USER MOD reduce.3.24.130724 H: found=0, std=0, add=2433, rem=0, adj=82 USER MOD reduce.3.24.130724 removed 2444 hydrogens (28 hets) HEADER SIGNALING PROTEIN, MEMBRANE PROTEIN 21-JUN-01 1JFP TITLE STRUCTURE OF BOVINE RHODOPSIN (DARK ADAPTED) CAVEAT 1JFP INCORRECT CARBON CHIRAL CENTERS COMPND MOL_ID: 1; COMPND 2 MOLECULE: RHODOPSIN; COMPND 3 CHAIN: A SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; SOURCE 3 ORGANISM_COMMON: CATTLE; SOURCE 4 ORGANISM_TAXID: 9913 KEYWDS G-PROTEIN COUPLED RECEPTOR, SIGNALING PROTEIN, MEMBRANE KEYWDS 2 PROTEIN EXPDTA SOLUTION NMR AUTHOR P.L.YEAGLE,G.CHOI,A.D.ALBERT REVDAT 2 24-FEB-09 1JFP 1 VERSN REVDAT 1 05-OCT-01 1JFP 0 JRNL AUTH P.L.YEAGLE,G.CHOI,A.D.ALBERT JRNL TITL STUDIES ON THE STRUCTURE OF THE G-PROTEIN-COUPLED JRNL TITL 2 RECEPTOR RHODOPSIN INCLUDING THE PUTATIVE JRNL TITL 3 G-PROTEIN BINDING SITE IN UNACTIVATED AND JRNL TITL 4 ACTIVATED FORMS. JRNL REF BIOCHEMISTRY V. 40 11932 2001 JRNL REFN ISSN 0006-2960 JRNL PMID 11570894 JRNL DOI 10.1021/BI015543F REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : SYBYL 6.6 REMARK 3 AUTHORS : TRIPOS REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: SECONDARY STRUCTURE FROM NMR REMARK 3 STRUCTURES OF PEPTIDES ENCODING HELICES OR TURNS, AND LONG- REMARK 3 RANGE DISTANCE CONSTRAINTS FROM OTHER MEASUREMENTS ON INTACT REMARK 3 PROTEIN AMINO TERMINUS REMOVED DUE TO LACK OF LONG-RANGE REMARK 3 CONSTRAINTS REMARK 4 REMARK 4 1JFP COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 27-JUN-01. REMARK 100 THE RCSB ID CODE IS RCSB013715. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 283 REMARK 210 PH : 6 REMARK 210 IONIC STRENGTH : 10 MM REMARK 210 PRESSURE : 1 ATM REMARK 210 SAMPLE CONTENTS : FRAGMENTS OF RHODOPSIN REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY, DQF-COSY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : AMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : SYBYL 6.6 REMARK 210 METHOD USED : NULL REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 3 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : TARGET FUNCTION REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 MET A 1 REMARK 465 ASN A 2 REMARK 465 GLY A 3 REMARK 465 THR A 4 REMARK 465 GLU A 5 REMARK 465 GLY A 6 REMARK 465 PRO A 7 REMARK 465 ASN A 8 REMARK 465 PHE A 9 REMARK 465 TYR A 10 REMARK 465 VAL A 11 REMARK 465 PRO A 12 REMARK 465 PHE A 13 REMARK 465 SER A 14 REMARK 465 ASN A 15 REMARK 465 LYS A 16 REMARK 465 THR A 17 REMARK 465 GLY A 18 REMARK 465 VAL A 19 REMARK 465 VAL A 20 REMARK 465 ARG A 21 REMARK 465 SER A 22 REMARK 465 PRO A 23 REMARK 465 PHE A 24 REMARK 465 GLU A 25 REMARK 465 ALA A 26 REMARK 465 PRO A 27 REMARK 465 GLN A 28 REMARK 465 TYR A 29 REMARK 465 TYR A 30 REMARK 465 LEU A 31 REMARK 465 ALA A 32 REMARK 465 GLU A 33 REMARK 465 PRO A 34 REMARK 465 TRP A 35 REMARK 465 GLN A 36 REMARK 465 PHE A 37 REMARK 465 SER A 38 REMARK 465 MET A 39 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(RES=RESIDUE NAME; REMARK 470 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 470 RES CSSEQI ATOMS REMARK 470 ALA A 348 C O 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 CD2 TYR A 102 CZ PHE A 105 0.41 REMARK 500 N PRO A 53 CE2 PHE A 56 0.63 REMARK 500 N ILE A 133 CE2 TYR A 136 0.73 REMARK 500 CA PRO A 53 CD2 PHE A 56 0.81 REMARK 500 CA THR A 97 CE2 TYR A 102 0.87 REMARK 500 C PHE A 52 CZ PHE A 56 0.90 REMARK 500 NZ LYS A 339 O SER A 343 0.94 REMARK 500 O GLU A 181 SG CYS A 185 0.95 REMARK 500 N PRO A 53 CZ PHE A 56 0.96 REMARK 500 C PRO A 53 CD2 PHE A 56 1.01 REMARK 500 CE LYS A 339 CA GLN A 344 1.03 REMARK 500 CA THR A 97 CD2 TYR A 102 1.07 REMARK 500 NZ LYS A 339 C SER A 343 1.07 REMARK 500 N ILE A 133 CD2 TYR A 136 1.09 REMARK 500 CD LYS A 339 CA GLN A 344 1.10 REMARK 500 CA ILE A 133 CD2 TYR A 136 1.11 REMARK 500 O GLY A 101 CD2 PHE A 103 1.11 REMARK 500 CA PRO A 53 CG PHE A 56 1.18 REMARK 500 N THR A 97 CZ TYR A 102 1.18 REMARK 500 C SER A 98 CZ PHE A 103 1.18 REMARK 500 C THR A 97 CE2 PHE A 105 1.25 REMARK 500 CA PRO A 53 CE2 PHE A 56 1.27 REMARK 500 C THR A 97 CE2 TYR A 102 1.29 REMARK 500 CA GLU A 247 CG1 VAL A 250 1.30 REMARK 500 CB THR A 97 CE2 TYR A 102 1.30 REMARK 500 CA SER A 98 CZ PHE A 103 1.31 REMARK 500 O GLY A 101 CE2 PHE A 103 1.32 REMARK 500 N SER A 98 CE1 TYR A 102 1.32 REMARK 500 N SER A 98 CD1 TYR A 102 1.33 REMARK 500 CA ILE A 133 CE2 TYR A 136 1.33 REMARK 500 CG PHE A 313 NZ LYS A 325 1.34 REMARK 500 CD2 LEU A 72 ND2 ASN A 310 1.36 REMARK 500 C GLN A 236 OG SER A 240 1.38 REMARK 500 CG LEU A 72 ND2 ASN A 310 1.38 REMARK 500 N LEU A 99 CZ PHE A 103 1.39 REMARK 500 CE LYS A 339 N GLN A 344 1.44 REMARK 500 CG TYR A 102 CZ PHE A 105 1.44 REMARK 500 C THR A 97 CZ TYR A 102 1.45 REMARK 500 N SER A 98 CZ PHE A 103 1.45 REMARK 500 CA THR A 97 CZ PHE A 105 1.46 REMARK 500 N SER A 98 CE2 PHE A 103 1.46 REMARK 500 N THR A 97 CE1 TYR A 102 1.50 REMARK 500 CB PRO A 53 CG PHE A 56 1.50 REMARK 500 NZ LYS A 339 N GLN A 344 1.51 REMARK 500 CA THR A 97 CZ TYR A 102 1.53 REMARK 500 CG1 VAL A 139 CD GLN A 225 1.56 REMARK 500 CA PHE A 52 CZ PHE A 56 1.58 REMARK 500 CG2 VAL A 318 N ASP A 331 1.59 REMARK 500 CD2 TYR A 102 CE2 PHE A 105 1.59 REMARK 500 CD1 PHE A 313 CE LYS A 325 1.60 REMARK 500 REMARK 500 THIS ENTRY HAS 166 CLOSE CONTACTS. REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 MET A 253 CA MET A 253 CB 0.197 REMARK 500 LYS A 296 C THR A 297 N 0.344 REMARK 500 ILE A 307 N ILE A 307 CA 0.177 REMARK 500 ASN A 310 N ASN A 310 CA 0.198 REMARK 500 PHE A 313 CA PHE A 313 CB 0.242 REMARK 500 ASP A 331 N ASP A 331 CA 0.143 REMARK 500 LYS A 339 N LYS A 339 CA 0.132 REMARK 500 GLN A 344 N GLN A 344 CA 0.128 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 VAL A 61 CB - CA - C ANGL. DEV. = 12.9 DEGREES REMARK 500 THR A 62 CA - CB - CG2 ANGL. DEV. = 8.7 DEGREES REMARK 500 TYR A 74 CB - CG - CD2 ANGL. DEV. = 5.7 DEGREES REMARK 500 TYR A 74 CB - CG - CD1 ANGL. DEV. = -7.3 DEGREES REMARK 500 TYR A 96 CB - CG - CD1 ANGL. DEV. = -5.3 DEGREES REMARK 500 SER A 98 N - CA - CB ANGL. DEV. = -12.7 DEGREES REMARK 500 GLU A 113 CA - C - N ANGL. DEV. = 18.5 DEGREES REMARK 500 GLU A 113 O - C - N ANGL. DEV. = -18.8 DEGREES REMARK 500 GLY A 114 C - N - CA ANGL. DEV. = -12.9 DEGREES REMARK 500 TRP A 126 CD1 - NE1 - CE2 ANGL. DEV. = -8.3 DEGREES REMARK 500 TRP A 126 CG - CD2 - CE3 ANGL. DEV. = -7.2 DEGREES REMARK 500 TRP A 126 CD2 - CE3 - CZ3 ANGL. DEV. = -14.8 DEGREES REMARK 500 TRP A 126 CE3 - CZ3 - CH2 ANGL. DEV. = -13.5 DEGREES REMARK 500 ILE A 133 CB - CA - C ANGL. DEV. = 18.8 DEGREES REMARK 500 ARG A 135 N - CA - CB ANGL. DEV. = -11.6 DEGREES REMARK 500 GLU A 134 CA - C - N ANGL. DEV. = -14.3 DEGREES REMARK 500 TYR A 136 CA - CB - CG ANGL. DEV. = 11.9 DEGREES REMARK 500 TYR A 136 CG - CD2 - CE2 ANGL. DEV. = -5.9 DEGREES REMARK 500 VAL A 137 CB - CA - C ANGL. DEV. = 12.8 DEGREES REMARK 500 CYS A 140 CB - CA - C ANGL. DEV. = -25.2 DEGREES REMARK 500 CYS A 140 N - CA - CB ANGL. DEV. = -11.4 DEGREES REMARK 500 PRO A 142 CA - N - CD ANGL. DEV. = -10.8 DEGREES REMARK 500 PRO A 142 CB - CA - C ANGL. DEV. = 31.4 DEGREES REMARK 500 PRO A 142 N - CA - CB ANGL. DEV. = -8.1 DEGREES REMARK 500 MET A 143 N - CA - CB ANGL. DEV. = -12.6 DEGREES REMARK 500 PRO A 142 CA - C - N ANGL. DEV. = -13.5 DEGREES REMARK 500 PHE A 148 CB - CG - CD2 ANGL. DEV. = 4.7 DEGREES REMARK 500 PRO A 171 CA - N - CD ANGL. DEV. = -8.8 DEGREES REMARK 500 TRP A 175 CD1 - NE1 - CE2 ANGL. DEV. = -6.3 DEGREES REMARK 500 TRP A 175 CD2 - CE2 - CZ2 ANGL. DEV. = -7.4 DEGREES REMARK 500 TRP A 175 NE1 - CE2 - CD2 ANGL. DEV. = -8.8 DEGREES REMARK 500 TRP A 175 CE2 - CD2 - CG ANGL. DEV. = -8.0 DEGREES REMARK 500 TRP A 175 CG - CD2 - CE3 ANGL. DEV. = -5.6 DEGREES REMARK 500 TYR A 178 CB - CG - CD2 ANGL. DEV. = -3.7 DEGREES REMARK 500 TYR A 178 CB - CG - CD1 ANGL. DEV. = -9.5 DEGREES REMARK 500 TYR A 178 CG - CD1 - CE1 ANGL. DEV. = -10.0 DEGREES REMARK 500 PRO A 180 CA - N - CD ANGL. DEV. = -12.5 DEGREES REMARK 500 THR A 193 C - N - CA ANGL. DEV. = -16.1 DEGREES REMARK 500 THR A 198 CB - CA - C ANGL. DEV. = -25.5 DEGREES REMARK 500 PRO A 215 CA - N - CD ANGL. DEV. = -13.3 DEGREES REMARK 500 PRO A 215 N - CA - CB ANGL. DEV. = -9.5 DEGREES REMARK 500 PRO A 215 C - N - CA ANGL. DEV. = -10.5 DEGREES REMARK 500 LEU A 216 N - CA - C ANGL. DEV. = 16.3 DEGREES REMARK 500 LEU A 216 C - N - CA ANGL. DEV. = 17.3 DEGREES REMARK 500 ILE A 219 C - N - CA ANGL. DEV. = 16.5 DEGREES REMARK 500 CYS A 222 CB - CA - C ANGL. DEV. = 13.8 DEGREES REMARK 500 TYR A 223 CA - CB - CG ANGL. DEV. = 13.4 DEGREES REMARK 500 TYR A 223 CB - CG - CD1 ANGL. DEV. = 3.6 DEGREES REMARK 500 THR A 229 N - CA - CB ANGL. DEV. = 12.5 DEGREES REMARK 500 GLU A 232 CB - CA - C ANGL. DEV. = 14.1 DEGREES REMARK 500 REMARK 500 THIS ENTRY HAS 76 ANGLE DEVIATIONS. 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 PHE A 45 68.27 -156.57 REMARK 500 LEU A 47 34.70 -156.61 REMARK 500 MET A 49 76.00 -153.82 REMARK 500 PRO A 53 54.25 -96.28 REMARK 500 PHE A 56 -62.29 -178.88 REMARK 500 LEU A 57 46.25 -85.10 REMARK 500 THR A 58 -50.94 -163.47 REMARK 500 LYS A 67 -177.45 48.02 REMARK 500 THR A 70 -72.49 -95.97 REMARK 500 PRO A 71 -157.20 43.86 REMARK 500 LEU A 72 36.22 -73.73 REMARK 500 LEU A 79 33.36 -86.60 REMARK 500 ALA A 82 -19.41 -156.84 REMARK 500 PHE A 91 -63.60 -105.96 REMARK 500 THR A 93 20.54 166.30 REMARK 500 LEU A 95 -3.37 -155.00 REMARK 500 THR A 97 60.08 -161.73 REMARK 500 SER A 98 26.71 162.74 REMARK 500 LEU A 99 55.80 156.67 REMARK 500 HIS A 100 75.27 64.63 REMARK 500 TYR A 102 -105.79 86.57 REMARK 500 PHE A 103 -136.67 174.94 REMARK 500 VAL A 104 -174.44 106.92 REMARK 500 PHE A 105 -35.17 156.02 REMARK 500 THR A 108 -62.50 75.74 REMARK 500 CYS A 110 -22.54 124.97 REMARK 500 PHE A 115 -68.61 -100.56 REMARK 500 THR A 118 -97.63 -72.13 REMARK 500 LEU A 119 -60.56 -16.69 REMARK 500 VAL A 130 -71.14 -82.72 REMARK 500 ILE A 133 17.35 109.39 REMARK 500 ARG A 135 -77.82 -67.47 REMARK 500 TYR A 136 -126.56 73.47 REMARK 500 VAL A 139 39.34 -67.97 REMARK 500 CYS A 140 46.66 -177.99 REMARK 500 ASN A 145 -11.32 -153.11 REMARK 500 PHE A 146 9.68 89.99 REMARK 500 ARG A 147 -63.50 -96.93 REMARK 500 ASN A 151 159.79 56.57 REMARK 500 HIS A 152 30.14 21.35 REMARK 500 ALA A 153 -25.41 -153.42 REMARK 500 PRO A 170 -99.95 -77.17 REMARK 500 PRO A 171 -81.66 47.39 REMARK 500 TYR A 178 100.33 106.28 REMARK 500 ILE A 179 36.30 71.25 REMARK 500 PRO A 180 -66.38 46.01 REMARK 500 GLU A 181 29.34 -65.95 REMARK 500 GLN A 184 -60.81 -137.40 REMARK 500 CYS A 187 88.45 -69.80 REMARK 500 ASP A 190 31.80 -151.69 REMARK 500 GLU A 197 27.10 -154.76 REMARK 500 SER A 202 66.42 -156.28 REMARK 500 TYR A 206 -45.36 -134.67 REMARK 500 MET A 207 51.71 -114.77 REMARK 500 PHE A 208 -86.59 -92.60 REMARK 500 VAL A 209 -51.62 46.61 REMARK 500 PHE A 212 30.93 -145.07 REMARK 500 ILE A 213 -72.43 -93.07 REMARK 500 PRO A 215 59.33 -155.09 REMARK 500 LEU A 216 -90.00 78.77 REMARK 500 PHE A 220 -84.17 -65.49 REMARK 500 PHE A 221 59.64 -99.14 REMARK 500 VAL A 227 -3.04 -162.07 REMARK 500 PHE A 228 45.71 -87.93 REMARK 500 THR A 229 -16.32 -144.35 REMARK 500 GLU A 232 41.24 -152.62 REMARK 500 ALA A 235 42.78 142.45 REMARK 500 GLN A 238 13.64 -162.28 REMARK 500 SER A 240 -2.83 175.17 REMARK 500 THR A 242 58.38 165.26 REMARK 500 GLN A 244 -38.73 101.72 REMARK 500 LYS A 245 -118.96 -102.25 REMARK 500 LYS A 248 -50.63 164.96 REMARK 500 VAL A 250 -40.45 -18.27 REMARK 500 ARG A 252 -5.16 -56.41 REMARK 500 MET A 253 -77.28 -1.16 REMARK 500 ILE A 259 60.47 -108.93 REMARK 500 ALA A 260 -24.42 -155.18 REMARK 500 PHE A 261 -78.51 -52.49 REMARK 500 TRP A 265 39.97 -93.84 REMARK 500 VAL A 271 47.71 -81.88 REMARK 500 ALA A 272 -38.72 -149.15 REMARK 500 TYR A 274 52.48 -102.67 REMARK 500 HIS A 278 -10.16 88.46 REMARK 500 PHE A 287 91.47 81.53 REMARK 500 MET A 288 80.83 89.95 REMARK 500 ILE A 290 -75.39 91.84 REMARK 500 PRO A 291 -19.98 -48.40 REMARK 500 ALA A 295 41.54 -97.27 REMARK 500 LYS A 296 -21.74 -142.08 REMARK 500 ASN A 302 -61.74 -91.89 REMARK 500 ILE A 307 22.77 40.58 REMARK 500 MET A 308 -23.96 -141.12 REMARK 500 MET A 309 -53.20 61.37 REMARK 500 ASN A 310 -36.16 -161.96 REMARK 500 PHE A 313 12.89 -152.49 REMARK 500 ARG A 314 82.12 -175.49 REMARK 500 CYS A 316 -119.83 178.00 REMARK 500 MET A 317 156.50 65.43 REMARK 500 VAL A 318 -158.83 142.76 REMARK 500 THR A 320 99.18 -166.58 REMARK 500 LEU A 321 -107.82 -165.74 REMARK 500 CYS A 323 14.85 56.91 REMARK 500 LYS A 325 32.86 -168.27 REMARK 500 ASN A 326 -28.65 178.24 REMARK 500 LEU A 328 -101.92 -90.01 REMARK 500 ASP A 330 111.29 -174.63 REMARK 500 ASP A 331 -155.42 -141.04 REMARK 500 ALA A 333 -159.08 -144.08 REMARK 500 SER A 334 -143.52 36.42 REMARK 500 THR A 335 -32.69 137.38 REMARK 500 THR A 336 120.04 175.00 REMARK 500 VAL A 337 -32.47 103.33 REMARK 500 LYS A 339 146.73 151.73 REMARK 500 GLU A 341 -165.52 -175.45 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 ALA A 42 TYR A 43 121.11 REMARK 500 PHE A 45 LEU A 46 85.35 REMARK 500 LEU A 46 LEU A 47 -146.69 REMARK 500 LEU A 47 ILE A 48 127.20 REMARK 500 MET A 49 LEU A 50 74.50 REMARK 500 PHE A 52 PRO A 53 -35.61 REMARK 500 PRO A 53 ILE A 54 145.87 REMARK 500 ILE A 54 ASN A 55 148.30 REMARK 500 TYR A 60 VAL A 61 -131.15 REMARK 500 VAL A 61 THR A 62 114.72 REMARK 500 THR A 62 VAL A 63 149.87 REMARK 500 LYS A 67 LEU A 68 134.84 REMARK 500 LEU A 72 ASN A 73 125.89 REMARK 500 LEU A 79 ALA A 80 143.85 REMARK 500 ASP A 83 LEU A 84 133.37 REMARK 500 PHE A 88 GLY A 89 55.03 REMARK 500 PHE A 91 THR A 92 -143.95 REMARK 500 THR A 93 THR A 94 107.71 REMARK 500 THR A 94 LEU A 95 144.57 REMARK 500 THR A 97 SER A 98 -136.40 REMARK 500 SER A 98 LEU A 99 88.94 REMARK 500 LEU A 99 HIS A 100 -132.32 REMARK 500 HIS A 100 GLY A 101 36.74 REMARK 500 TYR A 102 PHE A 103 -56.35 REMARK 500 PHE A 103 VAL A 104 -80.11 REMARK 500 PHE A 105 GLY A 106 -80.74 REMARK 500 PRO A 107 THR A 108 145.43 REMARK 500 ALA A 117 THR A 118 149.98 REMARK 500 LEU A 131 ALA A 132 -141.37 REMARK 500 ALA A 132 ILE A 133 -49.42 REMARK 500 ILE A 133 GLU A 134 132.15 REMARK 500 GLU A 134 ARG A 135 139.56 REMARK 500 ARG A 135 TYR A 136 76.93 REMARK 500 VAL A 137 VAL A 138 77.15 REMARK 500 CYS A 140 LYS A 141 37.67 REMARK 500 LYS A 141 PRO A 142 144.17 REMARK 500 MET A 143 SER A 144 -105.50 REMARK 500 PHE A 146 ARG A 147 103.88 REMARK 500 ARG A 147 PHE A 148 -94.54 REMARK 500 PHE A 148 GLY A 149 121.13 REMARK 500 GLY A 149 GLU A 150 130.26 REMARK 500 ASN A 151 HIS A 152 67.47 REMARK 500 ALA A 153 ILE A 154 122.39 REMARK 500 ALA A 166 CYS A 167 145.45 REMARK 500 CYS A 167 ALA A 168 144.20 REMARK 500 PRO A 170 PRO A 171 145.41 REMARK 500 SER A 176 ARG A 177 148.79 REMARK 500 CYS A 185 SER A 186 -140.96 REMARK 500 SER A 186 CYS A 187 -47.69 REMARK 500 CYS A 187 GLY A 188 -144.92 REMARK 500 ILE A 189 ASP A 190 44.07 REMARK 500 ASP A 190 TYR A 191 146.67 REMARK 500 TYR A 192 THR A 193 88.95 REMARK 500 PRO A 194 HIS A 195 66.20 REMARK 500 GLU A 197 THR A 198 99.88 REMARK 500 THR A 198 ASN A 199 -138.30 REMARK 500 SER A 202 PHE A 203 106.45 REMARK 500 VAL A 204 ILE A 205 81.05 REMARK 500 MET A 207 PHE A 208 82.63 REMARK 500 VAL A 210 HIS A 211 -145.68 REMARK 500 PRO A 215 LEU A 216 -46.47 REMARK 500 ILE A 219 PHE A 220 72.32 REMARK 500 PHE A 220 PHE A 221 -111.57 REMARK 500 PHE A 221 CYS A 222 105.95 REMARK 500 CYS A 222 TYR A 223 140.55 REMARK 500 TYR A 223 GLY A 224 148.17 REMARK 500 GLY A 224 GLN A 225 148.39 REMARK 500 LEU A 226 VAL A 227 141.27 REMARK 500 VAL A 227 PHE A 228 121.29 REMARK 500 PHE A 228 THR A 229 145.70 REMARK 500 GLU A 232 ALA A 233 105.48 REMARK 500 ALA A 233 ALA A 234 141.20 REMARK 500 ALA A 235 GLN A 236 99.21 REMARK 500 GLN A 238 GLU A 239 121.19 REMARK 500 SER A 240 ALA A 241 135.75 REMARK 500 ALA A 241 THR A 242 141.77 REMARK 500 GLU A 249 VAL A 250 131.73 REMARK 500 ARG A 252 MET A 253 138.54 REMARK 500 MET A 253 VAL A 254 -149.51 REMARK 500 VAL A 258 ILE A 259 121.26 REMARK 500 ALA A 260 PHE A 261 125.60 REMARK 500 LEU A 262 ILE A 263 -144.24 REMARK 500 CYS A 264 TRP A 265 -145.66 REMARK 500 TRP A 265 LEU A 266 139.76 REMARK 500 TYR A 274 ILE A 275 99.34 REMARK 500 PHE A 276 THR A 277 127.47 REMARK 500 HIS A 278 GLN A 279 -136.86 REMARK 500 SER A 281 ASP A 282 47.89 REMARK 500 GLY A 284 PRO A 285 31.17 REMARK 500 ILE A 286 PHE A 287 -146.41 REMARK 500 PHE A 287 MET A 288 -127.67 REMARK 500 MET A 308 MET A 309 90.27 REMARK 500 MET A 309 ASN A 310 -100.56 REMARK 500 ASN A 310 LYS A 311 141.10 REMARK 500 GLN A 312 PHE A 313 144.81 REMARK 500 ARG A 314 ASN A 315 49.33 REMARK 500 CYS A 316 MET A 317 -140.78 REMARK 500 THR A 320 LEU A 321 58.59 REMARK 500 CYS A 323 GLY A 324 41.03 REMARK 500 ASN A 326 PRO A 327 -58.26 REMARK 500 PRO A 327 LEU A 328 149.31 REMARK 500 ASP A 331 GLU A 332 44.40 REMARK 500 GLU A 341 THR A 342 -62.58 REMARK 500 SER A 343 GLN A 344 -128.09 REMARK 500 GLN A 344 VAL A 345 -84.82 REMARK 500 ALA A 346 PRO A 347 -143.48 REMARK 500 PRO A 347 ALA A 348 -30.24 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 TYR A 136 0.22 SIDE_CHAIN REMARK 500 TYR A 178 0.44 SIDE_CHAIN REMARK 500 PHE A 203 0.13 SIDE_CHAIN REMARK 500 HIS A 211 0.11 SIDE_CHAIN REMARK 500 TYR A 268 0.13 SIDE_CHAIN REMARK 500 TYR A 301 0.09 SIDE_CHAIN REMARK 500 PHE A 313 0.43 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: MAIN CHAIN PLANARITY REMARK 500 REMARK 500 THE FOLLOWING RESIDUES HAVE A PSEUDO PLANARITY REMARK 500 TORSION, C(I) - CA(I) - N(I+1) - O(I), GREATER REMARK 500 10.0 DEGREES. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 500 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 500 I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI ANGLE REMARK 500 THR A 198 10.40 REMARK 500 VAL A 258 -11.66 REMARK 500 ILE A 290 -10.00 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CHIRAL CENTERS REMARK 500 REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY REMARK 500 M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (11X,I3,1X,A3,1X,A1,I4,A1,6X,F5.1,6X,A1,10X,A1,3X,A16) REMARK 500 REMARK 500 M RES CSSEQI IMPROPER EXPECTED FOUND DETAILS REMARK 500 CYS A 110 115.2 ALPHA-CARBON REMARK 500 CYS A 140 88.2 ALPHA-CARBON REMARK 500 TYR A 191 133.4 ALPHA-CARBON REMARK 500 THR A 242 125.0 ALPHA-CARBON REMARK 500 THR A 335 119.1 ALPHA-CARBON REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE RET A 400 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1EDS RELATED DB: PDB REMARK 900 RELATED ID: 1EDV RELATED DB: PDB REMARK 900 RELATED ID: 1EDW RELATED DB: PDB REMARK 900 RELATED ID: 1EDX RELATED DB: PDB REMARK 900 RELATED ID: 1FDF RELATED DB: PDB DBREF 1JFP A 1 348 UNP P02699 OPSD_BOVIN 1 348 SEQRES 1 A 348 MET ASN GLY THR GLU GLY PRO ASN PHE TYR VAL PRO PHE SEQRES 2 A 348 SER ASN LYS THR GLY VAL VAL ARG SER PRO PHE GLU ALA SEQRES 3 A 348 PRO GLN TYR TYR LEU ALA GLU PRO TRP GLN PHE SER MET SEQRES 4 A 348 LEU ALA ALA TYR MET PHE LEU LEU ILE MET LEU GLY PHE SEQRES 5 A 348 PRO ILE ASN PHE LEU THR LEU TYR VAL THR VAL GLN HIS SEQRES 6 A 348 LYS LYS LEU ARG THR PRO LEU ASN TYR ILE LEU LEU ASN SEQRES 7 A 348 LEU ALA VAL ALA ASP LEU PHE MET VAL PHE GLY GLY PHE SEQRES 8 A 348 THR THR THR LEU TYR THR SER LEU HIS GLY TYR PHE VAL SEQRES 9 A 348 PHE GLY PRO THR GLY CYS ASN LEU GLU GLY PHE PHE ALA SEQRES 10 A 348 THR LEU GLY GLY GLU ILE ALA LEU TRP SER LEU VAL VAL SEQRES 11 A 348 LEU ALA ILE GLU ARG TYR VAL VAL VAL CYS LYS PRO MET SEQRES 12 A 348 SER ASN PHE ARG PHE GLY GLU ASN HIS ALA ILE MET GLY SEQRES 13 A 348 VAL ALA PHE THR TRP VAL MET ALA LEU ALA CYS ALA ALA SEQRES 14 A 348 PRO PRO LEU VAL GLY TRP SER ARG TYR ILE PRO GLU GLY SEQRES 15 A 348 MET GLN CYS SER CYS GLY ILE ASP TYR TYR THR PRO HIS SEQRES 16 A 348 GLU GLU THR ASN ASN GLU SER PHE VAL ILE TYR MET PHE SEQRES 17 A 348 VAL VAL HIS PHE ILE ILE PRO LEU ILE VAL ILE PHE PHE SEQRES 18 A 348 CYS TYR GLY GLN LEU VAL PHE THR VAL LYS GLU ALA ALA SEQRES 19 A 348 ALA GLN GLN GLN GLU SER ALA THR THR GLN LYS ALA GLU SEQRES 20 A 348 LYS GLU VAL THR ARG MET VAL ILE ILE MET VAL ILE ALA SEQRES 21 A 348 PHE LEU ILE CYS TRP LEU PRO TYR ALA GLY VAL ALA PHE SEQRES 22 A 348 TYR ILE PHE THR HIS GLN GLY SER ASP PHE GLY PRO ILE SEQRES 23 A 348 PHE MET THR ILE PRO ALA PHE PHE ALA LYS THR SER ALA SEQRES 24 A 348 VAL TYR ASN PRO VAL ILE TYR ILE MET MET ASN LYS GLN SEQRES 25 A 348 PHE ARG ASN CYS MET VAL THR THR LEU CYS CYS GLY LYS SEQRES 26 A 348 ASN PRO LEU GLY ASP ASP GLU ALA SER THR THR VAL SER SEQRES 27 A 348 LYS THR GLU THR SER GLN VAL ALA PRO ALA HET RET A 400 48 HETNAM RET RETINAL FORMUL 2 RET C20 H28 O HELIX 1 1 TYR A 43 ILE A 48 1 6 HELIX 2 2 THR A 70 ASN A 73 5 4 HELIX 3 3 TYR A 74 LEU A 79 1 6 HELIX 4 4 PHE A 85 PHE A 91 1 7 HELIX 5 5 THR A 118 ALA A 132 1 15 HELIX 6 6 THR A 160 ALA A 164 5 5 HELIX 7 7 ALA A 168 SER A 176 1 9 HELIX 8 8 HIS A 195 ASN A 200 1 6 HELIX 9 9 ILE A 213 VAL A 218 1 6 HELIX 10 10 LYS A 248 VAL A 250 5 3 HELIX 11 11 THR A 251 VAL A 258 1 8 HELIX 12 12 PHE A 261 LEU A 266 1 6 HELIX 13 13 LEU A 266 THR A 277 1 12 SSBOND *** CYS A 110 CYS A 187 1555 1555 2.05 LINK CD1 LEU A 125 C1 RET A 400 1555 1555 2.05 LINK CD2 LEU A 125 C2 RET A 400 1555 1555 1.94 LINK CD1 LEU A 125 C16 RET A 400 1555 1555 0.90 LINK CG LEU A 125 C16 RET A 400 1555 1555 1.47 LINK NZ LYS A 296 C15 RET A 400 1555 1555 1.28 CISPEP 1 ARG A 69 THR A 70 0 11.35 CISPEP 2 GLY A 106 PRO A 107 0 -22.81 CISPEP 3 CYS A 110 ASN A 111 0 -19.94 CISPEP 4 ILE A 179 PRO A 180 0 15.52 CISPEP 5 VAL A 218 ILE A 219 0 8.50 CISPEP 6 PRO A 285 ILE A 286 0 -14.50 CISPEP 7 MET A 288 THR A 289 0 11.71 CISPEP 8 TYR A 306 ILE A 307 0 5.77 CISPEP 9 VAL A 337 SER A 338 0 23.76 SITE *** AC1 8 GLU A 113 GLY A 121 GLU A 122 LEU A 125 SITE *** AC1 8 PHE A 208 PHE A 212 ALA A 295 LYS A 296 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 NoAdj-H: A 97 THR H : A 97 THR N : A 102 TYR CZ :(H bumps) USER MOD NoAdj-H: A 98 SER H : A 98 SER N : A 103 PHE CZ :(H bumps) USER MOD NoAdj-H: A 99 LEU H : A 99 LEU N : A 103 PHE CZ :(H bumps) USER MOD NoAdj-H: A 133 ILE H : A 133 ILE N : A 136 TYR CD2 :(H bumps) USER MOD NoAdj-H: A 135 ARG H : A 135 ARG N : A 136 TYR CG :(H bumps) USER MOD NoAdj-H: A 151 ASNHD21 : A 151 ASN ND2 : A 152 HIS CD2 :(H bumps) USER MOD NoAdj-H: A 296 LYS HZ1 : A 296 LYS NZ : A 400 RET C15 :(NH2R) USER MOD NoAdj-H: A 296 LYS HZ2 : A 296 LYS NZ : A 400 RET C15 :(NH2R) USER MOD NoAdj-H: A 296 LYS HZ3 : A 296 LYS NZ : A 400 RET C15 :(NH2R) USER MOD NoAdj-H: A 307 ILE H : A 307 ILE N : A 309 MET SD :(H bumps) USER MOD NoAdj-H: A 310 ASNHD21 : A 310 ASN ND2 : A 72 LEU CG :(H bumps) USER MOD NoAdj-H: A 325 LYS HZ1 : A 325 LYS NZ : A 313 PHE CG :(NH2R) USER MOD NoAdj-H: A 325 LYS HZ2 : A 325 LYS NZ : A 313 PHE CG :...(NH2R) USER MOD NoAdj-H: A 331 ASP H : A 331 ASP N : A 318 VAL CG2 :(H bumps) USER MOD NoAdj-H: A 339 LYS HZ1 : A 339 LYS NZ : A 344 GLN N :...(NH2R) USER MOD NoAdj-H: A 339 LYS HZ2 : A 339 LYS NZ : A 344 GLN N :(NH2R) USER MOD NoAdj-H: A 339 LYS HZ3 : A 339 LYS NZ : A 344 GLN N :...(NH2R) USER MOD NoAdj-H: A 400 RETH163 : A 400 RET C16 : A 125 LEU CD1 :(H bumps) USER MOD NoAdj-H: A 400 RETH162 : A 400 RET C16 : A 125 LEU CD1 :(H bumps) USER MOD NoAdj-H: A 400 RETH161 : A 400 RET C16 : A 125 LEU CD1 :(H bumps) USER MOD Set 1.1: A 315 ASN : amide:sc= -3.43! C(o=-7.3!,f=-7.7!) USER MOD Set 1.2: A 335 THR OG1 : rot 9:sc= -3.91! USER MOD Set 2.1: A 264 CYS SG : rot -160:sc= -1.02! USER MOD Set 2.2: A 298 SER OG : rot 132:sc= 1.06 USER MOD Set 3.1: A 237 GLN :FLIP amide:sc= -3.08! C(o=-4.6!,f=-3.8!) USER MOD Set 3.2: A 251 THR OG1 : rot -122:sc= -0.771 USER MOD Set 4.1: A 136 TYR OH : rot -172:sc= -6.5! USER MOD Set 4.2: A 229 THR OG1 : rot 71:sc= 1.14 USER MOD Set 4.3: A 253 MET CE :methyl 148:sc= -28.2! (180deg=-15.4!) USER MOD Set 5.1: A 200 ASN : amide:sc= -4.98! C(o=-4.3!,f=-6.7!) USER MOD Set 5.2: A 278 HIS : no HE2:sc= 0.631 K(o=-4.3,f=-17!) USER MOD Set 6.1: A 198 THR OG1 : rot -176:sc= -3.22! USER MOD Set 6.2: A 199 ASN : amide:sc= -21.8! C(o=-25!,f=-40!) USER MOD Set 7.1: A 167 CYS SG : rot 87:sc= -0.142 USER MOD Set 7.2: A 207 MET CE :methyl -159:sc= 0 (180deg=-0.0183) USER MOD Set 8.1: A 141 LYS NZ :NH3+ -159:sc= 2.16 (180deg=0.926) USER MOD Set 8.2: A 152 HIS : no HE2:sc= -38! C(o=-36!,f=-46!) USER MOD Set 9.1: A 93 THR OG1 : rot 64:sc= 1.28 USER MOD Set 9.2: A 98 SER OG : rot -42:sc= -19.8! USER MOD Set 9.3: A 102 TYR OH : rot -118:sc= -23.6! USER MOD Set10.1: A 78 ASN : amide:sc= -0.648 X(o=0.59,f=0.84) USER MOD Set10.2: A 160 THR OG1 : rot 42:sc= 1.24 USER MOD Set11.1: A 67 LYS NZ :NH3+ -148:sc= 1.95 (180deg=-1.08!) USER MOD Set11.2: A 73 ASN : amide:sc= 0.0455 K(o=3,f=-14!) USER MOD Set11.3: A 311 LYS NZ :NH3+ -143:sc= 1.04 (180deg=-1.39) USER MOD Set12.1: A 64 GLN : amide:sc= 0.72 K(o=1.8,f=-3.3!) USER MOD Set12.2: A 65 HIS : no HE2:sc= 1.13 K(o=1.8,f=-6.8!) USER MOD Set13.1: A 44 MET CE :methyl -170:sc= 0 (180deg=-0.294) USER MOD Set13.2: A 94 THR OG1 : rot 70:sc= 1.2 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 0.548 K(o=0.55,f=-4.8!) USER MOD Single : A 58 THR OG1 : rot 61:sc= -0.123 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -15:sc= 0.691 USER MOD Single : A 66 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0209) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 74 TYR OH : rot 100:sc= -0.0277 USER MOD Single : A 86 MET CE :methyl 176:sc= -0.145 (180deg=-0.197) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0518 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot -4:sc= 1.01 USER MOD Single : A 100 HIS : no HD1:sc= -0.0631 X(o=-0.063,f=-0.0038) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN :FLIP amide:sc= -0.82 F(o=-2.3!,f=-0.82) USER MOD Single : A 118 THR OG1 : rot 107:sc= 1.24 USER MOD Single : A 127 SER OG : rot 69:sc= 1.13 USER MOD Single : A 140 CYS SG : rot 11:sc= -13.2! USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 144 SER OG : rot -36:sc= 0.301 USER MOD Single : A 145 ASN : amide:sc=-0.00733 K(o=-0.0073,f=-0.78) USER MOD Single : A 155 MET CE :methyl 175:sc= 0 (180deg=-0.0136) USER MOD Single : A 163 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 176 SER OG : rot -52:sc= 0.816 USER MOD Single : A 178 TYR OH : rot 180:sc= 0 USER MOD Single : A 183 MET CE :methyl -115:sc= 0 (180deg=-0.0136) USER MOD Single : A 184 GLN : amide:sc= -0.032 X(o=-0.032,f=-0.015) USER MOD Single : A 186 SER OG : rot 97:sc= 0.976 USER MOD Single : A 191 TYR OH : rot 180:sc= 0 USER MOD Single : A 192 TYR OH : rot 28:sc= 0.403 USER MOD Single : A 193 THR OG1 : rot -55:sc= 0.405 USER MOD Single : A 195 HIS : no HE2:sc= 0.821 K(o=0.82,f=-3.9!) USER MOD Single : A 202 SER OG : rot 35:sc= 0.921 USER MOD Single : A 206 TYR OH : rot 180:sc= 0 USER MOD Single : A 211 HIS : no HE2:sc= -0.289 K(o=-0.29,f=-3.6!) USER MOD Single : A 222 CYS SG : rot 58:sc= -0.295 USER MOD Single : A 223 TYR OH : rot 180:sc=-0.00263 USER MOD Single : A 225 GLN : amide:sc= -28! C(o=-28!,f=-43!) USER MOD Single : A 231 LYS NZ :NH3+ -141:sc= 1.92 (180deg=-0.597!) USER MOD Single : A 236 GLN : amide:sc= -11! C(o=-11!,f=-26!) USER MOD Single : A 238 GLN : amide:sc= 0.174 K(o=0.17,f=-3.1!) USER MOD Single : A 242 THR OG1 : rot -148:sc= -0.261! USER MOD Single : A 243 THR OG1 : rot 163:sc= 1.23 USER MOD Single : A 244 GLN : amide:sc= 0.0919 X(o=0.092,f=-0.013) USER MOD Single : A 245 LYS NZ :NH3+ 159:sc= 2.28 (180deg=1.77) USER MOD Single : A 248 LYS NZ :NH3+ 153:sc= 0.71 (180deg=0.383) USER MOD Single : A 257 MET CE :methyl 155:sc= -0.0113 (180deg=-0.763) USER MOD Single : A 268 TYR OH : rot -73:sc= 1.64 USER MOD Single : A 274 TYR OH : rot 180:sc= 0 USER MOD Single : A 277 THR OG1 : rot 27:sc= 0.527 USER MOD Single : A 279 GLN : amide:sc= -0.474 X(o=-0.47,f=-0.46) USER MOD Single : A 281 SER OG : rot 180:sc= 0 USER MOD Single : A 288 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 289 THR OG1 : rot 180:sc= 0.183 USER MOD Single : A 297 THR OG1 : rot 174:sc= 0 USER MOD Single : A 301 TYR OH : rot 180:sc= 0 USER MOD Single : A 302 ASN : amide:sc= -0.223 X(o=-0.22,f=-0.64) USER MOD Single : A 306 TYR OH : rot 30:sc= 0.27 USER MOD Single : A 308 MET CE :methyl 150:sc= -1.32 (180deg=-2.71!) USER MOD Single : A 309 MET CE :methyl -118:sc= -5.08! (180deg=-10.7!) USER MOD Single : A 312 GLN : amide:sc= 0.628 X(o=0.63,f=0.17) USER MOD Single : A 316 CYS SG : rot -132:sc= -2.32 USER MOD Single : A 317 MET CE :methyl 165:sc= -0.205 (180deg=-0.225) USER MOD Single : A 319 THR