823 -15.900 1.00 0.50 C ATOM 1644 NZ LYS A 183 139.380 10.763 -14.916 1.00 0.49 N ATOM 0 H LYS A 183 133.197 8.695 -15.786 1.00 0.59 H new ATOM 0 HA LYS A 183 134.992 9.782 -17.874 1.00 0.58 H new ATOM 0 HB2 LYS A 183 135.614 10.016 -15.539 1.00 0.51 H new ATOM 0 HB3 LYS A 183 134.907 8.470 -15.111 1.00 0.51 H new ATOM 0 HG2 LYS A 183 136.751 7.257 -15.836 1.00 0.49 H new ATOM 0 HG3 LYS A 183 137.183 8.432 -17.062 1.00 0.49 H new ATOM 0 HD2 LYS A 183 137.332 9.527 -14.323 1.00 0.45 H new ATOM 0 HD3 LYS A 183 138.406 8.166 -14.574 1.00 0.45 H new ATOM 0 HE2 LYS A 183 139.530 9.231 -16.406 1.00 0.50 H new ATOM 0 HE3 LYS A 183 138.220 10.364 -16.672 1.00 0.50 H new ATOM 0 HZ1 LYS A 183 140.414 10.755 -15.026 1.00 0.49 H new ATOM 0 HZ2 LYS A 183 139.022 11.725 -15.085 1.00 0.49 H new ATOM 0 HZ3 LYS A 183 139.132 10.466 -13.951 1.00 0.49 H new ATOM 1658 N TYR A 184 134.754 6.588 -17.346 1.00 0.57 N ATOM 1659 CA TYR A 184 135.037 5.259 -17.972 1.00 0.59 C ATOM 1660 C TYR A 184 133.792 4.604 -18.572 1.00 0.65 C ATOM 1661 O TYR A 184 133.203 3.735 -17.971 1.00 0.67 O ATOM 1662 CB TYR A 184 135.579 4.379 -16.845 1.00 0.55 C ATOM 1663 CG TYR A 184 137.004 4.743 -16.614 1.00 0.52 C ATOM 1664 CD1 TYR A 184 137.970 4.393 -17.554 1.00 0.59 C ATOM 1665 CD2 TYR A 184 137.349 5.473 -15.488 1.00 0.45 C ATOM 1666 CE1 TYR A 184 139.293 4.774 -17.358 1.00 0.58 C ATOM 1667 CE2 TYR A 184 138.665 5.866 -15.292 1.00 0.44 C ATOM 1668 CZ TYR A 184 139.645 5.515 -16.225 1.00 0.50 C ATOM 1669 OH TYR A 184 140.951 5.904 -16.032 1.00 0.51 O ATOM 0 H TYR A 184 134.336 6.542 -16.417 1.00 0.57 H new ATOM 0 HA TYR A 184 135.738 5.384 -18.797 1.00 0.59 H new ATOM 0 HB2 TYR A 184 134.997 4.526 -15.935 1.00 0.55 H new ATOM 0 HB3 TYR A 184 135.494 3.325 -17.111 1.00 0.55 H new ATOM 0 HD1 TYR A 184 137.693 3.828 -18.432 1.00 0.59 H new ATOM 0 HD2 TYR A 184 136.593 5.736 -14.763 1.00 0.45 H new ATOM 0 HE1 TYR A 184 140.048 4.498 -18.080 1.00 0.58 H new ATOM 0 HE2 TYR A 184 138.932 6.443 -14.419 1.00 0.44 H new ATOM 0 HH TYR A 184 141.021 6.412 -15.197 1.00 0.51 H new ATOM 1679 N PRO A 185 133.462 4.984 -19.769 1.00 0.71 N ATOM 1680 CA PRO A 185 132.310 4.349 -20.455 1.00 0.78 C ATOM 1681 C PRO A 185 132.696 2.898 -20.762 1.00 0.80 C ATOM 1682 O PRO A 185 131.918 1.978 -20.630 1.00 0.84 O ATOM 1683 CB PRO A 185 132.183 5.168 -21.738 1.00 0.86 C ATOM 1684 CG PRO A 185 133.555 5.709 -21.965 1.00 0.83 C ATOM 1685 CD PRO A 185 134.101 6.007 -20.602 1.00 0.74 C ATOM 0 HA PRO A 185 131.380 4.332 -19.887 1.00 0.78 H new ATOM 0 HB2 PRO A 185 131.855 4.550 -22.574 1.00 0.86 H new ATOM 0 HB3 PRO A 185 131.452 5.969 -21.628 1.00 0.86 H new ATOM 0 HG2 PRO A 185 134.180 4.985 -22.488 1.00 0.83 H new ATOM 0 HG3 PRO A 185 133.525 6.608 -22.580 1.00 0.83 H new ATOM 0 HD2 PRO A 185 135.188 5.930 -20.575 1.00 0.74 H new ATOM 0 HD3 PRO A 185 133.845 7.014 -20.274 1.00 0.74 H new ATOM 1693 N HIS A 186 133.925 2.724 -21.172 1.00 0.80 N ATOM 1694 CA HIS A 186 134.468 1.373 -21.520 1.00 0.82 C ATOM 1695 C HIS A 186 134.354 0.358 -20.383 1.00 0.80 C ATOM 1696 O HIS A 186 133.920 -0.764 -20.567 1.00 0.85 O ATOM 1697 CB HIS A 186 135.938 1.653 -21.779 1.00 0.83 C ATOM 1698 CG HIS A 186 136.486 0.605 -22.694 1.00 0.89 C ATOM 1699 ND1 HIS A 186 136.023 0.433 -23.988 1.00 1.02 N ATOM 1700 CD2 HIS A 186 137.437 -0.358 -22.497 1.00 0.88 C ATOM 1701 CE1 HIS A 186 136.688 -0.609 -24.518 1.00 1.07 C ATOM 1702 NE2 HIS A 186 137.566 -1.129 -23.652 1.00 0.99 N ATOM 0 H HIS A 186 134.596 3.484 -21.284 1.00 0.80 H new ATOM 0 HA HIS A 186 133.919 0.936 -22.354 1.00 0.82 H new ATOM 0 HB2 HIS A 186 136.059 2.641 -22.224 1.00 0.83 H new ATOM 0 HB3 HIS A 186 136.491 1.657 -20.839 1.00 0.83 H new ATOM 0 HD2 HIS A 186 138.001 -0.500 -21.587 1.00 0.88 H new ATOM 0 HE1 HIS A 186 136.532 -0.981 -25.520 1.00 1.07 H new ATOM 0 HE2 HIS A 186 138.194 -1.918 -23.804 1.00 0.99 H new ATOM 1710 N MET A 187 134.773 0.748 -19.225 1.00 0.74 N ATOM 1711 CA MET A 187 134.753 -0.167 -18.047 1.00 0.72 C ATOM 1712 C MET A 187 133.340 -0.242 -17.458 1.00 0.73 C ATOM 1713 O MET A 187 132.967 -1.206 -16.826 1.00 0.77 O ATOM 1714 CB MET A 187 135.745 0.482 -17.070 1.00 0.65 C ATOM 1715 CG MET A 187 137.107 -0.219 -17.142 1.00 0.63 C ATOM 1716 SD MET A 187 136.905 -2.003 -16.931 1.00 0.77 S ATOM 1717 CE MET A 187 138.352 -2.513 -17.890 1.00 1.12 C ATOM 0 H MET A 187 135.138 1.681 -19.032 1.00 0.74 H new ATOM 0 HA MET A 187 135.027 -1.194 -18.287 1.00 0.72 H new ATOM 0 HB2 MET A 187 135.861 1.539 -17.309 1.00 0.65 H new ATOM 0 HB3 MET A 187 135.354 0.426 -16.054 1.00 0.65 H new ATOM 0 HG2 MET A 187 137.581 -0.011 -18.101 1.00 0.63 H new ATOM 0 HG3 MET A 187 137.767 0.173 -16.368 1.00 0.63 H new ATOM 0 HE1 MET A 187 138.422 -3.601 -17.892 1.00 1.12 H new ATOM 0 HE2 MET A 187 138.255 -2.154 -18.914 1.00 1.12 H new ATOM 0 HE3 MET A 187 139.252 -2.092 -17.442 1.00 1.12 H new ATOM 1727 N PHE A 188 132.560 0.776 -17.662 1.00 0.72 N ATOM 1728 CA PHE A 188 131.164 0.795 -17.119 1.00 0.73 C ATOM 1729 C PHE A 188 130.142 0.310 -18.170 1.00 0.79 C ATOM 1730 O PHE A 188 128.965 0.202 -17.885 1.00 0.82 O ATOM 1731 CB PHE A 188 130.969 2.264 -16.772 1.00 0.70 C ATOM 1732 CG PHE A 188 131.740 2.573 -15.506 1.00 0.62 C ATOM 1733 CD1 PHE A 188 133.139 2.595 -15.530 1.00 0.60 C ATOM 1734 CD2 PHE A 188 131.065 2.809 -14.306 1.00 0.61 C ATOM 1735 CE1 PHE A 188 133.857 2.845 -14.368 1.00 0.54 C ATOM 1736 CE2 PHE A 188 131.791 3.067 -13.139 1.00 0.56 C ATOM 1737 CZ PHE A 188 133.189 3.080 -13.176 1.00 0.51 C ATOM 0 H PHE A 188 132.826 1.609 -18.187 1.00 0.72 H new ATOM 0 HA PHE A 188 131.016 0.129 -16.269 1.00 0.73 H new ATOM 0 HB2 PHE A 188 131.318 2.894 -17.590 1.00 0.70 H new ATOM 0 HB3 PHE A 188 129.910 2.481 -16.632 1.00 0.70 H new ATOM 0 HD1 PHE A 188 133.663 2.417 -16.457 1.00 0.60 H new ATOM 0 HD2 PHE A 188 129.985 2.792 -14.280 1.00 0.61 H new ATOM 0 HE1 PHE A 188 134.937 2.856 -14.393 1.00 0.54 H new ATOM 0 HE2 PHE A 188 131.273 3.256 -12.210 1.00 0.56 H new ATOM 0 HZ PHE A 188 133.750 3.274 -12.274 1.00 0.51 H new ATOM 1747 N ILE A 189 130.589 0.008 -19.370 1.00 0.84 N ATOM 1748 CA ILE A 189 129.657 -0.484 -20.445 1.00 0.90 C ATOM 1749 C ILE A 189 128.837 -1.694 -19.960 1.00 0.94 C ATOM 1750 O ILE A 189 127.636 -1.749 -20.147 1.00 0.98 O ATOM 1751 CB ILE A 189 130.578 -0.878 -21.613 1.00 1.00 C ATOM 1752 CG1 ILE A 189 130.631 0.256 -22.635 1.00 1.01 C ATOM 1753 CG2 ILE A 189 130.065 -2.141 -22.315 1.00 1.10 C ATOM 1754 CD1 ILE A 189 132.037 0.333 -23.230 1.00 1.09 C ATOM 0 H ILE A 189 131.566 0.081 -19.654 1.00 0.84 H new ATOM 0 HA ILE A 189 128.929 0.275 -20.732 1.00 0.90 H new ATOM 0 HB ILE A 189 131.571 -1.071 -21.207 1.00 1.00 H new ATOM 0 HG12 ILE A 189 129.899 0.085 -23.424 1.00 1.01 H new ATOM 0 HG13 ILE A 189 130.372 1.202 -22.160 1.00 1.01 H new ATOM 0 HG21 ILE A 189 130.734 -2.398 -23.136 