OG1 : rot -37:sc= 0.031 USER MOD Single : A 320 THR OG1 : rot 22:sc= 1.26 USER MOD Single : A 322 CYS SG : rot 180:sc= 0.178 USER MOD Single : A 323 CYS SG : rot 180:sc= 0 USER MOD Single : A 325 LYS NZ :NH3+ 180:sc= -3.2! (180deg=-3.2!) USER MOD Single : A 326 ASN : amide:sc= 0.177 X(o=0.18,f=0) USER MOD Single : A 334 SER OG : rot 50:sc= 1.47 USER MOD Single : A 336 THR OG1 : rot 46:sc= 1.2 USER MOD Single : A 338 SER OG : rot 180:sc= 0 USER MOD Single : A 340 THR OG1 : rot 39:sc= 1.31 USER MOD Single : A 342 THR OG1 : rot 180:sc= 0 USER MOD Single : A 343 SER OG : rot 90:sc= -20.8! USER MOD Single : A 344 GLN : amide:sc= -0.216 K(o=-0.22,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 40 -5.885 10.678 -0.191 1.00 -0.73 N ATOM 2 CA LEU A 40 -5.684 9.318 0.203 1.00 0.36 C ATOM 3 C LEU A 40 -6.538 8.713 1.326 1.00 0.57 C ATOM 4 O LEU A 40 -6.723 7.499 1.432 1.00 -0.57 O ATOM 5 CB LEU A 40 -4.219 8.931 0.350 1.00 0.00 C ATOM 6 CG LEU A 40 -3.373 9.636 1.422 1.00 0.00 C ATOM 7 CD1 LEU A 40 -3.756 9.191 2.833 1.00 0.00 C ATOM 8 CD2 LEU A 40 -1.897 9.309 1.164 1.00 0.00 C ATOM 0 HA LEU A 40 -6.107 8.836 -0.678 1.00 0.36 H new ATOM 0 HB2 LEU A 40 -4.178 7.860 0.549 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.736 9.095 -0.613 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.553 10.709 1.358 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.134 9.713 3.560 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.804 9.426 3.017 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.603 8.116 2.930 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.279 9.801 1.915 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.748 8.231 1.220 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.614 9.663 0.173 1.00 0.00 H new ATOM 20 N ALA A 41 -7.115 9.639 2.162 1.00 -0.73 N ATOM 21 CA ALA A 41 -7.795 9.220 3.387 1.00 0.36 C ATOM 22 C ALA A 41 -8.904 8.172 3.143 1.00 0.57 C ATOM 23 O ALA A 41 -9.300 7.423 4.030 1.00 -0.57 O ATOM 24 CB ALA A 41 -8.435 10.429 4.055 1.00 0.00 C ATOM 0 H ALA A 41 -7.112 10.646 1.997 1.00 -0.73 H new ATOM 0 HA ALA A 41 -7.032 8.764 4.018 1.00 0.36 H new ATOM 0 HB1 ALA A 41 -8.941 10.115 4.968 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -7.664 11.159 4.301 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.158 10.880 3.376 1.00 0.00 H new ATOM 30 N ALA A 42 -9.484 8.202 1.896 1.00 -0.73 N ATOM 31 CA ALA A 42 -10.520 7.262 1.497 1.00 0.36 C ATOM 32 C ALA A 42 -10.248 6.660 0.107 1.00 0.57 C ATOM 33 O ALA A 42 -11.144 6.226 -0.615 1.00 -0.57 O ATOM 34 CB ALA A 42 -11.889 7.918 1.569 1.00 0.00 C ATOM 0 H ALA A 42 -9.233 8.876 1.173 1.00 -0.73 H new ATOM 0 HA ALA A 42 -10.506 6.430 2.201 1.00 0.36 H new ATOM 0 HB1 ALA A 42 -12.652 7.201 1.267 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -12.082 8.245 2.591 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -11.916 8.779 0.901 1.00 0.00 H new ATOM 40 N TYR A 43 -8.909 6.361 -0.146 1.00 -0.73 N ATOM 41 CA TYR A 43 -8.648 4.957 -0.459 1.00 0.36 C ATOM 42 C TYR A 43 -8.305 4.139 0.805 1.00 0.57 C ATOM 43 O TYR A 43 -8.354 2.909 0.819 1.00 -0.57 O ATOM 44 CB TYR A 43 -7.691 4.709 -1.618 1.00 0.14 C ATOM 45 CG TYR A 43 -6.260 5.098 -1.428 1.00 -0.14 C ATOM 46 CD1 TYR A 43 -5.502 4.437 -0.471 1.00 -0.15 C ATOM 47 CD2 TYR A 43 -5.660 6.089 -2.219 1.00 -0.15 C ATOM 48 CE1 TYR A 43 -4.196 4.817 -0.242 1.00 -0.15 C ATOM 49 CE2 TYR A 43 -4.316 6.418 -2.037 1.00 -0.15 C ATOM 50 CZ TYR A 43 -3.592 5.778 -1.038 1.00 0.08 C ATOM 51 OH TYR A 43 -2.290 6.087 -0.795 1.00 -0.53 O ATOM 0 H TYR A 43 -8.115 7.002 -0.136 1.00 -0.73 H new ATOM 0 HA TYR A 43 -9.596 4.579 -0.843 1.00 0.36 H new ATOM 0 HB2 TYR A 43 -7.721 3.646 -1.858 1.00 0.14 H new ATOM 0 HB3 TYR A 43 -8.072 5.243 -2.489 1.00 0.14 H new ATOM 0 HD1 TYR A 43 -5.935 3.625 0.094 1.00 -0.15 H new ATOM 0 HD2 TYR A 43 -6.241 6.600 -2.973 1.00 -0.15 H new ATOM 0 HE1 TYR A 43 -3.639 4.362 0.564 1.00 -0.15 H new ATOM 0 HE2 TYR A 43 -3.845 7.160 -2.664 1.00 -0.15 H new ATOM 0 HH TYR A 43 -1.993 6.775 -1.427 1.00 -0.53 H new ATOM 61 N MET A 44 -8.000 4.881 1.938 1.00 -0.73 N ATOM 62 CA MET A 44 -7.720 4.239 3.243 1.00 0.36 C ATOM 63 C MET A 44 -9.020 3.714 3.908 1.00 0.57 C ATOM 64 O MET A 44 -9.018 2.965 4.877 1.00 -0.57 O ATOM 65 CB MET A 44 -6.986 5.178 4.202 1.00 0.00 C ATOM 66 CG MET A 44 -5.672 4.637 4.767 1.00 0.23 C ATOM 67 SD MET A 44 -4.423 4.341 3.471 1.00 -0.46 S ATOM 68 CE MET A 44 -3.038 5.292 4.164 1.00 0.23 C ATOM 0 H MET A 44 -7.948 5.900 1.952 1.00 -0.73 H new ATOM 0 HA MET A 44 -7.066 3.392 3.035 1.00 0.36 H new ATOM 0 HB2 MET A 44 -6.781 6.114 3.682 1.00 0.00 H new ATOM 0 HB3 MET A 44 -7.650 5.414 5.033 1.00 0.00 H new ATOM 0 HG2 MET A 44 -5.275 5.344 5.495 1.00 0.23 H new ATOM 0 HG3 MET A 44 -5.865 3.706 5.300 1.00 0.23 H new ATOM 0 HE1 MET A 44 -2.244 5.372 3.422 1.00 0.23 H new ATOM 0 HE2 MET A 44 -3.382 6.290 4.436 1.00 0.23 H new ATOM 0 HE3 MET A 44 -2.656 4.785 5.050 1.00 0.23 H new ATOM 78 N PHE A 45 -10.149 4.065 3.230 1.00 -0.73 N ATOM 79 CA PHE A 45 -11.412 3.336 3.283 1.00 0.36 C ATOM 80 C PHE A 45 -12.142 3.697 1.993 1.00 0.57 C ATOM 81 O PHE A 45 -13.012 4.555 1.897 1.00 -0.57 O ATOM 82 CB PHE A 45 -12.292 3.460 4.527 1.00 0.14 C ATOM 83 CG PHE A 45 -12.496 4.718 5.330 1.00 -0.14 C ATOM 84 CD1 PHE A 45 -12.084 5.985 4.929 1.00 -0.15 C ATOM 85 CD2 PHE A 45 -13.186 4.611 6.550 1.00 -0.15 C ATOM 86 CE1 PHE A 45 -12.325 7.110 5.724 1.00 -0.15 C ATOM 87 CE2 PHE A 45 -13.438 5.730 7.346 1.00 -0.15 C ATOM 88 CZ PHE A 45 -13.002 6.983 6.933 1.00 -0.15 C ATOM 0 H PHE A 45 -10.188 4.884 2.623 1.00 -0.73 H new ATOM 0 HA PHE A 45 -11.168 2.277 3.371 1.00 0.36 H new ATOM 0 HB2 PHE A 45 -13.287 3.138 4.220 1.00 0.14 H new ATOM 0 HB3 PHE A 45 -11.919 2.716 5.230 1.00 0.14 H new ATOM 0 HD1 PHE A 45 -11.569 6.102 3.987 1.00 -0.15 H new ATOM 0 HD2 PHE A 45 -13.529 3.641 6.879 1.00 -0.15 H new ATOM 0 HE1 PHE A 45 -11.984 8.082 5.398 1.00 -0.15 H new ATOM 0 HE2 PHE A 45 -13.970 5.622 8.280 1.00 -0.15 H new ATOM 0 HZ PHE A 45 -13.187 7.852 7.546 1.00 -0.15 H new ATOM 98 N LEU A 46 -11.565 3.200 0.835 1.00 -0.73 N ATOM 99 CA LEU A 46 -11.906 1.832 0.403 1.00 0.36 C ATOM 100 C LEU A 46 -11.305 0.670 1.225 1.00 0.57 C ATOM 101 O LEU A 46 -11.895 -0.407 1.337 1.00 -0.57 O ATOM 102 CB LEU A 46 -11.381 1.544 -1.028 1.00 0.00 C ATOM 103 CG LEU A 46 -11.768 2.548 -2.128 1.00 0.00 C ATOM 104 CD1 LEU A 46 -11.131 2.128 -3.456 1.00 0.00 C ATOM 105 CD2 LEU A 46 -13.283 2.666 -2.291 1.00 0.00 C ATOM 0 H LEU A 46 -10.910 3.704 0.237 1.00 -0.73 H new ATOM 0 HA LEU A 46 -12.990 1.843 0.513 1.00 0.36 H new ATOM 0 HB2 LEU A 46 -10.293 1.490 -0.986 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -11.737 0.559 -1.328 1.00 0.00 H new ATOM 0 HG LEU A 46 -11.395 3.528 -1.829 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -11.407 2.841 -4.233 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -10.046 2.109 -3.349 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -11.486 1.135 -3.732 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -13.509 3.385 -3.078 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -13.697 1.694 -2.558 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.725 3.003 -1.353 1.00 0.00 H new ATOM 117 N LEU A 47 -9.973 0.814 1.594 1.00 -0.73 N ATOM 118 CA LEU A 47 -9.155 -0.400 1.673 1.00 0.36 C ATOM 119 C LEU A 47 -7.940 -0.248 2.594 1.00 0.57 C ATOM 120 O LEU A 47 -6.964 -0.991 2.517 1.00 -0.57 O ATOM 121 CB LEU A 47 -8.813 -0.874 0.260 1.00 0.00 C ATOM 122 CG LEU A 47 -8.495 -2.377 0.134 1.00 0.00 C ATOM 123 CD1 LEU A 47 -9.729 -3.248 0.395 1.00 0.00 C ATOM 124 CD2 LEU A 47 -7.945 -2.679 -1.259 1.00 0.00 C ATOM 0 H LEU A 47 -9.504 1.692 1.818 1.00 -0.73 H new ATOM 0 HA LEU A 47 -9.739 -1.186 2.153 1.00 0.36 H new ATOM 0 HB2 LEU A 47 -9.650 -0.639 -0.398 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -7.955 -0.306 -0.100 1.00 0.00 H new ATOM 0 HG LEU A 47 -7.748 -2.617 0.891 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -9.460 -4.300 0.296 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -10.099 -3.062 1.403 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -10.507 -3.003 -0.328 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -7.723 -3.743 -1.340 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.686 -2.405 -2.010 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -7.033 -2.105 -1.423 1.00 0.00 H new ATOM 136 N ILE A 48 -8.149 0.558 3.704 1.00 -0.73 N ATOM 137 CA ILE A 48 -7.818 0.006 5.040 1.00 0.36 C ATOM 138 C ILE A 48 -9.082 -0.094 5.933 1.00 0.57 C ATOM 139 O ILE A 48 -9.093 -0.547 7.073 1.00 -0.57 O ATOM 140 CB ILE A 48 -6.595 0.677 5.695 1.00 0.00 C ATOM 141 CG1 ILE A 48 -5.338 0.466 4.821 1.00 0.00 C ATOM 142 CG2 ILE A 48 -6.353 0.180 7.127 1.00 0.00 C ATOM 143 CD1 ILE A 48 -4.687 -0.907 5.029 1.00 0.00 C ATOM 0 H ILE A 48 -8.515 1.510 3.690 1.00 -0.73 H new ATOM 0 HA ILE A 48 -7.480 -1.021 4.902 1.00 0.36 H new ATOM 0 HB ILE A 48 -6.806 1.744 5.764 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.609 0.578 3.771 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.610 1.245 5.047 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -5.481 0.683 7.544 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -7.226 0.400 7.741 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -6.180 -0.896 7.114 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -3.810 -0.995 4.388 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -4.387 -1.013 6.071 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.401 -1.690 4.776 1.00 0.00 H new ATOM 155 N MET A 49 -10.238 0.188 5.258 1.00 -0.73 N ATOM 156 CA MET A 49 -11.560 -0.152 5.768 1.00 0.36 C ATOM 157 C MET A 49 -12.388 -0.282 4.507 1.00 0.57 C ATOM 158 O MET A 49 -12.986 0.632 3.954 1.00 -0.57 O ATOM 159 CB MET A 49 -12.074 0.811 6.833 1.00 0.00 C ATOM 160 CG MET A 49 -12.138 0.164 8.213 1.00 0.23 C ATOM 161 SD MET A 49 -12.479 1.369 9.540 1.00 -0.46 S ATOM 162 CE MET A 49 -14.264 1.548 9.321 1.00 0.23 C ATOM 0 H MET A 49 -10.256 0.655 4.352 1.00 -0.73 H new ATOM 0 HA MET A 49 -11.588 -1.077 6.344 1.00 0.36 H new ATOM 0 HB2 MET A 49 -11.425 1.685 6.873 1.00 0.00 H new ATOM 0 HB3 MET A 49 -13.067 1.164 6.553 1.00 0.00 H new ATOM 0 HG2 MET A 49 -12.914 -0.602 8.215 1.00 0.23 H new ATOM 0 HG3 MET A 49 -11.193 -0.339 8.418 1.00 0.23 H new ATOM 0 HE1 MET A 49 -14.651 2.255 10.055 1.00 0.23 H new ATOM 0 HE2 MET A 49 -14.472 1.917 8.317 1.00 0.23 H new ATOM 0 HE3 MET A 49 -14.746 0.580 9.460 1.00 0.23 H new ATOM 172 N LEU A 50 -12.135 -1.469 3.840 1.00 -0.73 N ATOM 173 CA LEU A 50 -12.674 -2.733 4.381 1.00 0.36 C ATOM 174 C LEU A 50 -11.609 -3.700 4.939 1.00 0.57 C ATOM 175 O LEU A 50 -11.887 -4.769 5.480 1.00 -0.57 O ATOM 176 CB LEU A 50 -13.546 -3.466 3.353 1.00 0.00 C ATOM 177 CG LEU A 50 -14.783 -2.680 2.876 1.00 0.00 C ATOM 178 CD1 LEU A 50 -15.508 -3.472 1.786 1.00 0.00 C ATOM 179 CD2 LEU A 50 -15.747 -2.366 4.021 1.00 0.00 C ATOM 0 H LEU A 50 -11.593 -1.555 2.980 1.00 -0.73 H new ATOM 0 HA LEU A 50 -13.285 -2.421 5.228 1.00 0.36 H new ATOM 0 HB2 LEU A 50 -12.932 -3.711 2.486 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -13.878 -4.410 3.786 1.00 0.00 H new ATOM 0 HG LEU A 50 -14.434 -1.728 2.476 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -16.382 -2.914 1.451 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -14.835 -3.632 0.944 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -15.824 -4.435 2.186 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -16.602 -1.811 3.635 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -16.092 -3.297 4.472 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -15.235 -1.766 4.773 1.00 0.00 H new ATOM 191 N GLY A 51 -10.334 -3.181 4.836 1.00 -0.73 N ATOM 192 CA GLY A 51 -9.168 -3.941 5.256 1.00 0.36 C ATOM 193 C GLY A 51 -9.339 -4.364 6.718 1.00 0.57 C ATOM 194 O GLY A 51 -9.577 -5.527 7.037 1.00 -0.57 O ATOM 0 H GLY A 51 -10.124 -2.253 4.468 1.00 -0.73 H new ATOM 0 HA2 GLY A 51 -9.045 -4.820 4.623 1.00 0.36 H new ATOM 0 HA3 GLY A 51 -8.267 -3.338 5.143 1.00 0.36 H new ATOM 198 N PHE A 52 -9.343 -3.339 7.650 1.00 -0.73 N ATOM 199 CA PHE A 52 -10.039 -3.606 8.904 1.00 0.36 C ATOM 200 C PHE A 52 -11.556 -3.531 8.601 1.00 0.57 C ATOM 201 O PHE A 52 -12.014 -2.809 7.711 1.00 -0.57 O ATOM 202 CB PHE A 52 -9.696 -2.644 10.055 1.00 0.14 C ATOM 203 CG PHE A 52 -8.534 -3.085 10.902 1.00 -0.14 C ATOM 204 CD1 PHE A 52 -7.323 -3.523 10.355 1.00 -0.15 C ATOM 205 CD2 PHE A 52 -8.688 -3.087 12.294 1.00 -0.15 C ATOM 206 CE1 PHE A 52 -6.322 -4.031 11.184 1.00 -0.15 C ATOM 207 CE2 PHE A 52 -7.700 -3.611 13.116 1.00 -0.15 C ATOM 208 CZ PHE A 52 -6.522 -4.099 12.562 1.00 -0.15 C ATOM 0 H PHE A 52 -8.910 -2.421 7.548 1.00 -0.73 H new ATOM 0 HA PHE A 52 -9.719 -4.587 9.256 1.00 0.36 H new ATOM 0 HB2 PHE A 52 -9.475 -1.661 9.638 1.00 0.14 H new ATOM 0 HB3 PHE A 52 -10.573 -2.530 10.692 1.00 0.14 H new ATOM 0 HD1 PHE A 52 -7.163 -3.468 9.288 1.00 -0.15 H new ATOM 0 HD2 PHE A 52 -9.585 -2.676 12.733 1.00 -0.15 H new ATOM 0 HE1 PHE A 52 -5.390 -4.372 10.757 1.00 -0.15 H new ATOM 0 HE2 PHE A 52 -7.846 -3.640 14.186 1.00 -0.15 H new ATOM 0 HZ PHE A 52 -5.763 -4.530 13.198 1.00 -0.15 H new ATOM 218 N PRO A 53 -12.437 -4.122 9.489 1.00 -0.66 N ATOM 219 CA PRO A 53 -12.190 -5.369 10.240 1.00 0.36 C ATOM 220 C PRO A 53 -12.757 -6.640 9.623 1.00 0.57 C ATOM 221 O PRO A 53 -13.256 -7.543 10.291 1.00 -0.57 O ATOM 222 CB PRO A 53 -12.803 -5.116 11.617 1.00 0.00 C ATOM 223 CG PRO A 53 -12.488 -3.655 11.742 1.00 0.00 C ATOM 224 CD PRO A 53 -12.997 -3.150 10.408 1.00 0.30 C ATOM 0 HA PRO A 53 -11.119 -5.569 10.255 1.00 0.36 H new ATOM 0 HB2 PRO A 53 -13.873 -5.321 11.647 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -12.341 -5.716 12.401 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -13.001 -3.191 12.584 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -11.422 -3.470 11.876 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -14.086 -3.129 10.367 1.00 0.30 H new ATOM 0 HD3 PRO A 53 -12.651 -2.139 10.195 1.00 0.30 H new ATOM 232 N ILE A 54 -12.354 -6.832 8.328 1.00 -0.73 N ATOM 233 CA ILE A 54 -12.130 -8.213 7.835 1.00 0.36 C ATOM 234 C ILE A 54 -10.623 -8.569 7.831 1.00 0.57 C ATOM 235 O ILE A 54 -10.159 -9.595 7.368 1.00 -0.57 O ATOM 236 CB ILE A 54 -12.995 -8.452 6.620 1.00 0.00 C ATOM 237 CG1 ILE A 54 -13.734 -9.803 6.599 1.00 0.00 C ATOM 238 CG2 ILE A 54 -12.291 -8.162 5.300 1.00 0.00 C ATOM 239 CD1 ILE A 54 -12.848 -11.036 6.578 1.00 0.00 C ATOM 0 H ILE A 54 -12.188 -6.090 7.648 1.00 -0.73 H new ATOM 0 HA ILE A 54 -12.486 -8.988 8.513 1.00 0.36 H new ATOM 0 HB ILE A 54 -13.780 -7.704 6.727 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -14.380 -9.857 7.475 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -14.382 -9.829 5.723 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -12.974 -8.356 4.473 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -11.979 -7.118 5.276 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -11.415 -8.804 5.206 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -13.470 -11.931 6.564 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.219 -11.017 5.688 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -12.217 -11.046 7.467 1.00 0.00 H new ATOM 251 N ASN A 55 -9.972 -7.685 8.647 1.00 -0.73 N ATOM 252 CA ASN A 55 -8.805 -7.792 9.487 1.00 0.36 C ATOM 253 C ASN A 55 -9.360 -7.345 10.838 1.00 0.57 C ATOM 254 O ASN A 55 -9.250 -6.240 11.337 1.00 -0.57 O ATOM 255 CB ASN A 55 -7.622 -6.938 9.163 1.00 0.06 C ATOM 256 CG ASN A 55 -6.672 -7.458 8.117 1.00 0.57 C ATOM 257 OD1 ASN A 55 -6.921 -8.366 7.332 1.00 -0.57 O ATOM 258 ND2 ASN A 55 -5.477 -6.806 8.126 1.00 -0.80 N ATOM 0 H ASN A 55 -10.343 -6.737 8.717 1.00 -0.73 H new ATOM 0 HA ASN A 55 -8.396 -8.798 9.396 1.00 0.36 H new ATOM 0 HB2 ASN A 55 -7.986 -5.964 8.836 1.00 0.06 H new ATOM 0 HB3 ASN A 55 -7.059 -6.776 10.082 1.00 0.06 H new ATOM 0 HD21 ASN A 55 -4.748 -7.068 7.462 1.00 -0.80 H new ATOM 0 HD22 ASN A 55 -5.311 -6.055 8.796 1.00 -0.80 H new ATOM 265 N PHE A 56 -10.121 -8.355 11.376 1.00 -0.73 N ATOM 266 CA PHE A 56 -11.065 -8.165 12.491 1.00 0.36 C ATOM 267 C PHE A 56 -11.629 -9.547 12.737 1.00 0.57 C ATOM 268 O PHE A 56 -11.325 -10.301 13.645 1.00 -0.57 O ATOM 269 CB PHE A 56 -12.192 -7.349 11.940 1.00 0.14 C ATOM 270 CG PHE A 56 -11.908 -6.175 11.050 1.00 -0.14 C ATOM 271 CD1 PHE A 56 -10.743 -5.403 11.168 1.00 -0.15 C ATOM 272 CD2 PHE A 56 -12.884 -5.775 10.123 1.00 -0.15 C ATOM 273 CE1 PHE A 56 -10.538 -4.296 10.341 1.00 -0.15 C ATOM 274 CE2 PHE A 56 -12.675 -4.672 9.297 1.00 -0.15 C ATOM 275 CZ PHE A 56 -11.499 -3.936 9.401 1.00 -0.15 C ATOM 0 H PHE A 56 -10.084 -9.316 11.036 1.00 -0.73 H new ATOM 0 HA PHE A 56 -10.619 -7.708 13.375 1.00 0.36 H new ATOM 0 HB2 PHE A 56 -12.840 -8.027 11.384 1.00 0.14 H new ATOM 0 HB3 PHE A 56 -12.769 -6.980 12.788 1.00 0.14 H new ATOM 0 HD1 PHE A 56 -9.998 -5.667 11.904 1.00 -0.15 H new ATOM 0 HD2 PHE A 56 -13.808 -6.329 10.049 1.00 -0.15 H new ATOM 0 HE1 PHE A 56 -9.631 -3.717 10.431 1.00 -0.15 H new ATOM 0 HE2 PHE A 56 -13.427 -4.388 8.575 1.00 -0.15 H new ATOM 0 HZ PHE A 56 -11.332 -3.088 8.754 1.00 -0.15 H new ATOM 285 N LEU A 57 -12.291 -9.945 11.607 1.00 -0.73 N ATOM 286 CA LEU A 57 -12.449 -11.355 11.249 1.00 0.36 C ATOM 287 C LEU A 57 -11.154 -11.741 10.486 1.00 0.57 C ATOM 288 O LEU A 57 -11.115 -12.413 9.466 1.00 -0.57 O ATOM 289 CB LEU A 57 -13.709 -11.603 10.418 1.00 0.00 C ATOM 290 CG LEU A 57 -15.049 -11.589 11.188 1.00 0.00 C ATOM 291 CD1 LEU A 57 -15.123 -12.684 12.252 1.00 0.00 C ATOM 292 CD2 LEU A 57 -15.383 -10.230 11.802 1.00 0.00 C ATOM 0 H LEU A 57 -12.715 -9.297 10.943 1.00 -0.73 H new ATOM 0 HA LEU A 57 -12.582 -11.975 12.136 1.00 0.36 H new ATOM 0 HB2 LEU A 57 -13.757 -10.847 9.634 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -13.608 -12.569 9.923 1.00 0.00 H new ATOM 0 HG LEU A 57 -15.806 -11.796 10.432 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -16.084 -12.630 12.763 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -15.019 -13.660 11.778 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -14.319 -12.544 12.975 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -16.336 -10.292 12.327 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -14.600 -9.946 12.504 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -15.452 -9.481 11.013 1.00 0.00 H new ATOM 304 N THR A 58 -10.014 -11.289 11.138 1.00 -0.73 N ATOM 305 CA THR A 58 -8.670 -11.751 10.771 1.00 0.36 C ATOM 306 C THR A 58 -7.700 -11.410 11.902 1.00 0.57 C ATOM 307 O THR A 58 -6.965 -12.226 12.447 1.00 -0.57 O ATOM 308 CB THR A 58 -8.250 -11.345 9.361 1.00 0.28 C ATOM 309 OG1 THR A 58 -8.551 -12.385 8.440 1.00 -0.68 O ATOM 310 CG2 THR A 58 -6.795 -10.964 9.219 1.00 0.00 C ATOM 0 H THR A 58 -10.030 -10.616 11.904 1.00 -0.73 H new ATOM 0 HA THR A 58 -8.662 -12.837 10.682 1.00 0.36 H new ATOM 0 HB THR A 58 -8.825 -10.445 9.141 1.00 0.28 H new ATOM 0 HG1 THR A 58 -9.517 -12.550 8.437 1.00 -0.68 H new ATOM 0 HG21 THR A 58 -6.590 -10.691 8.184 1.00 0.00 H new ATOM 0 HG22 THR A 58 -6.576 -10.116 9.868 1.00 0.00 H new ATOM 0 HG23 THR A 58 -6.168 -11.810 9.502 1.00 0.00 H new ATOM 318 N LEU A 59 -7.787 -10.100 12.277 1.00 -0.73 N ATOM 319 CA LEU A 59 -7.046 -9.564 13.411 1.00 0.36 C ATOM 320 C LEU A 59 -7.830 -9.612 14.734 1.00 0.57 C ATOM 321 O LEU A 59 -7.343 -9.172 15.777 1.00 -0.57 O ATOM 322 CB LEU A 59 -6.562 -8.128 13.174 1.00 0.00 C ATOM 323 CG LEU A 59 -5.067 -7.992 12.861 1.00 0.00 C ATOM 324 CD1 LEU A 59 -4.176 -8.501 13.993 1.00 0.00 C ATOM 325 CD2 LEU A 59 -4.710 -8.656 11.538 1.00 0.00 C ATOM 0 H LEU A 59 -8.368 -9.413 11.797 1.00 -0.73 H new ATOM 0 HA LEU A 59 -6.183 -10.224 13.501 1.00 0.36 H new ATOM 0 HB2 LEU A 59 -7.131 -7.700 12.349 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.788 -7.533 14.059 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.871 -6.924 12.766 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.129 -8.379 13.715 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.379 -7.931 14.900 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.383 -9.556 14.173 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.643 -8.540 11.349 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.957 -9.717 11.585 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.274 -8.188 10.732 1.00 0.00 H new ATOM 337 N TYR A 60 -8.974 -10.420 14.752 1.00 -0.73 N ATOM 338 CA TYR A 60 -9.290 -10.949 16.073 1.00 0.36 C ATOM 339 C TYR A 60 -8.088 -11.836 16.388 1.00 0.57 C ATOM 340 O TYR A 60 -7.723 -12.093 17.526 1.00 -0.57 O ATOM 341 CB TYR A 60 -10.443 -11.959 16.138 1.00 0.14 C ATOM 342 CG TYR A 60 -11.632 -11.514 16.925 1.00 -0.14 C ATOM 343 CD1 TYR A 60 -11.470 -11.236 18.276 1.00 -0.15 C ATOM 344 CD2 TYR A 60 -12.908 -11.433 16.345 1.00 -0.15 C ATOM 345 CE1 TYR A 60 -12.573 -10.898 19.040 1.00 -0.15 C ATOM 346 CE2 TYR A 60 -14.015 -11.079 17.117 1.00 -0.15 C ATOM 347 CZ TYR A 60 -13.835 -10.815 18.467 1.00 0.08 C ATOM 348 OH TYR A 60 -14.875 -10.468 19.274 1.00 -0.53 O ATOM 0 H TYR A 60 -9.584 -10.667 13.973 1.00 -0.73 H new ATOM 0 HA TYR A 60 -9.535 -10.099 16.710 1.00 0.36 H new ATOM 0 HB2 TYR A 60 -10.764 -12.186 15.121 1.00 0.14 H new ATOM 0 HB3 TYR A 60 -10.068 -12.887 16.569 1.00 0.14 H new ATOM 0 HD1 TYR A 60 -10.490 -11.283 18.727 1.00 -0.15 H new ATOM 0 HD2 TYR A 60 -13.034 -11.646 15.294 1.00 -0.15 H new ATOM 0 HE1 TYR A 60 -12.451 -10.696 20.094 1.00 -0.15 H new ATOM 0 HE2 TYR A 60 -14.996 -11.012 16.671 1.00 -0.15 H new ATOM 0 HH TYR A 60 -15.702 -10.445 18.749 1.00 -0.53 H new ATOM 358 N VAL A 61 -7.590 -12.549 15.319 1.00 -0.73 N ATOM 359 CA VAL A 61 -7.324 -13.973 15.430 1.00 0.36 C ATOM 360 C VAL A 61 -5.858 -14.310 15.212 1.00 0.57 C ATOM 361 O VAL A 61 -5.448 -15.421 14.880 1.00 -0.57 O ATOM 362 CB VAL A 61 -8.483 -14.793 14.882 1.00 0.00 C ATOM 363 CG1 VAL A 61 -8.848 -14.508 13.431 1.00 0.00 C ATOM 364 CG2 VAL A 61 -8.364 -16.297 15.074 1.00 0.00 C ATOM 0 H VAL A 61 -7.380 -12.145 14.406 1.00 -0.73 H new ATOM 0 HA VAL A 61 -7.359 -14.359 16.449 1.00 0.36 H new ATOM 0 HB VAL A 61 -9.296 -14.437 15.514 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -9.684 -15.142 13.135 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -9.131 -13.461 13.326 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -7.990 -14.717 12.792 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -9.239 -16.788 14.649 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -7.466 -16.658 14.572 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -8.301 -16.524 16.138 1.00 0.00 H new ATOM 374 N THR A 62 -5.084 -13.339 15.873 1.00 -0.73 N ATOM 375 CA THR A 62 -4.237 -13.751 17.028 1.00 0.36 C ATOM 376 C THR A 62 -4.219 -12.846 18.301 1.00 0.57 C ATOM 377 O THR A 62 -3.358 -12.953 19.172 1.00 -0.57 O ATOM 378 CB THR A 62 -2.831 -14.058 16.555 1.00 0.28 C ATOM 379 OG1 THR A 62 -2.906 -15.062 15.540 1.00 -0.68 O ATOM 380 CG2 THR A 62 -1.743 -14.460 17.537 1.00 0.00 C ATOM 0 H THR A 62 -5.047 -12.349 15.629 1.00 -0.73 H new ATOM 0 HA THR A 62 -4.743 -14.642 17.399 1.00 0.36 H new ATOM 0 HB THR A 62 -2.490 -13.073 16.235 1.00 0.28 H new ATOM 0 HG1 THR A 62 -3.794 -15.477 15.555 1.00 -0.68 H new ATOM 0 HG21 THR A 62 -0.812 -14.636 16.997 1.00 0.00 H new ATOM 0 HG22 THR A 62 -1.596 -13.661 18.264 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.039 -15.372 18.055 1.00 0.00 H new ATOM 388 N VAL A 63 -5.385 -12.179 18.568 1.00 -0.73 N ATOM 389 CA VAL A 63 -5.824 -11.825 19.924 1.00 0.36 C ATOM 390 C VAL A 63 -7.153 -12.526 20.347 1.00 0.57 C ATOM 391 O VAL A 63 -7.699 -12.298 21.422 1.00 -0.57 O ATOM 392 CB VAL A 63 -5.843 -10.316 20.235 1.00 0.00 C ATOM 393 CG1 VAL A 63 -4.434 -9.721 20.197 1.00 0.00 C ATOM 394 CG2 VAL A 63 -6.777 -9.530 19.315 1.00 0.00 C ATOM 0 H VAL A 63 -6.033 -11.880 17.839 1.00 -0.73 H new ATOM 0 HA VAL A 63 -5.033 -12.230 20.555 1.00 0.36 H new ATOM 0 HB VAL A 63 -6.237 -10.223 21.247 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -4.483 -8.655 20.421 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -3.809 -10.219 20.938 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -4.005 -9.864 19.205 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -6.747 -8.474 19.583 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -6.455 -9.651 18.281 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -7.795 -9.904 19.425 1.00 0.00 H new ATOM 404 N GLN A 64 -7.530 -13.594 19.528 1.00 -0.73 N ATOM 405 CA GLN A 64 -8.909 -14.147 19.649 1.00 0.36 C ATOM 406 C GLN A 64 -9.008 -14.883 21.000 1.00 0.57 C ATOM 407 O GLN A 64 -9.993 -14.879 21.720 1.00 -0.57 O ATOM 408 CB GLN A 64 -9.155 -15.115 18.488 1.00 0.00 C ATOM 409 CG GLN A 64 -10.627 -15.508 18.333 1.00 0.06 C ATOM 410 CD GLN A 64 -10.982 -16.728 19.151 1.00 0.57 C ATOM 411 OE1 GLN A 64 -10.137 -17.514 19.574 1.00 -0.57 O ATOM 412 NE2 GLN A 64 -12.315 -16.925 19.330 1.00 -0.80 N ATOM 0 H GLN A 64 -6.933 -14.044 18.834 1.00 -0.73 H new ATOM 0 HA GLN A 64 -9.658 -13.357 19.609 1.00 0.36 H new ATOM 0 HB2 GLN A 64 -8.808 -14.657 17.562 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -8.559 -16.015 18.641 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -11.258 -14.673 18.637 1.00 0.06 H new ATOM 0 HG3 GLN A 64 -10.840 -15.703 17.282 1.00 0.06 H new ATOM 0 HE21 GLN A 64 -12.984 -16.248 18.963 1.00 -0.80 H new ATOM 0 HE22 GLN A 64 -12.646 -17.749 19.831 1.00 -0.80 H new ATOM 421 N HIS A 65 -7.892 -15.670 21.218 1.00 -0.73 N ATOM 422 CA HIS A 65 -7.511 -16.182 22.540 1.00 0.36 C ATOM 423 C HIS A 65 -6.179 -15.505 22.968 1.00 0.57 C ATOM 424 O HIS A 65 -5.655 -15.704 24.058 1.00 -0.57 O ATOM 425 CB HIS A 65 -7.221 -17.695 22.457 1.00 0.18 C ATOM 426 CG HIS A 65 -8.380 -18.565 22.777 1.00 -0.33 C ATOM 427 ND1 HIS A 65 -9.556 -18.584 22.062 1.00 0.03 N ATOM 428 CD2 HIS A 65 -8.559 -19.517 23.759 1.00 0.08 C ATOM 429 CE1 HIS A 65 -10.358 -19.543 22.613 1.00 0.04 C ATOM 430 NE2 HIS A 65 -9.771 -20.135 23.626 1.00 -0.57 N ATOM 0 H HIS A 65 -7.254 -15.950 20.473 1.00 -0.73 H new ATOM 0 HA HIS A 65 -8.321 -15.979 23.240 1.00 0.36 H new ATOM 0 HB2 HIS A 65 -6.874 -17.930 21.451 1.00 0.18 H new ATOM 0 HB3 HIS A 65 -6.405 -17.933 23.140 1.00 0.18 H new ATOM 0 HD1 HIS A 65 -9.787 -17.990 21.266 1.00 0.03 H new ATOM 0 HD2 HIS A 65 -7.838 -19.744 24.530 1.00 0.08 H new ATOM 0 HE1 HIS A 65 -11.350 -19.783 22.259 1.00 0.04 H new ATOM 438 N LYS A 66 -5.503 -14.847 21.944 1.00 -0.73 N ATOM 439 CA LYS A 66 -4.043 -14.700 21.899 1.00 0.36 C ATOM 440 C LYS A 66 -3.465 -16.036 21.400 1.00 0.57 C ATOM 441 O LYS A 66 -2.300 -16.386 21.543 1.00 -0.57 O ATOM 442 CB LYS A 66 -3.396 -14.098 23.148 1.00 0.00 C ATOM 443 CG LYS A 66 -4.073 -12.777 23.557 1.00 0.00 C ATOM 444 CD LYS A 66 -3.576 -12.259 24.911 1.00 0.00 C ATOM 445 CE LYS A 66 -4.218 -10.935 25.327 1.00 0.50 C ATOM 446 NZ LYS A 66 -5.665 -11.104 25.610 1.00 -0.85 N ATOM 0 H LYS A 66 -5.979 -14.419 21.150 1.00 -0.73 H new ATOM 0 HA LYS A 66 -3.776 -13.918 21.188 1.00 0.36 H new ATOM 0 HB2 LYS A 66 -3.460 -14.810 23.971 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -2.337 -13.922 22.961 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -3.885 -12.024 22.792 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -5.152 -12.924 23.601 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.779 -13.009 25.675 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.494 -12.132 24.868 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -3.715 -10.547 26.212 1.00 0.50 H new ATOM 0 HE3 LYS A 66 -4.084 -10.198 24.535 1.00 0.50 H new ATOM 0 HZ1 LYS A 66 -6.059 -10.205 25.955 1.00 -0.85 H new ATOM 0 HZ2 LYS A 66 -6.158 -11.387 24.739 1.00 -0.85 H new ATOM 0 HZ3 LYS A 66 -5.793 -11.839 26.335 1.00 -0.85 H new ATOM 460 N LYS A 67 -4.402 -16.736 20.658 1.00 -0.73 N ATOM 461 CA LYS A 67 -4.286 -18.077 20.122 1.00 0.36 C ATOM 462 C LYS A 67 -3.774 -19.031 21.224 1.00 0.57 C ATOM 463 O LYS A 67 -3.429 -18.648 22.342 1.00 -0.57 O ATOM 464 CB LYS A 67 -3.498 -18.134 18.791 1.00 0.00 C ATOM 465 CG LYS A 67 -4.127 -17.189 17.762 1.00 0.00 C ATOM 466 CD LYS A 67 -5.624 -17.359 17.452 1.00 0.00 C ATOM 467 CE LYS A 67 -5.971 -18.461 16.455 1.00 0.50 C ATOM 468 NZ LYS A 67 -5.460 -18.118 15.114 1.00 -0.85 N ATOM 0 H LYS A 67 -5.302 -16.317 20.425 1.00 -0.73 H new ATOM 0 HA LYS A 67 -5.275 -18.430 19.831 1.00 0.36 H new ATOM 0 HB2 LYS A 67 -2.458 -17.855 18.963 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -3.495 -19.153 18.405 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -3.970 -16.167 18.107 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -3.577 -17.298 16.827 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.149 -17.560 18.386 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.007 -16.413 17.068 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -5.541 -19.407 16.784 1.00 0.50 H new ATOM 0 HE3 LYS A 67 -7.052 -18.598 16.416 1.00 0.50 H new ATOM 0 HZ1 LYS A 67 -6.096 -18.509 14.390 1.00 -0.85 H new ATOM 0 HZ2 LYS A 67 -5.415 -17.084 15.014 1.00 -0.85 H new ATOM 0 HZ3 LYS A 67 -4.508 -18.519 14.992 1.00 -0.85 H new ATOM 482 N LEU A 68 -3.565 -20.332 20.835 1.00 -0.73 N ATOM 483 CA LEU A 68 -2.316 -20.954 21.281 1.00 0.36 C ATOM 484 C LEU A 68 -1.296 -20.426 20.239 1.00 0.57 C ATOM 485 O LEU A 68 -1.010 -21.058 19.214 1.00 -0.57 O ATOM 486 CB LEU A 68 -2.432 -22.480 21.269 1.00 0.00 C ATOM 487 CG LEU A 68 -1.146 -23.230 21.676 1.00 0.00 C ATOM 488 CD1 LEU A 68 -0.676 -22.870 23.085 1.00 0.00 C ATOM 489 CD2 LEU A 68 -1.377 -24.740 21.575 1.00 0.00 C ATOM 0 H LEU A 68 -4.190 -20.906 20.269 1.00 -0.73 H new ATOM 0 HA LEU A 68 -2.034 -20.712 22.306 1.00 0.36 H new ATOM 0 HB2 LEU A 68 -3.236 -22.775 21.943 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -2.721 -22.800 20.268 1.00 0.00 H new ATOM 0 HG LEU A 68 -0.359 -22.922 20.987 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.232 -23.426 23.319 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.470 -21.801 23.138 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -1.454 -23.126 23.804 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.467 -25.267 21.863 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -2.190 -25.029 22.241 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.638 -25.000 20.549 1.00 0.00 H new ATOM 501 N ARG A 69 -0.906 -19.106 20.416 1.00 -0.73 N ATOM 502 CA ARG A 69 0.213 -18.537 19.660 1.00 0.36 C ATOM 503 C ARG A 69 1.490 -19.143 20.263 1.00 0.57 C ATOM 504 O ARG A 69 1.519 -19.571 21.419 1.00 -0.57 O ATOM 505 CB ARG A 69 0.136 -16.996 19.541 1.00 0.00 C ATOM 506 CG ARG A 69 1.111 -16.102 20.331 1.00 0.00 C ATOM 507 CD ARG A 69 1.302 -16.365 21.828 1.00 0.33 C ATOM 508 NE ARG A 69 0.044 -16.727 22.461 1.00 -0.84 N ATOM 509 CZ ARG A 69 -0.117 -17.498 23.540 1.00 1.20 C ATOM 510 NH1 ARG A 69 0.888 -17.833 24.343 1.00 -0.97 N ATOM 511 NH2 ARG A 69 -1.341 -17.963 23.785 1.00 -0.97 N ATOM 0 H ARG A 69 -1.355 -18.458 21.063 1.00 -0.73 H new ATOM 0 HA ARG A 69 0.191 -18.808 18.604 1.00 0.36 H new ATOM 0 HB2 ARG A 69 0.255 -16.748 18.486 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.874 -16.701 19.826 1.00 0.00 H new ATOM 0 HG2 ARG A 69 2.089 -16.178 19.855 1.00 0.00 H new ATOM 0 HG3 ARG A 69 0.780 -15.070 20.216 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.028 -17.166 21.970 1.00 0.33 H new ATOM 0 HD3 ARG A 69 1.711 -15.476 22.307 1.00 0.33 H new ATOM 0 HE ARG A 69 -0.805 -16.353 22.037 1.00 -0.84 H new ATOM 0 HH11 ARG A 69 1.831 -17.498 24.146 1.00 -0.97 H new ATOM 0 HH12 ARG A 69 0.716 -18.425 25.156 1.00 -0.97 H new ATOM 0 HH21 ARG A 69 -2.111 -17.727 23.159 1.00 -0.97 H new ATOM 0 HH22 ARG A 69 -1.508 -18.555 24.598 1.00 -0.97 H new ATOM 525 N THR A 70 2.586 -19.220 19.474 1.00 -0.73 N ATOM 526 CA THR A 70 2.810 -18.602 18.174 1.00 0.36 C ATOM 527 C THR A 70 2.497 -19.557 16.992 1.00 0.57 C ATOM 528 O THR A 70 1.455 -19.392 16.343 1.00 -0.57 O ATOM 529 CB THR A 70 4.273 -18.094 18.121 1.00 0.28 C ATOM 530 OG1 THR A 70 5.044 -18.793 19.114 1.00 -0.68 O ATOM 531 CG2 THR A 70 4.399 -16.604 18.410 1.00 0.00 C ATOM 0 H THR A 70 3.397 -19.765 19.767 1.00 -0.73 H new ATOM 0 HA THR A 70 2.119 -17.766 18.061 1.00 0.36 H new ATOM 0 HB THR A 70 4.633 -18.276 17.109 1.00 0.28 H new ATOM 0 HG1 THR A 70 5.972 -18.480 19.088 1.00 -0.68 H new ATOM 0 HG21 THR A 70 5.447 -16.311 18.358 1.00 0.00 H new ATOM 0 HG22 THR A 70 3.827 -16.041 17.672 1.00 0.00 H new ATOM 0 HG23 THR A 70 4.012 -16.393 19.407 1.00 0.00 H new ATOM 539 N PRO A 71 3.364 -20.617 16.717 1.00 -0.66 N ATOM 540 CA PRO A 71 3.280 -21.252 15.386 1.00 0.36 C ATOM 541 C PRO A 71 3.157 -20.440 14.084 1.00 0.57 C ATOM 542 O PRO A 71 3.316 -19.227 14.009 1.00 -0.57 O ATOM 543 CB PRO A 71 2.077 -22.171 15.590 1.00 0.00 C ATOM 544 CG PRO A 71 2.481 -22.850 16.892 1.00 0.00 C ATOM 545 CD PRO A 71 3.256 -21.744 17.657 1.00 0.30 C ATOM 0 HA PRO A 71 4.256 -21.680 15.159 1.00 0.36 H new ATOM 0 HB2 PRO A 71 1.141 -21.619 15.681 1.00 0.00 H new ATOM 0 HB3 PRO A 71 1.951 -22.880 14.772 1.00 0.00 H new ATOM 0 HG2 PRO A 71 1.611 -23.191 17.453 1.00 0.00 H new ATOM 0 HG3 PRO A 71 3.106 -23.725 16.711 1.00 0.00 H new ATOM 0 HD2 PRO A 71 2.727 -21.450 18.563 1.00 0.30 H new ATOM 0 HD3 PRO A 71 4.241 -22.095 17.963 1.00 0.30 H new ATOM 553 N LEU A 72 2.607 -21.147 13.038 1.00 -0.73 N ATOM 554 CA LEU A 72 1.930 -20.556 11.883 1.00 0.36 C ATOM 555 C LEU A 72 0.530 -20.033 12.312 1.00 0.57 C ATOM 556 O LEU A 72 -0.406 -19.899 11.524 1.00 -0.57 O ATOM 557 CB LEU A 72 1.685 -21.712 10.906 1.00 0.00 C ATOM 558 CG LEU A 72 0.643 -21.502 9.791 1.00 0.00 C ATOM 559 CD1 LEU A 72 0.723 -20.126 9.162 1.00 0.00 C ATOM 560 CD2 LEU A 72 0.815 -22.570 8.712 1.00 0.00 C ATOM 0 H LEU A 72 2.636 -22.166 12.998 1.00 -0.73 H new ATOM 0 HA LEU A 72 2.521 -19.744 11.460 1.00 0.36 H new ATOM 0 HB2 LEU A 72 2.636 -21.958 10.434 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.383 -22.583 11.487 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.340 -21.587 10.255 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.035 -20.037 8.384 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.551 -19.367 9.925 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.711 -19.983 8.724 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.075 -22.416 7.926 1.00 0.00 H new ATOM 0 HD22 LEU A 72 1.816 -22.500 8.287 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.677 -23.558 9.152 1.00 0.00 H new ATOM 572 N ASN A 73 0.440 -19.477 13.595 1.00 -0.73 N ATOM 573 CA ASN A 73 -0.112 -18.136 13.662 1.00 0.36 C ATOM 574 C ASN A 73 0.634 -17.076 14.480 1.00 0.57 C ATOM 575 O ASN A 73 0.151 -16.016 14.878 1.00 -0.57 O ATOM 576 CB ASN A 73 -1.602 -18.117 13.908 1.00 0.06 C ATOM 577 CG ASN A 73 -2.008 -18.815 15.190 1.00 0.57 C ATOM 578 OD1 ASN A 73 -3.151 -19.249 15.371 1.00 -0.57 O ATOM 579 ND2 ASN A 73 -1.128 -18.897 16.218 1.00 -0.80 N ATOM 0 H ASN A 73 0.719 -19.912 14.474 1.00 -0.73 H new ATOM 0 HA ASN A 73 0.075 -17.793 12.645 1.00 0.36 H new ATOM 0 HB2 ASN A 73 -1.944 -17.083 13.942 1.00 0.06 H new ATOM 0 HB3 ASN A 73 -2.108 -18.593 13.068 1.00 0.06 H new ATOM 0 HD21 ASN A 73 -1.418 -19.307 17.106 1.00 -0.80 H new ATOM 0 HD22 ASN A 73 -0.176 -18.549 16.104 1.00 -0.80 H new ATOM 586 N TYR A 74 2.001 -17.285 14.448 1.00 -0.73 N ATOM 587 CA TYR A 74 2.826 -16.130 14.666 1.00 0.36 C ATOM 588 C TYR A 74 2.533 -15.079 13.639 1.00 0.57 C ATOM 589 O TYR A 74 2.736 -13.890 13.837 1.00 -0.57 O ATOM 590 CB TYR A 74 4.293 -16.328 14.898 1.00 0.14 C ATOM 591 CG TYR A 74 5.177 -16.560 13.743 1.00 -0.14 C ATOM 592 CD1 TYR A 74 5.302 -15.470 12.916 1.00 -0.15 C ATOM 593 CD2 TYR A 74 5.947 -17.686 13.503 1.00 -0.15 C ATOM 594 CE1 TYR A 74 6.109 -15.485 11.830 1.00 -0.15 C ATOM 595 CE2 TYR A 74 6.813 -17.687 12.408 1.00 -0.15 C ATOM 596 CZ TYR A 74 6.907 -16.573 11.583 1.00 0.08 C ATOM 597 OH TYR A 74 7.787 -16.598 10.556 1.00 -0.53 O ATOM 0 H TYR A 74 2.479 -18.171 14.286 1.00 -0.73 H new ATOM 0 HA TYR A 74 2.523 -15.789 15.656 1.00 0.36 H new ATOM 0 HB2 TYR A 74 4.664 -15.448 15.424 1.00 0.14 H new ATOM 0 HB3 TYR A 74 4.407 -17.175 15.574 1.00 0.14 H new ATOM 0 HD1 TYR A 74 4.740 -14.575 13.139 1.00 -0.15 H new ATOM 0 HD2 TYR A 74 5.879 -18.547 14.151 1.00 -0.15 H new ATOM 0 HE1 TYR A 74 6.125 -14.640 11.157 1.00 -0.15 H new ATOM 0 HE2 TYR A 74 7.414 -18.560 12.201 1.00 -0.15 H new ATOM 0 HH TYR A 74 8.687 -16.403 10.892 1.00 -0.53 H new ATOM 607 N ILE A 75 1.996 -15.584 12.494 1.00 -0.73 N ATOM 608 CA ILE A 75 1.798 -14.644 11.413 1.00 0.36 C ATOM 609 C ILE A 75 0.861 -13.504 11.791 1.00 0.57 C ATOM 610 O ILE A 75 0.996 -12.398 11.278 1.00 -0.57 O ATOM 611 CB ILE A 75 1.351 -15.261 10.091 1.00 0.00 C ATOM 612 CG1 ILE A 75 0.131 -16.186 10.221 1.00 0.00 C ATOM 613 CG2 ILE A 75 2.505 -15.992 9.427 1.00 0.00 C ATOM 614 CD1 ILE A 75 -0.605 -16.351 8.901 1.00 0.00 C ATOM 0 H ILE A 75 1.721 -16.551 12.323 1.00 -0.73 H new ATOM 0 HA ILE A 75 2.799 -14.247 11.245 1.00 0.36 H new ATOM 0 HB ILE A 75 1.034 -14.429 9.462 1.00 0.00 H new ATOM 0 HG12 ILE A 75 0.454 -17.163 10.580 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.552 -15.782 10.968 1.00 0.00 H new ATOM 0 HG21 ILE A 75 2.168 -16.426 8.486 1.00 0.00 H new ATOM 0 HG22 ILE A 75 3.317 -15.291 9.233 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.860 -16.785 10.085 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.460 -17.013 9.041 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -0.953 -15.378 8.554 1.00 0.00 H new ATOM 0 HD13 ILE A 75 0.069 -16.781 8.160 1.00 0.00 H new ATOM 626 N LEU A 76 -0.086 -13.765 12.743 1.00 -0.73 N ATOM 627 CA LEU A 76 -0.911 -12.652 13.207 1.00 0.36 C ATOM 628 C LEU A 76 -0.465 -12.190 14.617 1.00 0.57 C ATOM 629 O LEU A 76 -1.175 -11.519 15.358 1.00 -0.57 O ATOM 630 CB LEU A 76 -2.406 -12.958 13.081 1.00 0.00 C ATOM 631 CG LEU A 76 -3.055 -12.768 11.690 1.00 0.00 C ATOM 632 CD1 LEU A 76 -2.707 -11.435 11.039 1.00 0.00 C ATOM 633 CD2 LEU A 76 -2.742 -13.906 10.725 1.00 0.00 C ATOM 0 H LEU A 76 -0.275 -14.674 13.166 1.00 -0.73 H new ATOM 0 HA LEU A 76 -0.751 -11.797 12.550 1.00 0.36 H new ATOM 0 HB2 LEU A 76 -2.566 -13.991 13.389 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.940 -12.327 13.791 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.126 -12.775 11.892 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -3.195 -11.367 10.067 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.050 -10.619 11.675 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -1.627 -11.364 10.909 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.226 -13.714 9.767 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.664 -13.974 10.580 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.113 -14.845 11.137 1.00 0.00 H new ATOM 645 N LEU A 77 0.854 -12.457 14.923 1.00 -0.73 N ATOM 646 CA LEU A 77 1.573 -11.835 16.052 1.00 0.36 C ATOM 647 C LEU A 77 2.719 -10.957 15.517 1.00 0.57 C ATOM 648 O LEU A 77 3.217 -10.030 16.136 1.00 -0.57 O ATOM 649 CB LEU A 77 2.070 -12.938 16.994 1.00 0.00 C ATOM 650 CG LEU A 77 2.474 -12.553 18.431 1.00 0.00 C ATOM 651 CD1 LEU A 77 3.905 -12.027 18.542 1.00 0.00 C ATOM 652 CD2 LEU A 77 1.490 -11.600 19.104 1.00 0.00 C ATOM 0 H LEU A 77 1.427 -13.108 14.386 1.00 -0.73 H new ATOM 0 HA LEU A 77 0.909 -11.184 16.621 1.00 0.36 H new ATOM 0 HB2 LEU A 77 1.287 -13.694 17.061 1.00 0.00 H new ATOM 0 HB3 LEU A 77 2.931 -13.412 16.524 1.00 0.00 H new ATOM 0 HG LEU A 77 2.436 -13.494 18.979 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.121 -11.776 19.580 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.602 -12.793 18.202 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.014 -11.136 17.923 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.836 -11.371 20.112 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.423 -10.678 18.526 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.507 -12.069 19.156 1.00 0.00 H new ATOM 664 N ASN A 78 3.136 -11.350 14.272 1.00 -0.73 N ATOM 665 CA ASN A 78 4.129 -10.627 13.491 1.00 0.36 C ATOM 666 C ASN A 78 3.248 -9.590 12.835 1.00 0.57 C ATOM 667 O ASN A 78 3.307 -8.394 13.103 1.00 -0.57 O ATOM 668 CB ASN A 78 4.777 -11.464 12.406 1.00 0.06 C ATOM 669 CG ASN A 78 6.092 -12.050 12.828 1.00 0.57 C ATOM 670 OD1 ASN A 78 7.036 -12.202 12.061 1.00 -0.57 O ATOM 671 ND2 ASN A 78 6.127 -12.512 14.112 1.00 -0.80 N ATOM 0 H ASN A 78 2.777 -12.182 13.803 1.00 -0.73 H new ATOM 0 HA ASN A 78 4.959 -10.268 14.099 1.00 0.36 H new ATOM 0 HB2 ASN A 78 4.100 -12.270 12.123 1.00 0.06 H new ATOM 0 HB3 ASN A 78 4.927 -10.848 11.520 1.00 0.06 H new ATOM 0 HD21 ASN A 78 6.955 -12.999 14.456 1.00 -0.80 H new ATOM 0 HD22 ASN A 78 5.326 -12.370 14.727 1.00 -0.80 H new ATOM 678 N LEU A 79 2.210 -10.133 12.086 1.00 -0.73 N ATOM 679 CA LEU A 79 1.222 -9.243 11.504 1.00 0.36 C ATOM 680 C LEU A 79 0.064 -8.927 12.491 1.00 0.57 C ATOM 681 O LEU A 79 -1.019 -8.498 12.112 1.00 -0.57 O ATOM 682 CB LEU A 79 0.843 -9.604 10.066 1.00 0.00 C ATOM 683 CG LEU A 79 2.094 -9.602 9.149 1.00 0.00 C ATOM 684 CD1 LEU A 79 2.436 -11.000 8.635 1.00 0.00 C ATOM 685 CD2 LEU A 79 1.940 -8.608 8.001 1.00 0.00 C ATOM 0 H LEU A 79 2.073 -11.127 11.901 1.00 -0.73 H new ATOM 0 HA LEU A 79 1.692 -8.270 11.359 1.00 0.36 H new ATOM 0 HB2 LEU A 79 0.373 -10.587 10.045 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.109 -8.892 9.689 1.00 0.00 H new ATOM 0 HG LEU A 79 2.935 -9.276 9.761 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.319 -10.947 7.998 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.637 -11.659 9.480 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.597 -11.392 8.061 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.834 -8.631 7.377 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.071 -8.877 7.400 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.805 -7.604 8.404 1.00 0.00 H new ATOM 697 N ALA A 80 0.439 -8.871 13.834 1.00 -0.73 N ATOM 698 CA ALA A 80 -0.174 -7.909 14.758 1.00 0.36 C ATOM 699 C ALA A 80 0.639 -6.623 14.900 1.00 0.57 C ATOM 700 O ALA A 80 0.147 -5.501 14.913 1.00 -0.57 O ATOM 701 CB ALA A 80 -0.432 -8.472 16.140 1.00 0.00 C ATOM 0 H ALA A 80 1.144 -9.475 14.257 1.00 -0.73 H new ATOM 0 HA ALA A 80 -1.134 -7.681 14.295 1.00 0.36 H new ATOM 0 HB1 ALA A 80 -0.886 -7.704 16.767 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -1.107 -9.325 16.065 1.00 0.00 H new ATOM 0 HB3 ALA A 80 0.510 -8.793 16.584 1.00 0.00 H new ATOM 707 N VAL A 81 1.980 -6.821 15.055 1.00 -0.73 N ATOM 708 CA VAL A 81 2.874 -5.664 15.068 1.00 0.36 C ATOM 709 C VAL A 81 3.233 -5.163 13.655 1.00 0.57 C ATOM 710 O VAL A 81 4.140 -4.376 13.407 1.00 -0.57 O ATOM 711 CB VAL A 81 4.151 -5.900 15.871 1.00 0.00 C ATOM 712 CG1 VAL A 81 3.858 -6.068 17.358 1.00 0.00 C ATOM 713 CG2 VAL A 81 5.027 -7.046 15.365 1.00 0.00 C ATOM 0 H VAL A 81 2.432 -7.729 15.166 1.00 -0.73 H new ATOM 0 HA VAL A 81 2.300 -4.885 15.569 1.00 0.36 H new ATOM 0 HB VAL A 81 4.737 -4.993 15.719 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.791 -6.234 17.896 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.375 -5.167 17.738 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.198 -6.923 17.504 1.00 0.00 H new ATOM 0 HG21 VAL A 81 5.910 -7.136 15.998 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.461 -7.977 15.396 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.335 -6.843 14.340 1.00 0.00 H new ATOM 723 N ALA A 82 2.340 -5.617 12.707 1.00 -0.73 N ATOM 724 CA ALA A 82 2.603 -5.343 11.316 1.00 0.36 C ATOM 725 C ALA A 82 1.397 -5.360 10.396 1.00 0.57 C ATOM 726 O ALA A 82 1.416 -4.806 9.304 1.00 -0.57 O ATOM 727 CB ALA A 82 3.698 -6.232 10.794 1.00 0.00 C ATOM 0 H ALA A 82 1.488 -6.143 12.902 1.00 -0.73 H new ATOM 0 HA ALA A 82 2.930 -4.303 11.301 1.00 0.36 H new ATOM 0 HB1 ALA A 82 3.879 -6.007 9.743 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.610 -6.059 11.364 1.00 0.00 H new ATOM 0 HB3 ALA A 82 3.399 -7.275 10.896 1.00 0.00 H new ATOM 733 N ASP A 83 0.315 -6.027 10.904 1.00 -0.73 N ATOM 734 CA ASP A 83 -1.036 -5.731 10.394 1.00 0.36 C ATOM 735 C ASP A 83 -2.100 -5.662 11.509 1.00 0.57 C ATOM 736 O ASP A 83 -3.308 -5.757 11.325 1.00 -0.57 O ATOM 737 CB ASP A 83 -1.461 -6.535 9.176 1.00 -0.11 C ATOM 738 CG ASP A 83 -2.448 -5.765 8.292 1.00 0.91 C ATOM 739 OD1 ASP A 83 -2.705 -4.566 8.603 1.00 -0.90 O ATOM 740 OD2 ASP A 83 -2.886 -6.406 7.290 1.00 -0.90 O ATOM 0 H ASP A 83 0.359 -6.739 11.633 1.00 -0.73 H new ATOM 0 HA ASP A 83 -0.958 -4.718 9.999 1.00 0.36 H new ATOM 0 HB2 ASP A 83 -0.580 -6.798 8.591 1.00 -0.11 H new ATOM 0 HB3 ASP A 83 -1.919 -7.469 9.501 1.00 -0.11 H new ATOM 745 N LEU A 84 -1.580 -5.203 12.720 1.00 -0.73 N ATOM 746 CA LEU A 84 -2.332 -4.168 13.444 1.00 0.36 C ATOM 747 C LEU A 84 -1.608 -2.836 13.283 1.00 0.57 C ATOM 748 O LEU A 84 -2.155 -1.738 13.181 1.00 -0.57 O ATOM 749 CB LEU A 84 -2.677 -4.556 14.880 1.00 0.00 C ATOM 750 CG LEU A 84 -3.770 -3.673 15.521 1.00 0.00 C ATOM 751 CD1 LEU A 84 -4.647 -4.518 16.449 1.00 0.00 C ATOM 752 CD2 LEU A 84 -3.166 -2.515 16.320 1.00 0.00 C ATOM 0 H LEU A 84 -0.716 -5.521 13.158 1.00 -0.73 H new ATOM 0 HA LEU A 84 -3.321 -4.058 12.999 1.00 0.36 H new ATOM 0 HB2 LEU A 84 -3.007 -5.595 14.896 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.774 -4.499 15.488 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.371 -3.256 14.712 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.415 -3.888 16.897 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.120 -5.315 15.876 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.031 -4.953 17.236 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.966 -1.917 16.755 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.536 -2.912 17.116 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.565 -1.891 15.658 1.00 0.00 H new ATOM 764 N PHE A 85 -0.233 -2.938 13.258 1.00 -0.73 N ATOM 765 CA PHE A 85 0.497 -1.668 13.256 1.00 0.36 C ATOM 766 C PHE A 85 0.373 -0.955 11.887 1.00 0.57 C ATOM 767 O PHE A 85 0.543 0.249 11.725 1.00 -0.57 O ATOM 768 CB PHE A 85 1.948 -1.783 13.669 1.00 0.14 C ATOM 769 CG PHE A 85 2.248 -1.938 15.146 1.00 -0.14 C ATOM 770 CD1 PHE A 85 1.271 -2.086 16.140 1.00 -0.15 C ATOM 771 CD2 PHE A 85 3.596 -1.916 15.541 1.00 -0.15 C ATOM 772 CE1 PHE A 85 1.633 -2.201 17.485 1.00 -0.15 C ATOM 773 CE2 PHE A 85 3.957 -2.027 16.885 1.00 -0.15 C ATOM 774 CZ PHE A 85 2.974 -2.167 17.859 1.00 -0.15 C ATOM 0 H PHE A 85 0.320 -3.795 13.241 1.00 -0.73 H new ATOM 0 HA PHE A 85 0.018 -1.060 14.024 1.00 0.36 H new ATOM 0 HB2 PHE A 85 2.379 -2.638 13.147 1.00 0.14 H new ATOM 0 HB3 PHE A 85 2.470 -0.895 13.312 1.00 0.14 H new ATOM 0 HD1 PHE A 85 0.227 -2.111 15.864 1.00 -0.15 H new ATOM 0 HD2 PHE A 85 4.367 -1.811 14.792 1.00 -0.15 H new ATOM 0 HE1 PHE A 85 0.868 -2.317 18.239 1.00 -0.15 H new ATOM 0 HE2 PHE A 85 4.999 -2.004 17.168 1.00 -0.15 H new ATOM 0 HZ PHE A 85 3.249 -2.249 18.900 1.00 -0.15 H new ATOM 784 N MET A 86 -0.036 -1.787 10.878 1.00 -0.73 N ATOM 785 CA MET A 86 -0.487 -1.284 9.563 1.00 0.36 C ATOM 786 C MET A 86 -1.883 -0.568 9.604 1.00 0.57 C ATOM 787 O MET A 86 -2.373 0.033 8.648 1.00 -0.57 O ATOM 788 CB MET A 86 -0.221 -2.283 8.442 1.00 0.00 C ATOM 789 CG MET A 86 -0.924 -2.034 7.114 1.00 0.23 C ATOM 790 SD MET A 86 -0.004 -2.615 5.642 1.00 -0.46 S ATOM 791 CE MET A 86 0.164 -4.372 6.046 1.00 0.23 C ATOM 0 H MET A 86 -0.058 -2.803 10.962 1.00 -0.73 H new ATOM 0 HA MET A 86 0.151 -0.446 9.282 1.00 0.36 H new ATOM 0 HB2 MET A 86 0.853 -2.307 8.258 1.00 0.00 H new ATOM 0 HB3 MET A 86 -0.506 -3.274 8.796 1.00 0.00 H new ATOM 0 HG2 MET A 86 -1.897 -2.526 7.135 1.00 0.23 H new ATOM 0 HG3 MET A 86 -1.109 -0.965 7.011 1.00 0.23 H new ATOM 0 HE1 MET A 86 0.642 -4.892 5.216 1.00 0.23 H new ATOM 0 HE2 MET A 86 0.774 -4.482 6.943 1.00 0.23 H new ATOM 0 HE3 MET A 86 -0.822 -4.801 6.223 1.00 0.23 H new ATOM 801 N VAL A 87 -2.403 -0.439 10.865 1.00 -0.73 N ATOM 802 CA VAL A 87 -3.596 0.328 11.274 1.00 0.36 C ATOM 803 C VAL A 87 -3.269 1.482 12.243 1.00 0.57 C ATOM 804 O VAL A 87 -4.062 2.364 12.555 1.00 -0.57 O ATOM 805 CB VAL A 87 -4.725 -0.580 11.770 1.00 0.00 C ATOM 806 CG1 VAL A 87 -5.125 -0.413 13.240 1.00 0.00 C ATOM 807 CG2 VAL A 87 -5.959 -0.377 10.887 1.00 0.00 C ATOM 0 H VAL A 87 -1.964 -0.901 11.661 1.00 -0.73 H new ATOM 0 HA VAL A 87 -3.973 0.813 10.374 1.00 0.36 H new ATOM 0 HB VAL A 87 -4.325 -1.592 11.699 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -5.932 -1.106 13.478 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.266 -0.623 13.877 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -5.462 0.609 13.411 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -6.766 -1.021 11.236 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -6.277 0.664 10.940 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -5.714 -0.629 9.855 1.00 0.00 H new ATOM 817 N PHE A 88 -1.968 1.489 12.662 1.00 -0.73 N ATOM 818 CA PHE A 88 -1.436 2.536 13.504 1.00 0.36 C ATOM 819 C PHE A 88 -1.279 3.812 12.687 1.00 0.57 C ATOM 820 O PHE A 88 -1.627 4.894 13.159 1.00 -0.57 O ATOM 821 CB PHE A 88 -0.099 2.146 14.144 1.00 0.14 C ATOM 822 CG PHE A 88 0.256 2.994 15.345 1.00 -0.14 C ATOM 823 CD1 PHE A 88 -0.440 2.837 16.552 1.00 -0.15 C ATOM 824 CD2 PHE A 88 1.287 3.938 15.274 1.00 -0.15 C ATOM 825 CE1 PHE A 88 -0.115 3.618 17.661 1.00 -0.15 C ATOM 826 CE2 PHE A 88 1.611 4.717 16.386 1.00 -0.15 C ATOM 827 CZ PHE A 88 0.909 4.559 17.577 1.00 -0.15 C ATOM 0 H PHE A 88 -1.290 0.768 12.415 1.00 -0.73 H new ATOM 0 HA PHE A 88 -2.141 2.700 14.319 1.00 0.36 H new ATOM 0 HB2 PHE A 88 -0.139 1.099 14.445 1.00 0.14 H new ATOM 0 HB3 PHE A 88 0.692 2.233 13.399 1.00 0.14 H new ATOM 0 HD1 PHE A 88 -1.233 2.107 16.623 1.00 -0.15 H new ATOM 0 HD2 PHE A 88 1.836 4.065 14.352 1.00 -0.15 H new ATOM 0 HE1 PHE A 88 -0.658 3.493 18.586 1.00 -0.15 H new ATOM 0 HE2 PHE A 88 2.408 5.443 16.322 1.00 -0.15 H new ATOM 0 HZ PHE A 88 1.158 5.165 18.435 1.00 -0.15 H new ATOM 837 N GLY A 89 -0.679 3.872 11.462 1.00 -0.73 N ATOM 838 CA GLY A 89 -1.055 3.071 10.322 1.00 0.36 C ATOM 839 C GLY A 89 -2.448 3.519 9.914 1.00 0.57 C ATOM 840 O GLY A 89 -2.943 4.579 10.295 1.00 -0.57 O ATOM 0 H GLY A 89 0.097 4.504 11.265 1.00 -0.73 H new ATOM 0 HA2 GLY A 89 -0.349 3.208 9.503 1.00 0.36 H new ATOM 0 HA3 GLY A 89 -1.048 2.011 10.575 1.00 0.36 H new ATOM 844 N GLY A 90 -3.147 2.663 9.140 1.00 -0.73 N ATOM 845 CA GLY A 90 -4.267 3.084 8.334 1.00 0.36 C ATOM 846 C GLY A 90 -5.573 3.520 8.982 1.00 0.57 C ATOM 847 O GLY A 90 -6.571 3.793 8.328 1.00 -0.57 O ATOM 0 H GLY A 90 -2.936 1.667 9.070 1.00 -0.73 H new ATOM 0 HA2 GLY A 90 -3.923 3.914 7.717 1.00 0.36 H new ATOM 0 HA3 GLY A 90 -4.503 2.261 7.659 1.00 0.36 H new ATOM 851 N PHE A 91 -5.478 3.628 10.333 1.00 -0.73 N ATOM 852 CA PHE A 91 -6.340 4.455 11.149 1.00 0.36 C ATOM 853 C PHE A 91 -5.614 5.709 11.642 1.00 0.57 C ATOM 854 O PHE A 91 -5.965 6.864 11.405 1.00 -0.57 O ATOM 855 CB PHE A 91 -6.874 3.636 12.312 1.00 0.14 C ATOM 856 CG PHE A 91 -8.253 4.043 12.748 1.00 -0.14 C ATOM 857 CD1 PHE A 91 -9.385 3.561 12.080 1.00 -0.15 C ATOM 858 CD2 PHE A 91 -8.413 4.938 13.813 1.00 -0.15 C ATOM 859 CE1 PHE A 91 -10.659 3.960 12.483 1.00 -0.15 C ATOM 860 CE2 PHE A 91 -9.687 5.336 14.213 1.00 -0.15 C ATOM 861 CZ PHE A 91 -10.810 4.846 13.549 1.00 -0.15 C ATOM 0 H PHE A 91 -4.778 3.123 10.876 1.00 -0.73 H new ATOM 0 HA PHE A 91 -7.177 4.794 10.539 1.00 0.36 H new ATOM 0 HB2 PHE A 91 -6.887 2.583 12.029 1.00 0.14 H new ATOM 0 HB3 PHE A 91 -6.192 3.731 13.157 1.00 0.14 H new ATOM 0 HD1 PHE A 91 -9.271 2.879 11.251 1.00 -0.15 H new ATOM 0 HD2 PHE A 91 -7.544 5.322 14.327 1.00 -0.15 H new ATOM 0 HE1 PHE A 91 -11.530 3.582 11.969 1.00 -0.15 H new ATOM 0 HE2 PHE A 91 -9.804 6.024 15.037 1.00 -0.15 H new ATOM 0 HZ PHE A 91 -11.798 5.153 13.860 1.00 -0.15 H new ATOM 871 N THR A 92 -4.553 5.442 12.471 1.00 -0.73 N ATOM 872 CA THR A 92 -4.333 6.382 13.561 1.00 0.36 C ATOM 873 C THR A 92 -3.242 7.387 13.259 1.00 0.57 C ATOM 874 O THR A 92 -3.052 8.375 13.948 1.00 -0.57 O ATOM 875 CB THR A 92 -4.046 5.724 14.903 1.00 0.28 C ATOM 876 OG1 THR A 92 -4.595 4.405 14.952 1.00 -0.68 O ATOM 877 CG2 THR A 92 -4.587 6.512 16.088 1.00 0.00 C ATOM 0 H THR A 92 -3.907 4.656 12.401 1.00 -0.73 H new ATOM 0 HA THR A 92 -5.287 6.903 13.644 1.00 0.36 H new ATOM 0 HB THR A 92 -2.959 5.692 14.984 1.00 0.28 H new ATOM 0 HG1 THR A 92 -4.397 4.000 15.822 1.00 -0.68 H new ATOM 0 HG21 THR A 92 -4.348 5.988 17.013 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.132 7.502 16.104 1.00 0.00 H new ATOM 0 HG23 THR A 92 -5.669 6.611 15.996 1.00 0.00 H new ATOM 885 N THR A 93 -2.510 7.089 12.152 1.00 -0.73 N ATOM 886 CA THR A 93 -1.213 7.739 11.880 1.00 0.36 C ATOM 887 C THR A 93 -0.384 7.070 10.798 1.00 0.57 C ATOM 888 O THR A 93 0.774 7.335 10.511 1.00 -0.57 O ATOM 889 CB THR A 93 -0.394 8.229 13.062 1.00 0.28 C ATOM 890 OG1 THR A 93 0.806 8.932 12.752 1.00 -0.68 O ATOM 891 CG2 THR A 93 -0.029 7.217 14.126 1.00 0.00 C ATOM 0 H THR A 93 -2.797 6.411 11.446 1.00 -0.73 H new ATOM 0 HA THR A 93 -1.561 8.682 11.458 1.00 0.36 H new ATOM 0 HB THR A 93 -1.142 8.913 13.464 1.00 0.28 H new ATOM 0 HG1 THR A 93 0.586 9.765 12.286 1.00 -0.68 H new ATOM 0 HG21 THR A 93 0.554 7.705 14.907 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.938 6.800 14.559 1.00 0.00 H new ATOM 0 HG23 THR A 93 0.560 6.416 13.680 1.00 0.00 H new ATOM 899 N THR A 94 -1.201 6.291 9.998 1.00 -0.73 N ATOM 900 CA THR A 94 -1.477 6.766 8.661 1.00 0.36 C ATOM 901 C THR A 94 -2.925 6.616 8.210 1.00 0.57 C ATOM 902 O THR A 94 -3.290 6.067 7.183 1.00 -0.57 O ATOM 903 CB THR A 94 -0.348 6.825 7.677 1.00 0.28 C ATOM 904 OG1 THR A 94 -0.706 6.930 6.311 1.00 -0.68 O ATOM 905 CG2 THR A 94 0.582 5.662 7.755 1.00 0.00 C ATOM 0 H THR A 94 -1.632 5.405 10.262 1.00 -0.73 H new ATOM 0 HA THR A 94 -1.460 7.853 8.738 1.00 0.36 H new ATOM 0 HB THR A 94 0.128 7.752 7.995 1.00 0.28 H new ATOM 0 HG1 THR A 94 -1.084 7.818 6.139 1.00 -0.68 H new ATOM 0 HG21 THR A 94 1.372 5.777 7.013 1.00 0.00 H new ATOM 0 HG22 THR A 94 1.024 5.616 8.750 1.00 0.00 H new ATOM 0 HG23 THR A 94 0.031 4.742 7.559 1.00 0.00 H new ATOM 913 N LEU A 95 -3.764 7.343 9.067 1.00 -0.73 N ATOM 914 CA LEU A 95 -4.943 7.994 8.458 1.00 0.36 C ATOM 915 C LEU A 95 -5.355 9.181 9.321 1.00 0.57 C ATOM 916 O LEU A 95 -6.210 9.995 8.987 1.00 -0.57 O ATOM 917 CB LEU A 95 -6.077 6.984 8.221 1.00 0.00 C ATOM 918 CG LEU A 95 -7.510 7.513 8.040 1.00 0.00 C ATOM 919 CD1 LEU A 95 -7.640 8.303 6.749 1.00 0.00 C ATOM 920 CD2 LEU A 95 -8.522 6.362 8.030 1.00 0.00 C ATOM 0 H LEU A 95 -3.641 7.467 10.072 1.00 -0.73 H new ATOM 0 HA LEU A 95 -4.690 8.377 7.469 1.00 0.36 H new ATOM 0 HB2 LEU A 95 -5.824 6.405 7.333 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.084 6.291 9.062 1.00 0.00 H new ATOM 0 HG LEU A 95 -7.722 8.170 8.884 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -8.663 8.665 6.646 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.955 9.151 6.771 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.396 7.660 5.903 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -9.527 6.763 7.901 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.293 5.684 7.208 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -8.466 5.820 8.974 1.00 0.00 H new ATOM 932 N TYR A 96 -4.623 9.350 10.480 1.00 -0.73 N ATOM 933 CA TYR A 96 -5.041 10.446 11.342 1.00 0.36 C ATOM 934 C TYR A 96 -4.057 11.555 11.191 1.00 0.57 C ATOM 935 O TYR A 96 -4.299 12.720 11.488 1.00 -0.57 O ATOM 936 CB TYR A 96 -4.853 10.029 12.762 1.00 0.14 C ATOM 937 CG TYR A 96 -5.874 10.498 13.727 1.00 -0.14 C ATOM 938 CD1 TYR A 96 -6.973 9.658 13.902 1.00 -0.15 C ATOM 939 CD2 TYR A 96 -5.778 11.691 14.444 1.00 -0.15 C ATOM 940 CE1 TYR A 96 -7.961 9.996 14.809 1.00 -0.15 C ATOM 941 CE2 TYR A 96 -6.786 12.038 15.343 1.00 -0.15 C ATOM 942 CZ TYR A 96 -7.870 11.186 15.521 1.00 0.08 C ATOM 943 OH TYR A 96 -8.832 11.553 16.414 1.00 -0.53 O ATOM 0 H TYR A 96 -3.828 8.791 10.790 1.00 -0.73 H new ATOM 0 HA TYR A 96 -6.066 10.721 11.095 1.00 0.36 H new ATOM 0 HB2 TYR A 96 -4.824 8.940 12.797 1.00 0.14 H new ATOM 0 HB3 TYR A 96 -3.878 10.384 13.096 1.00 0.14 H new ATOM 0 HD1 TYR A 96 -7.053 8.745 13.330 1.00 -0.15 H new ATOM 0 HD2 TYR A 96 -4.928 12.342 14.304 1.00 -0.15 H new ATOM 0 HE1 TYR A 96 -8.802 9.336 14.964 1.00 -0.15 H new ATOM 0 HE2 TYR A 96 -6.725 12.963 15.897 1.00 -0.15 H new ATOM 0 HH TYR A 96 -8.594 12.415 16.815 1.00 -0.53 H new ATOM 953 N THR A 97 -2.776 11.098 10.960 1.00 -0.73 N ATOM 954 CA THR A 97 -1.682 12.052 11.241 1.00 0.36 C ATOM 955 C THR A 97 -0.592 11.401 10.461 1.00 0.57 C ATOM 956 O THR A 97 0.332 10.746 10.913 1.00 -0.57 O ATOM 957 CB THR A 97 -1.415 12.156 12.733 1.00 0.28 C ATOM 958 OG1 THR A 97 -2.463 12.834 13.435 1.00 -0.68 O ATOM 959 CG2 THR A 97 -0.143 12.902 13.088 1.00 0.00 C ATOM 0 