1.00 1.10 H new ATOM 0 HG22 ILE A 189 130.032 -2.965 -21.603 1.00 1.10 H new ATOM 0 HG23 ILE A 189 129.064 -1.959 -22.706 1.00 1.10 H new ATOM 0 HD11 ILE A 189 132.079 1.141 -23.960 1.00 1.09 H new ATOM 0 HD12 ILE A 189 132.758 0.524 -22.435 1.00 1.09 H new ATOM 0 HD13 ILE A 189 132.277 -0.611 -23.719 1.00 1.09 H new ATOM 1766 N ASN A 190 129.477 -2.668 -19.354 1.00 0.96 N ATOM 1767 CA ASN A 190 128.725 -3.873 -18.876 1.00 1.03 C ATOM 1768 C ASN A 190 127.805 -3.517 -17.730 1.00 0.99 C ATOM 1769 O ASN A 190 128.181 -2.853 -16.782 1.00 0.91 O ATOM 1770 CB ASN A 190 129.782 -4.888 -18.434 1.00 1.06 C ATOM 1771 CG ASN A 190 130.070 -5.864 -19.578 1.00 1.12 C ATOM 1772 OD1 ASN A 190 129.163 -6.378 -20.196 1.00 1.68 O ATOM 1773 ND2 ASN A 190 131.301 -6.139 -19.886 1.00 0.92 N ATOM 0 H ASN A 190 130.480 -2.681 -19.171 1.00 0.96 H new ATOM 0 HA ASN A 190 128.092 -4.281 -19.664 1.00 1.03 H new ATOM 0 HB2 ASN A 190 130.697 -4.372 -18.144 1.00 1.06 H new ATOM 0 HB3 ASN A 190 129.432 -5.433 -17.557 1.00 1.06 H new ATOM 0 HD21 ASN A 190 131.504 -6.787 -20.647 1.00 0.92 H new ATOM 0 HD22 ASN A 190 132.065 -5.707 -19.367 1.00 0.92 H new ATOM 1780 N HIS A 191 126.585 -3.957 -17.833 1.00 1.08 N ATOM 1781 CA HIS A 191 125.586 -3.652 -16.784 1.00 1.08 C ATOM 1782 C HIS A 191 126.081 -4.075 -15.379 1.00 1.03 C ATOM 1783 O HIS A 191 125.697 -3.491 -14.389 1.00 1.04 O ATOM 1784 CB HIS A 191 124.316 -4.417 -17.207 1.00 1.21 C ATOM 1785 CG HIS A 191 124.154 -5.660 -16.378 1.00 1.24 C ATOM 1786 ND1 HIS A 191 124.209 -6.928 -16.925 1.00 1.32 N ATOM 1787 CD2 HIS A 191 123.950 -5.834 -15.036 1.00 1.25 C ATOM 1788 CE1 HIS A 191 124.037 -7.809 -15.920 1.00 1.36 C ATOM 1789 NE2 HIS A 191 123.874 -7.192 -14.745 1.00 1.32 N ATOM 0 H HIS A 191 126.237 -4.521 -18.609 1.00 1.08 H new ATOM 0 HA HIS A 191 125.399 -2.581 -16.701 1.00 1.08 H new ATOM 0 HB2 HIS A 191 123.442 -3.777 -17.089 1.00 1.21 H new ATOM 0 HB3 HIS A 191 124.377 -4.681 -18.263 1.00 1.21 H new ATOM 0 HD1 HIS A 191 124.353 -7.155 -17.909 1.00 1.32 H new ATOM 0 HD2 HIS A 191 123.861 -5.037 -14.312 1.00 1.25 H new ATOM 0 HE1 HIS A 191 124.031 -8.881 -16.048 1.00 1.36 H new ATOM 1797 N ASN A 192 126.909 -5.085 -15.280 1.00 1.03 N ATOM 1798 CA ASN A 192 127.393 -5.528 -13.930 1.00 1.01 C ATOM 1799 C ASN A 192 128.749 -4.889 -13.570 1.00 0.93 C ATOM 1800 O ASN A 192 129.152 -4.893 -12.421 1.00 1.05 O ATOM 1801 CB ASN A 192 127.533 -7.050 -14.050 1.00 1.08 C ATOM 1802 CG ASN A 192 127.206 -7.707 -12.709 1.00 1.19 C ATOM 1803 OD1 ASN A 192 128.035 -7.760 -11.826 1.00 1.37 O ATOM 1804 ND2 ASN A 192 126.024 -8.214 -12.518 1.00 1.38 N ATOM 0 H ASN A 192 127.271 -5.621 -16.069 1.00 1.03 H new ATOM 0 HA ASN A 192 126.705 -5.227 -13.140 1.00 1.01 H new ATOM 0 HB2 ASN A 192 126.863 -7.426 -14.823 1.00 1.08 H new ATOM 0 HB3 ASN A 192 128.547 -7.308 -14.354 1.00 1.08 H new ATOM 0 HD21 ASN A 192 125.796 -8.655 -11.627 1.00 1.38 H new ATOM 0 HD22 ASN A 192 125.325 -8.171 -13.259 1.00 1.38 H new ATOM 1811 N GLN A 193 129.462 -4.352 -14.532 1.00 0.85 N ATOM 1812 CA GLN A 193 130.795 -3.743 -14.226 1.00 0.77 C ATOM 1813 C GLN A 193 130.657 -2.467 -13.380 1.00 0.74 C ATOM 1814 O GLN A 193 131.347 -2.312 -12.391 1.00 0.70 O ATOM 1815 CB GLN A 193 131.434 -3.452 -15.586 1.00 0.79 C ATOM 1816 CG GLN A 193 132.260 -4.673 -16.015 1.00 0.91 C ATOM 1817 CD GLN A 193 133.073 -4.353 -17.271 1.00 0.69 C ATOM 1818 OE1 GLN A 193 132.774 -4.839 -18.338 1.00 0.89 O ATOM 1819 NE2 GLN A 193 134.098 -3.564 -17.194 1.00 1.00 N ATOM 0 H GLN A 193 129.180 -4.309 -15.511 1.00 0.85 H new ATOM 0 HA GLN A 193 131.412 -4.416 -13.631 1.00 0.77 H new ATOM 0 HB2 GLN A 193 130.664 -3.238 -16.327 1.00 0.79 H new ATOM 0 HB3 GLN A 193 132.070 -2.569 -15.523 1.00 0.79 H new ATOM 0 HG2 GLN A 193 132.929 -4.970 -15.207 1.00 0.91 H new ATOM 0 HG3 GLN A 193 131.599 -5.518 -16.208 1.00 0.91 H new ATOM 0 HE21 GLN A 193 134.357 -3.150 -16.298 1.00 1.00 H new ATOM 0 HE22 GLN A 193 134.646 -3.357 -18.029 1.00 1.00 H new ATOM 1828 N GLN A 194 129.768 -1.561 -13.722 1.00 0.77 N ATOM 1829 CA GLN A 194 129.623 -0.334 -12.884 1.00 0.76 C ATOM 1830 C GLN A 194 129.027 -0.717 -11.526 1.00 0.77 C ATOM 1831 O GLN A 194 129.303 -0.094 -10.518 1.00 0.77 O ATOM 1832 CB GLN A 194 128.744 0.641 -13.690 1.00 0.81 C ATOM 1833 CG GLN A 194 127.284 0.597 -13.228 1.00 0.87 C ATOM 1834 CD GLN A 194 126.572 -0.624 -13.801 1.00 0.90 C ATOM 1835 OE1 GLN A 194 125.752 -1.213 -13.135 1.00 0.95 O ATOM 1836 NE2 GLN A 194 126.833 -1.028 -15.011 1.00 0.93 N ATOM 0 H GLN A 194 129.149 -1.619 -14.531 1.00 0.77 H new ATOM 0 HA GLN A 194 130.575 0.150 -12.666 1.00 0.76 H new ATOM 0 HB2 GLN A 194 129.130 1.655 -13.582 1.00 0.81 H new ATOM 0 HB3 GLN A 194 128.799 0.391 -14.749 1.00 0.81 H new ATOM 0 HG2 GLN A 194 127.243 0.570 -12.139 1.00 0.87 H new ATOM 0 HG3 GLN A 194 126.770 1.505 -13.544 1.00 0.87 H new ATOM 0 HE21 GLN A 194 127.524 -0.534 -15.576 1.00 0.93 H new ATOM 0 HE22 GLN A 194 126.347 -1.839 -15.394 1.00 0.93 H new ATOM 1845 N VAL A 195 128.260 -1.776 -11.488 1.00 0.81 N ATOM 1846 CA VAL A 195 127.698 -2.246 -10.194 1.00 0.83 C ATOM 1847 C VAL A 195 128.847 -2.861 -9.382 1.00 0.78 C ATOM 1848 O VAL A 195 128.995 -2.625 -8.188 1.00 0.77 O ATOM 1849 CB VAL A 195 126.633 -3.296 -10.565 1.00 0.90 C ATOM 1850 CG1 VAL A 195 126.768 -4.538 -9.681 1.00 0.93 C ATOM 1851 CG2 VAL A 195 125.241 -2.695 -10.370 1.00 0.97 C ATOM 0 H VAL A 195 128.000 -2.334 -12.301 1.00 0.81 H new ATOM 0 HA VAL A 195 127.249 -1.455 -9.593 1.00 0.83 H new ATOM 0 HB VAL A 195 126.777 -3.585 -11.606 1.00 0.90 H new ATOM 0 HG11 VAL A 195 126.007 -5.267 -9.959 1.00 0.93 H new ATOM 0 HG12 VAL A 195 127.757 -4.976 -9.817 1.00 0.93 H new ATOM 0 HG13 VAL A 195 126.637 -4.257 -8.636 1.00 0.93 H new ATOM 0 HG21 VAL A 195 124.485 -3.435 -10.632 1.00 0.97 H new ATOM 0 HG22 VAL A 195 125.115 -2.400 -9.328 1.00 0.97 H new ATOM 0 HG23 VAL A 195 125.129 -1.820 -11.011 1.00 0.97 H new ATOM 1861 N SER A 196 129.685 -3.630 -10.029 1.00 0.76 N ATOM 1862 CA SER A 196 130.837 -4.230 -9.306 1.00 0.72 C ATOM 1863 C SER A 196 131.859 -3.143 -8.994 1.00 0.65 C ATOM 1864 O SER A 196 132.516 -3.171 -7.972 1.00 0.65 O ATOM 1865 CB SER A 196 131.427 -5.280 -10.251 1.00 0.73 C ATOM 1866 OG SER A 196 131.229 -6.575 -9.697 1.00 0.92 O ATOM 0 H SER A 196 129.619 -3.865 -11.019 1.00 0.76 H new ATOM 0 HA SER A 196 130.541 -4.683 -8.360 1.00 0.72 H new ATOM 0 HB2 SER A 196 130.951 -5.214 -11.229 1.00 0.73 H new ATOM 0 HB3 SER A 196 132.491 -5.095 -10.401 1.00 0.73 H new ATOM 0 HG SER A 196 131.604 -7.250 -10.301 1.00 0.92 H new ATOM 1872 N PHE A 197 131.982 -2.181 -9.864 1.00 0.63 N ATOM 1873 CA PHE A 197 132.946 -1.070 -9.635 1.00 0.56 C ATOM 1874 C PHE A 197 132.715 -0.416 -8.277 1.00 0.55 C ATOM 1875 O PHE A 197 133.641 -0.149 -7.534 1.00 0.51 O ATOM 1876 CB PHE A 197 132.643 -0.063 -10.750 