HA THR A 97 -1.854 13.092 10.965 1.00 0.36 H new ATOM 0 HB THR A 97 -1.335 11.111 13.033 1.00 0.28 H new ATOM 0 HG1 THR A 97 -3.129 13.160 12.794 1.00 -0.68 H new ATOM 0 HG21 THR A 97 -0.028 12.930 14.172 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.713 12.393 12.646 1.00 0.00 H new ATOM 0 HG23 THR A 97 -0.199 13.920 12.702 1.00 0.00 H new ATOM 967 N SER A 98 -1.047 11.379 9.161 1.00 -0.73 N ATOM 968 CA SER A 98 -0.837 10.172 8.458 1.00 0.36 C ATOM 969 C SER A 98 -1.707 10.053 7.210 1.00 0.57 C ATOM 970 O SER A 98 -2.040 8.977 6.731 1.00 -0.57 O ATOM 971 CB SER A 98 -1.517 9.234 9.448 1.00 0.28 C ATOM 972 OG SER A 98 -2.912 9.078 9.167 1.00 -0.68 O ATOM 0 HA SER A 98 0.203 10.028 8.164 1.00 0.36 H new ATOM 0 HB2 SER A 98 -1.030 8.259 9.417 1.00 0.28 H new ATOM 0 HB3 SER A 98 -1.392 9.621 10.459 1.00 0.28 H new ATOM 0 HG SER A 98 -3.297 9.947 8.929 1.00 -0.68 H new ATOM 978 N LEU A 99 -2.093 11.212 6.637 1.00 -0.73 N ATOM 979 CA LEU A 99 -1.243 11.853 5.605 1.00 0.36 C ATOM 980 C LEU A 99 -2.284 12.707 4.850 1.00 0.57 C ATOM 981 O LEU A 99 -2.567 12.576 3.667 1.00 -0.57 O ATOM 982 CB LEU A 99 -0.517 10.849 4.684 1.00 0.00 C ATOM 983 CG LEU A 99 0.657 11.321 3.804 1.00 0.00 C ATOM 984 CD1 LEU A 99 0.339 12.517 2.920 1.00 0.00 C ATOM 985 CD2 LEU A 99 1.926 11.548 4.617 1.00 0.00 C ATOM 0 HA LEU A 99 -0.411 12.420 6.022 1.00 0.36 H new ATOM 0 HB2 LEU A 99 -0.145 10.041 5.314 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -1.266 10.417 4.021 1.00 0.00 H new ATOM 0 HG LEU A 99 0.839 10.495 3.117 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.220 12.782 2.335 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.480 12.264 2.247 1.00 0.00 H new ATOM 0 HD13 LEU A 99 0.049 13.363 3.543 1.00 0.00 H new ATOM 0 HD21 LEU A 99 2.727 11.880 3.956 1.00 0.00 H new ATOM 0 HD22 LEU A 99 1.741 12.310 5.374 1.00 0.00 H new ATOM 0 HD23 LEU A 99 2.218 10.617 5.103 1.00 0.00 H new ATOM 997 N HIS A 100 -2.969 13.572 5.699 1.00 -0.73 N ATOM 998 CA HIS A 100 -4.426 13.624 5.592 1.00 0.36 C ATOM 999 C HIS A 100 -4.924 12.196 6.021 1.00 0.57 C ATOM 1000 O HIS A 100 -5.148 11.283 5.228 1.00 -0.57 O ATOM 1001 CB HIS A 100 -4.982 14.086 4.254 1.00 0.18 C ATOM 1002 CG HIS A 100 -6.365 14.627 4.428 1.00 -0.33 C ATOM 1003 ND1 HIS A 100 -7.481 14.004 3.935 1.00 0.03 N ATOM 1004 CD2 HIS A 100 -6.847 15.754 5.061 1.00 0.08 C ATOM 1005 CE1 HIS A 100 -8.567 14.739 4.312 1.00 0.04 C ATOM 1006 NE2 HIS A 100 -8.215 15.790 5.016 1.00 -0.57 N ATOM 0 H HIS A 100 -2.547 14.182 6.399 1.00 -0.73 H new ATOM 0 HA HIS A 100 -4.811 14.407 6.245 1.00 0.36 H new ATOM 0 HB2 HIS A 100 -4.335 14.853 3.828 1.00 0.18 H new ATOM 0 HB3 HIS A 100 -4.995 13.253 3.551 1.00 0.18 H new ATOM 0 HD2 HIS A 100 -6.229 16.506 5.529 1.00 0.08 H new ATOM 0 HE1 HIS A 100 -9.587 14.488 4.063 1.00 0.04 H new ATOM 0 HE2 HIS A 100 -8.830 16.485 5.439 1.00 -0.57 H new ATOM 1014 N GLY A 101 -4.888 11.921 7.381 1.00 -0.73 N ATOM 1015 CA GLY A 101 -5.198 12.954 8.330 1.00 0.36 C ATOM 1016 C GLY A 101 -3.844 13.529 8.753 1.00 0.57 C ATOM 1017 O GLY A 101 -2.792 13.000 8.394 1.00 -0.57 O ATOM 0 H GLY A 101 -4.652 11.015 7.786 1.00 -0.73 H new ATOM 0 HA2 GLY A 101 -5.830 13.722 7.884 1.00 0.36 H new ATOM 0 HA3 GLY A 101 -5.740 12.553 9.186 1.00 0.36 H new ATOM 1021 N TYR A 102 -3.825 14.649 9.509 1.00 -0.73 N ATOM 1022 CA TYR A 102 -2.606 15.456 9.659 1.00 0.36 C ATOM 1023 C TYR A 102 -2.835 16.310 8.401 1.00 0.57 C ATOM 1024 O TYR A 102 -3.862 16.966 8.230 1.00 -0.57 O ATOM 1025 CB TYR A 102 -1.359 14.614 9.534 1.00 0.14 C ATOM 1026 CG TYR A 102 -1.470 13.192 9.954 1.00 -0.14 C ATOM 1027 CD1 TYR A 102 -2.072 12.220 9.140 1.00 -0.15 C ATOM 1028 CD2 TYR A 102 -0.957 12.835 11.190 1.00 -0.15 C ATOM 1029 CE1 TYR A 102 -2.202 10.906 9.591 1.00 -0.15 C ATOM 1030 CE2 TYR A 102 -1.099 11.536 11.635 1.00 -0.15 C ATOM 1031 CZ TYR A 102 -1.720 10.575 10.850 1.00 0.08 C ATOM 1032 OH TYR A 102 -1.842 9.317 11.355 1.00 -0.53 O ATOM 0 H TYR A 102 -4.633 15.007 10.018 1.00 -0.73 H new ATOM 0 HA TYR A 102 -2.462 15.977 10.606 1.00 0.36 H new ATOM 0 HB2 TYR A 102 -1.035 14.637 8.493 1.00 0.14 H new ATOM 0 HB3 TYR A 102 -0.571 15.083 10.124 1.00 0.14 H new ATOM 0 HD1 TYR A 102 -2.436 12.490 8.160 1.00 -0.15 H new ATOM 0 HD2 TYR A 102 -0.450 13.567 11.801 1.00 -0.15 H new ATOM 0 HE1 TYR A 102 -2.671 10.157 8.970 1.00 -0.15 H new ATOM 0 HE2 TYR A 102 -0.721 11.263 12.609 1.00 -0.15 H new ATOM 0 HH TYR A 102 -2.389 9.342 12.168 1.00 -0.53 H new ATOM 1042 N PHE A 103 -2.016 15.983 7.355 1.00 -0.73 N ATOM 1043 CA PHE A 103 -0.584 16.004 7.528 1.00 0.36 C ATOM 1044 C PHE A 103 -0.019 15.470 6.221 1.00 0.57 C ATOM 1045 O PHE A 103 -0.440 15.759 5.112 1.00 -0.57 O ATOM 1046 CB PHE A 103 -0.218 14.953 8.604 1.00 0.14 C ATOM 1047 CG PHE A 103 -0.750 13.550 8.396 1.00 -0.14 C ATOM 1048 CD1 PHE A 103 -0.099 12.659 7.530 1.00 -0.15 C ATOM 1049 CD2 PHE A 103 -1.905 13.112 9.060 1.00 -0.15 C ATOM 1050 CE1 PHE A 103 -0.607 11.380 7.306 1.00 -0.15 C ATOM 1051 CE2 PHE A 103 -2.405 11.826 8.845 1.00 -0.15 C ATOM 1052 CZ PHE A 103 -1.760 10.965 7.963 1.00 -0.15 C ATOM 0 H PHE A 103 -2.338 15.714 6.425 1.00 -0.73 H new ATOM 0 HA PHE A 103 -0.219 16.995 7.798 1.00 0.36 H new ATOM 0 HB2 PHE A 103 0.869 14.898 8.670 1.00 0.14 H new ATOM 0 HB3 PHE A 103 -0.578 15.314 9.568 1.00 0.14 H new ATOM 0 HD1 PHE A 103 0.807 12.968 7.030 1.00 -0.15 H new ATOM 0 HD2 PHE A 103 -2.413 13.776 9.744 1.00 -0.15 H new ATOM 0 HE1 PHE A 103 -0.105 10.712 6.622 1.00 -0.15 H new ATOM 0 HE2 PHE A 103 -3.294 11.499 9.364 1.00 -0.15 H new ATOM 0 HZ PHE A 103 -2.155 9.975 7.789 1.00 -0.15 H new ATOM 1062 N VAL A 104 1.006 14.578 6.443 1.00 -0.73 N ATOM 1063 CA VAL A 104 2.287 15.218 6.735 1.00 0.36 C ATOM 1064 C VAL A 104 2.473 14.967 8.258 1.00 0.57 C ATOM 1065 O VAL A 104 1.619 14.414 8.955 1.00 -0.57 O ATOM 1066 CB VAL A 104 2.090 16.746 6.646 1.00 0.00 C ATOM 1067 CG1 VAL A 104 3.291 17.492 7.249 1.00 0.00 C ATOM 1068 CG2 VAL A 104 1.992 17.229 5.189 1.00 0.00 C ATOM 0 H VAL A 104 0.968 13.559 6.426 1.00 -0.73 H new ATOM 0 HA VAL A 104 3.086 14.865 6.083 1.00 0.36 H new ATOM 0 HB VAL A 104 1.168 16.954 7.189 1.00 0.00 H new ATOM 0 HG11 VAL A 104 3.127 18.567 7.174 1.00 0.00 H new ATOM 0 HG12 VAL A 104 3.403 17.215 8.297 1.00 0.00 H new ATOM 0 HG13 VAL A 104 4.196 17.224 6.704 1.00 0.00 H new ATOM 0 HG21 VAL A 104 1.854 18.310 5.173 1.00 0.00 H new ATOM 0 HG22 VAL A 104 2.909 16.972 4.658 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.144 16.747 4.702 1.00 0.00 H new ATOM 1078 N PHE A 105 3.549 15.572 8.809 1.00 -0.73 N ATOM 1079 CA PHE A 105 3.851 15.478 10.238 1.00 0.36 C ATOM 1080 C PHE A 105 5.363 15.731 10.340 1.00 0.57 C ATOM 1081 O PHE A 105 5.946 16.270 11.273 1.00 -0.57 O ATOM 1082 CB PHE A 105 3.567 14.057 10.736 1.00 0.14 C ATOM 1083 CG PHE A 105 2.100 13.713 10.850 1.00 -0.14 C ATOM 1084 CD1 PHE A 105 1.274 14.403 11.742 1.00 -0.15 C ATOM 1085 CD2 PHE A 105 1.553 12.669 10.092 1.00 -0.15 C ATOM 1086 CE1 PHE A 105 -0.076 14.071 11.867 1.00 -0.15 C ATOM 1087 CE2 PHE A 105 0.203 12.335 10.219 1.00 -0.15 C ATOM 1088 CZ PHE A 105 -0.611 13.036 11.104 1.00 -0.15 C ATOM 0 H PHE A 105 4.218 16.129 8.277 1.00 -0.73 H new ATOM 0 HA PHE A 105 3.257 16.179 10.825 1.00 0.36 H new ATOM 0 HB2 PHE A 105 4.042 13.347 10.059 1.00 0.14 H new ATOM 0 HB3 PHE A 105 4.034 13.928 11.712 1.00 0.14 H new ATOM 0 HD1 PHE A 105 1.685 15.202 12.341 1.00 -0.15 H new ATOM 0 HD2 PHE A 105 2.179 12.119 9.405 1.00 -0.15 H new ATOM 0 HE1 PHE A 105 -0.705 14.616 12.555 1.00 -0.15 H new ATOM 0 HE2 PHE A 105 -0.211 11.531 9.629 1.00 -0.15 H new ATOM 0 HZ PHE A 105 -1.655 12.778 11.199 1.00 -0.15 H new ATOM 1098 N GLY A 106 6.114 15.233 9.289 1.00 -0.73 N ATOM 1099 CA GLY A 106 6.460 13.798 9.301 1.00 0.36 C ATOM 1100 C GLY A 106 5.274 12.880 8.981 1.00 0.57 C ATOM 1101 O GLY A 106 4.604 13.062 7.961 1.00 -0.57 O ATOM 0 H GLY A 106 6.457 15.771 8.493 1.00 -0.73 H new ATOM 0 HA2 GLY A 106 7.254 13.618 8.577 1.00 0.36 H new ATOM 0 HA3 GLY A 106 6.857 13.536 10.282 1.00 0.36 H new ATOM 1105 N PRO A 107 4.886 11.962 9.928 1.00 -0.66 N ATOM 1106 CA PRO A 107 5.697 11.398 11.028 1.00 0.36 C ATOM 1107 C PRO A 107 6.613 10.205 10.630 1.00 0.57 C ATOM 1108 O PRO A 107 6.214 9.246 9.967 1.00 -0.57 O ATOM 1109 CB PRO A 107 4.648 10.831 12.001 1.00 0.00 C ATOM 1110 CG PRO A 107 3.350 11.512 11.599 1.00 0.00 C ATOM 1111 CD PRO A 107 3.469 11.638 10.089 1.00 0.30 C ATOM 0 HA PRO A 107 6.359 12.176 11.408 1.00 0.36 H new ATOM 0 HB2 PRO A 107 4.571 9.747 11.915 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.907 11.051 13.037 1.00 0.00 H new ATOM 0 HG2 PRO A 107 2.481 10.920 11.885 1.00 0.00 H new ATOM 0 HG3 PRO A 107 3.243 12.486 12.076 1.00 0.00 H new ATOM 0 HD2 PRO A 107 3.200 10.713 9.579 1.00 0.30 H new ATOM 0 HD3 PRO A 107 2.823 12.421 9.692 1.00 0.30 H new ATOM 1119 N THR A 108 7.865 10.217 11.187 1.00 -0.73 N ATOM 1120 CA THR A 108 8.625 9.017 11.595 1.00 0.36 C ATOM 1121 C THR A 108 9.274 8.179 10.449 1.00 0.57 C ATOM 1122 O THR A 108 10.489 7.968 10.397 1.00 -0.57 O ATOM 1123 CB THR A 108 7.787 8.203 12.610 1.00 0.28 C ATOM 1124 OG1 THR A 108 7.552 9.004 13.784 1.00 -0.68 O ATOM 1125 CG2 THR A 108 8.436 6.904 13.044 1.00 0.00 C ATOM 0 H THR A 108 8.373 11.084 11.363 1.00 -0.73 H new ATOM 0 HA THR A 108 9.527 9.371 12.094 1.00 0.36 H new ATOM 0 HB THR A 108 6.860 7.945 12.098 1.00 0.28 H new ATOM 0 HG1 THR A 108 7.020 8.492 14.428 1.00 -0.68 H new ATOM 0 HG21 THR A 108 7.787 6.393 13.755 1.00 0.00 H new ATOM 0 HG22 THR A 108 8.593 6.267 12.173 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.395 7.116 13.516 1.00 0.00 H new ATOM 1133 N GLY A 109 8.440 7.603 9.529 1.00 -0.73 N ATOM 1134 CA GLY A 109 8.894 6.938 8.319 1.00 0.36 C ATOM 1135 C GLY A 109 7.868 7.196 7.208 1.00 0.57 C ATOM 1136 O GLY A 109 7.932 6.677 6.103 1.00 -0.57 O ATOM 0 H GLY A 109 7.425 7.601 9.632 1.00 -0.73 H new ATOM 0 HA2 GLY A 109 9.874 7.314 8.025 1.00 0.36 H new ATOM 0 HA3 GLY A 109 9.003 5.868 8.493 1.00 0.36 H new ATOM 1140 N CYS A 110 6.805 7.952 7.644 1.00 -0.73 N ATOM 1141 CA CYS A 110 5.617 8.285 6.923 1.00 0.36 C ATOM 1142 C CYS A 110 4.387 7.834 7.771 1.00 0.57 C ATOM 1143 O CYS A 110 3.271 8.337 7.579 1.00 -0.57 O ATOM 1144 CB CYS A 110 5.536 9.819 6.811 1.00 0.23 C ATOM 1145 SG CYS A 110 7.124 10.654 6.367 1.00 -0.23 S ATOM 0 H CYS A 110 6.798 8.353 8.582 1.00 -0.73 H new ATOM 0 HA CYS A 110 5.626 7.809 5.943 1.00 0.36 H new ATOM 0 HB2 CYS A 110 4.787 10.075 6.062 1.00 0.23 H new ATOM 0 HB3 CYS A 110 5.186 10.220 7.762 1.00 0.23 H new ATOM 1150 N ASN A 111 4.425 6.866 8.742 1.00 -0.73 N ATOM 1151 CA ASN A 111 5.348 5.766 9.038 1.00 0.36 C ATOM 1152 C ASN A 111 4.798 4.358 8.903 1.00 0.57 C ATOM 1153 O ASN A 111 5.500 3.390 9.193 1.00 -0.57 O ATOM 1154 CB ASN A 111 6.011 5.777 10.410 1.00 0.06 C ATOM 1155 CG ASN A 111 5.147 5.434 11.596 1.00 0.57 C ATOM 1156 OD1 ASN A 111 3.870 5.911 11.593 1.00 -0.57 O flip ATOM 1157 ND2 ASN A 111 5.596 4.884 12.595 1.00 -0.80 N flip ATOM 0 H ASN A 111 3.677 6.860 9.435 1.00 -0.73 H new ATOM 0 HA ASN A 111 6.068 5.986 8.250 1.00 0.36 H new ATOM 0 HB2 ASN A 111 6.846 5.077 10.387 1.00 0.06 H new ATOM 0 HB3 ASN A 111 6.431 6.769 10.574 1.00 0.06 H new ATOM 0 HD21 ASN A 111 6.552 4.528 12.595 1.00 -0.80 H new ATOM 0 HD22 ASN A 111 5.014 4.782 13.426 1.00 -0.80 H new ATOM 1164 N LEU A 112 3.568 4.199 8.334 1.00 -0.73 N ATOM 1165 CA LEU A 112 3.165 2.820 8.028 1.00 0.36 C ATOM 1166 C LEU A 112 4.138 2.356 6.977 1.00 0.57 C ATOM 1167 O LEU A 112 5.034 1.570 7.283 1.00 -0.57 O ATOM 1168 CB LEU A 112 1.713 2.794 7.652 1.00 0.00 C ATOM 1169 CG LEU A 112 1.005 1.491 7.320 1.00 0.00 C ATOM 1170 CD1 LEU A 112 -0.398 1.853 6.828 1.00 0.00 C ATOM 1171 CD2 LEU A 112 1.734 0.657 6.291 1.00 0.00 C ATOM 0 H LEU A 112 2.904 4.937 8.101 1.00 -0.73 H new ATOM 0 HA LEU A 112 3.219 2.126 8.866 1.00 0.36 H new ATOM 0 HB2 LEU A 112 1.164 3.253 8.474 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.597 3.447 6.787 1.00 0.00 H new ATOM 0 HG LEU A 112 0.969 0.871 8.216 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.942 0.942 6.578 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -0.931 2.390 7.612 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.321 2.485 5.943 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.174 -0.258 6.101 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.828 1.223 5.364 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.726 0.404 6.664 1.00 0.00 H new ATOM 1183 N GLU A 113 4.057 3.033 5.818 1.00 0.00 N ATOM 1184 CA GLU A 113 5.121 2.995 4.828 1.00 0.00 C ATOM 1185 C GLU A 113 6.466 2.826 5.537 1.00 0.00 C ATOM 1186 O GLU A 113 7.030 1.734 5.551 1.00 0.00 O ATOM 1187 CB GLU A 113 5.117 4.248 3.950 1.00 0.00 C ATOM 1188 CG GLU A 113 4.835 3.893 2.489 1.00 0.00 C ATOM 1189 CD GLU A 113 4.644 2.384 2.318 1.00 0.00 C ATOM 1190 OE1 GLU A 113 5.631 1.645 2.187 1.00 0.00 O ATOM 1191 OE2 GLU A 113 3.418 1.986 2.325 1.00 0.00 O ATOM 0 H GLU A 113 3.259 3.611 5.554 1.00 0.00 H new ATOM 0 HA GLU A 113 4.953 2.144 4.167 1.00 0.00 H new ATOM 0 HB2 GLU A 113 4.362 4.947 4.310 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.080 4.753 4.026 1.00 0.00 H new ATOM 0 HG2 GLU A 113 3.941 4.417 2.150 1.00 0.00 H new ATOM 0 HG3 GLU A 113 5.660 4.232 1.863 1.00 0.00 H new ATOM 1192 N GLY A 114 7.272 3.658 6.397 1.00 -0.73 N ATOM 1193 CA GLY A 114 8.602 3.164 6.419 1.00 0.36 C ATOM 1194 C GLY A 114 8.790 1.980 7.348 1.00 0.57 C ATOM 1195 O GLY A 114 9.815 1.308 7.373 1.00 -0.57 O ATOM 0 H GLY A 114 7.021 4.484 6.941 1.00 -0.73 H new ATOM 0 HA2 GLY A 114 8.890 2.873 5.409 1.00 0.36 H new ATOM 0 HA3 GLY A 114 9.274 3.966 6.724 1.00 0.36 H new ATOM 1199 N PHE A 115 7.796 1.889 8.304 1.00 -0.73 N ATOM 1200 CA PHE A 115 8.064 1.113 9.510 1.00 0.36 C ATOM 1201 C PHE A 115 7.409 -0.280 9.396 1.00 0.57 C ATOM 1202 O PHE A 115 7.909 -1.400 9.249 1.00 -0.57 O ATOM 1203 CB PHE A 115 7.677 1.819 10.825 1.00 0.14 C ATOM 1204 CG PHE A 115 8.729 2.750 11.392 1.00 -0.14 C ATOM 1205 CD1 PHE A 115 9.540 3.555 10.581 1.00 -0.15 C ATOM 1206 CD2 PHE A 115 8.879 2.830 12.784 1.00 -0.15 C ATOM 1207 CE1 PHE A 115 10.498 4.394 11.141 1.00 -0.15 C ATOM 1208 CE2 PHE A 115 9.836 3.669 13.346 1.00 -0.15 C ATOM 1209 CZ PHE A 115 10.640 4.452 12.522 1.00 -0.15 C ATOM 0 H PHE A 115 6.874 2.321 8.246 1.00 -0.73 H new ATOM 0 HA PHE A 115 9.147 1.003 9.570 1.00 0.36 H new ATOM 0 HB2 PHE A 115 6.763 2.389 10.657 1.00 0.14 H new ATOM 0 HB3 PHE A 115 7.446 1.060 11.572 1.00 0.14 H new ATOM 0 HD1 PHE A 115 9.420 3.524 9.508 1.00 -0.15 H new ATOM 0 HD2 PHE A 115 8.246 2.235 13.426 1.00 -0.15 H new ATOM 0 HE1 PHE A 115 11.129 4.998 10.505 1.00 -0.15 H new ATOM 0 HE2 PHE A 115 9.955 3.713 14.419 1.00 -0.15 H new ATOM 0 HZ PHE A 115 11.378 5.108 12.959 1.00 -0.15 H new ATOM 1219 N PHE A 116 6.055 -0.018 9.448 1.00 -0.73 N ATOM 1220 CA PHE A 116 5.035 -1.010 9.404 1.00 0.36 C ATOM 1221 C PHE A 116 4.645 -1.362 8.006 1.00 0.57 C ATOM 1222 O PHE A 116 3.618 -1.977 7.766 1.00 -0.57 O ATOM 1223 CB PHE A 116 3.784 -0.721 10.211 1.00 0.14 C ATOM 1224 CG PHE A 116 4.007 0.187 11.389 1.00 -0.14 C ATOM 1225 CD1 PHE A 116 4.969 -0.103 12.363 1.00 -0.15 C ATOM 1226 CD2 PHE A 116 3.295 1.387 11.470 1.00 -0.15 C ATOM 1227 CE1 PHE A 116 5.292 0.849 13.329 1.00 -0.15 C ATOM 1228 CE2 PHE A 116 3.623 2.336 12.427 1.00 -0.15 C ATOM 1229 CZ PHE A 116 4.651 2.087 13.326 1.00 -0.15 C ATOM 0 H PHE A 116 5.685 0.930 9.523 1.00 -0.73 H new ATOM 0 HA PHE A 116 5.516 -1.859 9.890 1.00 0.36 H new ATOM 0 HB2 PHE A 116 3.038 -0.271 9.556 1.00 0.14 H new ATOM 0 HB3 PHE A 116 3.369 -1.664 10.567 1.00 0.14 H new ATOM 0 HD1 PHE A 116 5.461 -1.064 12.366 1.00 -0.15 H new ATOM 0 HD2 PHE A 116 2.484 1.577 10.783 1.00 -0.15 H new ATOM 0 HE1 PHE A 116 6.038 0.628 14.078 1.00 -0.15 H new ATOM 0 HE2 PHE A 116 3.079 3.268 12.473 1.00 -0.15 H new ATOM 0 HZ PHE A 116 4.955 2.853 14.024 1.00 -0.15 H new ATOM 1239 N ALA A 117 5.649 -1.192 7.099 1.00 -0.73 N ATOM 1240 CA ALA A 117 5.565 -1.942 5.876 1.00 0.36 C ATOM 1241 C ALA A 117 6.900 -2.475 5.438 1.00 0.57 C ATOM 1242 O ALA A 117 7.072 -3.242 4.497 1.00 -0.57 O ATOM 1243 CB ALA A 117 4.950 -1.121 4.844 1.00 0.00 C ATOM 0 H ALA A 117 6.459 -0.581 7.204 1.00 -0.73 H new ATOM 0 HA ALA A 117 4.939 -2.816 6.055 1.00 0.36 H new ATOM 0 HB1 ALA A 117 4.886 -1.690 3.916 1.00 0.00 H new ATOM 0 HB2 ALA A 117 3.949 -0.829 5.160 1.00 0.00 H new ATOM 0 HB3 ALA A 117 5.554 -0.228 4.681 1.00 0.00 H new ATOM 1249 N THR A 118 7.853 -2.118 6.361 1.00 -0.73 N ATOM 1250 CA THR A 118 8.976 -3.006 6.526 1.00 0.36 C ATOM 1251 C THR A 118 8.298 -4.133 7.232 1.00 0.57 C ATOM 1252 O THR A 118 7.571 -4.878 6.581 1.00 -0.57 O ATOM 1253 CB THR A 118 10.122 -2.287 7.178 1.00 0.28 C ATOM 1254 OG1 THR A 118 10.486 -1.146 6.384 1.00 -0.68 O ATOM 1255 CG2 THR A 118 11.375 -3.117 7.274 1.00 0.00 C ATOM 0 H THR A 118 7.844 -1.281 6.944 1.00 -0.73 H new ATOM 0 HA THR A 118 9.498 -3.383 5.647 1.00 0.36 H new ATOM 0 HB THR A 118 9.773 -2.031 8.178 1.00 0.28 H new ATOM 0 HG1 THR A 118 10.194 -0.327 6.836 1.00 -0.68 H new ATOM 0 HG21 THR A 118 12.161 -2.535 7.755 1.00 0.00 H new ATOM 0 HG22 THR A 118 11.174 -4.012 7.863 1.00 0.00 H new ATOM 0 HG23 THR A 118 11.698 -3.406 6.274 1.00 0.00 H new ATOM 1263 N LEU A 119 8.349 -4.250 8.560 1.00 -0.73 N ATOM 1264 CA LEU A 119 7.372 -5.059 9.239 1.00 0.36 C ATOM 1265 C LEU A 119 6.088 -5.446 8.492 1.00 0.57 C ATOM 1266 O LEU A 119 5.799 -6.605 8.206 1.00 -0.57 O ATOM 1267 CB LEU A 119 7.100 -4.540 10.648 1.00 0.00 C ATOM 1268 CG LEU A 119 8.324 -4.549 11.588 1.00 0.00 C ATOM 1269 CD1 LEU A 119 9.228 -3.325 11.422 1.00 0.00 C ATOM 1270 CD2 LEU A 119 7.843 -4.600 13.041 1.00 0.00 C ATOM 0 H LEU A 119 9.041 -3.803 9.161 1.00 -0.73 H new ATOM 0 HA LEU A 119 7.871 -6.026 9.291 1.00 0.36 H new ATOM 0 HB2 LEU A 119 6.721 -3.520 10.578 1.00 0.00 H new ATOM 0 HB3 LEU A 119 6.311 -5.143 11.096 1.00 0.00 H new ATOM 0 HG LEU A 119 8.912 -5.428 11.325 1.00 0.00 H new ATOM 0 HD11 LEU A 119 10.068 -3.397 12.113 1.00 0.00 H new ATOM 0 HD12 LEU A 119 9.602 -3.285 10.399 1.00 0.00 H new ATOM 0 HD13 LEU A 119 8.659 -2.420 11.636 1.00 0.00 H new ATOM 0 HD21 LEU A 119 8.704 -4.607 13.709 1.00 0.00 H new ATOM 0 HD22 LEU A 119 7.227 -3.726 13.251 1.00 0.00 H new ATOM 0 HD23 LEU A 119 7.255 -5.504 13.198 1.00 0.00 H new ATOM 1282 N GLY A 120 5.299 -4.426 8.079 1.00 -0.73 N ATOM 1283 CA GLY A 120 4.129 -4.819 7.291 1.00 0.36 C ATOM 1284 C GLY A 120 4.294 -5.393 5.880 1.00 0.57 C ATOM 1285 O GLY A 120 3.286 -5.688 5.226 1.00 -0.57 O ATOM 0 H GLY A 120 5.433 -3.431 8.257 1.00 -0.73 H new ATOM 0 HA2 GLY A 120 3.582 -5.558 7.876 1.00 0.36 H new ATOM 0 HA3 GLY A 120 3.489 -3.941 7.207 1.00 0.36 H new ATOM 1289 N GLY A 121 5.558 -5.655 5.389 1.00 -0.73 N ATOM 1290 CA GLY A 121 5.622 -6.524 4.241 1.00 0.36 C ATOM 1291 C GLY A 121 6.841 -7.403 4.337 1.00 0.57 C ATOM 1292 O GLY A 121 6.856 -8.565 3.950 1.00 -0.57 O ATOM 0 H GLY A 121 6.442 -5.299 5.753 1.00 -0.73 H new ATOM 0 HA2 GLY A 121 4.723 -7.138 4.187 1.00 0.36 H new ATOM 0 HA3 GLY A 121 5.660 -5.932 3.326 1.00 0.36 H new ATOM 1296 N GLU A 122 7.928 -6.780 4.878 1.00 -0.73 N ATOM 1297 CA GLU A 122 9.204 -7.396 5.230 1.00 0.36 C ATOM 1298 C GLU A 122 8.922 -8.676 5.965 1.00 0.57 C ATOM 1299 O GLU A 122 9.493 -9.745 5.809 1.00 -0.57 O ATOM 1300 CB GLU A 122 9.872 -6.451 6.202 1.00 0.00 C ATOM 1301 CG GLU A 122 11.289 -6.809 6.612 1.00 -0.11 C ATOM 1302 CD GLU A 122 11.551 -6.719 8.121 1.00 0.91 C ATOM 1303 OE1 GLU A 122 10.640 -6.138 8.794 1.00 -0.90 O ATOM 1304 OE2 GLU A 122 12.629 -7.256 8.513 1.00 -0.90 O ATOM 0 H GLU A 122 7.918 -5.781 5.084 1.00 -0.73 H new ATOM 0 HA GLU A 122 9.816 -7.589 4.349 1.00 0.36 H new ATOM 0 HB2 GLU A 122 9.884 -5.455 5.759 1.00 0.00 H new ATOM 0 HB3 GLU A 122 9.259 -6.393 7.101 1.00 0.00 H new ATOM 0 HG2 GLU A 122 11.506 -7.823 6.277 1.00 -0.11 H new ATOM 0 HG3 GLU A 122 11.983 -6.147 6.094 1.00 -0.11 H new ATOM 1311 N ILE A 123 7.925 -8.443 6.885 1.00 -0.73 N ATOM 1312 CA ILE A 123 7.750 -9.338 7.992 1.00 0.36 C ATOM 1313 C ILE A 123 6.915 -10.491 7.458 1.00 0.57 C ATOM 1314 O ILE A 123 6.813 -11.558 8.050 1.00 -0.57 O ATOM 1315 CB ILE A 123 7.167 -8.757 9.268 1.00 0.00 C ATOM 1316 CG1 ILE A 123 7.985 -9.106 10.521 1.00 0.00 C ATOM 1317 CG2 ILE A 123 5.682 -9.055 9.470 1.00 0.00 C ATOM 1318 CD1 ILE A 123 7.463 -8.392 11.764 1.00 0.00 C ATOM 0 H ILE A 123 7.272 -7.660 6.851 1.00 -0.73 H new ATOM 0 HA ILE A 123 8.739 -9.641 8.337 1.00 0.36 H new ATOM 0 HB ILE A 123 7.241 -7.679 9.124 1.00 0.00 H new ATOM 0 HG12 ILE A 123 7.957 -10.183 10.684 1.00 0.00 H new ATOM 0 HG13 ILE A 123 9.028 -8.835 10.359 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.344 -8.605 10.404 1.00 0.00 H new ATOM 0 HG22 ILE A 123 5.111 -8.639 8.640 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.530 -10.134 9.511 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.071 -8.669 12.625 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.516 -7.314 11.614 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.428 -8.683 11.943 1.00 0.00 H new ATOM 1330 N ALA A 124 6.197 -10.147 6.335 1.00 -0.73 N ATOM 1331 CA ALA A 124 5.448 -11.056 5.494 1.00 0.36 C ATOM 1332 C ALA A 124 6.372 -11.817 4.544 1.00 0.57 C ATOM 1333 O ALA A 124 6.122 -12.977 4.225 1.00 -0.57 O ATOM 1334 CB ALA A 124 4.356 -10.355 4.708 1.00 0.00 C ATOM 0 H ALA A 124 6.144 -9.183 6.007 1.00 -0.73 H new ATOM 0 HA ALA A 124 4.965 -11.767 6.165 1.00 0.36 H new ATOM 0 HB1 ALA A 124 3.825 -11.083 4.094 1.00 0.00 H new ATOM 0 HB2 ALA A 124 3.656 -9.884 5.398 1.00 0.00 H new ATOM 0 HB3 ALA A 124 4.801 -9.594 4.066 1.00 0.00 H new ATOM 1340 N LEU A 125 7.469 -11.141 4.062 1.00 -0.73 N ATOM 1341 CA LEU A 125 8.461 -11.814 3.235 1.00 0.36 C ATOM 1342 C LEU A 125 9.011 -12.915 4.137 1.00 0.57 C ATOM 1343 O LEU A 125 9.122 -14.074 3.758 1.00 -0.57 O ATOM 1344 CB LEU A 125 9.657 -10.960 2.795 1.00 0.00 C ATOM 1345 CG LEU A 125 9.319 -9.598 2.184 1.00 0.00 C ATOM 1346 CD1 LEU A 125 10.616 -8.933 1.708 1.00 0.00 C ATOM 1347 CD2 LEU A 125 8.355 -9.757 1.008 1.00 0.00 C ATOM 0 H LEU A 125 7.661 -10.156 4.242 1.00 -0.73 H new ATOM 0 HA LEU A 125 7.975 -12.129 2.311 1.00 0.36 H new ATOM 0 HB2 LEU A 125 10.301 -10.799 3.660 1.00 0.00 H new ATOM 0 HB3 LEU A 125 10.237 -11.529 2.068 1.00 0.00 H new ATOM 0 HG LEU A 125 8.835 -8.977 2.938 1.00 0.00 H new ATOM 0 HD11 LEU A 125 10.387 -7.961 1.271 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.289 -8.800 2.555 1.00 0.00 H new ATOM 0 HD13 LEU A 125 11.095 -9.564 0.959 1.00 0.00 H new ATOM 0 HD21 LEU A 125 8.128 -8.777 0.589 1.00 0.00 H new ATOM 0 HD22 LEU A 125 8.815 -10.382 0.242 1.00 0.00 H new ATOM 0 HD23 LEU A 125 7.434 -10.226 1.354 1.00 0.00 H new ATOM 1359 N TRP A 126 9.350 -12.492 5.403 1.00 -0.73 N ATOM 1360 CA TRP A 126 9.870 -13.399 6.405 1.00 0.36 C ATOM 1361 C TRP A 126 8.777 -14.377 6.797 1.00 0.57 C ATOM 1362 O TRP A 126 9.006 -15.559 7.045 1.00 -0.57 O ATOM 1363 CB TRP A 126 10.085 -12.710 7.730 1.00 0.18 C ATOM 1364 CG TRP A 126 11.244 -11.794 7.779 1.00 -0.18 C ATOM 1365 CD1 TRP A 126 11.330 -10.557 8.382 1.00 -0.30 C ATOM 1366 CD2 TRP A 126 12.584 -12.302 7.920 1.00 0.00 C ATOM 1367 NE1 TRP A 126 12.625 -10.099 8.241 1.00 0.03 N ATOM 1368 CE2 TRP A 126 13.333 -11.253 8.485 1.00 -0.15 C ATOM 1369 CE3 TRP A 126 12.954 -13.609 8.294 1.00 -0.15 C ATOM 1370 CZ2 TRP A 126 14.348 -11.521 9.407 1.00 -0.15 C ATOM 1371 CZ3 TRP A 126 13.170 -13.518 9.650 1.00 -0.15 C ATOM 1372 CH2 TRP A 126 14.353 -12.851 9.841 1.00 -0.15 C ATOM 0 H TRP A 126 9.261 -11.527 5.720 1.00 -0.73 H new ATOM 0 HA TRP A 126 10.777 -13.824 5.975 1.00 0.36 H new ATOM 0 HB2 TRP A 126 9.186 -12.147 7.979 1.00 0.18 H new ATOM 0 HB3 TRP A 126 10.209 -13.470 8.501 1.00 0.18 H new ATOM 0 HD1 TRP A 126 10.524 -10.037 8.878 1.00 -0.30 H new ATOM 0 HE1 TRP A 126 12.963 -9.163 8.018 1.00 0.03 H new ATOM 0 HE3 TRP A 126 13.047 -14.480 7.663 1.00 -0.15 H new ATOM 0 HZ2 TRP A 126 15.055 -10.779 9.749 1.00 -0.15 H new ATOM 0 HZ3 TRP A 126 12.524 -13.903 10.425 1.00 -0.15 H new ATOM 0 HH2 TRP A 126 15.219 -13.315 10.290 1.00 -0.15 H new ATOM 1383 N SER A 127 7.529 -13.782 7.038 1.00 -0.73 N ATOM 1384 CA SER A 127 6.520 -14.632 7.633 1.00 0.36 C ATOM 1385 C SER A 127 6.168 -15.716 6.623 1.00 0.57 C ATOM 1386 O SER A 127 5.547 -16.717 6.986 1.00 -0.57 O ATOM 1387 CB SER A 127 5.241 -13.943 8.099 1.00 0.28 C ATOM 1388 OG SER A 127 5.383 -13.314 9.380 1.00 -0.68 O ATOM 0 H SER A 127 7.263 -12.818 6.838 1.00 -0.73 H new ATOM 0 HA SER A 127 6.964 -15.022 8.549 1.00 0.36 H new ATOM 0 HB2 SER A 127 4.948 -13.195 7.363 1.00 0.28 H new ATOM 0 HB3 SER A 127 4.436 -14.676 8.147 1.00 0.28 H new ATOM 0 HG SER A 127 5.984 -12.544 9.301 1.00 -0.68 H new ATOM 1394 N LEU A 128 6.598 -15.479 5.314 1.00 -0.73 N ATOM 1395 CA LEU A 128 6.578 -16.528 4.331 1.00 0.36 C ATOM 1396 C LEU A 128 7.817 -17.280 3.831 1.00 0.57 C ATOM 1397 O LEU A 128 7.727 -18.404 3.320 1.00 -0.57 O ATOM 1398 CB LEU A 128 5.575 -16.273 3.213 1.00 0.00 C ATOM 1399 CG LEU A 128 6.094 -15.294 2.131 1.00 0.00 C ATOM 1400 CD1 LEU A 128 6.686 -16.015 0.918 1.00 0.00 C ATOM 1401 CD2 LEU A 128 4.972 -14.371 1.645 1.00 0.00 C ATOM 0 H LEU A 128 6.943 -14.581 4.975 1.00 -0.73 H new ATOM 0 HA LEU A 128 6.269 -17.295 5.041 1.00 0.36 H new ATOM 0 HB2 LEU A 128 5.319 -17.222 2.741 1.00 0.00 H new ATOM 0 HB3 LEU A 128 4.657 -15.873 3.643 1.00 0.00 H new ATOM 0 HG LEU A 128 6.883 -14.713 2.608 1.00 0.00 H new ATOM 0 HD11 LEU A 128 7.034 -15.280 0.192 1.00 0.00 H new ATOM 0 HD12 LEU A 128 7.524 -16.635 1.237 1.00 0.00 H new ATOM 0 HD13 LEU A 128 5.923 -16.644 0.460 1.00 0.00 H new ATOM 0 HD21 LEU A 128 5.362 -13.693 0.886 1.00 0.00 H new ATOM 0 HD22 LEU A 128 4.167 -14.970 1.218 1.00 0.00 H new ATOM 0 HD23 LEU A 128 4.587 -13.792 2.485 1.00 0.00 H new ATOM 1413 N VAL A 129 9.036 -16.690 4.098 1.00 -0.73 N ATOM 1414 CA VAL A 129 10.225 -17.497 3.864 1.00 0.36 C ATOM 1415 C VAL A 129 10.138 -18.688 4.858 1.00 0.57 C ATOM 1416 O VAL A 129 10.834 -19.696 4.747 1.00 -0.57 O ATOM 1417 CB VAL A 129 11.591 -16.802 4.020 1.00 0.00 C ATOM 1418 CG1 VAL A 129 11.753 -15.542 3.178 1.00 0.00 C ATOM 1419 CG2 VAL A 129 12.032 -16.539 5.460 1.00 0.00 C ATOM 0 H VAL A 129 9.187 -15.742 4.444 1.00 -0.73 H new ATOM 0 HA VAL A 129 10.209 -17.776 2.810 1.00 0.36 H new ATOM 0 HB VAL A 129 12.269 -17.557 3.623 1.00 0.00 H new ATOM 0 HG11 VAL A 129 12.742 -15.116 3.347 1.00 0.00 H new ATOM 0 HG12 VAL A 129 11.642 -15.793 2.123 1.00 0.00 H new ATOM 0 HG13 VAL A 129 10.992 -14.815 3.461 1.00 0.00 H new ATOM 0 HG21 VAL A 129 13.005 -16.047 5.459 1.00 0.00 H new ATOM 0 HG22 VAL A 129 11.302 -15.897 5.953 1.00 0.00 H new ATOM 0 HG23 VAL A 129 12.104 -17.485 5.997 1.00 0.00 H new ATOM 1429 N VAL A 130 9.311 -18.449 5.938 1.00 -0.73 N ATOM 1430 CA VAL A 130 8.795 -19.466 6.823 1.00 0.36 C ATOM 1431 C VAL A 130 7.533 -20.128 6.201 1.00 0.57 C ATOM 1432 O VAL A 130 7.616 -21.260 5.729 1.00 -0.57 O ATOM 1433 CB VAL A 130 8.610 -18.911 8.238 1.00 0.00 C ATOM 1434 CG1 VAL A 130 8.195 -20.035 9.180 1.00 0.00 C ATOM 1435 CG2 VAL A 130 9.925 -18.298 8.749 1.00 0.00 C ATOM 0 H VAL A 130 9.001 -17.510 6.189 1.00 -0.73 H new ATOM 0 HA VAL A 130 9.519 -20.273 6.935 1.00 0.36 H new ATOM 0 HB VAL A 130 7.838 -18.142 8.209 1.00 0.00 H new ATOM 0 HG11 VAL A 130 8.064 -19.637 10.186 1.00 0.00 H new ATOM 0 HG12 VAL A 130 7.256 -20.469 8.837 1.00 0.00 H new ATOM 0 HG13 VAL A 130 8.968 -20.804 9.192 1.00 0.00 H new ATOM 0 HG21 VAL A 130 9.777 -17.908 9.756 1.00 0.00 H new ATOM 0 HG22 VAL A 130 10.701 -19.064 8.767 1.00 0.00 H new ATOM 0 HG23 VAL A 130 10.230 -17.488 8.087 1.00 0.00 H new ATOM 1445 N LEU A 131 6.324 -19.496 6.085 1.00 -0.73 N ATOM 1446 CA LEU A 131 5.156 -20.272 5.625 1.00 0.36 C ATOM 1447 C LEU A 131 5.185 -21.102 4.359 1.00 0.57 C ATOM 1448 O LEU A 131 4.539 -22.146 4.175 1.00 -0.57 O ATOM 1449 CB LEU A 131 3.904 -19.384 5.563 1.00 0.00 C ATOM 1450 CG LEU A 131 2.845 -19.831 6.574 1.00 0.00 C ATOM 1451 CD1 LEU A 131 1.926 -18.679 6.968 1.00 0.00 C ATOM 1452 CD2 LEU A 131 1.985 -20.961 6.010 1.00 0.00 C ATOM 0 H LEU A 131 6.149 -18.513 6.292 1.00 -0.73 H new ATOM 0 HA LEU A 131 5.162 -21.036 6.402 1.00 0.36 H new ATOM 0 HB2 LEU A 131 4.182 -18.349 5.760 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.484 -19.416 4.558 1.00 0.00 H new ATOM 0 HG LEU A 131 3.385 -20.182 7.453 1.00 0.00 H new ATOM 0 HD11 LEU