1.00 0.56 C ATOM 1877 CG PHE A 197 133.656 -0.194 -11.844 1.00 0.54 C ATOM 1878 CD1 PHE A 197 134.995 -0.333 -11.513 1.00 0.52 C ATOM 1879 CD2 PHE A 197 133.255 -0.167 -13.178 1.00 0.59 C ATOM 1880 CE1 PHE A 197 135.958 -0.449 -12.523 1.00 0.54 C ATOM 1881 CE2 PHE A 197 134.207 -0.280 -14.190 1.00 0.60 C ATOM 1882 CZ PHE A 197 135.561 -0.421 -13.867 1.00 0.57 C ATOM 0 H PHE A 197 131.451 -2.116 -10.732 1.00 0.63 H new ATOM 0 HA PHE A 197 133.978 -1.422 -9.645 1.00 0.56 H new ATOM 0 HB2 PHE A 197 131.642 -0.236 -11.146 1.00 0.56 H new ATOM 0 HB3 PHE A 197 132.656 0.951 -10.350 1.00 0.56 H new ATOM 0 HD1 PHE A 197 135.296 -0.352 -10.476 1.00 0.52 H new ATOM 0 HD2 PHE A 197 132.210 -0.059 -13.427 1.00 0.59 H new ATOM 0 HE1 PHE A 197 137.002 -0.560 -12.268 1.00 0.54 H new ATOM 0 HE2 PHE A 197 133.899 -0.259 -15.225 1.00 0.60 H new ATOM 0 HZ PHE A 197 136.298 -0.508 -14.651 1.00 0.57 H new ATOM 1892 N LYS A 198 131.479 -0.172 -7.955 1.00 0.60 N ATOM 1893 CA LYS A 198 131.151 0.476 -6.652 1.00 0.61 C ATOM 1894 C LYS A 198 131.406 -0.486 -5.497 1.00 0.65 C ATOM 1895 O LYS A 198 131.489 -0.086 -4.348 1.00 0.68 O ATOM 1896 CB LYS A 198 129.664 0.830 -6.740 1.00 0.69 C ATOM 1897 CG LYS A 198 128.839 -0.394 -6.352 1.00 0.80 C ATOM 1898 CD LYS A 198 127.562 -0.442 -7.183 1.00 0.92 C ATOM 1899 CE LYS A 198 126.568 -1.435 -6.563 1.00 1.09 C ATOM 1900 NZ LYS A 198 127.340 -2.704 -6.377 1.00 1.04 N ATOM 0 H LYS A 198 130.674 -0.394 -8.540 1.00 0.60 H new ATOM 0 HA LYS A 198 131.767 1.356 -6.469 1.00 0.61 H new ATOM 0 HB2 LYS A 198 129.435 1.664 -6.076 1.00 0.69 H new ATOM 0 HB3 LYS A 198 129.412 1.149 -7.751 1.00 0.69 H new ATOM 0 HG2 LYS A 198 129.421 -1.302 -6.511 1.00 0.80 H new ATOM 0 HG3 LYS A 198 128.592 -0.356 -5.291 1.00 0.80 H new ATOM 0 HD2 LYS A 198 127.114 0.550 -7.233 1.00 0.92 H new ATOM 0 HD3 LYS A 198 127.795 -0.739 -8.206 1.00 0.92 H new ATOM 0 HE2 LYS A 198 126.184 -1.065 -5.612 1.00 1.09 H new ATOM 0 HE3 LYS A 198 125.708 -1.590 -7.215 1.00 1.09 H new ATOM 0 HZ1 LYS A 198 126.693 -3.516 -6.439 1.00 1.04 H new ATOM 0 HZ2 LYS A 198 128.065 -2.781 -7.119 1.00 1.04 H new ATOM 0 HZ3 LYS A 198 127.799 -2.697 -5.444 1.00 1.04 H new ATOM 1914 N ALA A 199 131.534 -1.748 -5.795 1.00 0.66 N ATOM 1915 CA ALA A 199 131.782 -2.733 -4.704 1.00 0.70 C ATOM 1916 C ALA A 199 133.199 -2.567 -4.167 1.00 0.64 C ATOM 1917 O ALA A 199 133.396 -2.397 -2.978 1.00 0.67 O ATOM 1918 CB ALA A 199 131.571 -4.116 -5.328 1.00 0.75 C ATOM 0 H ALA A 199 131.479 -2.138 -6.736 1.00 0.66 H new ATOM 0 HA ALA A 199 131.110 -2.590 -3.858 1.00 0.70 H new ATOM 0 HB1 ALA A 199 131.739 -4.885 -4.574 1.00 0.75 H new ATOM 0 HB2 ALA A 199 130.551 -4.194 -5.704 1.00 0.75 H new ATOM 0 HB3 ALA A 199 132.273 -4.255 -6.151 1.00 0.75 H new ATOM 1924 N TYR A 200 134.192 -2.547 -5.016 1.00 0.58 N ATOM 1925 CA TYR A 200 135.556 -2.314 -4.477 1.00 0.54 C ATOM 1926 C TYR A 200 135.720 -0.805 -4.238 1.00 0.48 C ATOM 1927 O TYR A 200 136.630 -0.369 -3.554 1.00 0.48 O ATOM 1928 CB TYR A 200 136.553 -2.906 -5.489 1.00 0.53 C ATOM 1929 CG TYR A 200 136.768 -2.010 -6.682 1.00 0.45 C ATOM 1930 CD1 TYR A 200 137.547 -0.853 -6.568 1.00 0.41 C ATOM 1931 CD2 TYR A 200 136.225 -2.370 -7.916 1.00 0.48 C ATOM 1932 CE1 TYR A 200 137.777 -0.055 -7.693 1.00 0.36 C ATOM 1933 CE2 TYR A 200 136.451 -1.571 -9.036 1.00 0.44 C ATOM 1934 CZ TYR A 200 137.228 -0.415 -8.927 1.00 0.38 C ATOM 1935 OH TYR A 200 137.459 0.363 -10.041 1.00 0.37 O ATOM 0 H TYR A 200 134.121 -2.677 -6.025 1.00 0.58 H new ATOM 0 HA TYR A 200 135.738 -2.802 -3.519 1.00 0.54 H new ATOM 0 HB2 TYR A 200 137.508 -3.080 -4.993 1.00 0.53 H new ATOM 0 HB3 TYR A 200 136.188 -3.876 -5.828 1.00 0.53 H new ATOM 0 HD1 TYR A 200 137.970 -0.577 -5.613 1.00 0.41 H new ATOM 0 HD2 TYR A 200 135.630 -3.267 -8.003 1.00 0.48 H new ATOM 0 HE1 TYR A 200 138.378 0.838 -7.609 1.00 0.36 H new ATOM 0 HE2 TYR A 200 136.025 -1.846 -9.989 1.00 0.44 H new ATOM 0 HH TYR A 200 136.796 0.151 -10.731 1.00 0.37 H new ATOM 1945 N ALA A 201 134.794 -0.007 -4.748 1.00 0.49 N ATOM 1946 CA ALA A 201 134.852 1.458 -4.494 1.00 0.45 C ATOM 1947 C ALA A 201 134.444 1.721 -3.040 1.00 0.48 C ATOM 1948 O ALA A 201 135.060 2.513 -2.353 1.00 0.50 O ATOM 1949 CB ALA A 201 133.839 2.081 -5.451 1.00 0.49 C ATOM 0 H ALA A 201 134.011 -0.317 -5.324 1.00 0.49 H new ATOM 0 HA ALA A 201 135.847 1.874 -4.649 1.00 0.45 H new ATOM 0 HB1 ALA A 201 133.830 3.163 -5.317 1.00 0.49 H new ATOM 0 HB2 ALA A 201 134.116 1.845 -6.478 1.00 0.49 H new ATOM 0 HB3 ALA A 201 132.847 1.681 -5.242 1.00 0.49 H new ATOM 1955 N GLU A 202 133.425 1.046 -2.538 1.00 0.51 N ATOM 1956 CA GLU A 202 133.058 1.281 -1.109 1.00 0.53 C ATOM 1957 C GLU A 202 134.169 0.704 -0.203 1.00 0.52 C ATOM 1958 O GLU A 202 134.298 1.049 0.965 1.00 0.56 O ATOM 1959 CB GLU A 202 131.688 0.605 -0.893 1.00 0.59 C ATOM 1960 CG GLU A 202 131.798 -0.924 -0.910 1.00 0.40 C ATOM 1961 CD GLU A 202 131.864 -1.463 0.520 1.00 0.71 C ATOM 1962 OE1 GLU A 202 130.814 -1.737 1.079 1.00 1.14 O ATOM 1963 OE2 GLU A 202 132.965 -1.602 1.029 1.00 0.74 O ATOM 0 H GLU A 202 132.854 0.367 -3.042 1.00 0.51 H new ATOM 0 HA GLU A 202 132.974 2.338 -0.858 1.00 0.53 H new ATOM 0 HB2 GLU A 202 131.269 0.929 0.060 1.00 0.59 H new ATOM 0 HB3 GLU A 202 130.997 0.928 -1.671 1.00 0.59 H new ATOM 0 HG2 GLU A 202 130.940 -1.352 -1.429 1.00 0.40 H new ATOM 0 HG3 GLU A 202 132.688 -1.226 -1.462 1.00 0.40 H new ATOM 1970 N LYS A 203 135.002 -0.148 -0.751 1.00 0.51 N ATOM 1971 CA LYS A 203 136.118 -0.726 0.044 1.00 0.52 C ATOM 1972 C LYS A 203 137.291 0.268 0.172 1.00 0.48 C ATOM 1973 O LYS A 203 137.979 0.281 1.177 1.00 0.52 O ATOM 1974 CB LYS A 203 136.539 -1.969 -0.737 1.00 0.52 C ATOM 1975 CG LYS A 203 137.528 -2.789 0.094 1.00 0.57 C ATOM 1976 CD LYS A 203 136.980 -3.009 1.515 1.00 0.61 C ATOM 1977 CE LYS A 203 135.622 -3.728 1.457 1.00 0.70 C ATOM 1978 NZ LYS A 203 134.682 -2.880 2.258 1.00 0.58 N ATOM 0 H LYS A 203 134.952 -0.466 -1.719 1.00 0.51 H new ATOM 0 HA LYS A 203 135.815 -0.958 1.065 1.00 0.52 H new ATOM 0 HB2 LYS A 203 135.664 -2.572 -0.978 1.00 0.52 H new ATOM 0 HB3 LYS A 203 136.997 -1.679 -1.683 1.00 0.52 H new ATOM 0 HG2 LYS A 203 137.707 -3.751 -0.387 1.00 0.57 H new ATOM 0 HG3 LYS A 203 138.487 -2.273 0.143 1.00 0.57 H new ATOM 0 HD2 LYS A 203 137.687 -3.599 2.098 1.00 0.61 H new ATOM 0 HD3 LYS A 203 136.871 -2.051 2.022 1.00 0.61 H new ATOM 0 HE2 LYS A 203 135.277 -3.831 0.428 1.00 0.70 H new ATOM 0 HE3 LYS A 203 135.693 -4.734 1.872 1.00 0.70 H new ATOM 0 HZ1 LYS A 203 133.981 -3.488 2.728 1.00 0.58 H new ATOM 0 HZ2 LYS A 203 135.218 -2.350 2.975 1.00 0.58 H new ATOM 0 HZ3 LYS A 203 134.194 -2.213 1.627 1.00 0.58 H new ATOM 1992 N ILE A 204 137.526 1.108 -0.819 1.00 0.42 N ATOM 1993 CA ILE A 204 138.644 2.082 -0.711 1.00 0.39 C ATOM 1994 C ILE A 204 138.248 3.233 0.193 1.00 0.37 C ATOM 1995 O ILE A 204 139.014 3.666 1.040 1.00 0.39 O ATOM 1996 CB ILE A 204 138.951 2.588 -2.125 1.00 0.36 C ATOM 1997 CG1 ILE A 204 137.675 2.835 -2.939 1.00 0.34 C ATOM 1998 CG2 ILE A 204 139.805 1.556 -2.849 1.00 0.42 C ATOM 1999 CD1 ILE A 204 138.024 3.570 -4.229 1.00 0.41 C ATOM 0 H ILE A 204 136.991 1.153 -1.686 1.00 0.42 H new ATOM 0 HA ILE A 204 139.526 1.611 -0.278 1.00 0.39 H new ATOM 0 HB ILE A 204 139.479 3.537 -2.031 1.00 0.36 H new ATOM 0 HG12 ILE A 204 137.189 1.887 -3.169 1.00 0.34 H new ATOM 0 HG13 ILE A 204 136.967 3.422 -2.354 1.00 0.34 H new ATOM 0 HG21 ILE A 204 140.027 1.909 -3.856 1.00 0.42 H new ATOM 0 HG22 ILE A 204 140.736 1.407 -2.303 1.00 0.42 H new ATOM 0 HG23 ILE A 204 139.263 0.612 -2.907 1.00 0.42 H new ATOM 0 HD11 ILE A 204 137.116 3.744 -4.806 1.00 0.41 H new ATOM 0 HD12 ILE A 204 138.490 4.526 -3.989 1.00 0.41 H new ATOM 0 HD13 ILE A 204 138.716 2.966 -4.816 1.00 0.41 H new ATOM 2011 N VAL A 205 137.054 3.728 0.038 1.00 0.33 N ATOM 2012 CA VAL A 205 136.616 4.837 0.912 1.00 0.32 C ATOM 2013 C VAL A 205 136.888 4.455 2.360 1.00 0.36 C ATOM 2014 O VAL A 205 137.220 5.296 3.154 1.00 0.38 O ATOM 2015 CB VAL A 205 135.114 5.035 0.687 1.00 0.31 C ATOM 2016 CG1 VAL A 205 134.826 5.330 -0.783 1.00 0.35 C ATOM 2017 CG2 VAL A 205 134.347 3.783 1.097 1.00 0.38 C ATOM 0 H VAL A 205 136.371 3.413 -0.651 1.00 0.33 H new ATOM 0 HA VAL A 205 137.151 5.759 0.686 1.00 0.32 H new ATOM 0 HB VAL A 205 134.792 5.879 1.297 1.00 0.31 H new ATOM 0 HG11 VAL A 205 133.754 5.468 -0.923 1.00 0.35 H new ATOM 0 HG12 VAL A 205 135.350 6.238 -1.081 1.00 0.35 H new ATOM 0 HG13 VAL A 205 135.168 4.496 -1.395 1.00 0.35 H new ATOM 0 HG21 VAL A 205 133.281 3.939 0.931 1.00 0.38 H new ATOM 0 HG22 VAL A 205 134.687 2.936 0.501 1.00 0.38 H new ATOM 0 HG23 VAL A 205 134.524 3.577 2.153 1.00 0.38 H new ATOM 2027 N MET A 206 136.780 3.186 2.703 1.00 0.38 N ATOM 2028 CA MET A 206 137.058 2.768 4.116 1.00 0.42 C ATOM 2029 C MET A 206 138.457 3.250 4.576 1.00 0.43 C ATOM 2030 O MET A 206 138.722 3.344 5.760 1.00 0.46 O ATOM 2031 CB MET A 206 136.940 1.233 4.100 1.00 0.45 C ATOM 2032 CG MET A 206 138.044 0.585 4.944 1.00 0.56 C ATOM 2033 SD MET A 206 137.661 -1.167 5.192 1.00 0.72 S ATOM 2034 CE MET A 206 139.212 -1.836 4.550 1.00 1.42 C ATOM 0 H MET A 206 136.514 2.432 2.070 1.00 0.38 H new ATOM 0 HA MET A 206 136.362 3.210 4.829 1.00 0.42 H new ATOM 0 HB2 MET A 206 135.964 0.936 4.483 1.00 0.45 H new ATOM 0 HB3 MET A 206 137.003 0.871 3.074 1.00 0.45 H new ATOM 0 HG2 MET A 206 139.008 0.691 4.446 1.00 0.56 H new ATOM 0 HG3 MET A 206 138.126 1.091 5.906 1.00 0.56 H new ATOM 0 HE1 MET A 206 139.191 -2.924 4.610 1.00 1.42 H new ATOM 0 HE2 MET A 206 139.337 -1.532 3.511 1.00 1.42 H new ATOM 0 HE3 MET A 206 140.045 -1.456 5.142 1.00 1.42 H new ATOM 2044 N LYS A 207 139.320 3.622 3.662 1.00 0.41 N ATOM 2045 CA LYS A 207 140.653 4.166 4.056 1.00 0.43 C ATOM 2046 C LYS A 207 140.500 5.676 4.230 1.00 0.41 C ATOM 2047 O LYS A 207 141.234 6.315 4.959 1.00 0.45 O ATOM 2048 CB LYS A 207 141.620 3.810 2.907 1.00 0.45 C ATOM 2049 CG LYS A 207 141.475 4.798 1.734 1.00 0.43 C ATOM 2050 CD LYS A 207 142.849 5.372 1.358 1.00 0.48 C ATOM 2051 CE LYS A 207 142.908 6.867 1.703 1.00 0.54 C ATOM 2052 NZ LYS A 207 142.166 7.560 0.602 1.00 0.49 N ATOM 0 H LYS A 207 139.156 3.571 2.657 1.00 0.41 H new ATOM 0 HA LYS A 207 141.036 3.755 4.990 1.00 0.43 H new ATOM 0 HB2 LYS A 207 142.646 3.824 3.274 1.00 0.45 H new ATOM 0 HB3 LYS A 207 141.420 2.796 2.560 1.00 0.45 H new ATOM 0 HG2 LYS A 207 141.035 4.293 0.874 1.00 0.43 H new ATOM 0 HG3 LYS A 207 140.797 5.606 2.010 1.00 0.43 H new ATOM 0 HD2 LYS A 207 143.634 4.836 1.892 1.00 0.48 H new ATOM 0 HD3 LYS A 207 143.033 5.229 0.293 1.00 0.48 H new ATOM 0 HE2 LYS A 207 142.448 7.065 2.671 1.00 0.54 H new ATOM 0 HE3 LYS A 207 143.939 7.216 1.762 1.00 0.54 H new ATOM 0 HZ1 LYS A 207 141.872 8.505 0.923 1.00 0.49 H new ATOM 0 HZ2 LYS A 207 142.785 7.654 -0.228 1.00 0.49 H new ATOM 0 HZ3 LYS A 207 141.325 7.004 0.346 1.00 0.49 H new ATOM 2066 N GLU A 208 139.518 6.235 3.569 1.00 0.38 N ATOM 2067 CA GLU A 208 139.261 7.693 3.687 1.00 0.39 C ATOM 2068 C GLU A 208 138.093 7.962 4.649 1.00 0.35 C ATOM 2069 O GLU A 208 138.111 8.908 5.407 1.00 0.36 O ATOM 2070 CB GLU A 208 138.940 8.158 2.264 1.00 0.43 C ATOM 2071 CG GLU A 208 138.869 9.691 2.219 1.00 0.48 C ATOM 2072 CD GLU A 208 140.264 10.294 2.014 1.00 0.49 C ATOM 2073 OE1 GLU A 208 141.094 9.651 1.384 1.00 0.50 O ATOM 2074 OE2 GLU A 208 140.476 11.400 2.486 1.00 0.63 O ATOM 0 H GLU A 208 138.881 5.735 2.949 1.00 0.38 H new ATOM 0 HA GLU A 208 140.115 8.232 4.097 1.00 0.39 H new ATOM 0 HB2 GLU A 208 139.704 7.800 1.574 1.00 0.43 H new ATOM 0 HB3 GLU A 208 137.991 7.732 1.938 1.00 0.43 H new ATOM 0 HG2 GLU A 208 138.209 10.006 1.410 1.00 0.48 H new ATOM 0 HG3 GLU A 208 138.438 10.067 3.147 1.00 0.48 H new ATOM 2081 N VAL A 209 137.080 7.142 4.616 1.00 0.35 N ATOM 2082 CA VAL A 209 135.902 7.325 5.520 1.00 0.32 C ATOM 2083 C VAL A 209 136.206 6.906 6.977 1.00 0.30 C ATOM 2084 O VAL A 209 135.637 7.441 7.908 1.00 0.32 O ATOM 2085 CB VAL A 209 134.817 6.419 4.944 1.00 0.34 C ATOM 2086 CG1 VAL A 209 134.472 6.850 3.521 1.00 0.39 C ATOM 2087 CG2 VAL A 209 135.283 4.969 4.929 1.00 0.36 C ATOM 0 H VAL A 209 137.015 6.338 3.991 1.00 0.35 H new ATOM 0 HA VAL A 209 135.611 8.375 5.562 1.00 0.32 H new ATOM 0 HB VAL A 209 133.933 6.504 5.576 1.00 0.34 H new ATOM 0 HG11 VAL A 209 133.697 6.196 3.121 1.00 0.39 H new ATOM 0 HG12 VAL A 209 134.111 7.878 3.530 1.00 0.39 H new ATOM 0 HG13 VAL A 209 135.362 6.784 2.895 1.00 0.39 H new ATOM 0 HG21 VAL A 209 134.496 4.338 4.515 1.00 0.36 H new ATOM 0 HG22 VAL A 209 136.179 4.881 4.315 1.00 0.36 H new ATOM 0 HG23 VAL A 209 135.507 4.648 5.946 1.00 0.36 H new ATOM 2097 N THR A 210 137.077 5.938 7.181 1.00 0.31 N ATOM 2098 CA THR A 210 137.398 5.472 8.581 1.00 0.32 C ATOM 2099 C THR A 210 137.579 6.651 9.559 1.00 0.31 C ATOM 2100 O THR A 210 137.048 6.613 10.652 1.00 0.33 O ATOM 2101 CB THR A 210 138.695 4.654 8.458 1.00 0.35 C ATOM 2102 OG1 THR A 210 138.367 3.324 8.089 1.00 0.36 O ATOM 2103 CG2 THR A 210 139.446 4.618 9.794 1.00 0.43 C ATOM 0 H THR A 210 137.580 5.449 6.440 1.00 0.31 H new ATOM 0 HA THR A 210 136.579 4.880 8.989 1.00 0.32 H new ATOM 0 HB THR A 210 139.331 5.121 7.706 1.00 0.35 H new ATOM 0 HG1 THR A 210 138.183 3.287 7.127 1.00 0.36 H new ATOM 0 HG21 THR A 210 140.360 4.034 9.682 1.00 0.43 H new ATOM 0 HG22 THR A 210 139.700 5.634 10.096 1.00 0.43 H new ATOM 0 HG23 THR A 210 138.814 4.160 10.555 1.00 0.43 H new ATOM 2111 N PRO A 211 138.323 7.662 9.160 1.00 0.31 N ATOM 2112 CA PRO A 211 138.550 8.827 10.059 1.00 0.32 C ATOM 2113 C PRO A 211 137.249 9.547 10.435 1.00 0.30 C ATOM 2114 O PRO A 211 137.164 10.141 11.495 1.00 0.34 O ATOM 2115 CB PRO A 211 139.515 9.712 9.262 1.00 0.35 C ATOM 2116 