A 131 1.187 -19.033 7.687 1.00 0.00 H new ATOM 0 HD12 LEU A 131 2.516 -17.880 7.418 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.418 -18.300 6.082 1.00 0.00 H new ATOM 0 HD21 LEU A 131 1.242 -21.257 6.751 1.00 0.00 H new ATOM 0 HD22 LEU A 131 1.480 -20.618 5.107 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.618 -21.815 5.770 1.00 0.00 H new ATOM 1464 N ALA A 132 6.093 -20.654 3.451 1.00 -0.73 N ATOM 1465 CA ALA A 132 5.652 -20.726 2.085 1.00 0.36 C ATOM 1466 C ALA A 132 5.394 -22.157 1.603 1.00 0.57 C ATOM 1467 O ALA A 132 4.726 -22.409 0.597 1.00 -0.57 O ATOM 1468 CB ALA A 132 6.462 -19.875 1.123 1.00 0.00 C ATOM 0 H ALA A 132 7.026 -20.283 3.632 1.00 -0.73 H new ATOM 0 HA ALA A 132 4.670 -20.253 2.082 1.00 0.36 H new ATOM 0 HB1 ALA A 132 6.064 -19.987 0.115 1.00 0.00 H new ATOM 0 HB2 ALA A 132 6.402 -18.829 1.423 1.00 0.00 H new ATOM 0 HB3 ALA A 132 7.503 -20.198 1.140 1.00 0.00 H new ATOM 1474 N ILE A 133 5.982 -23.205 2.280 1.00 -0.73 N ATOM 1475 CA ILE A 133 7.425 -23.215 2.606 1.00 0.36 C ATOM 1476 C ILE A 133 7.783 -23.037 4.093 1.00 0.57 C ATOM 1477 O ILE A 133 8.905 -23.042 4.574 1.00 -0.57 O ATOM 1478 CB ILE A 133 8.151 -22.759 1.364 1.00 0.00 C ATOM 1479 CG1 ILE A 133 8.049 -23.914 0.366 1.00 0.00 C ATOM 1480 CG2 ILE A 133 9.437 -22.022 1.538 1.00 0.00 C ATOM 1481 CD1 ILE A 133 9.144 -24.931 0.414 1.00 0.00 C ATOM 0 HA ILE A 133 7.990 -24.132 2.774 1.00 0.36 H new ATOM 0 HB ILE A 133 7.666 -21.889 0.921 1.00 0.00 H new ATOM 0 HG12 ILE A 133 7.100 -24.425 0.530 1.00 0.00 H new ATOM 0 HG13 ILE A 133 8.015 -23.495 -0.640 1.00 0.00 H new ATOM 0 HG21 ILE A 133 9.841 -21.760 0.560 1.00 0.00 H new ATOM 0 HG22 ILE A 133 9.261 -21.113 2.113 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.150 -22.654 2.068 1.00 0.00 H new ATOM 0 HD11 ILE A 133 8.961 -25.698 -0.339 1.00 0.00 H new ATOM 0 HD12 ILE A 133 10.100 -24.446 0.214 1.00 0.00 H new ATOM 0 HD13 ILE A 133 9.170 -25.391 1.402 1.00 0.00 H new ATOM 1493 N GLU A 134 6.644 -23.298 4.824 1.00 -0.73 N ATOM 1494 CA GLU A 134 6.468 -24.119 5.969 1.00 0.36 C ATOM 1495 C GLU A 134 5.527 -25.308 5.662 1.00 0.57 C ATOM 1496 O GLU A 134 4.883 -26.004 6.396 1.00 -0.57 O ATOM 1497 CB GLU A 134 6.109 -23.485 7.261 1.00 0.00 C ATOM 1498 CG GLU A 134 4.653 -23.065 7.465 1.00 -0.11 C ATOM 1499 CD GLU A 134 3.673 -23.605 8.505 1.00 0.91 C ATOM 1500 OE1 GLU A 134 4.154 -24.354 9.402 1.00 -0.90 O ATOM 1501 OE2 GLU A 134 2.495 -23.144 8.412 1.00 -0.90 O ATOM 0 H GLU A 134 5.760 -22.867 4.554 1.00 -0.73 H new ATOM 0 HA GLU A 134 7.489 -24.452 6.157 1.00 0.36 H new ATOM 0 HB2 GLU A 134 6.373 -24.178 8.060 1.00 0.00 H new ATOM 0 HB3 GLU A 134 6.734 -22.601 7.386 1.00 0.00 H new ATOM 0 HG2 GLU A 134 4.684 -21.988 7.630 1.00 -0.11 H new ATOM 0 HG3 GLU A 134 4.169 -23.226 6.502 1.00 -0.11 H new ATOM 1508 N ARG A 135 5.856 -25.634 4.363 1.00 -0.73 N ATOM 1509 CA ARG A 135 5.948 -27.005 3.958 1.00 0.36 C ATOM 1510 C ARG A 135 7.207 -27.688 4.700 1.00 0.57 C ATOM 1511 O ARG A 135 7.157 -28.404 5.699 1.00 -0.57 O ATOM 1512 CB ARG A 135 6.517 -26.805 2.575 1.00 0.00 C ATOM 1513 CG ARG A 135 6.471 -28.013 1.637 1.00 0.00 C ATOM 1514 CD ARG A 135 7.089 -29.341 2.109 1.00 0.33 C ATOM 1515 NE ARG A 135 6.273 -29.976 3.148 1.00 -0.84 N ATOM 1516 CZ ARG A 135 6.650 -30.879 4.069 1.00 1.20 C ATOM 1517 NH1 ARG A 135 7.859 -31.400 4.118 1.00 -0.97 N ATOM 1518 NH2 ARG A 135 5.756 -31.241 4.980 1.00 -0.97 N ATOM 0 HA ARG A 135 5.026 -27.567 4.105 1.00 0.36 H new ATOM 0 HB2 ARG A 135 5.980 -25.984 2.100 1.00 0.00 H new ATOM 0 HB3 ARG A 135 7.556 -26.490 2.676 1.00 0.00 H new ATOM 0 HG2 ARG A 135 5.425 -28.203 1.394 1.00 0.00 H new ATOM 0 HG3 ARG A 135 6.967 -27.729 0.709 1.00 0.00 H new ATOM 0 HD2 ARG A 135 7.190 -30.018 1.261 1.00 0.33 H new ATOM 0 HD3 ARG A 135 8.093 -29.160 2.494 1.00 0.33 H new ATOM 0 HE ARG A 135 5.292 -29.696 3.175 1.00 -0.84 H new ATOM 0 HH11 ARG A 135 8.563 -31.121 3.434 1.00 -0.97 H new ATOM 0 HH12 ARG A 135 8.091 -32.082 4.840 1.00 -0.97 H new ATOM 0 HH21 ARG A 135 4.820 -30.836 4.965 1.00 -0.97 H new ATOM 0 HH22 ARG A 135 6.005 -31.924 5.695 1.00 -0.97 H new ATOM 1532 N TYR A 136 8.503 -27.413 4.190 1.00 -0.73 N ATOM 1533 CA TYR A 136 9.117 -26.116 4.493 1.00 0.36 C ATOM 1534 C TYR A 136 9.432 -26.397 5.938 1.00 0.57 C ATOM 1535 O TYR A 136 10.011 -27.414 6.278 1.00 -0.57 O ATOM 1536 CB TYR A 136 8.101 -25.046 4.446 1.00 0.14 C ATOM 1537 CG TYR A 136 7.039 -24.910 3.408 1.00 -0.14 C ATOM 1538 CD1 TYR A 136 6.843 -25.892 2.468 1.00 -0.15 C ATOM 1539 CD2 TYR A 136 6.537 -23.663 3.098 1.00 -0.15 C ATOM 1540 CE1 TYR A 136 6.411 -25.612 1.192 1.00 -0.15 C ATOM 1541 CE2 TYR A 136 6.429 -23.383 1.734 1.00 -0.15 C ATOM 1542 CZ TYR A 136 6.058 -24.355 0.832 1.00 0.08 C ATOM 1543 OH TYR A 136 5.782 -24.078 -0.465 1.00 -0.53 O ATOM 0 H TYR A 136 9.062 -28.047 3.619 1.00 -0.73 H new ATOM 0 HA TYR A 136 9.931 -25.802 3.839 1.00 0.36 H new ATOM 0 HB2 TYR A 136 7.579 -25.089 5.402 1.00 0.14 H new ATOM 0 HB3 TYR A 136 8.657 -24.108 4.428 1.00 0.14 H new ATOM 0 HD1 TYR A 136 7.035 -26.920 2.740 1.00 -0.15 H new ATOM 0 HD2 TYR A 136 6.247 -22.952 3.858 1.00 -0.15 H new ATOM 0 HE1 TYR A 136 6.352 -26.408 0.465 1.00 -0.15 H new ATOM 0 HE2 TYR A 136 6.641 -22.385 1.380 1.00 -0.15 H new ATOM 0 HH TYR A 136 5.677 -23.110 -0.578 1.00 -0.53 H new ATOM 1553 N VAL A 137 8.985 -25.514 6.856 1.00 -0.73 N ATOM 1554 CA VAL A 137 9.255 -25.669 8.296 1.00 0.36 C ATOM 1555 C VAL A 137 8.085 -26.519 8.850 1.00 0.57 C ATOM 1556 O VAL A 137 7.171 -26.166 9.580 1.00 -0.57 O ATOM 1557 CB VAL A 137 9.634 -24.301 8.820 1.00 0.00 C ATOM 1558 CG1 VAL A 137 8.644 -23.623 9.752 1.00 0.00 C ATOM 1559 CG2 VAL A 137 10.979 -24.302 9.555 1.00 0.00 C ATOM 0 H VAL A 137 8.436 -24.687 6.622 1.00 -0.73 H new ATOM 0 HA VAL A 137 10.115 -26.244 8.638 1.00 0.36 H new ATOM 0 HB VAL A 137 9.665 -23.731 7.891 1.00 0.00 H new ATOM 0 HG11 VAL A 137 9.035 -22.652 10.054 1.00 0.00 H new ATOM 0 HG12 VAL A 137 7.693 -23.487 9.236 1.00 0.00 H new ATOM 0 HG13 VAL A 137 8.492 -24.244 10.635 1.00 0.00 H new ATOM 0 HG21 VAL A 137 11.201 -23.295 9.909 1.00 0.00 H new ATOM 0 HG22 VAL A 137 10.929 -24.983 10.405 1.00 0.00 H new ATOM 0 HG23 VAL A 137 11.765 -24.628 8.874 1.00 0.00 H new ATOM 1569 N VAL A 138 8.160 -27.828 8.355 1.00 -0.73 N ATOM 1570 CA VAL A 138 9.168 -28.636 9.020 1.00 0.36 C ATOM 1571 C VAL A 138 10.384 -29.246 8.266 1.00 0.57 C ATOM 1572 O VAL A 138 11.519 -29.251 8.751 1.00 -0.57 O ATOM 1573 CB VAL A 138 8.570 -29.677 9.980 1.00 0.00 C ATOM 1574 CG1 VAL A 138 7.652 -29.073 11.042 1.00 0.00 C ATOM 1575 CG2 VAL A 138 7.809 -30.758 9.212 1.00 0.00 C ATOM 0 H VAL A 138 7.608 -28.255 7.611 1.00 -0.73 H new ATOM 0 HA VAL A 138 9.654 -27.807 9.534 1.00 0.36 H new ATOM 0 HB VAL A 138 9.422 -30.116 10.499 1.00 0.00 H new ATOM 0 HG11 VAL A 138 7.267 -29.866 11.683 1.00 0.00 H new ATOM 0 HG12 VAL A 138 8.213 -28.359 11.645 1.00 0.00 H new ATOM 0 HG13 VAL A 138 6.820 -28.563 10.556 1.00 0.00 H new ATOM 0 HG21 VAL A 138 7.396 -31.482 9.915 1.00 0.00 H new ATOM 0 HG22 VAL A 138 6.999 -30.300 8.645 1.00 0.00 H new ATOM 0 HG23 VAL A 138 8.489 -31.265 8.527 1.00 0.00 H new ATOM 1585 N VAL A 139 10.154 -29.746 7.027 1.00 -0.73 N ATOM 1586 CA VAL A 139 11.223 -30.177 6.068 1.00 0.36 C ATOM 1587 C VAL A 139 12.104 -29.013 5.508 1.00 0.57 C ATOM 1588 O VAL A 139 12.571 -29.020 4.372 1.00 -0.57 O ATOM 1589 CB VAL A 139 10.360 -30.511 4.859 1.00 0.00 C ATOM 1590 CG1 VAL A 139 11.205 -30.799 3.615 1.00 0.00 C ATOM 1591 CG2 VAL A 139 9.463 -31.728 5.116 1.00 0.00 C ATOM 0 H VAL A 139 9.213 -29.866 6.653 1.00 -0.73 H new ATOM 0 HA VAL A 139 11.875 -30.916 6.534 1.00 0.36 H new ATOM 0 HB VAL A 139 9.743 -29.629 4.686 1.00 0.00 H new ATOM 0 HG11 VAL A 139 10.550 -31.033 2.776 1.00 0.00 H new ATOM 0 HG12 VAL A 139 11.806 -29.923 3.373 1.00 0.00 H new ATOM 0 HG13 VAL A 139 11.862 -31.647 3.809 1.00 0.00 H new ATOM 0 HG21 VAL A 139 8.864 -31.932 4.229 1.00 0.00 H new ATOM 0 HG22 VAL A 139 10.083 -32.595 5.343 1.00 0.00 H new ATOM 0 HG23 VAL A 139 8.804 -31.523 5.959 1.00 0.00 H new ATOM 1601 N CYS A 140 12.444 -28.028 6.388 1.00 -0.73 N ATOM 1602 CA CYS A 140 13.303 -26.875 6.114 1.00 0.36 C ATOM 1603 C CYS A 140 13.488 -25.984 7.444 1.00 0.57 C ATOM 1604 O CYS A 140 13.622 -24.764 7.499 1.00 -0.57 O ATOM 1605 CB CYS A 140 14.638 -27.475 6.484 1.00 0.23 C ATOM 1606 SG CYS A 140 15.068 -29.061 5.665 1.00 -0.41 S ATOM 0 H CYS A 140 12.102 -28.032 7.349 1.00 -0.73 H new ATOM 0 HA CYS A 140 12.997 -26.405 5.179 1.00 0.36 H new ATOM 0 HB2 CYS A 140 15.416 -26.748 6.253 1.00 0.23 H new ATOM 0 HB3 CYS A 140 14.657 -27.630 7.563 1.00 0.23 H new ATOM 0 HG CYS A 140 14.224 -29.296 4.705 1.00 -0.41 H new ATOM 1612 N LYS A 141 13.791 -26.658 8.633 1.00 -0.73 N ATOM 1613 CA LYS A 141 14.681 -27.787 8.536 1.00 0.36 C ATOM 1614 C LYS A 141 14.689 -28.880 9.537 1.00 0.57 C ATOM 1615 O LYS A 141 14.643 -28.595 10.732 1.00 -0.57 O ATOM 1616 CB LYS A 141 16.173 -27.459 8.488 1.00 0.00 C ATOM 1617 CG LYS A 141 16.688 -26.149 7.900 1.00 0.00 C ATOM 1618 CD LYS A 141 16.551 -24.882 8.748 1.00 0.00 C ATOM 1619 CE LYS A 141 16.559 -23.610 7.882 1.00 0.50 C ATOM 1620 NZ LYS A 141 15.291 -22.878 8.040 1.00 -0.85 N ATOM 0 H LYS A 141 13.443 -26.428 9.564 1.00 -0.73 H new ATOM 0 HA LYS A 141 14.209 -28.125 7.613 1.00 0.36 H new ATOM 0 HB2 LYS A 141 16.541 -27.511 9.513 1.00 0.00 H new ATOM 0 HB3 LYS A 141 16.656 -28.265 7.935 1.00 0.00 H new ATOM 0 HG2 LYS A 141 17.744 -26.281 7.663 1.00 0.00 H new ATOM 0 HG3 LYS A 141 16.169 -25.978 6.957 1.00 0.00 H new ATOM 0 HD2 LYS A 141 15.624 -24.926 9.320 1.00 0.00 H new ATOM 0 HD3 LYS A 141 17.368 -24.837 9.468 1.00 0.00 H new ATOM 0 HE2 LYS A 141 17.394 -22.971 8.169 1.00 0.50 H new ATOM 0 HE3 LYS A 141 16.706 -23.875 6.835 1.00 0.50 H new ATOM 0 HZ1 LYS A 141 15.150 -22.248 7.225 1.00 -0.85 H new ATOM 0 HZ2 LYS A 141 14.504 -23.555 8.095 1.00 -0.85 H new ATOM 0 HZ3 LYS A 141 15.323 -22.313 8.912 1.00 -0.85 H new ATOM 1634 N PRO A 142 14.905 -30.195 8.979 1.00 -0.66 N ATOM 1635 CA PRO A 142 15.688 -31.198 9.723 1.00 0.36 C ATOM 1636 C PRO A 142 14.922 -31.484 10.966 1.00 0.57 C ATOM 1637 O PRO A 142 15.262 -32.188 11.896 1.00 -0.57 O ATOM 1638 CB PRO A 142 17.002 -30.723 9.214 1.00 0.00 C ATOM 1639 CG PRO A 142 16.735 -30.844 7.687 1.00 0.00 C ATOM 1640 CD PRO A 142 15.218 -30.558 7.632 1.00 0.30 C ATOM 0 HA PRO A 142 15.903 -32.266 9.738 1.00 0.36 H new ATOM 0 HB2 PRO A 142 17.228 -29.702 9.522 1.00 0.00 H new ATOM 0 HB3 PRO A 142 17.832 -31.347 9.546 1.00 0.00 H new ATOM 0 HG2 PRO A 142 17.312 -30.123 7.109 1.00 0.00 H new ATOM 0 HG3 PRO A 142 16.983 -31.833 7.302 1.00 0.00 H new ATOM 0 HD2 PRO A 142 14.985 -29.754 6.934 1.00 0.30 H new ATOM 0 HD3 PRO A 142 14.655 -31.434 7.310 1.00 0.30 H new ATOM 1648 N MET A 143 13.701 -30.863 10.750 1.00 -0.73 N ATOM 1649 CA MET A 143 12.430 -31.007 11.330 1.00 0.36 C ATOM 1650 C MET A 143 12.788 -30.812 12.822 1.00 0.57 C ATOM 1651 O MET A 143 12.203 -31.368 13.741 1.00 -0.57 O ATOM 1652 CB MET A 143 12.133 -32.381 10.842 1.00 0.00 C ATOM 1653 CG MET A 143 10.709 -32.836 11.031 1.00 0.23 C ATOM 1654 SD MET A 143 10.535 -34.538 10.434 1.00 -0.46 S ATOM 1655 CE MET A 143 8.780 -34.783 10.787 1.00 0.23 C ATOM 0 H MET A 143 13.654 -30.141 10.031 1.00 -0.73 H new ATOM 0 HA MET A 143 11.570 -30.369 11.125 1.00 0.36 H new ATOM 0 HB2 MET A 143 12.376 -32.433 9.781 1.00 0.00 H new ATOM 0 HB3 MET A 143 12.792 -33.082 11.354 1.00 0.00 H new ATOM 0 HG2 MET A 143 10.434 -32.779 12.084 1.00 0.23 H new ATOM 0 HG3 MET A 143 10.030 -32.178 10.488 1.00 0.23 H new ATOM 0 HE1 MET A 143 8.485 -35.787 10.484 1.00 0.23 H new ATOM 0 HE2 MET A 143 8.603 -34.660 11.855 1.00 0.23 H new ATOM 0 HE3 MET A 143 8.192 -34.050 10.235 1.00 0.23 H new ATOM 1665 N SER A 144 13.642 -29.749 13.069 1.00 -0.73 N ATOM 1666 CA SER A 144 15.090 -29.751 13.417 1.00 0.36 C ATOM 1667 C SER A 144 15.552 -30.575 14.614 1.00 0.57 C ATOM 1668 O SER A 144 16.730 -30.681 14.934 1.00 -0.57 O ATOM 1669 CB SER A 144 15.574 -28.320 13.611 1.00 0.28 C ATOM 1670 OG SER A 144 16.983 -28.137 13.656 1.00 -0.68 O ATOM 0 H SER A 144 13.287 -28.794 13.021 1.00 -0.73 H new ATOM 0 HA SER A 144 15.534 -30.257 12.560 1.00 0.36 H new ATOM 0 HB2 SER A 144 15.175 -27.710 12.801 1.00 0.28 H new ATOM 0 HB3 SER A 144 15.148 -27.937 14.538 1.00 0.28 H new ATOM 0 HG SER A 144 17.398 -28.901 14.108 1.00 -0.68 H new ATOM 1676 N ASN A 145 14.503 -31.036 15.351 1.00 -0.73 N ATOM 1677 CA ASN A 145 14.624 -31.750 16.622 1.00 0.36 C ATOM 1678 C ASN A 145 13.422 -32.688 16.873 1.00 0.57 C ATOM 1679 O ASN A 145 13.325 -33.427 17.843 1.00 -0.57 O ATOM 1680 CB ASN A 145 14.726 -30.729 17.725 1.00 0.06 C ATOM 1681 CG ASN A 145 15.621 -31.115 18.869 1.00 0.57 C ATOM 1682 OD1 ASN A 145 16.199 -32.185 18.982 1.00 -0.57 O ATOM 1683 ND2 ASN A 145 15.733 -30.140 19.823 1.00 -0.80 N ATOM 0 H ASN A 145 13.534 -30.911 15.057 1.00 -0.73 H new ATOM 0 HA ASN A 145 15.515 -32.378 16.593 1.00 0.36 H new ATOM 0 HB2 ASN A 145 15.088 -29.793 17.300 1.00 0.06 H new ATOM 0 HB3 ASN A 145 13.726 -30.537 18.115 1.00 0.06 H new ATOM 0 HD21 ASN A 145 16.309 -30.299 20.650 1.00 -0.80 H new ATOM 0 HD22 ASN A 145 15.241 -29.254 19.707 1.00 -0.80 H new ATOM 1690 N PHE A 146 12.385 -32.486 16.001 1.00 -0.73 N ATOM 1691 CA PHE A 146 11.100 -33.193 15.887 1.00 0.36 C ATOM 1692 C PHE A 146 10.111 -32.459 16.790 1.00 0.57 C ATOM 1693 O PHE A 146 8.934 -32.755 16.942 1.00 -0.57 O ATOM 1694 CB PHE A 146 11.117 -34.712 16.056 1.00 0.14 C ATOM 1695 CG PHE A 146 11.803 -35.476 14.940 1.00 -0.14 C ATOM 1696 CD1 PHE A 146 12.793 -34.956 14.151 1.00 -0.15 C ATOM 1697 CD2 PHE A 146 11.502 -36.791 14.704 1.00 -0.15 C ATOM 1698 CE1 PHE A 146 13.437 -35.661 13.135 1.00 -0.15 C ATOM 1699 CE2 PHE A 146 12.102 -37.559 13.706 1.00 -0.15 C ATOM 1700 CZ PHE A 146 13.078 -36.981 12.904 1.00 -0.15 C ATOM 0 H PHE A 146 12.451 -31.749 15.299 1.00 -0.73 H new ATOM 0 HA PHE A 146 10.783 -33.149 14.845 1.00 0.36 H new ATOM 0 HB2 PHE A 146 11.612 -34.952 16.997 1.00 0.14 H new ATOM 0 HB3 PHE A 146 10.089 -35.064 16.138 1.00 0.14 H new ATOM 0 HD1 PHE A 146 13.095 -33.934 14.327 1.00 -0.15 H new ATOM 0 HD2 PHE A 146 10.756 -37.261 15.327 1.00 -0.15 H new ATOM 0 HE1 PHE A 146 14.202 -35.188 12.538 1.00 -0.15 H new ATOM 0 HE2 PHE A 146 11.812 -38.589 13.559 1.00 -0.15 H new ATOM 0 HZ PHE A 146 13.549 -37.549 12.115 1.00 -0.15 H new ATOM 1710 N ARG A 147 10.656 -31.262 17.247 1.00 -0.73 N ATOM 1711 CA ARG A 147 10.183 -30.076 16.625 1.00 0.36 C ATOM 1712 C ARG A 147 11.039 -29.526 15.508 1.00 0.57 C ATOM 1713 O ARG A 147 10.563 -29.169 14.431 1.00 -0.57 O ATOM 1714 CB ARG A 147 9.766 -29.130 17.680 1.00 0.00 C ATOM 1715 CG ARG A 147 8.590 -28.268 17.324 1.00 0.00 C ATOM 1716 CD ARG A 147 8.046 -27.670 18.621 1.00 0.33 C ATOM 1717 NE ARG A 147 6.963 -26.729 18.421 1.00 -0.84 N ATOM 1718 CZ ARG A 147 6.160 -26.257 19.382 1.00 1.20 C ATOM 1719 NH1 ARG A 147 6.091 -26.836 20.589 1.00 -0.97 N ATOM 1720 NH2 ARG A 147 5.404 -25.181 19.173 1.00 -0.97 N ATOM 0 H ARG A 147 11.357 -31.152 17.980 1.00 -0.73 H new ATOM 0 HA ARG A 147 9.300 -30.318 16.034 1.00 0.36 H new ATOM 0 HB2 ARG A 147 9.525 -29.695 18.580 1.00 0.00 H new ATOM 0 HB3 ARG A 147 10.610 -28.485 17.925 1.00 0.00 H new ATOM 0 HG2 ARG A 147 8.889 -27.479 16.634 1.00 0.00 H new ATOM 0 HG3 ARG A 147 7.822 -28.856 16.822 1.00 0.00 H new ATOM 0 HD2 ARG A 147 7.699 -28.478 19.265 1.00 0.33 H new ATOM 0 HD3 ARG A 147 8.858 -27.169 19.148 1.00 0.33 H new ATOM 0 HE ARG A 147 6.799 -26.399 17.470 1.00 -0.84 H new ATOM 0 HH11 ARG A 147 6.659 -27.658 20.794 1.00 -0.97 H new ATOM 0 HH12 ARG A 147 5.470 -26.455 21.303 1.00 -0.97 H new ATOM 0 HH21 ARG A 147 5.432 -24.705 18.271 1.00 -0.97 H new ATOM 0 HH22 ARG A 147 4.797 -24.833 19.915 1.00 -0.97 H new ATOM 1734 N PHE A 148 12.299 -29.124 15.917 1.00 -0.73 N ATOM 1735 CA PHE A 148 12.265 -27.714 16.200 1.00 0.36 C ATOM 1736 C PHE A 148 12.726 -26.827 15.078 1.00 0.57 C ATOM 1737 O PHE A 148 12.890 -25.629 15.258 1.00 -0.57 O ATOM 1738 CB PHE A 148 12.594 -27.399 17.653 1.00 0.14 C ATOM 1739 CG PHE A 148 13.927 -26.881 18.038 1.00 -0.14 C ATOM 1740 CD1 PHE A 148 14.945 -27.088 17.169 1.00 -0.15 C ATOM 1741 CD2 PHE A 148 14.230 -26.280 19.222 1.00 -0.15 C ATOM 1742 CE1 PHE A 148 16.258 -26.721 17.401 1.00 -0.15 C ATOM 1743 CE2 PHE A 148 15.527 -25.875 19.532 1.00 -0.15 C ATOM 1744 CZ PHE A 148 16.551 -26.099 18.610 1.00 -0.15 C ATOM 0 H PHE A 148 13.162 -29.656 16.030 1.00 -0.73 H new ATOM 0 HA PHE A 148 11.232 -27.368 16.180 1.00 0.36 H new ATOM 0 HB2 PHE A 148 11.858 -26.673 17.997 1.00 0.14 H new ATOM 0 HB3 PHE A 148 12.430 -28.313 18.223 1.00 0.14 H new ATOM 0 HD1 PHE A 148 14.716 -27.572 16.231 1.00 -0.15 H new ATOM 0 HD2 PHE A 148 13.442 -26.112 19.942 1.00 -0.15 H new ATOM 0 HE1 PHE A 148 17.029 -26.911 16.669 1.00 -0.15 H new ATOM 0 HE2 PHE A 148 15.738 -25.393 20.475 1.00 -0.15 H new ATOM 0 HZ PHE A 148 17.562 -25.792 18.834 1.00 -0.15 H new ATOM 1754 N GLY A 149 12.676 -27.468 13.875 1.00 -0.73 N ATOM 1755 CA GLY A 149 11.898 -27.017 12.734 1.00 0.36 C ATOM 1756 C GLY A 149 10.443 -26.552 12.971 1.00 0.57 C ATOM 1757 O GLY A 149 9.682 -26.339 12.032 1.00 -0.57 O ATOM 0 H GLY A 149 13.193 -28.327 13.691 1.00 -0.73 H new ATOM 0 HA2 GLY A 149 12.438 -26.192 12.270 1.00 0.36 H new ATOM 0 HA3 GLY A 149 11.872 -27.830 12.008 1.00 0.36 H new ATOM 1761 N GLU A 150 10.220 -26.131 14.269 1.00 -0.73 N ATOM 1762 CA GLU A 150 9.575 -24.858 14.566 1.00 0.36 C ATOM 1763 C GLU A 150 10.355 -23.710 13.834 1.00 0.57 C ATOM 1764 O GLU A 150 9.908 -22.581 13.639 1.00 -0.57 O ATOM 1765 CB GLU A 150 9.690 -24.661 16.075 1.00 0.00 C ATOM 1766 CG GLU A 150 8.719 -23.627 16.619 1.00 -0.11 C ATOM 1767 CD GLU A 150 7.329 -24.204 16.801 1.00 0.91 C ATOM 1768 OE1 GLU A 150 7.107 -25.363 16.340 1.00 -0.90 O ATOM 1769 OE2 GLU A 150 6.533 -23.585 17.560 1.00 -0.90 O ATOM 0 H GLU A 150 10.485 -26.669 15.094 1.00 -0.73 H new ATOM 0 HA GLU A 150 8.535 -24.845 14.240 1.00 0.36 H new ATOM 0 HB2 GLU A 150 9.513 -25.614 16.574 1.00 0.00 H new ATOM 0 HB3 GLU A 150 10.708 -24.358 16.319 1.00 0.00 H new ATOM 0 HG2 GLU A 150 9.085 -23.251 17.575 1.00 -0.11 H new ATOM 0 HG3 GLU A 150 8.674 -22.777 15.938 1.00 -0.11 H new ATOM 1776 N ASN A 151 11.703 -24.040 13.678 1.00 -0.73 N ATOM 1777 CA ASN A 151 12.772 -23.101 13.634 1.00 0.36 C ATOM 1778 C ASN A 151 12.603 -22.334 14.982 1.00 0.57 C ATOM 1779 O ASN A 151 11.605 -22.168 15.682 1.00 -0.57 O ATOM 1780 CB ASN A 151 12.692 -22.203 12.390 1.00 0.06 C ATOM 1781 CG ASN A 151 13.819 -21.231 12.136 1.00 0.57 C ATOM 1782 OD1 ASN A 151 14.877 -21.172 12.750 1.00 -0.57 O ATOM 1783 ND2 ASN A 151 13.601 -20.424 11.050 1.00 -0.80 N ATOM 0 H ASN A 151 12.020 -25.005 13.582 1.00 -0.73 H new ATOM 0 HA ASN A 151 13.760 -23.552 13.542 1.00 0.36 H new ATOM 0 HB2 ASN A 151 12.608 -22.851 11.517 1.00 0.06 H new ATOM 0 HB3 ASN A 151 11.767 -21.630 12.452 1.00 0.06 H new ATOM 0 HD22 ASN A 151 12.717 -20.478 10.543 1.00 -0.80 H new ATOM 1790 N HIS A 152 13.711 -21.686 15.400 1.00 -0.73 N ATOM 1791 CA HIS A 152 14.120 -20.551 14.570 1.00 0.36 C ATOM 1792 C HIS A 152 13.055 -19.855 13.625 1.00 0.57 C ATOM 1793 O HIS A 152 13.348 -19.140 12.680 1.00 -0.57 O ATOM 1794 CB HIS A 152 15.521 -20.668 13.998 1.00 0.18 C ATOM 1795 CG HIS A 152 15.787 -21.112 12.597 1.00 -0.33 C ATOM 1796 ND1 HIS A 152 17.038 -21.587 12.277 1.00 0.03 N ATOM 1797 CD2 HIS A 152 15.099 -21.173 11.400 1.00 0.08 C ATOM 1798 CE1 HIS A 152 17.052 -21.917 10.959 1.00 0.04 C ATOM 1799 NE2 HIS A 152 15.880 -21.719 10.399 1.00 -0.57 N ATOM 0 H HIS A 152 14.281 -21.901 16.218 1.00 -0.73 H new ATOM 0 HA HIS A 152 14.173 -19.775 15.334 1.00 0.36 H new ATOM 0 HB2 HIS A 152 15.984 -19.687 14.106 1.00 0.18 H new ATOM 0 HB3 HIS A 152 16.066 -21.351 14.649 1.00 0.18 H new ATOM 0 HD1 HIS A 152 17.824 -21.676 12.921 1.00 0.03 H new ATOM 0 HD2 HIS A 152 14.082 -20.837 11.264 1.00 0.08 H new ATOM 0 HE1 HIS A 152 17.919 -22.295 10.437 1.00 0.04 H new ATOM 1807 N ALA A 153 11.755 -19.894 14.072 1.00 -0.73 N ATOM 1808 CA ALA A 153 10.638 -19.125 13.480 1.00 0.36 C ATOM 1809 C ALA A 153 9.562 -18.853 14.469 1.00 0.57 C ATOM 1810 O ALA A 153 9.025 -17.752 14.494 1.00 -0.57 O ATOM 1811 CB ALA A 153 10.148 -19.683 12.171 1.00 0.00 C ATOM 0 H ALA A 153 11.466 -20.471 14.862 1.00 -0.73 H new ATOM 0 HA ALA A 153 11.044 -18.150 13.210 1.00 0.36 H new ATOM 0 HB1 ALA A 153 9.329 -19.068 11.797 1.00 0.00 H new ATOM 0 HB2 ALA A 153 10.963 -19.682 11.447 1.00 0.00 H new ATOM 0 HB3 ALA A 153 9.796 -20.704 12.320 1.00 0.00 H new ATOM 1817 N ILE A 154 9.512 -19.767 15.494 1.00 -0.73 N ATOM 1818 CA ILE A 154 9.655 -19.092 16.752 1.00 0.36 C ATOM 1819 C ILE A 154 11.031 -18.337 16.777 1.00 0.57 C ATOM 1820 O ILE A 154 11.109 -17.110 16.895 1.00 -0.57 O ATOM 1821 CB ILE A 154 9.533 -20.021 17.941 1.00 0.00 C ATOM 1822 CG1 ILE A 154 8.100 -20.508 18.260 1.00 0.00 C ATOM 1823 CG2 ILE A 154 10.005 -19.163 19.113 1.00 0.00 C ATOM 1824 CD1 ILE A 154 7.075 -20.454 17.136 1.00 0.00 C ATOM 0 H ILE A 154 9.395 -20.780 15.467 1.00 -0.73 H new ATOM 0 HA ILE A 154 8.834 -18.381 16.841 1.00 0.36 H new ATOM 0 HB ILE A 154 10.100 -20.930 17.742 1.00 0.00 H new ATOM 0 HG12 ILE A 154 8.164 -21.539 18.608 1.00 0.00 H new ATOM 0 HG13 ILE A 154 7.720 -19.914 19.091 1.00 0.00 H new ATOM 0 HG21 ILE A 154 9.956 -19.745 20.033 1.00 0.00 H new ATOM 0 HG22 ILE A 154 11.033 -18.844 18.940 1.00 0.00 H new ATOM 0 HG23 ILE A 154 9.363 -18.287 19.204 1.00 0.00 H new ATOM 0 HD11 ILE A 154 6.117 -20.824 17.500 1.00 0.00 H new ATOM 0 HD12 ILE A 154 6.961 -19.424 16.797 1.00 0.00 H new ATOM 0 HD13 ILE A 154 7.412 -21.074 16.306 1.00 0.00 H new ATOM 1836 N MET A 155 12.198 -19.101 16.697 1.00 -0.73 N ATOM 1837 CA MET A 155 13.422 -18.372 17.078 1.00 0.36 C ATOM 1838 C MET A 155 13.915 -17.334 16.030 1.00 0.57 C ATOM 1839 O MET A 155 14.801 -16.522 16.270 1.00 -0.57 O ATOM 1840 CB MET A 155 14.561 -19.226 17.651 1.00 0.00 C ATOM 1841 CG MET A 155 15.077 -18.642 18.968 1.00 0.23 C ATOM 1842 SD MET A 155 16.468 -19.624 19.612 1.00 -0.46 S ATOM 1843 CE MET A 155 17.804 -18.932 18.601 1.00 0.23 C ATOM 0 H MET A 155 12.290 -20.076 16.413 1.00 -0.73 H new ATOM 0 HA MET A 155 13.073 -17.788 17.929 1.00 0.36 H new ATOM 0 HB2 MET A 155 14.209 -20.245 17.814 1.00 0.00 H new ATOM 0 HB3 MET A 155 15.376 -19.282 16.930 1.00 0.00 H new ATOM 0 HG2 MET A 155 15.395 -17.611 18.814 1.00 0.23 H new ATOM 0 HG3 MET A 155 14.271 -18.621 19.702 1.00 0.23 H new ATOM 0 HE1 MET A 155 18.757 -19.353 18.920 1.00 0.23 H new ATOM 0 HE2 MET A 155 17.631 -19.177 17.553 1.00 0.23 H new ATOM 0 HE3 MET A 155 17.828 -17.849 18.721 1.00 0.23 H new ATOM 1853 N GLY A 156 13.244 -17.376 14.844 1.00 -0.73 N ATOM 1854 CA GLY A 156 13.284 -16.430 13.783 1.00 0.36 C ATOM 1855 C GLY A 156 12.341 -15.293 14.066 1.00 0.57 C ATOM 1856 O GLY A 156 12.487 -14.245 13.449 1.00 -0.57 O ATOM 0 H GLY A 156 12.620 -18.153 14.626 1.00 -0.73 H new ATOM 0 HA2 GLY A 156 14.298 -16.050 13.663 1.00 0.36 H new ATOM 0 HA3 GLY A 156 13.012 -16.913 12.845 1.00 0.36 H new ATOM 1860 N VAL A 157 11.428 -15.447 15.089 1.00 -0.73 N ATOM 1861 CA VAL A 157 10.774 -14.277 15.652 1.00 0.36 C ATOM 1862 C VAL A 157 11.800 -13.434 16.407 1.00 0.57 C ATOM 1863 O VAL A 157 11.683 -12.219 16.550 1.00 -0.57 O ATOM 1864 CB VAL A 157 9.481 -14.463 16.477 1.00 0.00 C ATOM 1865 CG1 VAL A 157 8.921 -13.126 16.997 1.00 0.00 C ATOM 1866 CG2 VAL A 157 8.367 -15.152 15.689 1.00 0.00 C ATOM 0 H VAL A 157 11.159 -16.339 15.503 1.00 -0.73 H new ATOM 0 HA VAL A 157 10.383 -13.765 14.773 1.00 0.36 H new ATOM 0 HB VAL A 157 9.781 -15.095 17.313 1.00 0.00 H new ATOM 0 HG11 VAL A 157 8.013 -13.310 17.570 1.00 0.00 H new ATOM 0 HG12 VAL A 157 9.662 -12.645 17.636 1.00 0.00 H new ATOM 0 HG13 VAL A 157 8.692 -12.475 16.153 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.485 -15.255 16.321 1.00 0.00 H new ATOM 0 HG22 VAL A 157 8.118 -14.554 14.812 1.00 0.00 H new ATOM 0 HG23 VAL A 157 8.703 -16.139 15.371 1.00 0.00 H new ATOM 1876 N ALA A 158 12.854 -14.159 16.908 1.00 -0.73 N ATOM 1877 CA ALA A 158 14.016 -13.432 17.416 1.00 0.36 C ATOM 1878 C ALA A 158 15.152 -13.141 16.442 1.00 0.57 C ATOM 1879 O ALA A 158 16.008 -12.289 16.661 1.00 -0.57 O ATOM 1880 CB ALA A 158 14.515 -13.996 18.725 1.00 0.00 C ATOM 0 H ALA A 158 12.905 -15.176 16.961 1.00 -0.73 H new ATOM 0 HA ALA A 158 13.605 -12.438 17.591 1.00 0.36 H new ATOM 0 HB1 ALA A 158 15.379 -13.423 19.062 1.00 0.00 H new ATOM 0 HB2 ALA A 158 13.724 -13.934 19.473 1.00 0.00 H new ATOM 0 HB3 ALA A 158 14.803 -15.038 18.586 1.00 0.00 H new ATOM 1886 N PHE A 159 15.031 -13.820 15.260 1.00 -0.73 N ATOM 1887 CA PHE A 159 15.611 -13.240 14.072 1.00 0.36 C ATOM 1888 C PHE A 159 14.809 -12.009 13.585 1.00 0.57 C ATOM 1889 O PHE A 159 15.273 -11.212 12.772 1.00 -0.57 O ATOM 1890 CB PHE A 159 15.734 -14.154 12.873 1.00 0.14 C ATOM 1891 CG PHE A 159 16.608 -15.386 12.943 1.00 -0.14 C ATOM 1892 CD1 PHE A 159 17.417 -15.703 14.040 1.00 -0.15 C ATOM 1893 CD2 PHE A 159 16.616 -16.251 11.835 1.00 -0.15 C ATOM 1894 CE1 PHE A 159 18.210 -16.854 14.032 1.00 -0.15 C ATOM 1895 CE2 PHE A 159 17.407 -17.402 11.828 1.00 -0.15 C ATOM 1896 CZ PHE A 159 18.209 -17.701 12.927 1.00 -0.15 C ATOM 0 H PHE A 159 14.560 -14.716 15.135 1.00 -0.73 H new ATOM 0 HA PHE A 159 16.615 -12.988 14.413 1.00 0.36 H new ATOM 0 HB2 PHE A 159 14.728 -14.485 12.615 1.00 0.14 H new ATOM 0 HB3 PHE A 159 16.094 -13.549 12.041 1.00 0.14 H new ATOM 0 HD1 PHE A 159 17.429 -15.052 14.901 1.00 -0.15 H new ATOM 0 HD2 PHE A 159 16.002 -16.022 10.977 1.00 -0.15 H new ATOM 0 HE1 PHE A 159 18.827 -17.088 14.887 1.00 -0.15 H new ATOM 0 HE2 PHE A 159 17.397 -18.060 10.971 1.00 -0.15 H new ATOM 0 HZ PHE A 159 18.828 -18.586 12.922 1.00 -0.15 H new ATOM 1906 N THR A 160 13.505 -11.921 14.045 1.00 -0.73 N ATOM 1907 CA THR A 160 12.621 -11.044 13.271 1.00 0.36 C ATOM 1908 C THR A 160 12.993 -9.626 13.700 1.00 0.57 C ATOM 1909 O THR A 160 13.319 -8.724 12.932 1.00 -0.57 O ATOM 1910 CB THR A 160 11.104 -11.253 13.475 1.00 0.28 C ATOM 1911 OG1 THR A 160 10.652 -12.379 12.710 1.00 -0.68 O ATOM 1912 CG2 THR A 160 10.259 -10.057 13.053 1.00 0.00 C ATOM 0 H THR A 160 13.104 -12.396 14.854 1.00 -0.73 H new ATOM 0 HA THR A 160 12.773 -11.263 12.214 1.00 0.36 H new ATOM 0 HB THR A 160 10.976 -11.407 14.547 1.00 0.28 H new ATOM 0 HG1 THR A 160 11.306 -13.105 12.779 1.00 -0.68 H new ATOM 0 HG21 THR A 160 9.205 -10.277 13.225 1.00 0.00 H new ATOM 0 HG22 THR A 160 10.548 -9.183 13.637 1.00 0.00 H new ATOM 0 HG23 THR A 160 10.419 -9.854 11.994 1.00 0.00 H new ATOM 1920 N TRP A 161 12.910 -9.422 15.078 1.00 -0.73 N ATOM 1921 CA TRP A 161 13.405 -8.152 15.572 1.00 0.36 C ATOM 1922 C TRP A 161 14.909 -8.018 15.422 1.00 0.57 C ATOM 1923 O TRP A 161 15.478 -6.934 15.526 1.00 -0.57 O ATOM 1924 CB TRP A 161 12.975 -7.777 16.978 1.00 0.18 C ATOM 1925 CG TRP A 161 13.544 -8.641 18.066 1.00 -0.18 C ATOM 1926 CD1 TRP A 161 14.850 -8.636 18.512 1.00 -0.30 C ATOM 1927 CD2 TRP A 161 12.853 -9.594 18.882 1.00 0.00 C ATOM 1928 NE1 TRP A 161 14.952 -9.564 19.505 1.00 0.03 N ATOM 1929 CE2 TRP A 161 13.751 -10.149 19.778 1.00 -0.15 C ATOM 1930 CE3 TRP A 161 11.529 -10.036 18.953 1.00 -0.15 C ATOM 1931 CZ2 TRP A 161 13.404 -11.108 20.737 1.00 -0.15 C ATOM 1932 CZ3 TRP A 161 11.137 -10.990 19.895 1.00 -0.15 C ATOM 1933 CH2 TRP A 161 12.069 -11.519 20.780 1.00 -0.15 C ATOM 0 H TRP A 161 12.538 -10.073 15.769 1.00 -0.73 H new ATOM 0 HA TRP A 161 12.915 -7.429 14.920 1.00 0.36 H new ATOM 0 HB2 TRP A 161 13.264 -6.743 17.167 1.00 0.18 H new ATOM 0 HB3 TRP A 161 11.887 -7.819 17.033 1.00 0.18 H new ATOM 0 HD1 TRP A 161 15.648 -8.010 18.141 1.00 -0.30 H new ATOM 0 HE1 TRP A 161 15.822 -9.793 19.986 1.00 0.03 H new ATOM 0 HE3 TRP A 161 10.797 -9.633 18.268 1.00 -0.15 H new ATOM 0 HZ2 TRP A 161 14.139 -11.514 21.417 1.00 -0.15 H new ATOM 0 HZ3 TRP A 161 10.108 -11.317 19.936 1.00 -0.15 H new ATOM 0 HH2 TRP A 161 11.759 -12.254 21.508 1.00 -0.15 H new ATOM 1944 N VAL A 162 15.569 -9.146 15.032 1.00 -0.73 N ATOM 1945 CA VAL A 162 16.939 -9.021 14.579 1.00 0.36 C ATOM 1946 C VAL A 162 17.017 -8.147 13.292 1.00 0.57 C ATOM 1947 O VAL A 162 17.987 -7.413 13.111 1.00 -0.57 O ATOM 1948 CB VAL A 162 17.570 -10.409 14.550 1.00 0.00 C ATOM 1949 CG1 VAL A 162 18.330 -10.750 13.270 1.00 0.00 C ATOM 1950 CG2 VAL A 162 18.512 -10.593 15.748 1.00 0.00 C ATOM 0 H VAL