CG PRO A 211 139.295 9.314 7.846 1.00 0.35 C ATOM 2117 CD PRO A 211 139.017 7.837 7.876 1.00 0.32 C ATOM 0 HA PRO A 211 138.959 8.536 11.027 1.00 0.32 H new ATOM 0 HB2 PRO A 211 139.303 10.770 9.415 1.00 0.35 H new ATOM 0 HB3 PRO A 211 140.549 9.547 9.566 1.00 0.35 H new ATOM 0 HG2 PRO A 211 138.458 9.861 7.411 1.00 0.35 H new ATOM 0 HG3 PRO A 211 140.171 9.535 7.237 1.00 0.35 H new ATOM 0 HD2 PRO A 211 138.397 7.525 7.035 1.00 0.32 H new ATOM 0 HD3 PRO A 211 139.935 7.252 7.829 1.00 0.32 H new ATOM 2125 N LEU A 212 136.213 9.454 9.644 1.00 0.28 N ATOM 2126 CA LEU A 212 134.931 10.095 10.056 1.00 0.27 C ATOM 2127 C LEU A 212 134.315 9.227 11.139 1.00 0.24 C ATOM 2128 O LEU A 212 133.469 9.650 11.911 1.00 0.25 O ATOM 2129 CB LEU A 212 134.029 10.122 8.815 1.00 0.30 C ATOM 2130 CG LEU A 212 134.859 10.237 7.541 1.00 0.35 C ATOM 2131 CD1 LEU A 212 133.940 10.516 6.361 1.00 0.41 C ATOM 2132 CD2 LEU A 212 135.872 11.370 7.682 1.00 0.40 C ATOM 0 H LEU A 212 136.198 8.971 8.746 1.00 0.28 H new ATOM 0 HA LEU A 212 135.069 11.106 10.438 1.00 0.27 H new ATOM 0 HB2 LEU A 212 133.425 9.215 8.780 1.00 0.30 H new ATOM 0 HB3 LEU A 212 133.338 10.963 8.881 1.00 0.30 H new ATOM 0 HG LEU A 212 135.392 9.301 7.373 1.00 0.35 H new ATOM 0 HD11 LEU A 212 134.533 10.598 5.450 1.00 0.41 H new ATOM 0 HD12 LEU A 212 133.225 9.700 6.256 1.00 0.41 H new ATOM 0 HD13 LEU A 212 133.403 11.450 6.530 1.00 0.41 H new ATOM 0 HD21 LEU A 212 136.462 11.447 6.768 1.00 0.40 H new ATOM 0 HD22 LEU A 212 135.346 12.309 7.854 1.00 0.40 H new ATOM 0 HD23 LEU A 212 136.533 11.165 8.524 1.00 0.40 H new ATOM 2144 N PHE A 213 134.772 8.012 11.208 1.00 0.25 N ATOM 2145 CA PHE A 213 134.263 7.074 12.249 1.00 0.26 C ATOM 2146 C PHE A 213 135.118 7.198 13.520 1.00 0.30 C ATOM 2147 O PHE A 213 134.908 6.501 14.494 1.00 0.38 O ATOM 2148 CB PHE A 213 134.369 5.668 11.629 1.00 0.29 C ATOM 2149 CG PHE A 213 133.780 5.671 10.229 1.00 0.26 C ATOM 2150 CD1 PHE A 213 132.824 6.628 9.868 1.00 0.32 C ATOM 2151 CD2 PHE A 213 134.208 4.728 9.289 1.00 0.28 C ATOM 2152 CE1 PHE A 213 132.308 6.646 8.576 1.00 0.32 C ATOM 2153 CE2 PHE A 213 133.679 4.743 7.988 1.00 0.28 C ATOM 2154 CZ PHE A 213 132.733 5.705 7.638 1.00 0.26 C ATOM 0 H PHE A 213 135.480 7.623 10.586 1.00 0.25 H new ATOM 0 HA PHE A 213 133.235 7.290 12.540 1.00 0.26 H new ATOM 0 HB2 PHE A 213 135.413 5.356 11.593 1.00 0.29 H new ATOM 0 HB3 PHE A 213 133.842 4.946 12.253 1.00 0.29 H new ATOM 0 HD1 PHE A 213 132.487 7.353 10.594 1.00 0.32 H new ATOM 0 HD2 PHE A 213 134.945 3.988 9.564 1.00 0.28 H new ATOM 0 HE1 PHE A 213 131.576 7.391 8.299 1.00 0.32 H new ATOM 0 HE2 PHE A 213 134.004 4.012 7.262 1.00 0.28 H new ATOM 0 HZ PHE A 213 132.328 5.722 6.637 1.00 0.26 H new ATOM 2164 N ASN A 214 136.068 8.106 13.519 1.00 0.29 N ATOM 2165 CA ASN A 214 136.924 8.304 14.721 1.00 0.35 C ATOM 2166 C ASN A 214 136.200 9.219 15.716 1.00 0.35 C ATOM 2167 O ASN A 214 136.182 8.973 16.905 1.00 0.50 O ATOM 2168 CB ASN A 214 138.202 8.963 14.189 1.00 0.41 C ATOM 2169 CG ASN A 214 139.281 8.954 15.272 1.00 0.82 C ATOM 2170 OD1 ASN A 214 140.042 8.019 15.373 1.00 1.22 O ATOM 2171 ND2 ASN A 214 139.385 9.960 16.090 1.00 1.21 N ATOM 0 H ASN A 214 136.283 8.718 12.732 1.00 0.29 H new ATOM 0 HA ASN A 214 137.146 7.375 15.246 1.00 0.35 H new ATOM 0 HB2 ASN A 214 138.556 8.430 13.306 1.00 0.41 H new ATOM 0 HB3 ASN A 214 137.992 9.987 13.881 1.00 0.41 H new ATOM 0 HD21 ASN A 214 140.106 9.958 16.812 1.00 1.21 H new ATOM 0 HD22 ASN A 214 138.746 10.751 16.009 1.00 1.21 H new ATOM 2178 N LYS A 215 135.591 10.272 15.227 1.00 0.34 N ATOM 2179 CA LYS A 215 134.852 11.203 16.127 1.00 0.35 C ATOM 2180 C LYS A 215 133.490 10.601 16.512 1.00 0.33 C ATOM 2181 O LYS A 215 132.775 10.060 15.676 1.00 0.33 O ATOM 2182 CB LYS A 215 134.674 12.507 15.328 1.00 0.39 C ATOM 2183 CG LYS A 215 133.859 12.251 14.051 1.00 0.36 C ATOM 2184 CD LYS A 215 132.375 12.526 14.320 1.00 0.35 C ATOM 2185 CE LYS A 215 131.518 11.827 13.258 1.00 0.35 C ATOM 2186 NZ LYS A 215 131.762 10.362 13.448 1.00 0.31 N ATOM 0 H LYS A 215 135.576 10.525 14.239 1.00 0.34 H new ATOM 0 HA LYS A 215 135.391 11.383 17.057 1.00 0.35 H new ATOM 0 HB2 LYS A 215 134.170 13.252 15.944 1.00 0.39 H new ATOM 0 HB3 LYS A 215 135.650 12.916 15.067 1.00 0.39 H new ATOM 0 HG2 LYS A 215 134.217 12.892 13.245 1.00 0.36 H new ATOM 0 HG3 LYS A 215 133.994 11.220 13.723 1.00 0.36 H new ATOM 0 HD2 LYS A 215 132.103 12.168 15.313 1.00 0.35 H new ATOM 0 HD3 LYS A 215 132.186 13.599 14.305 1.00 0.35 H new ATOM 0 HE2 LYS A 215 130.463 12.069 13.384 1.00 0.35 H new ATOM 0 HE3 LYS A 215 131.800 12.145 12.254 1.00 0.35 H new ATOM 0 HZ1 LYS A 215 130.902 9.832 13.200 1.00 0.31 H new ATOM 0 HZ2 LYS A 215 132.545 10.058 12.835 1.00 0.31 H new ATOM 0 HZ3 LYS A 215 132.008 10.177 14.441 1.00 0.31 H new ATOM 2200 N GLY A 216 133.127 10.694 17.766 1.00 0.37 N ATOM 2201 CA GLY A 216 131.821 10.139 18.224 1.00 0.39 C ATOM 2202 C GLY A 216 132.001 8.693 18.702 1.00 0.38 C ATOM 2203 O GLY A 216 132.817 8.412 19.556 1.00 0.46 O ATOM 0 H GLY A 216 133.686 11.135 18.497 1.00 0.37 H new ATOM 0 HA2 GLY A 216 131.421 10.750 19.033 1.00 0.39 H new ATOM 0 HA3 GLY A 216 131.097 10.174 17.410 1.00 0.39 H new ATOM 2207 N THR A 217 131.235 7.780 18.157 1.00 0.36 N ATOM 2208 CA THR A 217 131.339 6.334 18.574 1.00 0.38 C ATOM 2209 C THR A 217 131.001 5.420 17.396 1.00 0.32 C ATOM 2210 O THR A 217 130.393 4.378 17.548 1.00 0.36 O ATOM 2211 CB THR A 217 130.293 6.155 19.680 1.00 0.46 C ATOM 2212 OG1 THR A 217 129.055 6.701 19.243 1.00 0.47 O ATOM 2213 CG2 THR A 217 130.743 6.870 20.952 1.00 0.55 C ATOM 0 H THR A 217 130.537 7.969 17.437 1.00 0.36 H new ATOM 0 HA THR A 217 132.345 6.082 18.910 1.00 0.38 H new ATOM 0 HB THR A 217 130.176 5.093 19.895 1.00 0.46 H new ATOM 0 HG1 THR A 217 128.381 6.588 19.946 1.00 0.47 H new ATOM 0 HG21 THR A 217 129.992 6.736 21.730 1.00 0.55 H new ATOM 0 HG22 THR A 217 131.692 6.452 21.288 1.00 0.55 H new ATOM 0 HG23 THR A 217 130.867 7.933 20.747 1.00 0.55 H new ATOM 2221 N MET A 218 131.369 5.829 16.228 1.00 0.28 N ATOM 2222 CA MET A 218 131.064 5.034 15.001 1.00 0.26 C ATOM 2223 C MET A 218 132.018 3.836 14.836 1.00 0.26 C ATOM 2224 O MET A 218 133.193 3.924 15.144 1.00 0.31 O ATOM 2225 CB MET A 218 131.252 6.022 13.846 1.00 0.26 C ATOM 2226 CG MET A 218 129.998 6.039 12.969 1.00 0.39 C ATOM 2227 SD MET A 218 129.612 7.750 12.521 1.00 0.76 S ATOM 2228 CE MET A 218 127.890 7.749 13.072 1.00 0.91 C ATOM 0 H MET A 218 131.879 6.696 16.058 1.00 0.28 H new ATOM 0 HA MET A 218 130.061 4.610 15.043 1.00 0.26 H new ATOM 0 HB2 MET A 218 131.447 7.020 14.238 1.00 0.26 H new ATOM 0 HB3 MET A 218 132.120 5.738 13.250 1.00 0.26 H new ATOM 0 HG2 MET A 218 130.159 5.442 12.071 1.00 0.39 H new ATOM 0 HG3 MET A 218 129.160 5.592 13.503 1.00 0.39 H new ATOM 0 HE1 MET A 218 127.379 8.623 12.669 1.00 0.91 H new ATOM 0 HE2 MET A 218 127.395 6.844 12.718 1.00 0.91 H new ATOM 0 HE3 MET A 218 127.856 7.778 14.161 1.00 0.91 H new ATOM 2238 N PRO A 219 131.476 2.756 14.314 1.00 0.24 N ATOM 2239 CA PRO A 219 132.285 1.535 14.059 1.00 0.25 C ATOM 2240 C PRO A 219 133.086 1.745 12.776 1.00 0.25 C ATOM 2241 O PRO A 219 132.723 2.556 11.939 1.00 0.28 O ATOM 2242 CB PRO A 219 131.238 0.445 13.865 1.00 0.27 C ATOM 2243 CG PRO A 219 130.017 1.163 13.387 1.00 0.26 C ATOM 2244 CD PRO A 219 130.076 2.575 13.916 1.00 0.28 C ATOM 0 HA PRO A 219 132.990 1.292 14.854 1.00 0.25 H new ATOM 0 HB2 PRO A 219 131.570 -0.296 13.138 1.00 0.27 H new ATOM 0 HB3 PRO A 219 131.044 -0.087 14.797 1.00 0.27 H new ATOM 0 HG2 PRO A 219 129.977 1.164 12.298 1.00 0.26 H new ATOM 0 HG3 PRO A 219 129.116 0.661 13.739 1.00 0.26 H new ATOM 0 HD2 PRO A 219 129.783 3.297 13.154 1.00 0.28 H new ATOM 0 HD3 PRO A 219 129.402 2.711 14.761 1.00 0.28 H new ATOM 2252 N THR A 220 134.148 1.019 12.580 1.00 0.25 N ATOM 2253 CA THR A 220 134.915 1.196 11.330 1.00 0.26 C ATOM 2254 C THR A 220 134.205 0.415 10.238 1.00 0.24 C ATOM 2255 O THR A 220 133.411 -0.465 10.522 1.00 0.26 O ATOM 2256 CB THR A 220 136.329 0.637 11.588 1.00 0.30 C ATOM 2257 OG1 THR A 220 136.360 -0.108 12.801 1.00 0.32 O ATOM 2258 CG2 THR A 220 137.322 1.795 11.685 1.00 0.37 C ATOM 0 H THR A 220 134.512 0.319 13.227 1.00 0.25 H new ATOM 0 HA THR A 220 134.988 2.239 11.022 1.00 0.26 H new ATOM 0 HB THR A 220 136.600 -0.021 10.763 1.00 0.30 H new ATOM 0 HG1 THR A 220 137.102 0.206 13.359 1.00 0.32 H new ATOM 0 HG21 THR A 220 138.322 1.402 11.867 1.00 0.37 H new ATOM 0 HG22 THR A 220 137.318 2.357 10.751 1.00 0.37 H new ATOM 0 HG23 THR A 220 137.035 2.452 12.506 1.00 0.37 H new ATOM 2266 N PRO A 221 134.513 0.742 9.025 1.00 0.24 N ATOM 2267 CA PRO A 221 133.889 0.049 7.876 1.00 0.26 C ATOM 2268 C PRO A 221 134.207 -1.430 7.945 1.00 0.26 C ATOM 2269 O PRO A 221 133.361 -2.266 7.754 1.00 0.29 O ATOM 2270 CB PRO A 221 134.563 0.697 6.673 1.00 0.29 C ATOM 2271 CG PRO A 221 135.830 1.249 7.223 1.00 0.29 C ATOM 2272 CD PRO A 221 135.478 1.747 8.584 1.00 0.27 C ATOM 0 HA PRO A 221 132.803 0.133 7.843 1.00 0.26 H new ATOM 0 HB2 PRO A 221 134.754 -0.030 5.883 1.00 0.29 H new ATOM 0 HB3 PRO A 221 133.941 1.481 6.241 1.00 0.29 H new ATOM 0 HG2 PRO A 221 136.605 0.484 7.271 1.00 0.29 H new ATOM 0 HG3 PRO A 221 136.215 2.053 6.596 1.00 0.29 H new ATOM 0 HD2 PRO A 221 136.347 1.796 9.240 1.00 0.27 H new ATOM 0 HD3 PRO A 221 135.044 2.747 8.555 1.00 0.27 H new ATOM 2280 N GLN A 222 135.434 -1.744 8.219 1.00 0.27 N ATOM 2281 CA GLN A 222 135.843 -3.174 8.296 1.00 0.30 C ATOM 2282 C GLN A 222 135.273 -3.860 9.531 1.00 0.30 C ATOM 2283 O GLN A 222 134.788 -4.973 9.467 1.00 0.38 O ATOM 2284 CB GLN A 222 137.374 -3.149 8.329 1.00 0.34 C ATOM 2285 CG GLN A 222 137.913 -4.556 8.060 1.00 0.69 C ATOM 2286 CD GLN A 222 139.425 -4.500 7.827 1.00 0.88 C ATOM 2287 OE1 GLN A 222 140.140 -3.848 8.556 1.00 0.92 O ATOM 2288 NE2 GLN A 222 139.947 -5.159 6.835 1.00 1.43 N ATOM 0 H GLN A 222 136.180 -1.071 8.395 1.00 0.27 H new ATOM 0 HA GLN A 222 135.462 -3.745 7.449 1.00 0.30 H new ATOM 0 HB2 GLN A 222 137.753 -2.453 7.580 1.00 0.34 H new ATOM 0 HB3 GLN A 222 137.722 -2.794 9.299 1.00 0.34 H new ATOM 0 HG2 GLN A 222 137.691 -5.208 8.905 1.00 0.69 H new ATOM 0 HG3 GLN A 222 137.418 -4.984 7.188 1.00 0.69 H new ATOM 0 HE21 GLN A 222 139.350 -5.710 6.218 1.00 1.43 H new ATOM 0 HE22 GLN A 222 140.954 -5.125 6.674 1.00 1.43 H new ATOM 2297 N GLN A 223 135.300 -3.197 10.635 1.00 0.25 N ATOM 2298 CA GLN A 223 134.735 -3.793 11.888 1.00 0.25 C ATOM 2299 C GLN A 223 133.225 -3.929 11.708 1.00 0.23 C ATOM 2300 O GLN A 223 132.628 -4.950 12.010 1.00 0.26 O ATOM 2301 CB GLN A 223 135.114 -2.818 13.026 1.00 0.27 C ATOM 2302 CG GLN A 223 133.878 -2.083 13.572 1.00 0.27 C ATOM 2303 CD GLN A 223 134.171 -1.539 14.972 1.00 0.31 C ATOM 2304 OE1 GLN A 223 133.439 -1.799 15.900 1.00 0.39 O ATOM 2305 NE2 GLN A 223 135.208 -0.779 15.166 1.00 0.33 N ATOM 0 H GLN A 223 135.689 -2.260 10.739 1.00 0.25 H new ATOM 0 HA GLN A 223 135.122 -4.785 12.118 1.00 0.25 H new ATOM 0 HB2 GLN A 223 135.597 -3.369 13.833 1.00 0.27 H new ATOM 0 HB3 GLN A 223 135.838 -2.091 12.658 1.00 0.27 H new ATOM 0 HG2 GLN A 223 133.606 -1.265 12.904 1.00 0.27 H new ATOM 0 HG3 GLN A 223 133.026 -2.762 13.607 1.00 0.27 H new ATOM 0 HE21 GLN A 223 135.829 -0.556 14.388 1.00 0.33 H new ATOM 0 HE22 GLN A 223 135.400 -0.406 16.096 1.00 0.33 H new ATOM 2314 N PHE A 224 132.610 -2.905 11.189 1.00 0.20 N ATOM 2315 CA PHE A 224 131.153 -2.952 10.950 1.00 0.19 C ATOM 2316 C PHE A 224 130.847 -3.867 9.753 1.00 0.19 C ATOM 2317 O PHE A 224 129.937 -4.672 9.812 1.00 0.21 O ATOM 2318 CB PHE A 224 130.797 -1.504 10.642 1.00 0.20 C ATOM 2319 CG PHE A 224 129.302 -1.349 10.567 1.00 0.19 C ATOM 2320 CD1 PHE A 224 128.561 -1.199 11.738 1.00 0.23 C ATOM 2321 CD2 PHE A 224 128.660 -1.354 9.327 1.00 0.24 C ATOM 2322 CE1 PHE A 224 127.175 -1.052 11.671 1.00 0.27 C ATOM 2323 CE2 PHE A 224 127.270 -1.208 9.256 1.00 0.25 C ATOM 2324 CZ PHE A 224 126.527 -1.057 10.430 1.00 0.25 C ATOM 0 H PHE A 224 133.064 -2.032 10.920 1.00 0.20 H new ATOM 0 HA PHE A 224 130.585 -3.350 11.791 1.00 0.19 H new ATOM 0 HB2 PHE A 224 131.201 -0.849 11.414 1.00 0.20 H new ATOM 0 HB3 PHE A 224 131.251 -1.202 9.698 1.00 0.20 H new ATOM 0 HD1 PHE A 224 129.059 -1.197 12.696 1.00 0.23 H new ATOM 0 HD2 PHE A 224 129.237 -1.471 8.422 1.00 0.24 H new ATOM 0 HE1 PHE A 224 126.601 -0.934 12.578 1.00 0.27 H new ATOM 0 HE2 PHE A 224 126.773 -1.212 8.297 1.00 0.25 H new ATOM 0 HZ PHE A 224 125.454 -0.944 10.380 1.00 0.25 H new ATOM 2334 N GLN A 225 131.607 -3.769 8.675 1.00 0.20 N ATOM 2335 CA GLN A 225 131.345 -4.647 7.501 1.00 0.23 C ATOM 2336 C GLN A 225 131.455 -6.100 7.915 1.00 0.23 C ATOM 2337 O GLN A 225 130.607 -6.897 7.618 1.00 0.28 O ATOM 2338 CB GLN A 225 132.400 -4.301 6.452 1.00 0.29 C ATOM 2339 CG GLN A 225 132.380 -5.363 5.351 1.00 0.30 C ATOM 2340 CD GLN A 225 132.160 -4.709 3.990 1.00 0.34 C ATOM 2341 OE1 GLN A 225 133.065 -4.123 3.436 1.00 0.52 O ATOM 2342 NE2 GLN A 225 130.994 -4.783 3.419 1.00 0.60 N ATOM 0 H GLN A 225 132.388 -3.121 8.569 1.00 0.20 H new ATOM 0 HA GLN A 225 130.343 -4.494 7.101 1.00 0.23 H new ATOM 0 HB2 GLN A 225 132.200 -3.317 6.028 1.00 0.29 H new ATOM 0 HB3 GLN A 225 133.387 -4.255 6.912 1.00 0.29 H new ATOM 0 HG2 GLN A 225 133.321 -5.914 5.350 1.00 0.30 H new ATOM 0 HG3 GLN A 225 131.588 -6.086 5.547 1.00 0.30 H new ATOM 0 HE21 GLN A 225 130.230 -5.275 3.882 1.00 0.60 H new ATOM 0 HE22 GLN A 225 130.844 -4.349 2.508 1.00 0.60 H new ATOM 2351 N LEU A 226 132.481 -6.445 8.612 1.00 0.24 N ATOM 2352 CA LEU A 226 132.617 -7.857 9.056 1.00 0.27 C ATOM 2353 C LEU A 226 131.421 -8.231 9.918 1.00 0.25 C ATOM 2354 O LEU A 226 130.770 -9.223 9.671 1.00 0.28 O ATOM 