A 162 15.182 -10.090 15.029 1.00 -0.73 H new ATOM 0 HA VAL A 162 17.565 -8.456 15.270 1.00 0.36 H new ATOM 0 HB VAL A 162 16.725 -11.096 14.597 1.00 0.00 H new ATOM 0 HG11 VAL A 162 18.741 -11.757 13.348 1.00 0.00 H new ATOM 0 HG12 VAL A 162 17.651 -10.700 12.419 1.00 0.00 H new ATOM 0 HG13 VAL A 162 19.142 -10.037 13.128 1.00 0.00 H new ATOM 0 HG21 VAL A 162 18.955 -11.588 15.713 1.00 0.00 H new ATOM 0 HG22 VAL A 162 19.302 -9.843 15.708 1.00 0.00 H new ATOM 0 HG23 VAL A 162 17.949 -10.478 16.674 1.00 0.00 H new ATOM 1960 N MET A 163 15.986 -8.229 12.387 1.00 -0.73 N ATOM 1961 CA MET A 163 15.793 -7.307 11.250 1.00 0.36 C ATOM 1962 C MET A 163 14.634 -6.303 11.496 1.00 0.57 C ATOM 1963 O MET A 163 14.044 -5.707 10.604 1.00 -0.57 O ATOM 1964 CB MET A 163 15.564 -8.023 9.923 1.00 0.00 C ATOM 1965 CG MET A 163 16.707 -8.910 9.444 1.00 0.23 C ATOM 1966 SD MET A 163 18.098 -7.962 8.735 1.00 -0.46 S ATOM 1967 CE MET A 163 19.224 -9.344 8.434 1.00 0.23 C ATOM 0 H MET A 163 15.267 -8.950 12.441 1.00 -0.73 H new ATOM 0 HA MET A 163 16.732 -6.758 11.178 1.00 0.36 H new ATOM 0 HB2 MET A 163 14.666 -8.635 10.012 1.00 0.00 H new ATOM 0 HB3 MET A 163 15.364 -7.274 9.157 1.00 0.00 H new ATOM 0 HG2 MET A 163 17.071 -9.508 10.280 1.00 0.23 H new ATOM 0 HG3 MET A 163 16.330 -9.606 8.695 1.00 0.23 H new ATOM 0 HE1 MET A 163 20.149 -8.971 7.995 1.00 0.23 H new ATOM 0 HE2 MET A 163 19.446 -9.845 9.377 1.00 0.23 H new ATOM 0 HE3 MET A 163 18.757 -10.051 7.749 1.00 0.23 H new ATOM 1977 N ALA A 164 14.548 -5.880 12.805 1.00 -0.73 N ATOM 1978 CA ALA A 164 13.743 -4.724 13.216 1.00 0.36 C ATOM 1979 C ALA A 164 14.555 -3.892 14.233 1.00 0.57 C ATOM 1980 O ALA A 164 14.222 -2.763 14.579 1.00 -0.57 O ATOM 1981 CB ALA A 164 12.373 -5.079 13.759 1.00 0.00 C ATOM 0 H ALA A 164 15.035 -6.338 13.575 1.00 -0.73 H new ATOM 0 HA ALA A 164 13.536 -4.137 12.321 1.00 0.36 H new ATOM 0 HB1 ALA A 164 11.845 -4.167 14.039 1.00 0.00 H new ATOM 0 HB2 ALA A 164 11.804 -5.607 12.994 1.00 0.00 H new ATOM 0 HB3 ALA A 164 12.483 -5.718 14.635 1.00 0.00 H new ATOM 1987 N LEU A 165 15.685 -4.512 14.722 1.00 -0.73 N ATOM 1988 CA LEU A 165 16.874 -3.803 15.144 1.00 0.36 C ATOM 1989 C LEU A 165 17.773 -3.702 13.913 1.00 0.57 C ATOM 1990 O LEU A 165 18.667 -2.853 13.864 1.00 -0.57 O ATOM 1991 CB LEU A 165 17.567 -4.560 16.280 1.00 0.00 C ATOM 1992 CG LEU A 165 18.786 -3.853 16.907 1.00 0.00 C ATOM 1993 CD1 LEU A 165 18.418 -2.521 17.560 1.00 0.00 C ATOM 1994 CD2 LEU A 165 19.437 -4.774 17.942 1.00 0.00 C ATOM 0 H LEU A 165 15.761 -5.524 14.821 1.00 -0.73 H new ATOM 0 HA LEU A 165 16.637 -2.811 15.528 1.00 0.36 H new ATOM 0 HB2 LEU A 165 16.836 -4.749 17.066 1.00 0.00 H new ATOM 0 HB3 LEU A 165 17.887 -5.531 15.903 1.00 0.00 H new ATOM 0 HG LEU A 165 19.487 -3.635 16.101 1.00 0.00 H new ATOM 0 HD11 LEU A 165 19.312 -2.065 17.986 1.00 0.00 H new ATOM 0 HD12 LEU A 165 17.992 -1.854 16.811 1.00 0.00 H new ATOM 0 HD13 LEU A 165 17.687 -2.693 18.350 1.00 0.00 H new ATOM 0 HD21 LEU A 165 20.298 -4.273 18.384 1.00 0.00 H new ATOM 0 HD22 LEU A 165 18.715 -5.011 18.723 1.00 0.00 H new ATOM 0 HD23 LEU A 165 19.762 -5.694 17.457 1.00 0.00 H new ATOM 2006 N ALA A 166 17.529 -4.587 12.871 1.00 -0.73 N ATOM 2007 CA ALA A 166 18.269 -4.450 11.627 1.00 0.36 C ATOM 2008 C ALA A 166 17.494 -3.963 10.399 1.00 0.57 C ATOM 2009 O ALA A 166 18.035 -3.705 9.329 1.00 -0.57 O ATOM 2010 CB ALA A 166 19.346 -5.478 11.357 1.00 0.00 C ATOM 0 H ALA A 166 16.855 -5.352 12.898 1.00 -0.73 H new ATOM 0 HA ALA A 166 18.858 -3.565 11.869 1.00 0.36 H new ATOM 0 HB1 ALA A 166 19.821 -5.264 10.400 1.00 0.00 H new ATOM 0 HB2 ALA A 166 20.093 -5.439 12.150 1.00 0.00 H new ATOM 0 HB3 ALA A 166 18.900 -6.472 11.327 1.00 0.00 H new ATOM 2016 N CYS A 167 16.203 -3.621 10.715 1.00 -0.73 N ATOM 2017 CA CYS A 167 15.488 -2.533 10.070 1.00 0.36 C ATOM 2018 C CYS A 167 15.114 -1.496 11.142 1.00 0.57 C ATOM 2019 O CYS A 167 14.231 -0.658 10.993 1.00 -0.57 O ATOM 2020 CB CYS A 167 14.270 -2.928 9.252 1.00 0.23 C ATOM 2021 SG CYS A 167 14.668 -4.154 7.973 1.00 -0.41 S ATOM 0 H CYS A 167 15.655 -4.107 11.425 1.00 -0.73 H new ATOM 0 HA CYS A 167 16.170 -2.120 9.326 1.00 0.36 H new ATOM 0 HB2 CYS A 167 13.505 -3.333 9.915 1.00 0.23 H new ATOM 0 HB3 CYS A 167 13.847 -2.040 8.782 1.00 0.23 H new ATOM 0 HG CYS A 167 14.593 -5.349 8.479 1.00 -0.41 H new ATOM 2027 N ALA A 168 16.018 -1.472 12.196 1.00 -0.73 N ATOM 2028 CA ALA A 168 16.330 -0.198 12.829 1.00 0.36 C ATOM 2029 C ALA A 168 17.681 0.328 12.314 1.00 0.57 C ATOM 2030 O ALA A 168 17.905 1.532 12.207 1.00 -0.57 O ATOM 2031 CB ALA A 168 16.402 -0.275 14.342 1.00 0.00 C ATOM 0 H ALA A 168 16.498 -2.286 12.580 1.00 -0.73 H new ATOM 0 HA ALA A 168 15.512 0.473 12.567 1.00 0.36 H new ATOM 0 HB1 ALA A 168 16.638 0.710 14.746 1.00 0.00 H new ATOM 0 HB2 ALA A 168 15.441 -0.608 14.736 1.00 0.00 H new ATOM 0 HB3 ALA A 168 17.178 -0.982 14.634 1.00 0.00 H new ATOM 2037 N ALA A 169 18.667 -0.629 12.110 1.00 -0.73 N ATOM 2038 CA ALA A 169 20.049 -0.181 12.047 1.00 0.36 C ATOM 2039 C ALA A 169 20.256 0.802 10.901 1.00 0.57 C ATOM 2040 O ALA A 169 20.662 1.935 11.183 1.00 -0.57 O ATOM 2041 CB ALA A 169 21.052 -1.326 12.009 1.00 0.00 C ATOM 0 H ALA A 169 18.513 -1.631 11.998 1.00 -0.73 H new ATOM 0 HA ALA A 169 20.247 0.347 12.980 1.00 0.36 H new ATOM 0 HB1 ALA A 169 22.063 -0.922 11.962 1.00 0.00 H new ATOM 0 HB2 ALA A 169 20.945 -1.934 12.908 1.00 0.00 H new ATOM 0 HB3 ALA A 169 20.867 -1.943 11.130 1.00 0.00 H new ATOM 2047 N PRO A 170 20.006 0.445 9.595 1.00 -0.66 N ATOM 2048 CA PRO A 170 20.132 1.427 8.543 1.00 0.36 C ATOM 2049 C PRO A 170 18.867 2.319 8.605 1.00 0.57 C ATOM 2050 O PRO A 170 18.826 3.080 9.585 1.00 -0.57 O ATOM 2051 CB PRO A 170 20.528 0.649 7.306 1.00 0.00 C ATOM 2052 CG PRO A 170 20.229 -0.813 7.670 1.00 0.00 C ATOM 2053 CD PRO A 170 19.488 -0.741 9.000 1.00 0.30 C ATOM 0 HA PRO A 170 20.916 2.182 8.603 1.00 0.36 H new ATOM 0 HB2 PRO A 170 19.956 0.968 6.435 1.00 0.00 H new ATOM 0 HB3 PRO A 170 21.581 0.792 7.065 1.00 0.00 H new ATOM 0 HG2 PRO A 170 19.621 -1.295 6.904 1.00 0.00 H new ATOM 0 HG3 PRO A 170 21.147 -1.394 7.760 1.00 0.00 H new ATOM 0 HD2 PRO A 170 18.409 -0.682 8.858 1.00 0.30 H new ATOM 0 HD3 PRO A 170 19.681 -1.619 9.617 1.00 0.30 H new ATOM 2061 N PRO A 171 17.713 2.268 7.821 1.00 -0.66 N ATOM 2062 CA PRO A 171 16.463 2.617 8.537 1.00 0.36 C ATOM 2063 C PRO A 171 16.295 3.872 9.465 1.00 0.57 C ATOM 2064 O PRO A 171 15.884 4.954 9.037 1.00 -0.57 O ATOM 2065 CB PRO A 171 16.190 1.267 9.156 1.00 0.00 C ATOM 2066 CG PRO A 171 16.272 0.399 7.891 1.00 0.00 C ATOM 2067 CD PRO A 171 17.316 1.120 7.025 1.00 0.30 C ATOM 0 HA PRO A 171 15.732 3.051 7.855 1.00 0.36 H new ATOM 0 HB2 PRO A 171 16.932 0.990 9.905 1.00 0.00 H new ATOM 0 HB3 PRO A 171 15.214 1.215 9.639 1.00 0.00 H new ATOM 0 HG2 PRO A 171 16.579 -0.621 8.124 1.00 0.00 H new ATOM 0 HG3 PRO A 171 15.308 0.334 7.386 1.00 0.00 H new ATOM 0 HD2 PRO A 171 18.166 0.474 6.807 1.00 0.30 H new ATOM 0 HD3 PRO A 171 16.895 1.427 6.067 1.00 0.30 H new ATOM 2075 N LEU A 172 16.760 3.761 10.756 1.00 -0.73 N ATOM 2076 CA LEU A 172 16.836 4.889 11.682 1.00 0.36 C ATOM 2077 C LEU A 172 18.084 5.760 11.387 1.00 0.57 C ATOM 2078 O LEU A 172 18.072 6.978 11.513 1.00 -0.57 O ATOM 2079 CB LEU A 172 16.916 4.409 13.136 1.00 0.00 C ATOM 2080 CG LEU A 172 15.764 3.506 13.625 1.00 0.00 C ATOM 2081 CD1 LEU A 172 15.889 3.306 15.138 1.00 0.00 C ATOM 2082 CD2 LEU A 172 14.347 3.960 13.296 1.00 0.00 C ATOM 0 H LEU A 172 17.085 2.881 11.157 1.00 -0.73 H new ATOM 0 HA LEU A 172 15.930 5.478 11.542 1.00 0.36 H new ATOM 0 HB2 LEU A 172 17.853 3.868 13.266 1.00 0.00 H new ATOM 0 HB3 LEU A 172 16.962 5.285 13.783 1.00 0.00 H new ATOM 0 HG LEU A 172 15.889 2.580 13.064 1.00 0.00 H new ATOM 0 HD11 LEU A 172 15.077 2.669 15.489 1.00 0.00 H new ATOM 0 HD12 LEU A 172 16.845 2.834 15.365 1.00 0.00 H new ATOM 0 HD13 LEU A 172 15.834 4.273 15.639 1.00 0.00 H new ATOM 0 HD21 LEU A 172 13.632 3.240 13.694 1.00 0.00 H new ATOM 0 HD22 LEU A 172 14.165 4.937 13.743 1.00 0.00 H new ATOM 0 HD23 LEU A 172 14.229 4.028 12.215 1.00 0.00 H new ATOM 2094 N VAL A 173 19.241 5.130 11.057 1.00 -0.73 N ATOM 2095 CA VAL A 173 20.489 5.682 10.482 1.00 0.36 C ATOM 2096 C VAL A 173 20.441 5.510 8.933 1.00 0.57 C ATOM 2097 O VAL A 173 21.386 5.616 8.165 1.00 -0.57 O ATOM 2098 CB VAL A 173 21.640 4.886 11.076 1.00 0.00 C ATOM 2099 CG1 VAL A 173 23.030 5.278 10.576 1.00 0.00 C ATOM 2100 CG2 VAL A 173 21.651 4.924 12.610 1.00 0.00 C ATOM 0 H VAL A 173 19.329 4.124 11.202 1.00 -0.73 H new ATOM 0 HA VAL A 173 20.612 6.741 10.708 1.00 0.36 H new ATOM 0 HB VAL A 173 21.440 3.875 10.722 1.00 0.00 H new ATOM 0 HG11 VAL A 173 23.780 4.652 11.059 1.00 0.00 H new ATOM 0 HG12 VAL A 173 23.081 5.138 9.496 1.00 0.00 H new ATOM 0 HG13 VAL A 173 23.221 6.324 10.815 1.00 0.00 H new ATOM 0 HG21 VAL A 173 22.493 4.340 12.982 1.00 0.00 H new ATOM 0 HG22 VAL A 173 21.748 5.956 12.948 1.00 0.00 H new ATOM 0 HG23 VAL A 173 20.721 4.503 12.991 1.00 0.00 H new ATOM 2110 N GLY A 174 19.164 5.340 8.494 1.00 -0.73 N ATOM 2111 CA GLY A 174 18.666 5.434 7.146 1.00 0.36 C ATOM 2112 C GLY A 174 18.210 6.906 7.131 1.00 0.57 C ATOM 2113 O GLY A 174 18.878 7.790 6.583 1.00 -0.57 O ATOM 0 H GLY A 174 18.416 5.116 9.150 1.00 -0.73 H new ATOM 0 HA2 GLY A 174 19.436 5.229 6.402 1.00 0.36 H new ATOM 0 HA3 GLY A 174 17.846 4.742 6.956 1.00 0.36 H new ATOM 2117 N TRP A 175 17.197 7.239 8.005 1.00 -0.73 N ATOM 2118 CA TRP A 175 16.873 8.633 8.333 1.00 0.36 C ATOM 2119 C TRP A 175 18.135 9.284 8.788 1.00 0.57 C ATOM 2120 O TRP A 175 18.480 10.343 8.260 1.00 -0.57 O ATOM 2121 CB TRP A 175 15.743 8.714 9.335 1.00 0.18 C ATOM 2122 CG TRP A 175 15.782 9.617 10.514 1.00 -0.18 C ATOM 2123 CD1 TRP A 175 16.686 10.559 10.972 1.00 -0.30 C ATOM 2124 CD2 TRP A 175 14.818 9.454 11.591 1.00 0.00 C ATOM 2125 NE1 TRP A 175 16.230 10.882 12.248 1.00 0.03 N ATOM 2126 CE2 TRP A 175 15.657 9.687 12.680 1.00 -0.15 C ATOM 2127 CE3 TRP A 175 13.811 8.500 11.710 1.00 -0.15 C ATOM 2128 CZ2 TRP A 175 16.138 8.539 13.307 1.00 -0.15 C ATOM 2129 CZ3 TRP A 175 14.087 7.479 12.610 1.00 -0.15 C ATOM 2130 CH2 TRP A 175 15.212 7.506 13.431 1.00 -0.15 C ATOM 0 H TRP A 175 16.610 6.552 8.478 1.00 -0.73 H new ATOM 0 HA TRP A 175 16.499 9.171 7.462 1.00 0.36 H new ATOM 0 HB2 TRP A 175 14.846 8.975 8.773 1.00 0.18 H new ATOM 0 HB3 TRP A 175 15.596 7.705 9.720 1.00 0.18 H new ATOM 0 HD1 TRP A 175 17.549 10.954 10.457 1.00 -0.30 H new ATOM 0 HE1 TRP A 175 16.298 11.771 12.743 1.00 0.03 H new ATOM 0 HE3 TRP A 175 12.890 8.550 11.148 1.00 -0.15 H new ATOM 0 HZ2 TRP A 175 17.152 8.457 13.669 1.00 -0.15 H new ATOM 0 HZ3 TRP A 175 13.410 6.640 12.675 1.00 -0.15 H new ATOM 0 HH2 TRP A 175 15.366 6.727 14.163 1.00 -0.15 H new ATOM 2141 N SER A 176 18.894 8.665 9.743 1.00 -0.73 N ATOM 2142 CA SER A 176 20.100 9.343 10.179 1.00 0.36 C ATOM 2143 C SER A 176 21.375 8.881 9.464 1.00 0.57 C ATOM 2144 O SER A 176 22.506 9.140 9.858 1.00 -0.57 O ATOM 2145 CB SER A 176 20.235 9.536 11.686 1.00 0.28 C ATOM 2146 OG SER A 176 20.190 8.320 12.421 1.00 -0.68 O ATOM 0 H SER A 176 18.694 7.766 10.182 1.00 -0.73 H new ATOM 0 HA SER A 176 19.959 10.365 9.827 1.00 0.36 H new ATOM 0 HB2 SER A 176 21.177 10.043 11.896 1.00 0.28 H new ATOM 0 HB3 SER A 176 19.436 10.191 12.033 1.00 0.28 H new ATOM 0 HG SER A 176 19.397 7.808 12.158 1.00 -0.68 H new ATOM 2152 N ARG A 177 21.121 8.424 8.180 1.00 -0.73 N ATOM 2153 CA ARG A 177 22.118 8.578 7.135 1.00 0.36 C ATOM 2154 C ARG A 177 22.084 10.098 6.751 1.00 0.57 C ATOM 2155 O ARG A 177 23.011 10.680 6.191 1.00 -0.57 O ATOM 2156 CB ARG A 177 21.820 7.771 5.868 1.00 0.00 C ATOM 2157 CG ARG A 177 23.052 7.574 4.969 1.00 0.00 C ATOM 2158 CD ARG A 177 22.903 8.273 3.616 1.00 0.33 C ATOM 2159 NE ARG A 177 22.993 9.726 3.755 1.00 -0.84 N ATOM 2160 CZ ARG A 177 23.168 10.598 2.756 1.00 1.20 C ATOM 2161 NH1 ARG A 177 23.165 10.235 1.480 1.00 -0.97 N ATOM 2162 NH2 ARG A 177 23.371 11.879 3.057 1.00 -0.97 N ATOM 0 H ARG A 177 20.257 7.968 7.888 1.00 -0.73 H new ATOM 0 HA ARG A 177 23.077 8.221 7.510 1.00 0.36 H new ATOM 0 HB2 ARG A 177 21.426 6.795 6.151 1.00 0.00 H new ATOM 0 HB3 ARG A 177 21.040 8.277 5.298 1.00 0.00 H new ATOM 0 HG2 ARG A 177 23.936 7.958 5.478 1.00 0.00 H new ATOM 0 HG3 ARG A 177 23.215 6.508 4.809 1.00 0.00 H new ATOM 0 HD2 ARG A 177 23.679 7.922 2.936 1.00 0.33 H new ATOM 0 HD3 ARG A 177 21.944 8.007 3.171 1.00 0.33 H new ATOM 0 HE ARG A 177 22.915 10.108 4.697 1.00 -0.84 H new ATOM 0 HH11 ARG A 177 23.025 9.256 1.228 1.00 -0.97 H new ATOM 0 HH12 ARG A 177 23.302 10.934 0.750 1.00 -0.97 H new ATOM 0 HH21 ARG A 177 23.391 12.177 4.032 1.00 -0.97 H new ATOM 0 HH22 ARG A 177 23.507 12.563 2.312 1.00 -0.97 H new ATOM 2176 N TYR A 178 20.831 10.658 6.884 1.00 -0.73 N ATOM 2177 CA TYR A 178 20.453 12.064 7.020 1.00 0.36 C ATOM 2178 C TYR A 178 19.810 12.748 5.809 1.00 0.57 C ATOM 2179 O TYR A 178 20.441 13.064 4.811 1.00 -0.57 O ATOM 2180 CB TYR A 178 21.491 12.824 7.794 1.00 0.14 C ATOM 2181 CG TYR A 178 21.054 14.046 8.582 1.00 -0.14 C ATOM 2182 CD1 TYR A 178 20.150 13.715 9.568 1.00 -0.15 C ATOM 2183 CD2 TYR A 178 22.026 15.028 8.838 1.00 -0.15 C ATOM 2184 CE1 TYR A 178 20.757 13.637 10.792 1.00 -0.15 C ATOM 2185 CE2 TYR A 178 22.347 15.311 10.163 1.00 -0.15 C ATOM 2186 CZ TYR A 178 21.783 14.508 11.140 1.00 0.08 C ATOM 2187 OH TYR A 178 22.327 14.505 12.386 1.00 -0.53 O ATOM 0 H TYR A 178 20.005 10.060 6.897 1.00 -0.73 H new ATOM 0 HA TYR A 178 19.557 12.079 7.641 1.00 0.36 H new ATOM 0 HB2 TYR A 178 21.959 12.130 8.491 1.00 0.14 H new ATOM 0 HB3 TYR A 178 22.263 13.140 7.092 1.00 0.14 H new ATOM 0 HD1 TYR A 178 19.098 13.540 9.397 1.00 -0.15 H new ATOM 0 HD2 TYR A 178 22.512 15.550 8.027 1.00 -0.15 H new ATOM 0 HE1 TYR A 178 20.434 12.887 11.499 1.00 -0.15 H new ATOM 0 HE2 TYR A 178 23.010 16.125 10.419 1.00 -0.15 H new ATOM 0 HH TYR A 178 23.032 15.184 12.437 1.00 -0.53 H new ATOM 2197 N ILE A 179 18.422 12.828 5.933 1.00 -0.73 N ATOM 2198 CA ILE A 179 17.487 13.508 5.015 1.00 0.36 C ATOM 2199 C ILE A 179 17.286 12.815 3.639 1.00 0.57 C ATOM 2200 O ILE A 179 17.053 13.525 2.646 1.00 -0.57 O ATOM 2201 CB ILE A 179 17.491 15.060 5.027 1.00 0.00 C ATOM 2202 CG1 ILE A 179 18.799 15.703 4.535 1.00 0.00 C ATOM 2203 CG2 ILE A 179 17.019 15.661 6.357 1.00 0.00 C ATOM 2204 CD1 ILE A 179 19.781 16.168 5.601 1.00 0.00 C ATOM 0 H ILE A 179 17.936 12.393 6.717 1.00 -0.73 H new ATOM 0 HA ILE A 179 16.527 13.331 5.500 1.00 0.36 H new ATOM 0 HB ILE A 179 16.743 15.323 4.279 1.00 0.00 H new ATOM 0 HG12 ILE A 179 19.310 14.985 3.893 1.00 0.00 H new ATOM 0 HG13 ILE A 179 18.542 16.560 3.913 1.00 0.00 H new ATOM 0 HG21 ILE A 179 17.047 16.749 6.295 1.00 0.00 H new ATOM 0 HG22 ILE A 179 15.999 15.335 6.562 1.00 0.00 H new ATOM 0 HG23 ILE A 179 17.675 15.326 7.161 1.00 0.00 H new ATOM 0 HD11 ILE A 179 20.659 16.602 5.122 1.00 0.00 H new ATOM 0 HD12 ILE A 179 19.304 16.918 6.232 1.00 0.00 H new ATOM 0 HD13 ILE A 179 20.084 15.318 6.213 1.00 0.00 H new ATOM 2216 N PRO A 180 17.261 11.420 3.451 1.00 -0.66 N ATOM 2217 CA PRO A 180 17.121 10.218 4.251 1.00 0.36 C ATOM 2218 C PRO A 180 16.020 10.212 5.276 1.00 0.57 C ATOM 2219 O PRO A 180 14.934 9.663 5.147 1.00 -0.57 O ATOM 2220 CB PRO A 180 18.537 9.830 4.606 1.00 0.00 C ATOM 2221 CG PRO A 180 19.377 10.343 3.475 1.00 0.00 C ATOM 2222 CD PRO A 180 18.344 11.011 2.622 1.00 0.30 C ATOM 0 HA PRO A 180 16.676 9.381 3.713 1.00 0.36 H new ATOM 0 HB2 PRO A 180 18.841 10.272 5.555 1.00 0.00 H new ATOM 0 HB3 PRO A 180 18.635 8.750 4.712 1.00 0.00 H new ATOM 0 HG2 PRO A 180 20.143 11.040 3.815 1.00 0.00 H new ATOM 0 HG3 PRO A 180 19.890 9.539 2.946 1.00 0.00 H new ATOM 0 HD2 PRO A 180 18.775 11.872 2.112 1.00 0.30 H new ATOM 0 HD3 PRO A 180 17.991 10.327 1.850 1.00 0.30 H new ATOM 2230 N GLU A 181 16.314 11.138 6.233 1.00 -0.73 N ATOM 2231 CA GLU A 181 15.272 11.809 7.067 1.00 0.36 C ATOM 2232 C GLU A 181 14.363 12.719 6.182 1.00 0.57 C ATOM 2233 O GLU A 181 13.776 13.722 6.573 1.00 -0.57 O ATOM 2234 CB GLU A 181 15.976 12.625 8.166 1.00 0.00 C ATOM 2235 CG GLU A 181 15.176 13.343 9.240 1.00 -0.11 C ATOM 2236 CD GLU A 181 14.246 12.467 10.044 1.00 0.91 C ATOM 2237 OE1 GLU A 181 13.562 11.648 9.367 1.00 -0.90 O ATOM 2238 OE2 GLU A 181 14.238 12.686 11.288 1.00 -0.90 O ATOM 0 H GLU A 181 17.265 11.437 6.446 1.00 -0.73 H new ATOM 0 HA GLU A 181 14.627 11.062 7.530 1.00 0.36 H new ATOM 0 HB2 GLU A 181 16.661 11.949 8.677 1.00 0.00 H new ATOM 0 HB3 GLU A 181 16.585 13.377 7.665 1.00 0.00 H new ATOM 0 HG2 GLU A 181 15.871 13.830 9.923 1.00 -0.11 H new ATOM 0 HG3 GLU A 181 14.589 14.131 8.767 1.00 -0.11 H new ATOM 2245 N GLY A 182 14.239 12.275 4.881 1.00 -0.73 N ATOM 2246 CA GLY A 182 13.611 13.051 3.847 1.00 0.36 C ATOM 2247 C GLY A 182 12.150 12.745 4.000 1.00 0.57 C ATOM 2248 O GLY A 182 11.438 13.330 4.818 1.00 -0.57 O ATOM 0 H GLY A 182 14.583 11.369 4.564 1.00 -0.73 H new ATOM 0 HA2 GLY A 182 13.811 14.115 3.970 1.00 0.36 H new ATOM 0 HA3 GLY A 182 13.976 12.770 2.859 1.00 0.36 H new ATOM 2252 N MET A 183 11.681 11.668 3.303 1.00 -0.73 N ATOM 2253 CA MET A 183 10.354 11.158 3.614 1.00 0.36 C ATOM 2254 C MET A 183 10.410 10.120 4.746 1.00 0.57 C ATOM 2255 O MET A 183 10.019 8.965 4.652 1.00 -0.57 O ATOM 2256 CB MET A 183 9.530 10.725 2.404 1.00 0.00 C ATOM 2257 CG MET A 183 10.222 9.723 1.492 1.00 0.23 C ATOM 2258 SD MET A 183 9.070 9.112 0.206 1.00 -0.46 S ATOM 2259 CE MET A 183 8.234 7.826 1.170 1.00 0.23 C ATOM 0 H MET A 183 12.185 11.174 2.566 1.00 -0.73 H new ATOM 0 HA MET A 183 9.784 12.007 3.990 1.00 0.36 H new ATOM 0 HB2 MET A 183 8.594 10.291 2.755 1.00 0.00 H new ATOM 0 HB3 MET A 183 9.272 11.609 1.821 1.00 0.00 H new ATOM 0 HG2 MET A 183 11.086 10.190 1.020 1.00 0.23 H new ATOM 0 HG3 MET A 183 10.595 8.885 2.081 1.00 0.23 H new ATOM 0 HE1 MET A 183 8.458 6.848 0.744 1.00 0.23 H new ATOM 0 HE2 MET A 183 8.583 7.860 2.202 1.00 0.23 H new ATOM 0 HE3 MET A 183 7.157 7.995 1.145 1.00 0.23 H new ATOM 2269 N GLN A 184 10.890 10.677 5.915 1.00 -0.73 N ATOM 2270 CA GLN A 184 10.764 10.021 7.208 1.00 0.36 C ATOM 2271 C GLN A 184 10.354 11.152 8.190 1.00 0.57 C ATOM 2272 O GLN A 184 9.252 11.207 8.727 1.00 -0.57 O ATOM 2273 CB GLN A 184 12.055 9.287 7.567 1.00 0.00 C ATOM 2274 CG GLN A 184 12.296 8.049 6.697 1.00 0.06 C ATOM 2275 CD GLN A 184 13.348 7.117 7.252 1.00 0.57 C ATOM 2276 OE1 GLN A 184 14.393 6.843 6.671 1.00 -0.57 O ATOM 2277 NE2 GLN A 184 13.056 6.536 8.452 1.00 -0.80 N ATOM 0 H GLN A 184 11.363 11.580 5.954 1.00 -0.73 H new ATOM 0 HA GLN A 184 10.011 9.233 7.232 1.00 0.36 H new ATOM 0 HB2 GLN A 184 12.898 9.970 7.460 1.00 0.00 H new ATOM 0 HB3 GLN A 184 12.018 8.988 8.614 1.00 0.00 H new ATOM 0 HG2 GLN A 184 11.359 7.503 6.589 1.00 0.06 H new ATOM 0 HG3 GLN A 184 12.596 8.369 5.699 1.00 0.06 H new ATOM 0 HE21 GLN A 184 12.186 6.767 8.932 1.00 -0.80 H new ATOM 0 HE22 GLN A 184 13.708 5.871 8.869 1.00 -0.80 H new ATOM 2286 N CYS A 185 11.281 12.160 8.282 1.00 -0.73 N ATOM 2287 CA CYS A 185 11.126 13.348 9.124 1.00 0.36 C ATOM 2288 C CYS A 185 10.243 14.405 8.446 1.00 0.57 C ATOM 2289 O CYS A 185 9.528 15.203 9.050 1.00 -0.57 O ATOM 2290 CB CYS A 185 12.511 14.008 8.989 1.00 0.23 C ATOM 2291 SG CYS A 185 13.480 13.762 7.473 1.00 -0.41 S ATOM 0 H CYS A 185 12.157 12.150 7.760 1.00 -0.73 H new ATOM 0 HA CYS A 185 10.743 13.076 10.108 1.00 0.36 H new ATOM 0 HB2 CYS A 185 12.374 15.082 9.118 1.00 0.23 H new ATOM 0 HB3 CYS A 185 13.120 13.662 9.824 1.00 0.23 H new ATOM 2297 N SER A 186 10.513 14.538 7.084 1.00 -0.73 N ATOM 2298 CA SER A 186 10.499 15.870 6.496 1.00 0.36 C ATOM 2299 C SER A 186 9.163 16.361 5.930 1.00 0.57 C ATOM 2300 O SER A 186 8.985 17.547 5.635 1.00 -0.57 O ATOM 2301 CB SER A 186 11.711 16.221 5.642 1.00 0.28 C ATOM 2302 OG SER A 186 12.906 16.251 6.420 1.00 -0.68 O ATOM 0 H SER A 186 10.725 13.772 6.445 1.00 -0.73 H new ATOM 0 HA SER A 186 10.613 16.487 7.388 1.00 0.36 H new ATOM 0 HB2 SER A 186 11.816 15.491 4.840 1.00 0.28 H new ATOM 0 HB3 SER A 186 11.557 17.192 5.171 1.00 0.28 H new ATOM 0 HG SER A 186 13.373 15.394 6.335 1.00 -0.68 H new ATOM 2308 N CYS A 187 8.111 15.512 5.704 1.00 -0.73 N ATOM 2309 CA CYS A 187 8.197 14.212 5.005 1.00 0.36 C ATOM 2310 C CYS A 187 8.471 14.696 3.557 1.00 0.57 C ATOM 2311 O CYS A 187 7.581 15.153 2.840 1.00 -0.57 O ATOM 2312 CB CYS A 187 6.864 13.464 5.157 1.00 0.23 C ATOM 2313 SG CYS A 187 6.795 11.713 4.638 1.00 -0.23 S ATOM 0 H CYS A 187 7.164 15.729 6.015 1.00 -0.73 H new ATOM 0 HA CYS A 187 8.946 13.508 5.367 1.00 0.36 H new ATOM 0 HB2 CYS A 187 6.572 13.512 6.206 1.00 0.23 H new ATOM 0 HB3 CYS A 187 6.109 14.010 4.591 1.00 0.23 H new ATOM 2318 N GLY A 188 9.809 14.868 3.260 1.00 -0.73 N ATOM 2319 CA GLY A 188 10.278 15.917 2.383 1.00 0.36 C ATOM 2320 C GLY A 188 11.694 15.577 1.942 1.00 0.57 C ATOM 2321 O GLY A 188 11.922 14.590 1.242 1.00 -0.57 O ATOM 0 H GLY A 188 10.550 14.275 3.633 1.00 -0.73 H new ATOM 0 HA2 GLY A 188 9.623 16.008 1.517 1.00 0.36 H new ATOM 0 HA3 GLY A 188 10.261 16.878 2.898 1.00 0.36 H new ATOM 2325 N ILE A 189 12.708 16.404 2.403 1.00 -0.73 N ATOM 2326 CA ILE A 189 14.008 16.304 1.720 1.00 0.36 C ATOM 2327 C ILE A 189 15.123 16.921 2.610 1.00 0.57 C ATOM 2328 O ILE A 189 14.821 17.312 3.745 1.00 -0.57 O ATOM 2329 CB ILE A 189 13.967 16.812 0.249 1.00 0.00 C ATOM 2330 CG1 ILE A 189 12.802 17.704 -0.203 1.00 0.00 C ATOM 2331 CG2 ILE A 189 14.229 15.684 -0.720 1.00 0.00 C ATOM 2332 CD1 ILE A 189 12.740 19.031 0.538 1.00 0.00 C ATOM 0 H ILE A 189 12.642 17.075 3.169 1.00 -0.73 H new ATOM 0 HA ILE A 189 14.264 15.251 1.598 1.00 0.36 H new ATOM 0 HB ILE A 189 14.785 17.532 0.236 1.00 0.00 H new ATOM 0 HG12 ILE A 189 12.894 17.896 -1.272 1.00 0.00 H new ATOM 0 HG13 ILE A 189 11.864 17.168 -0.055 1.00 0.00 H new ATOM 0 HG21 ILE A 189 14.195 16.066 -1.740 1.00 0.00 H new ATOM 0 HG22 ILE A 189 15.213 15.258 -0.525 1.00 0.00 H new ATOM 0 HG23 ILE A 189 13.469 14.913 -0.595 1.00 0.00 H new ATOM 0 HD11 ILE A 189 11.895 19.613 0.171 1.00 0.00 H new ATOM 0 HD12 ILE A 189 12.618 18.846 1.605 1.00 0.00 H new ATOM 0 HD13 ILE A 189 13.663 19.585 0.369 1.00 0.00 H new ATOM 2344 N ASP A 190 16.451 16.891 2.265 1.00 -0.73 N ATOM 2345 CA ASP A 190 17.085 17.163 0.970 1.00 0.36 C ATOM 2346 C ASP A 190 18.416 16.467 0.638 1.00 0.57 C ATOM 2347 O ASP A 190 19.107 16.839 -0.308 1.00 -0.57 O ATOM 2348 CB ASP A 190 17.130 18.657 0.658 1.00 -0.11 C ATOM 2349 CG ASP A 190 18.154 19.371 1.532 1.00 0.91 C ATOM 2350 OD1 ASP A 190 18.465 18.774 2.601 1.00 -0.90 O ATOM 2351 OD2 ASP A 190 18.535 20.489 1.090 1.00 -0.90 O ATOM 0 H ASP A 190 17.153 16.652 2.966 1.00 -0.73 H new ATOM 0 HA ASP A 190 16.401 16.660 0.287 1.00 0.36 H new ATOM 0 HB2 ASP A 190 17.379 18.805 -0.393 1.00 -0.11 H new ATOM 0 HB3 ASP A 190 16.144 19.094 0.817 1.00 -0.11 H new ATOM 2356 N TYR A 191 18.571 15.212 1.188 1.00 -0.73 N ATOM 2357 CA TYR A 191 19.304 14.158 0.510 1.00 0.36 C ATOM 2358 C TYR A 191 18.476 13.514 -0.610 1.00 0.57 C ATOM 2359 O TYR A 191 18.951 12.865 -1.533 1.00 -0.57 O ATOM 2360 CB TYR A 191 20.705 14.507 0.133 1.00 0.14 C ATOM 2361 CG TYR A 191 21.633 15.053 1.184 1.00 -0.14 C ATOM 2362 CD1 TYR A 191 21.743 14.536 2.444 1.00 -0.15 C ATOM 2363 CD2 TYR A 191 22.457 16.110 0.906 1.00 -0.15 C ATOM 2364 CE1 TYR A 191 22.616 15.042 3.411 1.00 -0.15 C ATOM 2365 CE2 TYR A 191 23.350 16.668 1.820 1.00 -0.15 C ATOM 2366 CZ TYR A 191 23.420 16.118 3.087 1.00 0.08 C ATOM 2367 OH TYR A 191 24.253 16.621 4.039 1.00 -0.53 O ATOM 0 H TYR A 191 18.189 14.940 2.094 1.00 -0.73 H new ATOM 0 HA TYR A 191 19.457 13.377 1.255 1.00 0.36 H new ATOM 0 HB2 TYR A 191 21.167 13.610 -0.279 1.00 0.14 H new ATOM 0 HB3 TYR A 191 20.655 15.239 -0.673 1.00 0.14 H new ATOM 0 HD1 TYR A 191 21.123 13.692 2.706 1.00 -0.15 H new ATOM 0 HD2 TYR A 191 22.413 16.539 -0.084 1.00 -0.15 H new ATOM 0 HE1 TYR A 191 22.661 14.599 4.395 1.00 -0.15 H new ATOM 0 HE2 TYR A 191 23.971 17.508 1.546 1.00 -0.15 H new ATOM 0 HH TYR A 191 24.757 17.374 3.667 1.00 -0.53 H new ATOM 2377 N TYR A 192 17.138 13.566 -0.301 1.00 -0.73 N ATOM 2378 CA TYR A 192 16.101 12.653 -0.863 1.00 0.36 C ATOM 2379 C TYR A 192 15.339 13.405 -1.947 1.00 0.57 C ATOM 2380 O TYR A 192 14.273 13.088 -2.463 1.00 -0.57 O ATOM 2381 CB TYR A 192 15.143 12.225 0.217 1.00 0.14 C ATOM 2382 CG TYR A 192 14.452 10.888 0.181 1.00 -0.14 C ATOM 2383 CD1 TYR A 192 13.535 10.504 -0.800 1.00 -0.15 C ATOM 2384 CD2 TYR A 192 14.709 9.993 1.229 1.00 -0.15 C ATOM 2385 CE1 TYR A 192 12.935 9.240 -0.753 1.00 -0.15 C ATOM 2386 CE2 TYR A 192 14.106 8.742 1.297 1.00 -0.15 C ATOM 2387 CZ TYR A 192 13.237 8.370 0.286 1.00 0.08 C ATOM 2388 OH TYR A 192 12.673 7.130 0.300 1.00 -0.53 O ATOM 0 H TYR A 192 16.754 14.251 0.351 1.00 -0.73 H new ATOM 0 HA TYR A 192 16.578 11.765 -1.277 1.00 0.36 H new ATOM 0 HB2 TYR A 192 15.689 12.272 1.159 1.00 0.14 H new ATOM 0 HB3 TYR A 192 14.361 12.983 0.263 1.00 0.14 H new ATOM 0 HD1 TYR A 192 13.287 11.186 -1.600 1.00 -0.15 H new ATOM 0 HD2 TYR A 192 15.397 10.285 2.008 1.00 -0.15 H new ATOM 0 HE1 TYR A 192 12.239 8.942 -1.523 1.00 -0.15 H new ATOM 0 HE2 TYR A 192 14.311 8.075 2.121 1.00 -0.15 H new ATOM 0 HH TYR A 192 12.480 6.848 -0.618 1.00 -0.53 H new ATOM 2398 N THR A 193 16.113 14.424 -2.510 1.00 -0.73 N ATOM 2399 CA THR A 193 16.825 13.811 -3.604 1.00 0.36 C ATOM 2400 C THR A 193 18.309 13.981 -3.948 1.00 0.57 C ATOM 2401 O THR A 193 18.838 13.108 -4.648 1.00 -0.57 O ATOM 2402 CB THR A 193 16.037 13.957 -4.914 1.00 0.28 C ATOM 2403 OG1 THR A 193 14.808 14.684 -4.783 1.00 -0.68 O ATOM 2404 CG2 THR A 193 15.753 12.638 -5.601 1.00 0.00 C ATOM 0 H THR A 193 16.223 15.411 -2.277 1.00 -0.73 H new ATOM 0 HA THR A 193 16.885 12.840 -3.113 1.00 0.36 H new ATOM 0 HB THR A 193 16.713 14.541 -5.538 1.00 0.28 H new ATOM 0 HG1 THR A 193 14.252 14.265 -4.093 1.00 -0.68 H new ATOM 0 HG21 THR A 193 15.194 12.819 -6.519 1.00 0.00 H new ATOM 0 HG22 THR A 193 16.694 12.143 -5.841 1.00 0.00 H new ATOM 0 HG23 THR A 193 15.167 12.001 -4.938 1.00 0.00 H new ATOM 2412 N PRO A 194 19.010 15.109 -3.582 1.00 -0.66 N ATOM 2413 CA PRO A 194 20.399 15.192 -3.969 1.00 0.36 C ATOM 2414 C PRO A 194 21.426 14.527 -3.022 1.00 0.57 C ATOM 2415 O PRO A 194 22.343 15.173 -2.506 1.00 -0.57 O ATOM 2416 CB PRO A 194 20.657 16.686 -4.228 1.00 0.00 C ATOM 2417 CG PRO A 194 19.557 17.385 -3.486 1.00 0.00 C ATOM 2418 CD PRO A 194 18.462 16.407 -3.828 1.00 0.30 C ATOM 0 HA PRO A 194 20.562 14.586 -4.860 1.00 0.36 H new ATOM 0 HB2 PRO A 194 21.638 16.989 -3.863 1.00 0.00 H new ATOM 0 HB3 PRO A 194 20.627 16.916 -5.293 1.00 0.00 H new ATOM 0 HG2 PRO A 194 19.743 17.465 -2.415 1.00 0.00 H new ATOM 0 HG3 PRO A 194 19.364 18.393 -3.852 1.00 0.00 H new ATOM 0 HD2 PRO A 194 17.577 16.581 -3.216 1.00 0.30 H new ATOM 0 HD3 PRO A 194 18.155 16.511 -4.869 1.00 0.30 H new ATOM 2426 N HIS A 195 21.334 13.182 -2.726 1.00 -0.73 N ATOM 2427 CA HIS A 195 21.546 12.162 -3.762 1.00 0.36 C ATOM 2428 C HIS A 195 20.875 10.899 -3.300 1.00 0.57 C ATOM 2429 O HIS A 195 21.308 10.186 -2.392 1.00 -0.57 O ATOM 2430 CB HIS A 195 22.982 11.742 -3.917 1.00 0.18 C ATOM 2431 CG HIS A 195 23.696 12.514 -4.944 1.00 -0.33 C ATOM 2432 ND1 HIS A 195 24.091 12.039 -6.167 1.00 0.03 N ATOM 2433 CD2 HIS A 195 23.987 13.850 -4.977 1.00 0.08 C ATOM 2434 CE1 HIS A 195 24.642 13.097 -6.841 1.00 0.04 C ATOM 2435 NE2 HIS A 195 24.604 14.210 -6.136 1.00 -0.57 N ATOM 0 H HIS A 195 21.120 12.811 -1.800 1.00 -0.73 H new ATOM 0 HA HIS A 195 21.175 12.596 -4.690 1.00 0.36 H new ATOM 0 HB2 HIS A 195 23.494 11.857 -2.962 1.00 0.18 H new ATOM 0 HB3 HIS A 195 23.020 10.683 -4.174 1.00 0.18 H new ATOM 0 HD1 HIS A 195 23.994 11.083 -6.509 1.00 0.03 H new ATOM 0 HD2 HIS A 195 23.755 14.538 -4.178 1.00 0.08 H new ATOM 0 HE1 HIS A 195 25.059 13.027 -7.835 1.00 0.04 H new ATOM 2443 N GLU A 196 19.710 10.684 -3.992 1.00 -0.73 N ATOM 2444 CA GLU A 196 18.850 9.609 -3.570 1.00 0.36 C ATOM 2445 C GLU A 196 19.243 8.221 -4.037 1.00 0.57 C ATOM 2446 O GLU A 196 18.578 7.206 -3.887 1.00 -0.57 O ATOM 2447 CB GLU A 196 17.393 9.972 -3.602 1.00 0.00 C ATOM 2448 CG GLU A 196 16.437 9.094 -2.803 1.00 -0.11 C ATOM 2449 CD GLU A 196 16.825 8.823 -1.353 1.00 0.91 C ATOM 2450 OE1 GLU A 196 17.654 9.629 -0.827 1.00 -0.90 O ATOM 2451 OE2 GLU A 196 16.343 7.778 -0.836 1.00 -0.90 O ATOM 0 H GLU A 196 19.388 11.225 -4.795 1.00 -0.73 H new ATOM 0 HA GLU A 196 19.045 9.484 -2.505 1.00 