2355 CB LEU A 226 133.914 -7.907 9.855 1.00 0.33 C ATOM 2356 CG LEU A 226 134.959 -8.720 9.088 1.00 0.48 C ATOM 2357 CD1 LEU A 226 136.251 -7.914 8.958 1.00 0.94 C ATOM 2358 CD2 LEU A 226 135.250 -10.019 9.839 1.00 1.15 C ATOM 0 H LEU A 226 133.234 -5.820 8.898 1.00 0.24 H new ATOM 0 HA LEU A 226 132.645 -8.561 8.225 1.00 0.27 H new ATOM 0 HB2 LEU A 226 134.283 -6.897 10.032 1.00 0.33 H new ATOM 0 HB3 LEU A 226 133.734 -8.356 10.832 1.00 0.33 H new ATOM 0 HG LEU A 226 134.573 -8.949 8.095 1.00 0.48 H new ATOM 0 HD11 LEU A 226 136.991 -8.498 8.411 1.00 0.94 H new ATOM 0 HD12 LEU A 226 136.050 -6.988 8.419 1.00 0.94 H new ATOM 0 HD13 LEU A 226 136.635 -7.680 9.951 1.00 0.94 H new ATOM 0 HD21 LEU A 226 135.994 -10.597 9.291 1.00 1.15 H new ATOM 0 HD22 LEU A 226 135.631 -9.787 10.834 1.00 1.15 H new ATOM 0 HD23 LEU A 226 134.333 -10.601 9.928 1.00 1.15 H new ATOM 2370 N THR A 227 131.100 -7.427 10.899 1.00 0.24 N ATOM 2371 CA THR A 227 129.912 -7.732 11.753 1.00 0.24 C ATOM 2372 C THR A 227 128.662 -7.822 10.869 1.00 0.22 C ATOM 2373 O THR A 227 127.771 -8.610 11.111 1.00 0.25 O ATOM 2374 CB THR A 227 129.810 -6.561 12.742 1.00 0.27 C ATOM 2375 OG1 THR A 227 131.068 -6.356 13.377 1.00 0.31 O ATOM 2376 CG2 THR A 227 128.765 -6.874 13.810 1.00 0.35 C ATOM 0 H THR A 227 131.606 -6.576 11.145 1.00 0.24 H new ATOM 0 HA THR A 227 130.003 -8.682 12.280 1.00 0.24 H new ATOM 0 HB THR A 227 129.521 -5.664 12.195 1.00 0.27 H new ATOM 0 HG1 THR A 227 131.495 -5.555 13.007 1.00 0.31 H new ATOM 0 HG21 THR A 227 128.697 -6.040 14.508 1.00 0.35 H new ATOM 0 HG22 THR A 227 127.796 -7.030 13.336 1.00 0.35 H new ATOM 0 HG23 THR A 227 129.055 -7.776 14.349 1.00 0.35 H new ATOM 2384 N ILE A 228 128.619 -7.041 9.822 1.00 0.22 N ATOM 2385 CA ILE A 228 127.462 -7.084 8.876 1.00 0.22 C ATOM 2386 C ILE A 228 127.628 -8.293 7.989 1.00 0.24 C ATOM 2387 O ILE A 228 126.759 -9.143 7.904 1.00 0.26 O ATOM 2388 CB ILE A 228 127.589 -5.744 8.133 1.00 0.22 C ATOM 2389 CG1 ILE A 228 126.237 -5.095 7.969 1.00 0.24 C ATOM 2390 CG2 ILE A 228 128.213 -5.877 6.743 1.00 0.25 C ATOM 2391 CD1 ILE A 228 126.460 -3.744 7.320 1.00 0.29 C ATOM 0 H ILE A 228 129.344 -6.367 9.578 1.00 0.22 H new ATOM 0 HA ILE A 228 126.474 -7.185 9.324 1.00 0.22 H new ATOM 0 HB ILE A 228 128.248 -5.134 8.750 1.00 0.22 H new ATOM 0 HG12 ILE A 228 125.586 -5.715 7.352 1.00 0.24 H new ATOM 0 HG13 ILE A 228 125.746 -4.980 8.935 1.00 0.24 H new ATOM 0 HG21 ILE A 228 128.273 -4.894 6.275 1.00 0.25 H new ATOM 0 HG22 ILE A 228 129.215 -6.298 6.833 1.00 0.25 H new ATOM 0 HG23 ILE A 228 127.597 -6.534 6.129 1.00 0.25 H new ATOM 0 HD11 ILE A 228 125.502 -3.243 7.185 1.00 0.29 H new ATOM 0 HD12 ILE A 228 127.101 -3.135 7.958 1.00 0.29 H new ATOM 0 HD13 ILE A 228 126.938 -3.881 6.350 1.00 0.29 H new ATOM 2403 N GLU A 229 128.757 -8.393 7.373 1.00 0.25 N ATOM 2404 CA GLU A 229 129.050 -9.546 6.506 1.00 0.28 C ATOM 2405 C GLU A 229 128.765 -10.783 7.289 1.00 0.28 C ATOM 2406 O GLU A 229 128.241 -11.746 6.791 1.00 0.31 O ATOM 2407 CB GLU A 229 130.525 -9.438 6.197 1.00 0.29 C ATOM 2408 CG GLU A 229 130.667 -8.893 4.779 1.00 0.33 C ATOM 2409 CD GLU A 229 132.063 -8.301 4.548 1.00 0.35 C ATOM 2410 OE1 GLU A 229 132.863 -8.290 5.475 1.00 0.47 O ATOM 2411 OE2 GLU A 229 132.307 -7.861 3.437 1.00 0.39 O ATOM 0 H GLU A 229 129.508 -7.706 7.436 1.00 0.25 H new ATOM 0 HA GLU A 229 128.460 -9.572 5.590 1.00 0.28 H new ATOM 0 HB2 GLU A 229 131.017 -8.778 6.911 1.00 0.29 H new ATOM 0 HB3 GLU A 229 131.005 -10.413 6.281 1.00 0.29 H new ATOM 0 HG2 GLU A 229 130.485 -9.692 4.060 1.00 0.33 H new ATOM 0 HG3 GLU A 229 129.911 -8.127 4.604 1.00 0.33 H new ATOM 2418 N ASN A 230 129.097 -10.733 8.534 1.00 0.27 N ATOM 2419 CA ASN A 230 128.834 -11.890 9.411 1.00 0.29 C ATOM 2420 C ASN A 230 127.364 -12.289 9.346 1.00 0.31 C ATOM 2421 O ASN A 230 127.031 -13.441 9.546 1.00 0.33 O ATOM 2422 CB ASN A 230 129.207 -11.443 10.823 1.00 0.29 C ATOM 2423 CG ASN A 230 130.445 -12.203 11.293 1.00 0.31 C ATOM 2424 OD1 ASN A 230 130.338 -13.202 11.972 1.00 0.45 O ATOM 2425 ND2 ASN A 230 131.624 -11.772 10.957 1.00 0.44 N ATOM 0 H ASN A 230 129.543 -9.935 8.987 1.00 0.27 H new ATOM 0 HA ASN A 230 129.413 -12.761 9.104 1.00 0.29 H new ATOM 0 HB2 ASN A 230 129.400 -10.370 10.836 1.00 0.29 H new ATOM 0 HB3 ASN A 230 128.376 -11.626 11.504 1.00 0.29 H new ATOM 0 HD21 ASN A 230 132.457 -12.274 11.264 1.00 0.44 H new ATOM 0 HD22 ASN A 230 131.716 -10.932 10.386 1.00 0.44 H new ATOM 2432 N ILE A 231 126.477 -11.379 9.019 1.00 0.29 N ATOM 2433 CA ILE A 231 125.057 -11.793 8.904 1.00 0.32 C ATOM 2434 C ILE A 231 124.779 -12.116 7.446 1.00 0.34 C ATOM 2435 O ILE A 231 123.872 -12.857 7.118 1.00 0.38 O ATOM 2436 CB ILE A 231 124.195 -10.620 9.367 1.00 0.31 C ATOM 2437 CG1 ILE A 231 124.743 -10.043 10.663 1.00 0.32 C ATOM 2438 CG2 ILE A 231 122.781 -11.130 9.629 1.00 0.34 C ATOM 2439 CD1 ILE A 231 124.659 -8.515 10.629 1.00 0.33 C ATOM 0 H ILE A 231 126.673 -10.396 8.833 1.00 0.29 H new ATOM 0 HA ILE A 231 124.836 -12.670 9.513 1.00 0.32 H new ATOM 0 HB ILE A 231 124.197 -9.848 8.597 1.00 0.31 H new ATOM 0 HG12 ILE A 231 124.177 -10.428 11.511 1.00 0.32 H new ATOM 0 HG13 ILE A 231 125.778 -10.356 10.802 1.00 0.32 H new ATOM 0 HG21 ILE A 231 122.152 -10.304 9.961 1.00 0.34 H new ATOM 0 HG22 ILE A 231 122.371 -11.553 8.712 1.00 0.34 H new ATOM 0 HG23 ILE A 231 122.809 -11.898 10.402 1.00 0.34 H new ATOM 0 HD11 ILE A 231 125.053 -8.108 11.560 1.00 0.33 H new ATOM 0 HD12 ILE A 231 125.245 -8.137 9.791 1.00 0.33 H new ATOM 0 HD13 ILE A 231 123.619 -8.210 10.511 1.00 0.33 H new ATOM 2451 N ALA A 232 125.611 -11.613 6.571 1.00 0.32 N ATOM 2452 CA ALA A 232 125.465 -11.904 5.141 1.00 0.34 C ATOM 2453 C ALA A 232 126.030 -13.280 4.950 1.00 0.38 C ATOM 2454 O ALA A 232 125.451 -14.114 4.315 1.00 0.42 O ATOM 2455 CB ALA A 232 126.301 -10.833 4.440 1.00 0.35 C ATOM 0 H ALA A 232 126.395 -11.004 6.806 1.00 0.32 H new ATOM 0 HA ALA A 232 124.446 -11.886 4.754 1.00 0.34 H new ATOM 0 HB1 ALA A 232 126.247 -10.978 3.361 1.00 0.35 H new ATOM 0 HB2 ALA A 232 125.914 -9.846 4.694 1.00 0.35 H new ATOM 0 HB3 ALA A 232 127.339 -10.911 4.765 1.00 0.35 H new ATOM 2461 N ASN A 233 127.138 -13.501 5.589 1.00 0.37 N ATOM 2462 CA ASN A 233 127.824 -14.806 5.580 1.00 0.41 C ATOM 2463 C ASN A 233 126.991 -15.836 6.329 1.00 0.43 C ATOM 2464 O ASN A 233 126.998 -17.009 6.009 1.00 0.48 O ATOM 2465 CB ASN A 233 129.088 -14.512 6.363 1.00 0.41 C ATOM 2466 CG ASN A 233 130.235 -14.186 5.409 1.00 0.45 C ATOM 2467 OD1 ASN A 233 130.987 -15.052 5.023 1.00 0.55 O ATOM 2468 ND2 ASN A 233 130.401 -12.960 5.011 1.00 0.45 N ATOM 0 H ASN A 233 127.615 -12.790 6.143 1.00 0.37 H new ATOM 0 HA ASN A 233 128.000 -15.202 4.580 1.00 0.41 H new ATOM 0 HB2 ASN A 233 128.919 -13.674 7.040 1.00 0.41 H new ATOM 0 HB3 ASN A 233 129.351 -15.372 6.979 1.00 0.41 H new ATOM 0 HD21 ASN A 233 131.164 -12.729 4.375 1.00 0.45 H new ATOM 0 HD22 ASN A 233 129.768 -12.229 5.335 1.00 0.45 H new ATOM 2475 N LYS A 234 126.264 -15.401 7.322 1.00 0.41 N ATOM 2476 CA LYS A 234 125.421 -16.362 8.084 1.00 0.45 C ATOM 2477 C LYS A 234 124.284 -16.803 7.184 1.00 0.48 C ATOM 2478 O LYS A 234 123.988 -17.980 7.059 1.00 0.53 O ATOM 2479 CB LYS A 234 124.930 -15.590 9.327 1.00 0.44 C ATOM 2480 CG LYS A 234 123.443 -15.868 9.609 1.00 0.51 C ATOM 2481 CD LYS A 234 123.260 -17.314 10.090 1.00 0.61 C ATOM 2482 CE LYS A 234 122.057 -17.950 9.380 1.00 0.63 C ATOM 2483 NZ LYS A 234 122.623 -19.123 8.652 1.00 0.66 N ATOM 0 H LYS A 234 126.218 -14.431 7.635 1.00 0.41 H new ATOM 0 HA LYS A 234 125.949 -17.262 8.400 1.00 0.45 H new ATOM 0 HB2 LYS A 234 125.526 -15.876 10.194 1.00 0.44 H new ATOM 0 HB3 LYS A 234 125.080 -14.521 9.176 1.00 0.44 H new ATOM 0 HG2 LYS A 234 123.072 -15.175 10.365 1.00 0.51 H new ATOM 0 HG3 LYS A 234 122.856 -15.699 8.706 1.00 0.51 H new ATOM 0 HD2 LYS A 234 124.161 -17.892 9.886 1.00 0.61 H new ATOM 0 HD3 LYS A 234 123.108 -17.331 11.169 1.00 0.61 H new ATOM 0 HE2 LYS A 234 121.293 -18.258 10.094 1.00 0.63 H new ATOM 0 HE3 LYS A 234 121.586 -17.247 8.693 1.00 0.63 H new ATOM 0 HZ1 LYS A 234 121.905 -19.512 8.008 1.00 0.66 H new ATOM 0 HZ2 LYS A 234 123.454 -18.823 8.103 1.00 0.66 H new ATOM 0 HZ3 LYS A 234 122.906 -19.853 9.337 1.00 0.66 H new ATOM 2497 N TYR A 235 123.689 -15.868 6.519 1.00 0.46 N ATOM 2498 CA TYR A 235 122.601 -16.205 5.570 1.00 0.49 C ATOM 2499 C TYR A 235 123.218 -16.650 4.242 1.00 0.51 C ATOM 2500 O TYR A 235 122.584 -17.285 3.423 1.00 0.54 O ATOM 2501 CB TYR A 235 121.793 -14.925 5.411 1.00 0.48 C ATOM 2502 CG TYR A 235 120.456 -15.123 6.081 1.00 0.52 C ATOM 2503 CD1 TYR A 235 119.412 -15.755 5.396 1.00 0.61 C ATOM 2504 CD2 TYR A 235 120.274 -14.702 7.402 1.00 0.54 C ATOM 2505 CE1 TYR A 235 118.182 -15.962 6.034 1.00 0.66 C ATOM 2506 CE2 TYR A 235 119.048 -14.916 8.042 1.00 0.59 C ATOM 2507 CZ TYR A 235 118.002 -15.545 7.357 1.00 0.63 C ATOM 2508 OH TYR A 235 116.798 -15.770 7.991 1.00 0.71 O ATOM 0 H TYR A 235 123.909 -14.875 6.590 1.00 0.46 H new ATOM 0 HA TYR A 235 121.966 -17.020 5.918 1.00 0.49 H new ATOM 0 HB2 TYR A 235 122.322 -14.084 5.860 1.00 0.48 H new ATOM 0 HB3 TYR A 235 121.658 -14.690 4.355 1.00 0.48 H new ATOM 0 HD1 TYR A 235 119.554 -16.083 4.377 1.00 0.61 H new ATOM 0 HD2 TYR A 235 121.080 -14.212 7.928 1.00 0.54 H new ATOM 0 HE1 TYR A 235 117.373 -16.443 5.505 1.00 0.66 H new ATOM 0 HE2 TYR A 235 118.909 -14.596 9.064 1.00 0.59 H new ATOM 0 HH TYR A 235 116.839 -15.420 8.905 1.00 0.71 H new ATOM 2518 N LEU A 236 124.467 -16.321 4.056 1.00 0.49 N ATOM 2519 CA LEU A 236 125.212 -16.698 2.831 1.00 0.50 C ATOM 2520 C LEU A 236 125.201 -18.192 2.656 1.00 0.53 C ATOM 2521 O LEU A 236 124.751 -18.728 1.660 1.00 0.57 O ATOM 2522 CB LEU A 236 126.632 -16.275 3.160 1.00 0.49 C ATOM 2523 CG LEU A 236 127.523 -16.393 1.947 1.00 0.52 C ATOM 2524 CD1 LEU A 236 127.172 -15.299 0.941 1.00 0.50 C ATOM 2525 CD2 LEU A 236 128.944 -16.190 2.422 1.00 0.53 C ATOM 0 H LEU A 236 125.016 -15.788 4.730 1.00 0.49 H new ATOM 0 HA LEU A 236 124.797 -16.250 1.928 1.00 0.50 H new ATOM 0 HB2 LEU A 236 126.635 -15.246 3.520 1.00 0.49 H new ATOM 0 HB3 LEU A 236 127.023 -16.896 3.966 1.00 0.49 H new ATOM 0 HG LEU A 236 127.398 -17.364 1.467 1.00 0.52 H new ATOM 0 HD11 LEU A 236 127.817 -15.388 0.067 1.00 0.50 H new ATOM 0 HD12 LEU A 236 126.131 -15.406 0.636 1.00 0.50 H new ATOM 0 HD13 LEU A 236 127.317 -14.322 1.401 1.00 0.50 H new ATOM 0 HD21 LEU A 236 129.625 -16.267 1.575 1.00 0.53 H new ATOM 0 HD22 LEU A 236 129.039 -15.203 2.875 1.00 0.53 H new ATOM 0 HD23 LEU A 236 129.194 -16.953 3.159 1.00 0.53 H new ATOM 2537 N GLN A 237 125.740 -18.854 3.629 1.00 0.54 N ATOM 2538 CA GLN A 237 125.823 -20.337 3.564 1.00 0.59 C ATOM 2539 C GLN A 237 124.415 -20.956 3.670 1.00 0.60 C ATOM 2540 O GLN A 237 123.738 -21.155 2.677 1.00 0.63 O ATOM 2541 CB GLN A 237 126.728 -20.789 4.737 1.00 0.60 C ATOM 2542 CG GLN A 237 126.498 -19.931 5.997 1.00 0.58 C ATOM 2543 CD GLN A 237 126.381 -20.835 7.225 1.00 0.63 C ATOM 2544 OE1 GLN A 237 125.306 -21.294 7.552 1.00 0.72 O ATOM 2545 NE2 GLN A 237 127.443 -21.113 7.924 1.00 0.80 N ATOM 0 H GLN A 237 126.130 -18.434 4.473 1.00 0.54 H new ATOM 0 HA GLN A 237 126.243 -20.669 2.615 1.00 0.59 H new ATOM 0 HB2 GLN A 237 126.529 -21.836 4.968 1.00 0.60 H new ATOM 0 HB3 GLN A 237 127.774 -20.722 4.437 1.00 0.60 H new ATOM 0 HG2 GLN A 237 127.323 -19.231 6.127 1.00 0.58 H new ATOM 0 HG3 GLN A 237 125.591 -19.337 5.883 1.00 0.58 H new ATOM 0 HE21 GLN A 237 128.348 -20.729 7.652 1.00 0.80 H new ATOM 0 HE22 GLN A 237 127.371 -21.715 8.744 1.00 0.80 H new ATOM 2554 N ASN A 238 123.972 -21.251 4.867 1.00 0.61 N ATOM 2555 CA ASN A 238 122.609 -21.848 5.071 1.00 0.64 C ATOM 2556 C ASN A 238 122.428 -23.087 4.184 1.00 0.69 C ATOM 2557 O ASN A 238 121.578 -23.120 3.310 1.00 0.72 O ATOM 2558 CB ASN A 238 121.637 -20.755 4.643 1.00 0.62 C ATOM 2559 CG ASN A 238 120.885 -20.187 5.852 1.00 0.62 C ATOM 2560 OD1 ASN A 238 121.307 -20.331 6.987 1.00 0.63 O ATOM 2561 ND2 ASN A 238 119.783 -19.528 5.658 1.00 0.70 N ATOM 0 H ASN A 238 124.502 -21.102 5.726 1.00 0.61 H new ATOM 0 HA ASN A 238 122.452 -22.166 6.102 1.00 0.64 H new ATOM 0 HB2 ASN A 238 122.181 -19.956 4.140 1.00 0.62 H new ATOM 0 HB3 ASN A 238 120.925 -21.158 3.923 1.00 0.62 H new ATOM 0 HD21 ASN A 238 119.277 -19.135 6.452 1.00 0.70 H new ATOM 0 HD22 ASN A 238 119.423 -19.403 4.712 1.00 0.70 H new ATOM 2568 N ALA A 239 123.243 -24.086 4.386 1.00 0.74 N ATOM 2569 CA ALA A 239 123.176 -25.338 3.550 1.00 0.81 C ATOM 2570 C ALA A 239 123.639 -25.033 2.115 1.00 0.80 C ATOM 2571 O ALA A 239 124.506 -25.699 1.582 1.00 0.85 O ATOM 2572 CB ALA A 239 121.709 -25.791 3.580 1.00 0.86 C ATOM 0 H ALA A 239 123.967 -24.096 5.104 1.00 0.74 H new ATOM 0 HA ALA A 239 123.828 -26.123 3.933 1.00 0.81 H new ATOM 0 HB1 ALA A 239 121.597 -26.699 2.988 1.00 0.86 H new ATOM 0 HB2 ALA A 239 121.410 -25.989 4.609 1.00 0.86 H new ATOM 0 HB3 ALA A 239 121.077 -25.006 3.164 1.00 0.86 H new ATOM 2578 N SER A 240 123.068 -24.019 1.508 1.00 0.77 N ATOM 2579 CA SER A 240 123.445 -23.613 0.116 1.00 0.78 C ATOM 2580 C SER A 240 123.026 -24.689 -0.904 1.00 0.86 C ATOM 2581 O SER A 240 121.885 -25.118 -0.840 1.00 1.17 O ATOM 2582 CB SER A 240 124.967 -23.414 0.136 1.00 0.81 C ATOM 2583 OG SER A 240 125.278 -22.155 -0.466 1.00 0.80 O ATOM 2584 OXT SER A 240 123.843 -25.055 -1.739 1.00 1.14 O ATOM 0 H SER A 240 122.340 -23.443 1.930 1.00 0.77 H new ATOM 0 HA SER A 240 122.936 -22.699 -0.189 1.00 0.78 H new ATOM 0 HB2 SER A 240 125.337 -23.443 1.161 1.00 0.81 H new ATOM 0 HB3 SER A 240 125.460 -24.222 -0.404 1.00 0.81 H new ATOM 0 HG SER A 240 126.248 -22.018 -0.456 1.00 0.80 H new TER 2590 SER A 240 END