0.36 H new ATOM 0 HB2 GLU A 196 17.292 10.996 -3.241 1.00 0.00 H new ATOM 0 HB3 GLU A 196 17.067 9.967 -4.642 1.00 0.00 H new ATOM 0 HG2 GLU A 196 15.453 9.562 -2.813 1.00 -0.11 H new ATOM 0 HG3 GLU A 196 16.340 8.137 -3.316 1.00 -0.11 H new ATOM 2458 N GLU A 197 20.567 8.132 -4.380 1.00 -0.73 N ATOM 2459 CA GLU A 197 21.024 7.010 -5.171 1.00 0.36 C ATOM 2460 C GLU A 197 22.509 6.786 -4.896 1.00 0.57 C ATOM 2461 O GLU A 197 23.287 6.102 -5.539 1.00 -0.57 O ATOM 2462 CB GLU A 197 20.654 7.400 -6.581 1.00 0.00 C ATOM 2463 CG GLU A 197 21.716 8.040 -7.478 1.00 -0.11 C ATOM 2464 CD GLU A 197 22.288 9.345 -6.953 1.00 0.91 C ATOM 2465 OE1 GLU A 197 21.679 9.856 -5.969 1.00 -0.90 O ATOM 2466 OE2 GLU A 197 23.328 9.793 -7.507 1.00 -0.90 O ATOM 0 H GLU A 197 21.286 8.807 -4.120 1.00 -0.73 H new ATOM 0 HA GLU A 197 20.575 6.043 -4.945 1.00 0.36 H new ATOM 0 HB2 GLU A 197 20.294 6.504 -7.086 1.00 0.00 H new ATOM 0 HB3 GLU A 197 19.814 8.092 -6.521 1.00 0.00 H new ATOM 0 HG2 GLU A 197 22.532 7.330 -7.615 1.00 -0.11 H new ATOM 0 HG3 GLU A 197 21.281 8.219 -8.461 1.00 -0.11 H new ATOM 2473 N THR A 198 22.783 7.250 -3.626 1.00 -0.73 N ATOM 2474 CA THR A 198 22.854 6.234 -2.608 1.00 0.36 C ATOM 2475 C THR A 198 21.625 5.589 -2.034 1.00 0.57 C ATOM 2476 O THR A 198 21.658 4.490 -1.503 1.00 -0.57 O ATOM 2477 CB THR A 198 22.894 7.054 -1.328 1.00 0.28 C ATOM 2478 OG1 THR A 198 22.567 6.242 -0.194 1.00 -0.68 O ATOM 2479 CG2 THR A 198 22.098 8.342 -1.267 1.00 0.00 C ATOM 0 H THR A 198 22.937 8.217 -3.340 1.00 -0.73 H new ATOM 0 HA THR A 198 23.570 5.540 -3.048 1.00 0.36 H new ATOM 0 HB THR A 198 23.930 7.394 -1.315 1.00 0.28 H new ATOM 0 HG1 THR A 198 22.535 6.801 0.610 1.00 -0.68 H new ATOM 0 HG21 THR A 198 22.232 8.806 -0.290 1.00 0.00 H new ATOM 0 HG22 THR A 198 22.447 9.023 -2.043 1.00 0.00 H new ATOM 0 HG23 THR A 198 21.041 8.125 -1.424 1.00 0.00 H new ATOM 2487 N ASN A 199 20.606 6.495 -1.760 1.00 -0.73 N ATOM 2488 CA ASN A 199 19.915 6.254 -0.490 1.00 0.36 C ATOM 2489 C ASN A 199 18.762 5.321 -0.701 1.00 0.57 C ATOM 2490 O ASN A 199 18.456 4.432 0.080 1.00 -0.57 O ATOM 2491 CB ASN A 199 19.540 7.381 0.406 1.00 0.06 C ATOM 2492 CG ASN A 199 20.652 8.357 0.436 1.00 0.57 C ATOM 2493 OD1 ASN A 199 21.805 8.102 0.772 1.00 -0.57 O ATOM 2494 ND2 ASN A 199 20.317 9.559 -0.072 1.00 -0.80 N ATOM 0 H ASN A 199 20.299 7.283 -2.330 1.00 -0.73 H new ATOM 0 HA ASN A 199 20.719 5.817 0.102 1.00 0.36 H new ATOM 0 HB2 ASN A 199 18.628 7.859 0.049 1.00 0.06 H new ATOM 0 HB3 ASN A 199 19.335 7.012 1.411 1.00 0.06 H new ATOM 0 HD21 ASN A 199 21.028 10.281 -0.185 1.00 -0.80 H new ATOM 0 HD22 ASN A 199 19.352 9.747 -0.344 1.00 -0.80 H new ATOM 2501 N ASN A 200 18.122 5.595 -1.867 1.00 -0.73 N ATOM 2502 CA ASN A 200 17.364 4.603 -2.558 1.00 0.36 C ATOM 2503 C ASN A 200 18.237 3.557 -3.152 1.00 0.57 C ATOM 2504 O ASN A 200 17.873 2.388 -3.209 1.00 -0.57 O ATOM 2505 CB ASN A 200 16.309 5.114 -3.510 1.00 0.06 C ATOM 2506 CG ASN A 200 16.723 5.498 -4.924 1.00 0.57 C ATOM 2507 OD1 ASN A 200 16.372 6.553 -5.447 1.00 -0.57 O ATOM 2508 ND2 ASN A 200 17.460 4.620 -5.643 1.00 -0.80 N ATOM 0 H ASN A 200 18.136 6.507 -2.323 1.00 -0.73 H new ATOM 0 HA ASN A 200 16.765 4.132 -1.779 1.00 0.36 H new ATOM 0 HB2 ASN A 200 15.536 4.349 -3.588 1.00 0.06 H new ATOM 0 HB3 ASN A 200 15.847 5.988 -3.052 1.00 0.06 H new ATOM 0 HD21 ASN A 200 17.717 4.838 -6.606 1.00 -0.80 H new ATOM 0 HD22 ASN A 200 17.759 3.740 -5.222 1.00 -0.80 H new ATOM 2515 N GLU A 201 19.427 4.035 -3.646 1.00 -0.73 N ATOM 2516 CA GLU A 201 20.198 3.078 -4.416 1.00 0.36 C ATOM 2517 C GLU A 201 20.891 2.119 -3.436 1.00 0.57 C ATOM 2518 O GLU A 201 21.589 1.156 -3.738 1.00 -0.57 O ATOM 2519 CB GLU A 201 21.096 3.678 -5.456 1.00 0.00 C ATOM 2520 CG GLU A 201 21.364 2.774 -6.657 1.00 -0.11 C ATOM 2521 CD GLU A 201 20.183 2.644 -7.641 1.00 0.91 C ATOM 2522 OE1 GLU A 201 19.165 3.355 -7.397 1.00 -0.90 O ATOM 2523 OE2 GLU A 201 20.373 1.832 -8.590 1.00 -0.90 O ATOM 0 H GLU A 201 19.815 4.971 -3.530 1.00 -0.73 H new ATOM 0 HA GLU A 201 19.515 2.504 -5.042 1.00 0.36 H new ATOM 0 HB2 GLU A 201 20.651 4.608 -5.809 1.00 0.00 H new ATOM 0 HB3 GLU A 201 22.048 3.936 -4.991 1.00 0.00 H new ATOM 0 HG2 GLU A 201 22.229 3.158 -7.198 1.00 -0.11 H new ATOM 0 HG3 GLU A 201 21.629 1.781 -6.295 1.00 -0.11 H new ATOM 2530 N SER A 202 20.589 2.439 -2.136 1.00 -0.73 N ATOM 2531 CA SER A 202 20.883 1.591 -0.993 1.00 0.36 C ATOM 2532 C SER A 202 19.933 1.950 0.132 1.00 0.57 C ATOM 2533 O SER A 202 20.242 2.232 1.283 1.00 -0.57 O ATOM 2534 CB SER A 202 22.366 1.553 -0.610 1.00 0.28 C ATOM 2535 OG SER A 202 23.094 0.638 -1.437 1.00 -0.68 O ATOM 0 H SER A 202 20.128 3.312 -1.879 1.00 -0.73 H new ATOM 0 HA SER A 202 20.701 0.550 -1.262 1.00 0.36 H new ATOM 0 HB2 SER A 202 22.794 2.551 -0.704 1.00 0.28 H new ATOM 0 HB3 SER A 202 22.466 1.261 0.435 1.00 0.28 H new ATOM 0 HG SER A 202 22.721 0.649 -2.343 1.00 -0.68 H new ATOM 2541 N PHE A 203 18.637 1.595 -0.264 1.00 -0.73 N ATOM 2542 CA PHE A 203 18.011 0.421 0.341 1.00 0.36 C ATOM 2543 C PHE A 203 17.291 -0.469 -0.670 1.00 0.57 C ATOM 2544 O PHE A 203 16.936 -1.621 -0.434 1.00 -0.57 O ATOM 2545 CB PHE A 203 17.335 0.608 1.671 1.00 0.14 C ATOM 2546 CG PHE A 203 16.139 1.473 1.454 1.00 -0.14 C ATOM 2547 CD1 PHE A 203 14.960 0.883 0.980 1.00 -0.15 C ATOM 2548 CD2 PHE A 203 16.293 2.847 1.382 1.00 -0.15 C ATOM 2549 CE1 PHE A 203 13.959 1.658 0.410 1.00 -0.15 C ATOM 2550 CE2 PHE A 203 15.379 3.575 0.634 1.00 -0.15 C ATOM 2551 CZ PHE A 203 14.182 3.011 0.211 1.00 -0.15 C ATOM 0 H PHE A 203 18.073 2.092 -0.954 1.00 -0.73 H new ATOM 0 HA PHE A 203 18.862 -0.175 0.671 1.00 0.36 H new ATOM 0 HB2 PHE A 203 17.040 -0.355 2.089 1.00 0.14 H new ATOM 0 HB3 PHE A 203 18.017 1.070 2.385 1.00 0.14 H new ATOM 0 HD1 PHE A 203 14.828 -0.186 1.059 1.00 -0.15 H new ATOM 0 HD2 PHE A 203 17.105 3.340 1.896 1.00 -0.15 H new ATOM 0 HE1 PHE A 203 13.018 1.212 0.125 1.00 -0.15 H new ATOM 0 HE2 PHE A 203 15.602 4.600 0.376 1.00 -0.15 H new ATOM 0 HZ PHE A 203 13.432 3.622 -0.269 1.00 -0.15 H new ATOM 2561 N VAL A 204 17.124 0.178 -1.850 1.00 -0.73 N ATOM 2562 CA VAL A 204 16.882 -0.448 -3.181 1.00 0.36 C ATOM 2563 C VAL A 204 18.221 -0.479 -3.971 1.00 0.57 C ATOM 2564 O VAL A 204 18.281 -0.579 -5.196 1.00 -0.57 O ATOM 2565 CB VAL A 204 15.808 0.285 -3.970 1.00 0.00 C ATOM 2566 CG1 VAL A 204 15.116 -0.663 -4.955 1.00 0.00 C ATOM 2567 CG2 VAL A 204 14.770 0.874 -3.023 1.00 0.00 C ATOM 0 H VAL A 204 17.155 1.196 -1.906 1.00 -0.73 H new ATOM 0 HA VAL A 204 16.517 -1.463 -3.027 1.00 0.36 H new ATOM 0 HB VAL A 204 16.288 1.088 -4.529 1.00 0.00 H new ATOM 0 HG11 VAL A 204 14.352 -0.118 -5.509 1.00 0.00 H new ATOM 0 HG12 VAL A 204 15.852 -1.064 -5.652 1.00 0.00 H new ATOM 0 HG13 VAL A 204 14.652 -1.482 -4.406 1.00 0.00 H new ATOM 0 HG21 VAL A 204 14.006 1.396 -3.599 1.00 0.00 H new ATOM 0 HG22 VAL A 204 14.306 0.073 -2.448 1.00 0.00 H new ATOM 0 HG23 VAL A 204 15.254 1.575 -2.343 1.00 0.00 H new ATOM 2577 N ILE A 205 19.397 -0.614 -3.250 1.00 -0.73 N ATOM 2578 CA ILE A 205 19.790 -1.950 -2.818 1.00 0.36 C ATOM 2579 C ILE A 205 20.486 -2.088 -1.357 1.00 0.57 C ATOM 2580 O ILE A 205 21.689 -2.259 -1.189 1.00 -0.57 O ATOM 2581 CB ILE A 205 20.547 -2.743 -3.956 1.00 0.00 C ATOM 2582 CG1 ILE A 205 20.645 -4.232 -3.576 1.00 0.00 C ATOM 2583 CG2 ILE A 205 21.935 -2.175 -4.284 1.00 0.00 C ATOM 2584 CD1 ILE A 205 21.096 -5.137 -4.713 1.00 0.00 C ATOM 0 H ILE A 205 20.026 0.145 -2.988 1.00 -0.73 H new ATOM 0 HA ILE A 205 18.834 -2.444 -2.643 1.00 0.36 H new ATOM 0 HB ILE A 205 19.957 -2.628 -4.865 1.00 0.00 H new ATOM 0 HG12 ILE A 205 21.341 -4.338 -2.744 1.00 0.00 H new ATOM 0 HG13 ILE A 205 19.671 -4.570 -3.222 1.00 0.00 H new ATOM 0 HG21 ILE A 205 22.394 -2.770 -5.073 1.00 0.00 H new ATOM 0 HG22 ILE A 205 21.836 -1.142 -4.619 1.00 0.00 H new ATOM 0 HG23 ILE A 205 22.562 -2.209 -3.393 1.00 0.00 H new ATOM 0 HD11 ILE A 205 21.139 -6.168 -4.362 1.00 0.00 H new ATOM 0 HD12 ILE A 205 20.388 -5.064 -5.539 1.00 0.00 H new ATOM 0 HD13 ILE A 205 22.084 -4.828 -5.054 1.00 0.00 H new ATOM 2596 N TYR A 206 19.622 -2.073 -0.269 1.00 -0.73 N ATOM 2597 CA TYR A 206 19.960 -2.314 1.178 1.00 0.36 C ATOM 2598 C TYR A 206 18.954 -3.285 1.931 1.00 0.57 C ATOM 2599 O TYR A 206 19.381 -4.152 2.699 1.00 -0.57 O ATOM 2600 CB TYR A 206 20.493 -1.111 2.017 1.00 0.14 C ATOM 2601 CG TYR A 206 21.617 -1.520 2.952 1.00 -0.14 C ATOM 2602 CD1 TYR A 206 21.315 -2.148 4.165 1.00 -0.15 C ATOM 2603 CD2 TYR A 206 22.958 -1.319 2.601 1.00 -0.15 C ATOM 2604 CE1 TYR A 206 22.332 -2.551 5.031 1.00 -0.15 C ATOM 2605 CE2 TYR A 206 23.976 -1.716 3.468 1.00 -0.15 C ATOM 2606 CZ TYR A 206 23.658 -2.325 4.676 1.00 0.08 C ATOM 2607 OH TYR A 206 24.685 -2.702 5.490 1.00 -0.53 O ATOM 0 H TYR A 206 18.628 -1.883 -0.394 1.00 -0.73 H new ATOM 0 HA TYR A 206 20.884 -2.886 1.088 1.00 0.36 H new ATOM 0 HB2 TYR A 206 20.848 -0.330 1.345 1.00 0.14 H new ATOM 0 HB3 TYR A 206 19.676 -0.685 2.598 1.00 0.14 H new ATOM 0 HD1 TYR A 206 20.284 -2.323 4.434 1.00 -0.15 H new ATOM 0 HD2 TYR A 206 23.204 -0.856 1.657 1.00 -0.15 H new ATOM 0 HE1 TYR A 206 22.092 -3.033 5.967 1.00 -0.15 H new ATOM 0 HE2 TYR A 206 25.009 -1.550 3.201 1.00 -0.15 H new ATOM 0 HH TYR A 206 25.538 -2.462 5.072 1.00 -0.53 H new ATOM 2617 N MET A 207 17.592 -3.150 1.796 1.00 -0.73 N ATOM 2618 CA MET A 207 16.630 -4.225 2.036 1.00 0.36 C ATOM 2619 C MET A 207 16.035 -4.439 0.596 1.00 0.57 C ATOM 2620 O MET A 207 14.833 -4.521 0.355 1.00 -0.57 O ATOM 2621 CB MET A 207 15.582 -3.821 3.101 1.00 0.00 C ATOM 2622 CG MET A 207 16.058 -4.094 4.528 1.00 0.23 C ATOM 2623 SD MET A 207 17.271 -2.892 5.163 1.00 -0.46 S ATOM 2624 CE MET A 207 18.273 -4.048 6.136 1.00 0.23 C ATOM 0 H MET A 207 17.152 -2.274 1.514 1.00 -0.73 H new ATOM 0 HA MET A 207 17.053 -5.139 2.452 1.00 0.36 H new ATOM 0 HB2 MET A 207 15.352 -2.761 2.995 1.00 0.00 H new ATOM 0 HB3 MET A 207 14.656 -4.367 2.920 1.00 0.00 H new ATOM 0 HG2 MET A 207 15.193 -4.102 5.191 1.00 0.23 H new ATOM 0 HG3 MET A 207 16.498 -5.090 4.566 1.00 0.23 H new ATOM 0 HE1 MET A 207 18.832 -3.497 6.892 1.00 0.23 H new ATOM 0 HE2 MET A 207 17.621 -4.773 6.623 1.00 0.23 H new ATOM 0 HE3 MET A 207 18.968 -4.569 5.478 1.00 0.23 H new ATOM 2634 N PHE A 208 16.962 -4.632 -0.453 1.00 -0.73 N ATOM 2635 CA PHE A 208 17.441 -6.019 -0.564 1.00 0.36 C ATOM 2636 C PHE A 208 18.747 -6.217 0.250 1.00 0.57 C ATOM 2637 O PHE A 208 18.711 -6.670 1.393 1.00 -0.57 O ATOM 2638 CB PHE A 208 17.595 -6.583 -1.994 1.00 0.14 C ATOM 2639 CG PHE A 208 16.637 -6.065 -3.031 1.00 -0.14 C ATOM 2640 CD1 PHE A 208 15.264 -5.936 -2.767 1.00 -0.15 C ATOM 2641 CD2 PHE A 208 17.118 -5.677 -4.288 1.00 -0.15 C ATOM 2642 CE1 PHE A 208 14.417 -5.332 -3.694 1.00 -0.15 C ATOM 2643 CE2 PHE A 208 16.268 -5.084 -5.218 1.00 -0.15 C ATOM 2644 CZ PHE A 208 14.924 -4.893 -4.912 1.00 -0.15 C ATOM 0 H PHE A 208 17.320 -3.942 -1.114 1.00 -0.73 H new ATOM 0 HA PHE A 208 16.631 -6.610 -0.136 1.00 0.36 H new ATOM 0 HB2 PHE A 208 18.610 -6.376 -2.334 1.00 0.14 H new ATOM 0 HB3 PHE A 208 17.490 -7.667 -1.945 1.00 0.14 H new ATOM 0 HD1 PHE A 208 14.861 -6.308 -1.837 1.00 -0.15 H new ATOM 0 HD2 PHE A 208 18.156 -5.839 -4.538 1.00 -0.15 H new ATOM 0 HE1 PHE A 208 13.369 -5.205 -3.467 1.00 -0.15 H new ATOM 0 HE2 PHE A 208 16.652 -4.772 -6.178 1.00 -0.15 H new ATOM 0 HZ PHE A 208 14.274 -4.403 -5.622 1.00 -0.15 H new ATOM 2654 N VAL A 209 19.910 -5.918 -0.396 1.00 -0.73 N ATOM 2655 CA VAL A 209 21.277 -6.337 -0.077 1.00 0.36 C ATOM 2656 C VAL A 209 21.529 -7.807 0.243 1.00 0.57 C ATOM 2657 O VAL A 209 22.452 -8.444 -0.253 1.00 -0.57 O ATOM 2658 CB VAL A 209 22.130 -5.410 0.786 1.00 0.00 C ATOM 2659 CG1 VAL A 209 22.135 -5.739 2.278 1.00 0.00 C ATOM 2660 CG2 VAL A 209 23.574 -5.345 0.275 1.00 0.00 C ATOM 0 H VAL A 209 19.896 -5.324 -1.225 1.00 -0.73 H new ATOM 0 HA VAL A 209 21.658 -6.209 -1.090 1.00 0.36 H new ATOM 0 HB VAL A 209 21.648 -4.437 0.689 1.00 0.00 H new ATOM 0 HG11 VAL A 209 22.768 -5.026 2.806 1.00 0.00 H new ATOM 0 HG12 VAL A 209 21.119 -5.679 2.667 1.00 0.00 H new ATOM 0 HG13 VAL A 209 22.522 -6.747 2.427 1.00 0.00 H new ATOM 0 HG21 VAL A 209 24.155 -4.677 0.911 1.00 0.00 H new ATOM 0 HG22 VAL A 209 24.014 -6.342 0.299 1.00 0.00 H new ATOM 0 HG23 VAL A 209 23.581 -4.970 -0.748 1.00 0.00 H new ATOM 2670 N VAL A 210 20.702 -8.315 1.202 1.00 -0.73 N ATOM 2671 CA VAL A 210 20.455 -9.697 1.356 1.00 0.36 C ATOM 2672 C VAL A 210 18.869 -10.019 1.260 1.00 0.57 C ATOM 2673 O VAL A 210 18.515 -11.185 1.036 1.00 -0.57 O ATOM 2674 CB VAL A 210 20.852 -10.246 2.720 1.00 0.00 C ATOM 2675 CG1 VAL A 210 22.354 -10.501 2.831 1.00 0.00 C ATOM 2676 CG2 VAL A 210 20.368 -9.442 3.927 1.00 0.00 C ATOM 0 H VAL A 210 20.204 -7.732 1.875 1.00 -0.73 H new ATOM 0 HA VAL A 210 21.047 -10.154 0.563 1.00 0.36 H new ATOM 0 HB VAL A 210 20.317 -11.194 2.764 1.00 0.00 H new ATOM 0 HG11 VAL A 210 22.584 -10.892 3.822 1.00 0.00 H new ATOM 0 HG12 VAL A 210 22.657 -11.226 2.076 1.00 0.00 H new ATOM 0 HG13 VAL A 210 22.894 -9.567 2.674 1.00 0.00 H new ATOM 0 HG21 VAL A 210 20.707 -9.923 4.844 1.00 0.00 H new ATOM 0 HG22 VAL A 210 20.772 -8.431 3.876 1.00 0.00 H new ATOM 0 HG23 VAL A 210 19.279 -9.398 3.922 1.00 0.00 H new ATOM 2686 N HIS A 211 17.867 -9.083 1.604 1.00 -0.73 N ATOM 2687 CA HIS A 211 16.561 -9.494 2.235 1.00 0.36 C ATOM 2688 C HIS A 211 15.580 -10.272 1.334 1.00 0.57 C ATOM 2689 O HIS A 211 14.589 -10.866 1.728 1.00 -0.57 O ATOM 2690 CB HIS A 211 15.815 -8.269 2.759 1.00 0.18 C ATOM 2691 CG HIS A 211 15.277 -8.384 4.126 1.00 -0.33 C ATOM 2692 ND1 HIS A 211 15.972 -7.845 5.176 1.00 0.03 N ATOM 2693 CD2 HIS A 211 14.093 -8.820 4.679 1.00 0.08 C ATOM 2694 CE1 HIS A 211 15.078 -7.690 6.181 1.00 0.04 C ATOM 2695 NE2 HIS A 211 13.979 -8.364 5.972 1.00 -0.57 N ATOM 0 H HIS A 211 17.957 -8.079 1.451 1.00 -0.73 H new ATOM 0 HA HIS A 211 16.870 -10.178 3.025 1.00 0.36 H new ATOM 0 HB2 HIS A 211 16.490 -7.414 2.725 1.00 0.18 H new ATOM 0 HB3 HIS A 211 14.990 -8.051 2.081 1.00 0.18 H new ATOM 0 HD1 HIS A 211 16.964 -7.608 5.197 1.00 0.03 H new ATOM 0 HD2 HIS A 211 13.361 -9.431 4.172 1.00 0.08 H new ATOM 0 HE1 HIS A 211 15.253 -7.080 7.055 1.00 0.04 H new ATOM 2703 N PHE A 212 15.914 -10.140 0.022 1.00 -0.73 N ATOM 2704 CA PHE A 212 15.302 -10.937 -1.088 1.00 0.36 C ATOM 2705 C PHE A 212 16.430 -11.185 -2.139 1.00 0.57 C ATOM 2706 O PHE A 212 16.230 -11.440 -3.320 1.00 -0.57 O ATOM 2707 CB PHE A 212 14.066 -10.249 -1.648 1.00 0.14 C ATOM 2708 CG PHE A 212 12.978 -11.259 -1.932 1.00 -0.14 C ATOM 2709 CD1 PHE A 212 12.134 -11.697 -0.901 1.00 -0.15 C ATOM 2710 CD2 PHE A 212 12.864 -11.850 -3.197 1.00 -0.15 C ATOM 2711 CE1 PHE A 212 11.178 -12.686 -1.135 1.00 -0.15 C ATOM 2712 CE2 PHE A 212 11.912 -12.848 -3.428 1.00 -0.15 C ATOM 2713 CZ PHE A 212 11.068 -13.261 -2.399 1.00 -0.15 C ATOM 0 H PHE A 212 16.618 -9.476 -0.302 1.00 -0.73 H new ATOM 0 HA PHE A 212 14.930 -11.900 -0.738 1.00 0.36 H new ATOM 0 HB2 PHE A 212 13.704 -9.506 -0.938 1.00 0.14 H new ATOM 0 HB3 PHE A 212 14.323 -9.716 -2.563 1.00 0.14 H new ATOM 0 HD1 PHE A 212 12.225 -11.264 0.084 1.00 -0.15 H new ATOM 0 HD2 PHE A 212 13.515 -11.533 -3.998 1.00 -0.15 H new ATOM 0 HE1 PHE A 212 10.524 -13.005 -0.337 1.00 -0.15 H new ATOM 0 HE2 PHE A 212 11.831 -13.299 -4.406 1.00 -0.15 H new ATOM 0 HZ PHE A 212 10.329 -14.027 -2.581 1.00 -0.15 H new ATOM 2723 N ILE A 213 17.689 -11.268 -1.554 1.00 -0.73 N ATOM 2724 CA ILE A 213 18.859 -11.921 -2.179 1.00 0.36 C ATOM 2725 C ILE A 213 19.076 -13.406 -1.809 1.00 0.57 C ATOM 2726 O ILE A 213 18.913 -14.286 -2.663 1.00 -0.57 O ATOM 2727 CB ILE A 213 20.188 -11.229 -1.835 1.00 0.00 C ATOM 2728 CG1 ILE A 213 20.123 -9.716 -2.126 1.00 0.00 C ATOM 2729 CG2 ILE A 213 21.374 -11.831 -2.619 1.00 0.00 C ATOM 2730 CD1 ILE A 213 19.682 -9.328 -3.535 1.00 0.00 C ATOM 0 H ILE A 213 17.894 -10.875 -0.635 1.00 -0.73 H new ATOM 0 HA ILE A 213 18.604 -11.839 -3.236 1.00 0.36 H new ATOM 0 HB ILE A 213 20.348 -11.392 -0.769 1.00 0.00 H new ATOM 0 HG12 ILE A 213 19.439 -9.257 -1.412 1.00 0.00 H new ATOM 0 HG13 ILE A 213 21.108 -9.288 -1.943 1.00 0.00 H new ATOM 0 HG21 ILE A 213 22.292 -11.312 -2.345 1.00 0.00 H new ATOM 0 HG22 ILE A 213 21.470 -12.890 -2.378 1.00 0.00 H new ATOM 0 HG23 ILE A 213 21.198 -11.717 -3.689 1.00 0.00 H new ATOM 0 HD11 ILE A 213 19.672 -8.242 -3.627 1.00 0.00 H new ATOM 0 HD12 ILE A 213 20.377 -9.748 -4.262 1.00 0.00 H new ATOM 0 HD13 ILE A 213 18.681 -9.717 -3.723 1.00 0.00 H new ATOM 2742 N ILE A 214 19.541 -13.717 -0.506 1.00 -0.73 N ATOM 2743 CA ILE A 214 19.714 -15.077 -0.253 1.00 0.36 C ATOM 2744 C ILE A 214 18.389 -15.726 0.082 1.00 0.57 C ATOM 2745 O ILE A 214 18.444 -16.834 0.616 1.00 -0.57 O ATOM 2746 CB ILE A 214 20.670 -15.278 0.939 1.00 0.00 C ATOM 2747 CG1 ILE A 214 20.823 -14.096 1.935 1.00 0.00 C ATOM 2748 CG2 ILE A 214 22.051 -15.700 0.440 1.00 0.00 C ATOM 2749 CD1 ILE A 214 21.574 -14.444 3.215 1.00 0.00 C ATOM 0 H ILE A 214 19.757 -13.064 0.248 1.00 -0.73 H new ATOM 0 HA ILE A 214 20.132 -15.535 -1.149 1.00 0.36 H new ATOM 0 HB ILE A 214 20.184 -16.060 1.522 1.00 0.00 H new ATOM 0 HG12 ILE A 214 21.343 -13.280 1.434 1.00 0.00 H new ATOM 0 HG13 ILE A 214 19.831 -13.728 2.199 1.00 0.00 H new ATOM 0 HG21 ILE A 214 22.718 -15.839 1.291 1.00 0.00 H new ATOM 0 HG22 ILE A 214 21.968 -16.636 -0.113 1.00 0.00 H new ATOM 0 HG23 ILE A 214 22.453 -14.927 -0.214 1.00 0.00 H new ATOM 0 HD11 ILE A 214 21.635 -13.562 3.852 1.00 0.00 H new ATOM 0 HD12 ILE A 214 21.045 -15.238 3.743 1.00 0.00 H new ATOM 0 HD13 ILE A 214 22.580 -14.782 2.966 1.00 0.00 H new ATOM 2761 N PRO A 215 17.146 -15.174 -0.145 1.00 -0.66 N ATOM 2762 CA PRO A 215 16.252 -15.675 0.799 1.00 0.36 C ATOM 2763 C PRO A 215 14.857 -15.550 0.120 1.00 0.57 C ATOM 2764 O PRO A 215 13.848 -15.124 0.677 1.00 -0.57 O ATOM 2765 CB PRO A 215 16.714 -14.693 1.882 1.00 0.00 C ATOM 2766 CG PRO A 215 16.159 -13.458 1.286 1.00 0.00 C ATOM 2767 CD PRO A 215 16.743 -13.796 -0.096 1.00 0.30 C ATOM 0 HA PRO A 215 16.208 -16.694 1.183 1.00 0.36 H new ATOM 0 HB2 PRO A 215 16.298 -14.916 2.864 1.00 0.00 H new ATOM 0 HB3 PRO A 215 17.798 -14.662 1.994 1.00 0.00 H new ATOM 0 HG2 PRO A 215 15.071 -13.395 1.312 1.00 0.00 H new ATOM 0 HG3 PRO A 215 16.542 -12.536 1.723 1.00 0.00 H new ATOM 0 HD2 PRO A 215 16.001 -13.600 -0.870 1.00 0.30 H new ATOM 0 HD3 PRO A 215 17.598 -13.153 -0.304 1.00 0.30 H new ATOM 2775 N LEU A 216 14.753 -16.236 -1.045 1.00 -0.73 N ATOM 2776 CA LEU A 216 15.529 -16.444 -2.303 1.00 0.36 C ATOM 2777 C LEU A 216 16.773 -17.385 -2.511 1.00 0.57 C ATOM 2778 O LEU A 216 16.491 -18.536 -2.888 1.00 -0.57 O ATOM 2779 CB LEU A 216 15.495 -15.246 -3.245 1.00 0.00 C ATOM 2780 CG LEU A 216 15.645 -15.581 -4.743 1.00 0.00 C ATOM 2781 CD1 LEU A 216 14.475 -16.413 -5.270 1.00 0.00 C ATOM 2782 CD2 LEU A 216 15.761 -14.285 -5.550 1.00 0.00 C ATOM 0 H LEU A 216 13.905 -16.795 -1.140 1.00 -0.73 H new ATOM 0 HA LEU A 216 14.886 -17.291 -2.543 1.00 0.36 H new ATOM 0 HB2 LEU A 216 14.553 -14.718 -3.100 1.00 0.00 H new ATOM 0 HB3 LEU A 216 16.292 -14.559 -2.962 1.00 0.00 H new ATOM 0 HG LEU A 216 16.549 -16.178 -4.858 1.00 0.00 H new ATOM 0 HD11 LEU A 216 14.626 -16.623 -6.329 1.00 0.00 H new ATOM 0 HD12 LEU A 216 14.418 -17.351 -4.718 1.00 0.00 H new ATOM 0 HD13 LEU A 216 13.546 -15.858 -5.139 1.00 0.00 H new ATOM 0 HD21 LEU A 216 15.867 -14.524 -6.608 1.00 0.00 H new ATOM 0 HD22 LEU A 216 14.865 -13.683 -5.402 1.00 0.00 H new ATOM 0 HD23 LEU A 216 16.634 -13.725 -5.215 1.00 0.00 H new ATOM 2794 N ILE A 217 18.106 -17.049 -2.341 1.00 -0.73 N ATOM 2795 CA ILE A 217 19.079 -18.164 -2.510 1.00 0.36 C ATOM 2796 C ILE A 217 19.428 -19.242 -1.336 1.00 0.57 C ATOM 2797 O ILE A 217 19.953 -20.319 -1.630 1.00 -0.57 O ATOM 2798 CB ILE A 217 20.218 -17.697 -3.474 1.00 0.00 C ATOM 2799 CG1 ILE A 217 20.258 -18.517 -4.781 1.00 0.00 C ATOM 2800 CG2 ILE A 217 21.592 -17.568 -2.834 1.00 0.00 C ATOM 2801 CD1 ILE A 217 20.943 -19.870 -4.713 1.00 0.00 C ATOM 0 H ILE A 217 18.484 -16.129 -2.115 1.00 -0.73 H new ATOM 0 HA ILE A 217 18.483 -18.960 -2.956 1.00 0.36 H new ATOM 0 HB ILE A 217 19.943 -16.675 -3.735 1.00 0.00 H new ATOM 0 HG12 ILE A 217 19.233 -18.671 -5.119 1.00 0.00 H new ATOM 0 HG13 ILE A 217 20.758 -17.920 -5.543 1.00 0.00 H new ATOM 0 HG21 ILE A 217 22.313 -17.239 -3.583 1.00 0.00 H new ATOM 0 HG22 ILE A 217 21.550 -16.838 -2.026 1.00 0.00 H new ATOM 0 HG23 ILE A 217 21.899 -18.534 -2.434 1.00 0.00 H new ATOM 0 HD11 ILE A 217 20.905 -20.347 -5.693 1.00 0.00 H new ATOM 0 HD12 ILE A 217 21.983 -19.737 -4.414 1.00 0.00 H new ATOM 0 HD13 ILE A 217 20.434 -20.499 -3.983 1.00 0.00 H new ATOM 2813 N VAL A 218 19.153 -18.959 -0.012 1.00 -0.73 N ATOM 2814 CA VAL A 218 19.402 -19.818 1.161 1.00 0.36 C ATOM 2815 C VAL A 218 18.327 -20.961 1.405 1.00 0.57 C ATOM 2816 O VAL A 218 18.758 -22.124 1.472 1.00 -0.57 O ATOM 2817 CB VAL A 218 19.727 -18.938 2.418 1.00 0.00 C ATOM 2818 CG1 VAL A 218 19.746 -19.739 3.724 1.00 0.00 C ATOM 2819 CG2 VAL A 218 21.171 -18.411 2.286 1.00 0.00 C ATOM 0 H VAL A 218 18.729 -18.071 0.256 1.00 -0.73 H new ATOM 0 HA VAL A 218 20.291 -20.408 0.938 1.00 0.36 H new ATOM 0 HB VAL A 218 18.957 -18.167 2.454 1.00 0.00 H new ATOM 0 HG11 VAL A 218 19.977 -19.073 4.556 1.00 0.00 H new ATOM 0 HG12 VAL A 218 18.770 -20.196 3.885 1.00 0.00 H new ATOM 0 HG13 VAL A 218 20.505 -20.518 3.662 1.00 0.00 H new ATOM 0 HG21 VAL A 218 21.415 -17.796 3.152 1.00 0.00 H new ATOM 0 HG22 VAL A 218 21.862 -19.252 2.232 1.00 0.00 H new ATOM 0 HG23 VAL A 218 21.258 -17.812 1.380 1.00 0.00 H new ATOM 2829 N ILE A 219 16.970 -20.823 1.623 1.00 -0.73 N ATOM 2830 CA ILE A 219 15.985 -19.788 1.585 1.00 0.36 C ATOM 2831 C ILE A 219 15.809 -19.369 0.172 1.00 0.57 C ATOM 2832 O ILE A 219 15.097 -18.432 -0.145 1.00 -0.57 O ATOM 2833 CB ILE A 219 16.129 -18.758 2.675 1.00 0.00 C ATOM 2834 CG1 ILE A 219 16.280 -19.413 4.074 1.00 0.00 C ATOM 2835 CG2 ILE A 219 14.892 -17.867 2.791 1.00 0.00 C ATOM 2836 CD1 ILE A 219 16.779 -18.445 5.139 1.00 0.00 C ATOM 0 H ILE A 219 16.482 -21.677 1.891 1.00 -0.73 H new ATOM 0 HA ILE A 219 15.000 -20.146 1.884 1.00 0.36 H new ATOM 0 HB ILE A 219 17.014 -18.185 2.397 1.00 0.00 H new ATOM 0 HG12 ILE A 219 15.317 -19.819 4.384 1.00 0.00 H new ATOM 0 HG13 ILE A 219 16.972 -20.252 4.002 1.00 0.00 H new ATOM 0 HG21 ILE A 219 15.041 -17.140 3.589 1.00 0.00 H new ATOM 0 HG22 ILE A 219 14.731 -17.343 1.849 1.00 0.00 H new ATOM 0 HG23 ILE A 219 14.021 -18.482 3.018 1.00 0.00 H new ATOM 0 HD11 ILE A 219 16.863 -18.965 6.093 1.00 0.00 H new ATOM 0 HD12 ILE A 219 17.756 -18.058 4.850 1.00 0.00 H new ATOM 0 HD13 ILE A 219 16.076 -17.618 5.237 1.00 0.00 H new ATOM 2848 N PHE A 220 16.298 -20.122 -0.829 1.00 -0.73 N ATOM 2849 CA PHE A 220 15.768 -21.378 -1.258 1.00 0.36 C ATOM 2850 C PHE A 220 15.884 -22.448 -0.245 1.00 0.57 C ATOM 2851 O PHE A 220 15.004 -22.651 0.597 1.00 -0.57 O ATOM 2852 CB PHE A 220 16.445 -21.822 -2.547 1.00 0.14 C ATOM 2853 CG PHE A 220 15.575 -22.089 -3.729 1.00 -0.14 C ATOM 2854 CD1 PHE A 220 15.176 -21.062 -4.592 1.00 -0.15 C ATOM 2855 CD2 PHE A 220 15.220 -23.409 -4.013 1.00 -0.15 C ATOM 2856 CE1 PHE A 220 14.444 -21.353 -5.742 1.00 -0.15 C ATOM 2857 CE2 PHE A 220 14.527 -23.690 -5.181 1.00 -0.15 C ATOM 2858 CZ PHE A 220 14.126 -22.672 -6.043 1.00 -0.15 C ATOM 0 H PHE A 220 17.113 -19.836 -1.371 1.00 -0.73 H new ATOM 0 HA PHE A 220 14.703 -21.215 -1.423 1.00 0.36 H new ATOM 0 HB2 PHE A 220 17.167 -21.056 -2.828 1.00 0.14 H new ATOM 0 HB3 PHE A 220 17.010 -22.730 -2.334 1.00 0.14 H new ATOM 0 HD1 PHE A 220 15.437 -20.039 -4.366 1.00 -0.15 H new ATOM 0 HD2 PHE A 220 15.482 -24.203 -3.330 1.00 -0.15 H new ATOM 0 HE1 PHE A 220 14.125 -20.556 -6.397 1.00 -0.15 H new ATOM 0 HE2 PHE A 220 14.294 -24.716 -5.426 1.00 -0.15 H new ATOM 0 HZ PHE A 220 13.571 -22.906 -6.940 1.00 -0.15 H new ATOM 2868 N PHE A 221 17.035 -23.161 -0.131 1.00 -0.73 N ATOM 2869 CA PHE A 221 16.900 -24.507 -0.527 1.00 0.36 C ATOM 2870 C PHE A 221 16.711 -25.489 0.646 1.00 0.57 C ATOM 2871 O PHE A 221 17.291 -26.558 0.788 1.00 -0.57 O ATOM 2872 CB PHE A 221 17.882 -25.005 -1.538 1.00 0.14 C ATOM 2873 CG PHE A 221 19.288 -24.507 -1.513 1.00 -0.14 C ATOM 2874 CD1 PHE A 221 20.104 -24.663 -0.385 1.00 -0.15 C ATOM 2875 CD2 PHE A 221 19.806 -23.886 -2.650 1.00 -0.15 C ATOM 2876 CE1 PHE A 221 21.412 -24.179 -0.390 1.00 -0.15 C ATOM 2877 CE2 PHE A 221 21.108 -23.405 -2.651 1.00 -0.15 C ATOM 2878 CZ PHE A 221 21.914 -23.546 -1.525 1.00 -0.15 C ATOM 0 H PHE A 221 17.947 -22.841 0.196 1.00 -0.73 H new ATOM 0 HA PHE A 221 15.957 -24.484 -1.074 1.00 0.36 H new ATOM 0 HB2 PHE A 221 17.920 -26.091 -1.447 1.00 0.14 H new ATOM 0 HB3 PHE A 221 17.475 -24.781 -2.524 1.00 0.14 H new ATOM 0 HD1 PHE A 221 19.718 -25.160 0.493 1.00 -0.15 H new ATOM 0 HD2 PHE A 221 19.192 -23.779 -3.532 1.00 -0.15 H new ATOM 0 HE1 PHE A 221 22.035 -24.295 0.485 1.00 -0.15 H new ATOM 0 HE2 PHE A 221 21.499 -22.918 -3.532 1.00 -0.15 H new ATOM 0 HZ PHE A 221 22.925 -23.166 -1.531 1.00 -0.15 H new ATOM 2888 N CYS A 222 15.576 -25.174 1.376 1.00 -0.73 N ATOM 2889 CA CYS A 222 14.447 -26.085 1.166 1.00 0.36 C ATOM 2890 C CYS A 222 13.137 -25.404 0.758 1.00 0.57 C ATOM 2891 O CYS A 222 12.036 -25.889 0.960 1.00 -0.57 O ATOM 2892 CB CYS A 222 14.557 -27.399 1.935 1.00 0.23 C ATOM 2893 SG CYS A 222 15.163 -28.828 0.948 1.00 -0.41 S ATOM 0 H CYS A 222 15.448 -24.398 2.025 1.00 -0.73 H new ATOM 0 HA CYS A 222 14.480 -26.602 0.207 1.00 0.36 H new ATOM 0 HB2 CYS A 222 15.227 -27.252 2.782 1.00 0.23 H new ATOM 0 HB3 CYS A 222 13.577 -27.647 2.342 1.00 0.23 H new ATOM 0 HG CYS A 222 16.329 -28.546 0.447 1.00 -0.41 H new ATOM 2899 N TYR A 223 13.358 -24.416 -0.213 1.00 -0.73 N ATOM 2900 CA TYR A 223 12.421 -24.230 -1.331 1.00 0.36 C ATOM 2901 C TYR A 223 12.809 -25.158 -2.567 1.00 0.57 C ATOM 2902 O TYR A 223 12.240 -25.168 -3.647 1.00 -0.57 O ATOM 2903 CB TYR A 223 12.335 -22.860 -1.949 1.00 0.14 C ATOM 2904 CG TYR A 223 12.180 -21.553 -1.224 1.00 -0.14 C ATOM 2905 CD1 TYR A 223 12.248 -21.402 0.160 1.00 -0.15 C ATOM 2906 CD2 TYR A 223 12.037 -20.385 -2.002 1.00 -0.15 C ATOM 2907 CE1 TYR A 223 12.168 -20.139 0.756 1.00 -0.15 C ATOM 2908 CE2 TYR A 223 11.977 -19.116 -1.411 1.00 -0.15 C ATOM 2909 CZ TYR A 223 12.044 -19.006 -0.032 1.00 0.08 C ATOM 2910 OH TYR A 223 12.016 -17.803 0.603 1.00 -0.53 O ATOM 0 H TYR A 223 14.155 -23.779 -0.214 1.00 -0.73 H new ATOM 0 HA TYR A 223 11.475 -24.461 -0.842 1.00 0.36 H new ATOM 0 HB2 TYR A 223 13.240 -22.754 -2.547 1.00 0.14 H new ATOM 0 HB3 TYR A 223 11.497 -22.907 -2.644 1.00 0.14 H new ATOM 0 HD1 TYR A 223 12.365 -22.276 0.784 1.00 -0.15 H new ATOM 0 HD2 TYR A 223 11.972 -20.471 -3.077 1.00 -0.15 H new ATOM 0 HE1 TYR A 223 12.203 -20.047 1.831 1.00 -0.15 H new ATOM 0 HE2 TYR A 223 11.879 -18.233 -2.025 1.00 -0.15 H new ATOM 0 HH TYR A 223 11.927 -17.086 -0.059 1.00 -0.53 H new ATOM 2920 N GLY A 224 13.778 -26.064 -2.268 1.00 -0.73 N ATOM 2921 CA GLY A 224 13.931 -27.399 -2.836 1.00 0.36 C ATOM 2922 C GLY A 224 13.098 -28.439 -2.045 1.00 0.57 C ATOM 2923 O GLY A 224 12.861 -29.569 -2.462 1.00 -0.57 O ATOM 0 H GLY A 224 14.506 -25.855 -1.584 1.00 -0.73 H new ATOM 0 HA2 GLY A 224 13.615 -27.392 -3.879 1.00 0.36 H new ATOM 0 HA3 GLY A 224 14.983 -27.685 -2.823 1.00 0.36 H new ATOM 2927 N GLN A 225 12.632 -27.999 -0.801 1.00 -0.73 N ATOM 2928 CA GLN A 225 11.339 -28.509 -0.268 1.00 0.36 C ATOM 2929 C GLN A 225 10.154 -27.780 -0.981 1.00 0.57 C ATOM 2930 O GLN A 225 8.984 -27.879 -0.659 1.00 -0.57 O ATOM 2931 CB GLN A 225 11.222 -28.772 1.198 1.00 0.00 C ATOM 2932 CG GLN A 225 11.874 -30.123 1.548 1.00 0.06 C ATOM 2933 CD GLN A 225 10.897 -31.116 2.117 1.00 0.57 C ATOM 2934 OE1 GLN A 225 9.865 -30.788 2.688 1.00 -0.57 O ATOM 2935 NE2 GLN A 225 11.256 -32.424 2.019 1.00 -0.80 N ATOM 0 H GLN A 225 13.117 -27.333 -0.200 1.00 -0.73 H new ATOM 0 HA GLN A 225 11.285 -29.562 -0.546 1.00 0.36 H new ATOM 0 HB2 GLN A 225 11.704 -27.971 1.758 1.00 0.00 H new ATOM 0 HB3 GLN A 225 10.172 -28.779 1.491 1.00 0.00 H new ATOM 0 HG2 GLN A 225 12.331 -30.543 0.652 1.00 0.06 H new ATOM 0 HG3 GLN A 225 12.676 -29.958 2.267 1.00 0.06 H new ATOM 0 HE21 GLN A 225 12.119 -32.681 1.540 1.00 -0.80 H new ATOM 0 HE22 GLN A 225 10.662 -33.148 2.424 1.00 -0.80 H new ATOM 2944 N LEU A 226 10.586 -27.172 -2.136 1.00 -0.73 N ATOM 2945 CA LEU A 226 9.851 -26.823 -3.380 1.00 0.36 C ATOM 2946 C LEU A 226 10.549 -27.396 -4.646 1.00 0.57 C ATOM 2947 O LEU A 226 10.526 -26.929 -5.774 1.00 -0.57 O ATOM 2948 CB LEU A 226 9.355 -25.366 -3.345 1.00 0.00 C ATOM 2949 CG LEU A 226 9.152 -24.638 -4.671 1.00 0.00 C ATOM 2950 CD1 LEU A 226 8.030 -25.237 -5.521 1.00 0.00 C ATOM 2951 CD2 LEU A 226 8.838 -23.156 -4.432 1.00 0.00 C ATOM 0 H LEU A 226 11.563 -26.889 -2.215 1.00 -0.73 H new ATOM 0 HA LEU A 226 8.899 -27.349 -3.450 1.00 0.36 H new ATOM 0 HB2 LEU A 226 8.406 -25.351 -2.809 1.00 0.00 H new ATOM 0 HB3 LEU A 226 10.065 -24.787 -2.753 1.00 0.00 H new ATOM 0 HG LEU A 226 10.089 -24.752 -5.217 1.00 0.00 H new ATOM 0 HD11 LEU A 226 7.937 -24.674 -6.450 1.00 0.00 H new ATOM 0 HD12 LEU A 226 8.262 -26.277 -5.749 1.00 0.00 H new ATOM 0 HD13 LEU A 226 7.090 -25.187 -4.971 1.00 0.00 H new ATOM 0 HD21 LEU A 226 8.697 -22.655 -5.390 1.00 0.00 H new ATOM 0 HD22 LEU A 226 7.928 -23.068 -3.839 1.00 0.00 H new ATOM 0 HD23 LEU A 226 9.666 -22.690 -3.897 1.00 0.00 H new ATOM 2963 N VAL A 227 10.899 -28.722 -4.405 1.00 -0.73 N ATOM 2964 CA VAL A 227 10.765 -29.730 -5.472 1.00 0.36 C ATOM 2965 C VAL A 227 10.771 -31.147 -4.897 1.00 0.57 C ATOM 2966 O VAL A 227 10.568 -32.171 -5.538 1.00 -0.57 O ATOM 2967 CB VAL A 227 11.842 -29.565 -6.555 1.00 0.00 C ATOM 2968 CG1 VAL A 227 13.182 -30.215 -6.185 1.00 0.00 C ATOM 2969 CG2 VAL A 227 11.370 -30.061 -7.916 1.00 0.00 C ATOM 0 H VAL A 227 11.256 -29.076 -3.518 1.00 -0.73 H new ATOM 0 HA VAL A 227 9.800 -29.566 -5.951 1.00 0.36 H new ATOM 0 HB VAL A 227 12.015 -28.491 -6.621 1.00 0.00 H new ATOM 0 HG11 VAL A 227 13.897 -30.061 -6.993 1.00 0.00 H new ATOM 0 HG12 VAL A 227 13.566 -29.763 -5.270 1.00 0.00 H new ATOM 0 HG13 VAL A 227 13.037 -31.284 -6.028 1.00 0.00 H new ATOM 0 HG21 VAL A 227 12.165 -29.924 -8.649 1.00 0.00 H new ATOM 0 HG22 VAL A 227 11.116 -31.119 -7.850 1.00 0.00 H new ATOM 0 HG23 VAL A 227 10.491 -29.496 -8.224 1.00 0.00 H new ATOM 2979 N PHE A 228 10.967 -31.110 -3.547 1.00 -0.73 N ATOM 2980 CA PHE A 228 9.999 -31.674 -2.633 1.00 0.36 C ATOM 2981 C PHE A 228 8.848 -30.674 -2.193 1.00 0.57 C ATOM 2982 O PHE A 228 8.444 -30.643 -1.032 1.00 -0.57 O ATOM 2983 CB PHE A 228 10.688 -32.344 -1.439 1.00 0.14 C ATOM 2984 CG PHE A 228 11.422 -33.612 -1.829 1.00 -0.14 C ATOM 2985 CD1 PHE A 228 12.727 -33.556 -2.339 1.00 -0.15 C ATOM 2986 CD2 PHE A 228 10.790 -34.858 -1.721 1.00 -0.15 C ATOM 2987 CE1 PHE A 228 13.385 -34.723 -2.729 1.00 -0.15 C ATOM 2988 CE2 PHE A 228 11.451 -36.025 -2.108 1.00 -0.15 C ATOM 2989 CZ PHE A 228 12.748 -35.958 -2.613 1.00 -0.15 C ATOM 0 H PHE A 228 11.784 -30.696 -3.098 1.00 -0.73 H new ATOM 0 HA PHE A 228 9.477 -32.448 -3.196 1.00 0.36 H new ATOM 0 HB2 PHE A 228 11.392 -31.644 -0.990 1.00 0.14 H new ATOM 0 HB3 PHE A 228 9.943 -32.578 -0.678 1.00 0.14 H new ATOM 0 HD1 PHE A 228 13.226 -32.603 -2.431 1.00 -0.15 H new ATOM 0 HD2 PHE A 228 9.783 -34.916 -1.335 1.00 -0.15 H new ATOM 0 HE1 PHE A 228 14.390 -34.670 -3.122 1.00 -0.15 H new ATOM 0 HE2 PHE A 228 10.957 -36.981 -2.016 1.00 -0.15 H new ATOM 0 HZ PHE A 228 13.259 -36.861 -2.914 1.00 -0.15 H new ATOM 2999 N THR A 229 8.231 -29.907 -3.200 1.00 -0.73 N ATOM 3000 CA THR A 229 6.787 -29.584 -3.080 1.00 0.36 C ATOM 3001 C THR A 229 6.120 -29.580 -4.448 1.00 0.57 C ATOM 3002 O THR A 229 4.906 -29.720 -4.587 1.00 -0.57 O ATOM 3003 CB THR A 229 6.256 -28.482 -2.153 1.00 0.28 C ATOM 3004 OG1 THR A 229 4.829 -28.422 -2.071 1.00 -0.68 O ATOM 3005 CG2 THR A 229 6.613 -27.078 -2.571 1.00 0.00 C ATOM 0 H THR A 229 8.697 -29.541 -4.030 1.00 -0.73 H new ATOM 0 HA THR A 229 6.474 -30.420 -2.455 1.00 0.36 H new ATOM 0 HB THR A 229 6.728 -28.773 -1.215 1.00 0.28 H new ATOM 0 HG1 THR A 229 4.497 -29.201 -1.578 1.00 -0.68 H new ATOM 0 HG21 THR A 229 6.195 -26.368 -1.857 1.00 0.00 H new ATOM 0 HG22 THR A 229 7.697 -26.971 -2.597 1.00 0.00 H new ATOM 0 HG23 THR A 229 6.205 -26.878 -3.562 1.00 0.00 H new ATOM 3013 N VAL A 230 6.959 -29.515 -5.556 1.00 -0.73 N ATOM 3014 CA VAL A 230 6.244 -29.530 -6.846 1.00 0.36 C ATOM 3015 C VAL A 230 5.638 -30.900 -7.210 1.00 0.57 C ATOM 3016 O VAL A 230 4.748 -31.055 -8.036 1.00 -0.57 O ATOM 3017 CB VAL A 230 7.074 -28.911 -7.975 1.00 0.00 C ATOM 3018 CG1 VAL A 230 7.833 -29.941 -8.812 1.00 0.00 C ATOM 3019 CG2 VAL A 230 6.196 -28.045 -8.880 1.00 0.00 C ATOM 0 H VAL A 230 7.977 -29.460 -5.571 1.00 -0.73 H new ATOM 0 HA VAL A 230 5.378 -28.882 -6.711 1.00 0.36 H new ATOM 0 HB VAL A 230 7.825 -28.290 -7.487 1.00 0.00 H new ATOM 0 HG11 VAL A 230 8.398 -29.431 -9.592 1.00 0.00 H new ATOM 0 HG12 VAL A 230 8.518 -30.497 -8.172 1.00 0.00 H new ATOM 0 HG13 VAL A 230 7.124 -30.631 -9.270 1.00 0.00 H new ATOM 0 HG21 VAL A 230 6.805 -27.615 -9.675 1.00 0.00 H new ATOM 0 HG22 VAL A 230 5.408 -28.658 -9.318 1.00 0.00 H new ATOM 0 HG23 VAL A 230 5.748 -27.244 -8.293 1.00 0.00 H new ATOM 3029 N LYS A 231 6.244 -31.921 -6.536 1.00 -0.73 N ATOM 3030 CA LYS A 231 5.755 -33.301 -6.525 1.00 0.36 C ATOM 3031 C LYS A 231 5.082 -33.714 -5.167 1.00 0.57 C ATOM 3032 O LYS A 231 4.776 -34.851 -4.837 1.00 -0.57 O ATOM 3033 CB LYS A 231 6.815 -34.316 -6.950 1.00 0.00 C ATOM 3034 CG LYS A 231 8.123 -33.722 -7.481 1.00 0.00 C ATOM 3035 CD LYS A 231 9.202 -34.748 -7.833 1.00 0.00 C ATOM 3036 CE LYS A 231 9.755 -35.592 -6.687 1.00 0.50 C ATOM 3037 NZ LYS A 231 10.203 -34.771 -5.567 1.00 -0.85 N ATOM 0 H LYS A 231 7.092 -31.790 -5.985 1.00 -0.73 H new ATOM 0 HA LYS A 231 4.971 -33.321 -7.282 1.00 0.36 H new ATOM 0 HB2 LYS A 231 7.046 -34.953 -6.096 1.00 0.00 H new ATOM 0 HB3 LYS A 231 6.389 -34.959 -7.721 1.00 0.00 H new ATOM 0 HG2 LYS A 231 7.902 -33.130 -8.369 1.00 0.00 H new ATOM 0 HG3 LYS A 231 8.524 -33.037 -6.733 1.00 0.00 H new ATOM 0 HD2 LYS A 231 8.795 -35.423 -8.586 1.00 0.00 H new ATOM 0 HD3 LYS A 231 10.035 -34.219 -8.297 1.00 0.00 H new ATOM 0 HE2 LYS A 231 8.986 -36.284 -6.344 1.00 0.50 H new ATOM 0 HE3 LYS A 231 10.588 -36.195 -7.050 1.00 0.50 H new ATOM 0 HZ1 LYS A 231 11.076 -35.173 -5.170 1.00 -0.85 H new ATOM 0 HZ2 LYS A 231 10.387 -33.802 -5.898 1.00 -0.85 H new ATOM 0 HZ3 LYS A 231 9.466 -34.752 -4.834 1.00 -0.85 H new ATOM 3051 N GLU A 232 4.789 -32.635 -4.391 1.00 -0.73 N ATOM 3052 CA GLU A 232 4.638 -32.497 -2.952 1.00 0.36 C ATOM 3053 C GLU A 232 3.676 -31.318 -2.788 1.00 0.57 C ATOM 3054 O GLU A 232 3.622 -30.580 -1.812 1.00 -0.57 O ATOM 3055 CB GLU A 232 5.805 -32.794 -2.021 1.00 0.00 C ATOM 3056 CG GLU A 232 6.760 -33.888 -2.445 1.00 -0.11 C ATOM 3057 CD GLU A 232 7.591 -33.589 -3.659 1.00 0.91 C ATOM 3058 OE1 GLU A 232 7.520 -32.437 -4.177 1.00 -0.90 O ATOM 3059 OE2 GLU A 232 8.349 -34.527 -4.041 1.00 -0.90 O ATOM 0 H GLU A 232 4.637 -31.732 -4.841 1.00 -0.73 H new ATOM 0 HA GLU A 232 4.200 -33.366 -2.461 1.00 0.36 H new ATOM 0 HB2 GLU A 232 6.378 -31.876 -1.892 1.00 0.00 H new ATOM 0 HB3 GLU A 232 5.400 -33.057 -1.044 1.00 0.00 H new ATOM 0 HG2 GLU A 232 7.430 -34.104 -1.613 1.00 -0.11 H new ATOM 0 HG3 GLU A 232 6.185 -34.794 -2.635 1.00 -0.11 H new ATOM 3066 N ALA A 233 2.648 -31.379 -3.723 1.00 -0.73 N ATOM 3067 CA ALA A 233 1.315 -31.784 -3.288 1.00 0.36 C ATOM 3068 C ALA A 233 0.917 -33.274 -3.397 1.00 0.57 C ATOM 3069 O ALA A 233 -0.236 -33.669 -3.245 1.00 -0.57 O ATOM 3070 CB ALA A 233 0.287 -30.927 -3.999 1.00 0.00 C ATOM 0 H ALA A 233 2.741 -31.161 -4.715 1.00 -0.73 H new ATOM 0 HA ALA A 233 1.344 -31.629 -2.210 1.00 0.36 H new ATOM 0 HB1 ALA A 233 -0.714 -31.221 -3.682 1.00 0.00 H new ATOM 0 HB2 ALA A 233 0.453 -29.879 -3.751 1.00 0.00 H new ATOM 0 HB3 ALA A 233 0.381 -31.064 -5.076 1.00 0.00 H new ATOM 3076 N ALA A 234 1.994 -34.114 -3.353 1.00 -0.73 N ATOM 3077 CA ALA A 234 2.003 -35.398 -2.657 1.00 0.36 C ATOM 3078 C ALA A 234 2.999 -35.366 -1.447 1.00 0.57 C ATOM 3079 O ALA A 234 3.720 -36.307 -1.136 1.00 -0.57 O ATOM 3080 CB ALA A 234 2.238 -36.565 -3.595 1.00 0.00 C ATOM 0 H ALA A 234 2.880 -33.898 -3.811 1.00 -0.73 H new ATOM 0 HA ALA A 234 1.007 -35.563 -2.246 1.00 0.36 H new ATOM 0 HB1 ALA A 234 2.235 -37.495 -3.027 1.00 0.00 H new ATOM 0 HB2 ALA A 234 1.446 -36.595 -4.344 1.00 0.00 H new ATOM 0 HB3 ALA A 234 3.202 -36.445 -4.090 1.00 0.00 H new ATOM 3086 N ALA A 235 2.896 -34.232 -0.654 1.00 -0.73 N ATOM 3087 CA ALA A 235 3.785 -33.812 0.470 1.00 0.36 C ATOM 3088 C ALA A 235 3.951 -32.285 0.437 1.00 0.57 C ATOM 3089 O ALA A 235 4.946 -31.640 0.719 1.00 -0.57 O ATOM 3090 CB ALA A 235 4.993 -34.651 0.840 1.00 0.00 C ATOM 0 H ALA A 235 2.143 -33.560 -0.803 1.00 -0.73 H new ATOM 0 HA ALA A 235 3.253 -34.086 1.381 1.00 0.36 H new ATOM 0 HB1 ALA A 235 5.515 -34.188 1.677 1.00 0.00 H new ATOM 0 HB2 ALA A 235 4.668 -35.652 1.124 1.00 0.00 H new ATOM 0 HB3 ALA A 235 5.666 -34.717 -0.015 1.00 0.00 H new ATOM 3096 N GLN A 236 2.716 -31.675 0.181 1.00 -0.73 N ATOM 3097 CA GLN A 236 2.069 -31.183 1.377 1.00 0.36 C ATOM 3098 C GLN A 236 0.694 -31.845 1.490 1.00 0.57 C ATOM 3099 O GLN A 236 -0.277 -31.257 1.956 1.00 -0.57 O ATOM 3100 CB GLN A 236 2.060 -29.654 1.408 1.00 0.00 C ATOM 3101 CG GLN A 236 1.779 -28.978 2.748 1.00 0.06 C ATOM 3102 CD GLN A 236 2.911 -29.163 3.725 1.00 0.57 C ATOM 3103 OE1 GLN A 236 3.718 -30.081 3.652 1.00 -0.57 O ATOM 3104 NE2 GLN A 236 2.950 -28.341 4.801 1.00 -0.80 N ATOM 0 H GLN A 236 2.246 -31.546 -0.715 1.00 -0.73 H new ATOM 0 HA GLN A 236 2.627 -31.460 2.272 1.00 0.36 H new ATOM 0 HB2 GLN A 236 3.029 -29.305 1.052 1.00 0.00 H new ATOM 0 HB3 GLN A 236 1.314 -29.307 0.693 1.00 0.00 H new ATOM 0 HG2 GLN A 236 1.609 -27.913 2.588 1.00 0.06 H new ATOM 0 HG3 GLN A 236 0.863 -29.386 3.174 1.00 0.06 H new ATOM 0 HE21 GLN A 236 2.286 -27.571 4.879 1.00 -0.80 H new ATOM 0 HE22 GLN A 236 3.644 -28.492 5.533 1.00 -0.80 H new ATOM 3113 N GLN A 237 0.629 -33.193 1.145 1.00 -0.73 N ATOM 3114 CA GLN A 237 -0.630 -33.941 1.286 1.00 0.36 C ATOM 3115 C GLN A 237 -0.693 -35.131 2.213 1.00 0.57 C ATOM 3116 O GLN A 237 -1.757 -35.600 2.595 1.00 -0.57 O ATOM 3117 CB GLN A 237 -1.198 -34.373 -0.070 1.00 0.00 C ATOM 3118 CG GLN A 237 -2.323 -33.511 -0.626 1.00 0.06 C ATOM 3119 CD GLN A 237 -2.059 -32.029 -0.711 1.00 0.57 C ATOM 3120 OE1 GLN A 237 -0.760 -31.634 -0.901 1.00 -0.57 O flip ATOM 3121 NE2 GLN A 237 -2.980 -31.218 -0.600 1.00 -0.80 N flip ATOM 0 H GLN A 237 1.414 -33.736 0.785 1.00 -0.73 H new ATOM 0 HA GLN A 237 -1.231 -33.180 1.783 1.00 0.36 H new ATOM 0 HB2 GLN A 237 -0.384 -34.386 -0.795 1.00 0.00 H new ATOM 0 HB3 GLN A 237 -1.561 -35.397 0.020 1.00 0.00 H new ATOM 0 HG2 GLN A 237 -2.566 -33.872 -1.625 1.00 0.06 H new ATOM 0 HG3 GLN A 237 -3.207 -33.665 -0.008 1.00 0.06 H new ATOM 0 HE21 GLN A 237 -3.935 -31.547 -0.459 1.00 -0.80 H new ATOM 0 HE22 GLN A 237 -2.787 -30.218 -0.649 1.00 -0.80 H new ATOM 3130 N GLN A 238 0.534 -35.618 2.534 1.00 -0.73 N ATOM 3131 CA GLN A 238 0.583 -36.794 3.423 1.00 0.36 C ATOM 3132 C GLN A 238 1.947 -37.020 4.075 1.00 0.57 C ATOM 3133 O GLN A 238 2.197 -37.977 4.793 1.00 -0.57 O ATOM 3134 CB GLN A 238 -0.006 -38.064 2.799 1.00 0.00 C ATOM 3135 CG GLN A 238 0.923 -38.817 1.847 1.00 0.06 C ATOM 3136 CD GLN A 238 1.519 -37.852 0.858 1.00 0.57 C ATOM 3137 OE1 GLN A 238 0.855 -37.153 0.095 1.00 -0.57 O ATOM 3138 NE2 GLN A 238 2.850 -37.634 1.013 1.00 -0.80 N ATOM 0 H GLN A 238 1.431 -35.248 2.219 1.00 -0.73 H new ATOM 0 HA GLN A 238 -0.086 -36.541 4.245 1.00 0.36 H new ATOM 0 HB2 GLN A 238 -0.301 -38.740 3.602 1.00 0.00 H new ATOM 0 HB3 GLN A 238 -0.913 -37.796 2.258 1.00 0.00 H new ATOM 0 HG2 GLN A 238 1.714 -39.312 2.410 1.00 0.06 H new ATOM 0 HG3 GLN A 238 0.370 -39.596 1.323 1.00 0.06 H new ATOM 0 HE21 GLN A 238 3.392 -38.219 1.648 1.00 -0.80 H new ATOM 0 HE22 GLN A 238 3.308 -36.885 0.494 1.00 -0.80 H new ATOM 3147 N GLU A 239 2.756 -35.908 3.932 1.00 -0.73 N ATOM 3148 CA GLU A 239 3.242 -35.288 5.178 1.00 0.36 C ATOM 3149 C GLU A 239 3.129 -33.816 4.824 1.00 0.57 C ATOM 3150 O GLU A 239 3.949 -33.049 4.361 1.00 -0.57 O ATOM 3151 CB GLU A 239 4.548 -35.866 5.701 1.00 0.00 C ATOM 3152 CG GLU A 239 5.824 -35.443 4.979 1.00 -0.11 C ATOM 3153 CD GLU A 239 6.474 -34.166 5.491 1.00 0.91 C ATOM 3154 OE1 GLU A 239 5.869 -33.512 6.396 1.00 -0.90 O ATOM 3155 OE2 GLU A 239 7.531 -33.787 4.912 1.00 -0.90 O ATOM 0 H GLU A 239 3.049 -35.476 3.056 1.00 -0.73 H new ATOM 0 HA GLU A 239 2.679 -35.497 6.088 1.00 0.36 H new ATOM 0 HB2 GLU A 239 4.645 -35.591 6.751 1.00 0.00 H new ATOM 0 HB3 GLU A 239 4.479 -36.953 5.661 1.00 0.00 H new ATOM 0 HG2 GLU A 239 6.549 -36.254 5.053 1.00 -0.11 H new ATOM 0 HG3 GLU A 239 5.596 -35.315 3.921 1.00 -0.11 H new ATOM 3162 N SER A 240 1.773 -33.503 4.806 1.00 -0.73 N ATOM 3163 CA SER A 240 1.369 -32.140 4.671 1.00 0.36 C ATOM 3164 C SER A 240 -0.135 -31.995 4.553 1.00 0.57 C ATOM 3165 O SER A 240 -0.688 -30.896 4.467 1.00 -0.57 O ATOM 3166 CB SER A 240 1.931 -31.617 3.401 1.00 0.28 C ATOM 3167 OG SER A 240 1.597 -32.481 2.313 1.00 -0.68 O ATOM 0 H SER A 240 1.014 -34.180 4.883 1.00 -0.73 H new ATOM 0 HA SER A 240 1.718 -31.606 5.555 1.00 0.36 H new ATOM 0 HB2 SER A 240 1.544 -30.616 3.210 1.00 0.28 H new ATOM 0 HB3 SER A 240 3.014 -31.530 3.484 1.00 0.28 H new ATOM 3173 N ALA A 241 -0.761 -33.200 4.540 1.00 -0.73 N ATOM 3174 CA ALA A 241 -1.960 -33.558 5.277 1.00 0.36 C ATOM 3175 C ALA A 241 -1.407 -34.718 6.098 1.00 0.57 C ATOM 3176 O ALA A 241 -1.853 -35.851 6.139 1.00 -0.57 O ATOM 3177 CB ALA A 241 -3.171 -33.957 4.480 1.00 0.00 C ATOM 0 H ALA A 241 -0.409 -33.976 3.979 1.00 -0.73 H new ATOM 0 HA ALA A 241 -2.377 -32.710 5.820 1.00 0.36 H new ATOM 0 HB1 ALA A 241 -3.990 -34.197 5.158 1.00 0.00 H new ATOM 0 HB2 ALA A 241 -3.467 -33.133 3.831 1.00 0.00 H new ATOM 0 HB3 ALA A 241 -2.935 -34.831 3.872 1.00 0.00 H new ATOM 3183 N THR A 242 -0.292 -34.290 6.843 1.00 -0.73 N ATOM 3184 CA THR A 242 -0.270 -34.903 8.178 1.00 0.36 C ATOM 3185 C THR A 242 1.041 -34.801 8.942 1.00 0.57 C ATOM 3186 O THR A 242 1.580 -35.765 9.472 1.00 -0.57 O ATOM 3187 CB THR A 242 -1.431 -34.298 9.008 1.00 0.28 C ATOM 3188 OG1 THR A 242 -1.042 -34.114 10.371 1.00 -0.68 O ATOM 3189 CG2 THR A 242 -2.809 -34.977 8.893 1.00 0.00 C ATOM 0 H THR A 242 0.452 -33.645 6.578 1.00 -0.73 H new ATOM 0 HA THR A 242 -0.390 -35.975 8.020 1.00 0.36 H new ATOM 0 HB THR A 242 -1.605 -33.331 8.535 1.00 0.28 H new ATOM 0 HG1 THR A 242 -1.823 -34.228 10.952 1.00 -0.68 H new ATOM 0 HG21 THR A 242 -3.527 -34.453 9.524 1.00 0.00 H new ATOM 0 HG22 THR A 242 -3.145 -34.944 7.857 1.00 0.00 H new ATOM 0 HG23 THR A 242 -2.731 -36.015 9.217 1.00 0.00 H new ATOM 3197 N THR A 243 1.446 -33.499 9.135 1.00 -0.73 N ATOM 3198 CA THR A 243 2.766 -33.243 9.773 1.00 0.36 C ATOM 3199 C THR A 243 2.568 -32.310 11.002 1.00 0.57 C ATOM 3200 O THR A 243 3.260 -31.345 11.310 1.00 -0.57 O ATOM 3201 CB THR A 243 3.784 -32.921 8.677 1.00 0.28 C ATOM 3202 OG1 THR A 243 4.854 -33.870 8.722 1.00 -0.68 O ATOM 3203 CG2 THR A 243 4.407 -31.543 8.722 1.00 0.00 C ATOM 0 H THR A 243 0.912 -32.670 8.875 1.00 -0.73 H new ATOM 0 HA THR A 243 3.236 -34.103 10.251 1.00 0.36 H new ATOM 0 HB THR A 243 3.200 -32.965 7.758 1.00 0.28 H new ATOM 0 HG1 THR A 243 5.356 -33.837 7.881 1.00 -0.68 H new ATOM 0 HG21 THR A 243 5.110 -31.434 7.896 1.00 0.00 H new ATOM 0 HG22 THR A 243 3.626 -30.788 8.635 1.00 0.00 H new ATOM 0 HG23 THR A 243 4.934 -31.413 9.667 1.00 0.00 H new ATOM 3211 N GLN A 244 1.497 -32.752 11.770 1.00 -0.73 N ATOM 3212 CA GLN A 244 1.317 -32.533 13.226 1.00 0.36 C ATOM 3213 C GLN A 244 0.305 -31.389 13.561 1.00 0.57 C ATOM 3214 O GLN A 244 -0.341 -31.361 14.614 1.00 -0.57 O ATOM 3215 CB GLN A 244 2.631 -32.210 13.973 1.00 0.00 C ATOM 3216 CG GLN A 244 2.512 -32.013 15.493 1.00 0.06 C ATOM 3217 CD GLN A 244 1.903 -33.219 16.157 1.00 0.57 C ATOM 3218 OE1 GLN A 244 2.485 -34.292 16.250 1.00 -0.57 O ATOM 3219 NE2 GLN A 244 0.636 -33.062 16.625 1.00 -0.80 N ATOM 0 H GLN A 244 0.728 -33.282 11.361 1.00 -0.73 H new ATOM 0 HA GLN A 244 0.925 -33.491 13.569 1.00 0.36 H new ATOM 0 HB2 GLN A 244 3.340 -33.017 13.786 1.00 0.00 H new ATOM 0 HB3 GLN A 244 3.058 -31.304 13.542 1.00 0.00 H new ATOM 0 HG2 GLN A 244 3.499 -31.823 15.915 1.00 0.06 H new ATOM 0 HG3 GLN A 244 1.902 -31.134 15.701 1.00 0.06 H new ATOM 0 HE21 GLN A 244 0.168 -32.160 16.538 1.00 -0.80 H new ATOM 0 HE22 GLN A 244 0.153 -33.846 17.063 1.00 -0.80 H new ATOM 3228 N LYS A 245 0.413 -30.316 12.695 1.00 -0.73 N ATOM 3229 CA LYS A 245 -0.079 -28.966 13.120 1.00 0.36 C ATOM 3230 C LYS A 245 -1.442 -28.681 12.466 1.00 0.57 C ATOM 3231 O LYS A 245 -2.325 -29.542 12.467 1.00 -0.57 O ATOM 3232 CB LYS A 245 0.959 -27.817 13.077 1.00 0.00 C ATOM 3233 CG LYS A 245 2.341 -28.164 12.527 1.00 0.00 C ATOM 3234 CD LYS A 245 3.040 -26.902 11.981 1.00 0.00 C ATOM 3235 CE LYS A 245 4.352 -27.261 11.281 1.00 0.50 C ATOM 3236 NZ LYS A 245 4.371 -26.709 9.926 1.00 -0.85 N ATOM 0 H LYS A 245 0.812 -30.360 11.757 1.00 -0.73 H new ATOM 0 HA LYS A 245 -0.243 -29.004 14.197 1.00 0.36 H new ATOM 0 HB2 LYS A 245 0.546 -27.007 12.475 1.00 0.00 H new ATOM 0 HB3 LYS A 245 1.082 -27.431 14.089 1.00 0.00 H new ATOM 0 HG2 LYS A 245 2.949 -28.612 13.313 1.00 0.00 H new ATOM 0 HG3 LYS A 245 2.247 -28.906 11.734 1.00 0.00 H new ATOM 0 HD2 LYS A 245 2.379 -26.390 11.282 1.00 0.00 H new ATOM 0 HD3 LYS A 245 3.238 -26.209 12.799 1.00 0.00 H new ATOM 0 HE2 LYS A 245 5.195 -26.872 11.852 1.00 0.50 H new ATOM 0 HE3 LYS A 245 4.467 -28.344 11.242 1.00 0.50 H new ATOM 0 HZ1 LYS A 245 5.354 -26.639 9.593 1.00 -0.85 H new ATOM 0 HZ2 LYS A 245 3.834 -27.332 9.290 1.00 -0.85 H new ATOM 0 HZ3 LYS A 245 3.939 -25.763 9.930 1.00 -0.85 H new ATOM 3250 N ALA A 246 -1.530 -27.589 11.624 1.00 -0.73 N ATOM 3251 CA ALA A 246 -2.502 -27.207 10.515 1.00 0.36 C ATOM 3252 C ALA A 246 -2.411 -27.404 8.867 1.00 0.57 C ATOM 3253 O ALA A 246 -2.277 -26.415 8.135 1.00 -0.57 O ATOM 3254 CB ALA A 246 -1.938 -25.827 10.488 1.00 0.00 C ATOM 0 H ALA A 246 -0.828 -26.855 11.716 1.00 -0.73 H new ATOM 0 HA ALA A 246 -3.444 -27.696 10.763 1.00 0.36 H new ATOM 0 HB1 ALA A 246 -2.457 -25.236 9.733 1.00 0.00 H new ATOM 0 HB2 ALA A 246 -2.067 -25.362 11.465 1.00 0.00 H new ATOM 0 HB3 ALA A 246 -0.876 -25.873 10.245 1.00 0.00 H new ATOM 3260 N GLU A 247 -2.573 -28.614 8.232 1.00 -0.73 N ATOM 3261 CA GLU A 247 -1.962 -28.723 6.892 1.00 0.36 C ATOM 3262 C GLU A 247 -2.574 -29.955 6.158 1.00 0.57 C ATOM 3263 O GLU A 247 -2.795 -30.963 6.806 1.00 -0.57 O ATOM 3264 CB GLU A 247 -0.448 -29.042 6.904 1.00 0.00 C ATOM 3265 CG GLU A 247 0.545 -27.895 7.131 1.00 -0.11 C ATOM 3266 CD GLU A 247 1.762 -28.356 7.915 1.00 0.91 C ATOM 3267 OE1 GLU A 247 2.014 -29.594 7.934 1.00 -0.90 O ATOM 3268 OE2 GLU A 247 2.229 -27.553 8.767 1.00 -0.90 O ATOM 0 H GLU A 247 -3.066 -29.433 8.588 1.00 -0.73 H new ATOM 0 HA GLU A 247 -2.143 -27.755 6.425 1.00 0.36 H new ATOM 0 HB2 GLU A 247 -0.274 -29.788 7.679 1.00 0.00 H new ATOM 0 HB3 GLU A 247 -0.201 -29.509 5.951 1.00 0.00 H new ATOM 0 HG2 GLU A 247 0.862 -27.492 6.169 1.00 -0.11 H new ATOM 0 HG3 GLU A 247 0.050 -27.086 7.668 1.00 -0.11 H new ATOM 3275 N LYS A 248 -2.779 -29.707 4.795 1.00 -0.73 N ATOM 3276 CA LYS A 248 -3.288 -30.455 3.535 1.00 0.36 C ATOM 3277 C LYS A 248 -3.507 -29.269 2.624 1.00 0.57 C ATOM 3278 O LYS A 248 -3.197 -29.053 1.504 1.00 -0.57 O ATOM 3279 CB LYS A 248 -4.723 -31.076 3.452 1.00 0.00 C ATOM 3280 CG LYS A 248 -5.115 -31.648 2.048 1.00 0.00 C ATOM 3281 CD LYS A 248 -6.044 -30.778 1.161 1.00 0.00 C ATOM 3282 CE LYS A 248 -7.497 -30.791 1.631 1.00 0.50 C ATOM 3283 NZ LYS A 248 -8.361 -30.031 0.706 1.00 -0.85 N ATOM 0 H LYS A 248 -2.536 -28.766 4.487 1.00 -0.73 H new ATOM 0 HA LYS A 248 -2.592 -31.281 3.386 1.00 0.36 H new ATOM 0 HB2 LYS A 248 -4.800 -31.876 4.188 1.00 0.00 H new ATOM 0 HB3 LYS A 248 -5.450 -30.314 3.733 1.00 0.00 H new ATOM 0 HG2 LYS A 248 -4.197 -31.836 1.492 1.00 0.00 H new ATOM 0 HG3 LYS A 248 -5.599 -32.613 2.200 1.00 0.00 H new ATOM 0 HD2 LYS A 248 -5.678 -29.751 1.158 1.00 0.00 H new ATOM 0 HD3 LYS A 248 -5.997 -31.137 0.133 1.00 0.00 H new ATOM 0 HE2 LYS A 248 -7.851 -31.820 1.702 1.00 0.50 H new ATOM 0 HE3 LYS A 248 -7.563 -30.362 2.631 1.00 0.50 H new ATOM 0 HZ1 LYS A 248 -9.331 -30.404 0.752 1.00 -0.85 H new ATOM 0 HZ2 LYS A 248 -8.363 -29.027 0.978 1.00 -0.85 H new ATOM 0 HZ3 LYS A 248 -7.999 -30.126 -0.264 1.00 -0.85 H new ATOM 3297 N GLU A 249 -4.257 -28.391 3.349 1.00 -0.73 N ATOM 3298 CA GLU A 249 -4.786 -27.183 2.805 1.00 0.36 C ATOM 3299 C GLU A 249 -3.670 -26.139 3.057 1.00 0.57 C ATOM 3300 O GLU A 249 -3.488 -25.244 2.276 1.00 -0.57 O ATOM 3301 CB GLU A 249 -6.199 -27.181 3.336 1.00 0.00 C ATOM 3302 CG GLU A 249 -7.075 -26.076 2.800 1.00 -0.11 C ATOM 3303 CD GLU A 249 -7.842 -26.516 1.561 1.00 0.91 C ATOM 3304 OE1 GLU A 249 -8.212 -27.722 1.480 1.00 -0.90 O ATOM 3305 OE2 GLU A 249 -8.028 -25.601 0.714 1.00 -0.90 O ATOM 0 H GLU A 249 -4.492 -28.536 4.331 1.00 -0.73 H new ATOM 0 HA GLU A 249 -4.969 -26.981 1.750 1.00 0.36 H new ATOM 0 HB2 GLU A 249 -6.662 -28.139 3.100 1.00 0.00 H new ATOM 0 HB3 GLU A 249 -6.164 -27.103 4.423 1.00 0.00 H new ATOM 0 HG2 GLU A 249 -7.779 -25.763 3.571 1.00 -0.11 H new ATOM 0 HG3 GLU A 249 -6.460 -25.209 2.558 1.00 -0.11 H new ATOM 3312 N VAL A 250 -2.800 -26.483 4.096 1.00 -0.73 N ATOM 3313 CA VAL A 250 -1.306 -26.421 3.963 1.00 0.36 C ATOM 3314 C VAL A 250 -0.875 -26.388 2.484 1.00 0.57 C ATOM 3315 O VAL A 250 0.012 -25.644 2.130 1.00 -0.57 O ATOM 3316 CB VAL A 250 -0.909 -27.887 4.458 1.00 0.00 C ATOM 3317 CG1 VAL A 250 -1.332 -28.111 5.940 1.00 0.00 C ATOM 3318 CG2 VAL A 250 -1.449 -29.123 3.726 1.00 0.00 C ATOM 0 H VAL A 250 -3.119 -26.798 5.012 1.00 -0.73 H new ATOM 0 HA VAL A 250 -0.878 -25.561 4.478 1.00 0.36 H new ATOM 0 HB VAL A 250 0.161 -27.848 4.256 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.050 -29.117 6.251 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -0.831 -27.381 6.576 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -2.412 -27.992 6.032 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -1.070 -30.025 4.207 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.538 -29.121 3.764 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -1.122 -29.102 2.686 1.00 0.00 H new ATOM 3328 N THR A 251 -1.481 -27.151 1.527 1.00 -0.73 N ATOM 3329 CA THR A 251 -1.000 -27.205 0.100 1.00 0.36 C ATOM 3330 C THR A 251 -1.445 -26.012 -0.711 1.00 0.57 C ATOM 3331 O THR A 251 -0.806 -25.468 -1.614 1.00 -0.57 O ATOM 3332 CB THR A 251 -1.650 -28.337 -0.660 1.00 0.28 C ATOM 3333 OG1 THR A 251 -1.239 -29.464 0.092 1.00 -0.68 O ATOM 3334 CG2 THR A 251 -1.203 -28.504 -2.101 1.00 0.00 C ATOM 0 H THR A 251 -2.297 -27.735 1.709 1.00 -0.73 H new ATOM 0 HA THR A 251 0.083 -27.284 0.197 1.00 0.36 H new ATOM 0 HB THR A 251 -2.724 -28.171 -0.750 1.00 0.28 H new ATOM 0 HG1 THR A 251 -0.748 -30.083 -0.488 1.00 -0.68 H new ATOM 0 HG21 THR A 251 -1.732 -29.344 -2.551 1.00 0.00 H new ATOM 0 HG22 THR A 251 -1.426 -27.594 -2.659 1.00 0.00 H new ATOM 0 HG23 THR A 251 -0.130 -28.694 -2.129 1.00 0.00 H new ATOM 3342 N ARG A 252 -2.703 -25.610 -0.294 1.00 -0.73 N ATOM 3343 CA ARG A 252 -3.049 -24.224 -0.606 1.00 0.36 C ATOM 3344 C ARG A 252 -2.028 -23.189 -0.035 1.00 0.57 C ATOM 3345 O ARG A 252 -2.003 -22.013 -0.367 1.00 -0.57 O ATOM 3346 CB ARG A 252 -4.524 -23.884 -0.501 1.00 0.00 C ATOM 3347 CG ARG A 252 -5.046 -22.978 0.612 1.00 0.00 C ATOM 3348 CD ARG A 252 -6.372 -22.277 0.228 1.00 0.33 C ATOM 3349 NE ARG A 252 -7.485 -23.218 0.105 1.00 -0.84 N ATOM 3350 CZ ARG A 252 -8.717 -22.979 -0.361 1.00 1.20 C ATOM 3351 NH1 ARG A 252 -9.087 -21.812 -0.877 1.00 -0.97 N ATOM 3352 NH2 ARG A 252 -9.619 -23.953 -0.302 1.00 -0.97 N ATOM 0 H ARG A 252 -3.399 -26.170 0.198 1.00 -0.73 H new ATOM 0 HA ARG A 252 -2.913 -24.122 -1.683 1.00 0.36 H new ATOM 0 HB2 ARG A 252 -4.814 -23.427 -1.447 1.00 0.00 H new ATOM 0 HB3 ARG A 252 -5.064 -24.828 -0.424 1.00 0.00 H new ATOM 0 HG2 ARG A 252 -5.198 -23.568 1.516 1.00 0.00 H new ATOM 0 HG3 ARG A 252 -4.294 -22.224 0.846 1.00 0.00 H new ATOM 0 HD2 ARG A 252 -6.615 -21.528 0.981 1.00 0.33 H new ATOM 0 HD3 ARG A 252 -6.240 -21.749 -0.716 1.00 0.33 H new ATOM 0 HE ARG A 252 -7.300 -24.173 0.412 1.00 -0.84 H new ATOM 0 HH11 ARG A 252 -8.418 -21.044 -0.932 1.00 -0.97 H new ATOM 0 HH12 ARG A 252 -10.040 -21.684 -1.218 1.00 -0.97 H new ATOM 0 HH21 ARG A 252 -9.366 -24.859 0.092 1.00 -0.97 H new ATOM 0 HH22 ARG A 252 -10.564 -23.794 -0.651 1.00 -0.97 H new ATOM 3366 N MET A 253 -1.107 -23.868 0.729 1.00 -0.73 N ATOM 3367 CA MET A 253 0.383 -23.720 0.845 1.00 0.36 C ATOM 3368 C MET A 253 0.741 -22.628 -0.116 1.00 0.57 C ATOM 3369 O MET A 253 0.897 -21.456 0.135 1.00 -0.57 O ATOM 3370 CB MET A 253 1.466 -25.027 0.499 1.00 0.00 C ATOM 3371 CG MET A 253 2.592 -24.827 1.505 1.00 0.23 C ATOM 3372 SD MET A 253 3.650 -26.251 1.403 1.00 -0.46 S ATOM 3373 CE MET A 253 4.412 -25.924 -0.196 1.00 0.23 C ATOM 0 H MET A 253 -1.430 -24.614 1.345 1.00 -0.73 H new ATOM 0 HA MET A 253 0.532 -23.575 1.915 1.00 0.36 H new ATOM 0 HB2 MET A 253 0.981 -25.995 0.626 1.00 0.00 H new ATOM 0 HB3 MET A 253 1.832 -24.985 -0.527 1.00 0.00 H new ATOM 0 HG2 MET A 253 3.149 -23.917 1.282 1.00 0.23 H new ATOM 0 HG3 MET A 253 2.192 -24.717 2.513 1.00 0.23 H new ATOM 0 HE1 MET A 253 5.431 -26.312 -0.200 1.00 0.23 H new ATOM 0 HE2 MET A 253 3.835 -26.412 -0.981 1.00 0.23 H new ATOM 0 HE3 MET A 253 4.433 -24.849 -0.376 1.00 0.23 H new ATOM 3383 N VAL A 254 0.708 -23.207 -1.359 1.00 -0.73 N ATOM 3384 CA VAL A 254 1.598 -22.696 -2.391 1.00 0.36 C ATOM 3385 C VAL A 254 0.857 -22.339 -3.665 1.00 0.57 C ATOM 3386 O VAL A 254 1.381 -21.745 -4.600 1.00 -0.57 O ATOM 3387 CB VAL A 254 2.876 -23.523 -2.555 1.00 0.00 C ATOM 3388 CG1 VAL A 254 2.642 -24.822 -3.320 1.00 0.00 C ATOM 3389 CG2 VAL A 254 4.000 -22.699 -3.164 1.00 0.00 C ATOM 0 H VAL A 254 0.104 -23.981 -1.636 1.00 -0.73 H new ATOM 0 HA VAL A 254 1.986 -21.738 -2.043 1.00 0.36 H new ATOM 0 HB VAL A 254 3.190 -23.814 -1.553 1.00 0.00 H new ATOM 0 HG11 VAL A 254 3.582 -25.368 -3.406 1.00 0.00 H new ATOM 0 HG12 VAL A 254 1.915 -25.433 -2.785 1.00 0.00 H new ATOM 0 HG13 VAL A 254 2.262 -24.594 -4.316 1.00 0.00 H new ATOM 0 HG21 VAL A 254 4.891 -23.318 -3.266 1.00 0.00 H new ATOM 0 HG22 VAL A 254 3.695 -22.338 -4.146 1.00 0.00 H new ATOM 0 HG23 VAL A 254 4.220 -21.850 -2.517 1.00 0.00 H new ATOM 3399 N ILE A 255 -0.494 -22.586 -3.547 1.00 -0.73 N ATOM 3400 CA ILE A 255 -1.424 -21.837 -4.380 1.00 0.36 C ATOM 3401 C ILE A 255 -1.212 -20.343 -4.022 1.00 0.57 C ATOM 3402 O ILE A 255 -0.943 -19.483 -4.857 1.00 -0.57 O ATOM 3403 CB ILE A 255 -2.889 -22.298 -4.159 1.00 0.00 C ATOM 3404 CG1 ILE A 255 -3.045 -23.785 -4.562 1.00 0.00 C ATOM 3405 CG2 ILE A 255 -3.871 -21.406 -4.932 1.00 0.00 C ATOM 3406 CD1 ILE A 255 -4.460 -24.335 -4.442 1.00 0.00 C ATOM 0 H ILE A 255 -0.916 -23.264 -2.913 1.00 -0.73 H new ATOM 0 HA ILE A 255 -1.235 -22.007 -5.440 1.00 0.36 H new ATOM 0 HB ILE A 255 -3.127 -22.202 -3.100 1.00 0.00 H new ATOM 0 HG12 ILE A 255 -2.710 -23.904 -5.592 1.00 0.00 H new ATOM 0 HG13 ILE A 255 -2.383 -24.387 -3.940 1.00 0.00 H new ATOM 0 HG21 ILE A 255 -4.890 -21.752 -4.759 1.00 0.00 H new ATOM 0 HG22 ILE A 255 -3.774 -20.376 -4.589 1.00 0.00 H new ATOM 0 HG23 ILE A 255 -3.647 -21.456 -5.998 1.00 0.00 H new ATOM 0 HD11 ILE A 255 -4.470 -25.382 -4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 255 -4.796 -24.254 -3.408 1.00 0.00 H new ATOM 0 HD13 ILE A 255 -5.128 -23.764 -5.086 1.00 0.00 H new ATOM 3418 N ILE A 256 -1.350 -20.018 -2.691 1.00 -0.73 N ATOM 3419 CA ILE A 256 -1.139 -18.633 -2.282 1.00 0.36 C ATOM 3420 C ILE A 256 0.354 -18.325 -2.293 1.00 0.57 C ATOM 3421 O ILE A 256 0.822 -17.299 -2.795 1.00 -0.57 O ATOM 3422 CB ILE A 256 -1.749 -18.397 -0.892 1.00 0.00 C ATOM 3423 CG1 ILE A 256 -3.277 -18.458 -1.063 1.00 0.00 C ATOM 3424 CG2 ILE A 256 -1.325 -17.042 -0.305 1.00 0.00 C ATOM 3425 CD1 ILE A 256 -4.050 -18.446 0.236 1.00 0.00 C ATOM 0 H ILE A 256 -1.592 -20.670 -1.945 1.00 -0.73 H new ATOM 0 HA ILE A 256 -1.635 -17.960 -2.982 1.00 0.36 H new ATOM 0 HB ILE A 256 -1.396 -19.156 -0.194 1.00 0.00 H new ATOM 0 HG12 ILE A 256 -3.597 -17.611 -1.670 1.00 0.00 H new ATOM 0 HG13 ILE A 256 -3.533 -19.362 -1.616 1.00 0.00 H new ATOM 0 HG21 ILE A 256 -1.778 -16.914 0.678 1.00 0.00 H new ATOM 0 HG22 ILE A 256 -0.239 -17.009 -0.212 1.00 0.00 H new ATOM 0 HG23 ILE A 256 -1.657 -16.240 -0.964 1.00 0.00 H new ATOM 0 HD11 ILE A 256 -5.118 -18.491 0.024 1.00 0.00 H new ATOM 0 HD12 ILE A 256 -3.763 -19.308 0.838 1.00 0.00 H new ATOM 0 HD13 ILE A 256 -3.827 -17.530 0.783 1.00 0.00 H new ATOM 3437 N MET A 257 1.158 -19.228 -1.623 1.00 -0.73 N ATOM 3438 CA MET A 257 2.433 -18.693 -1.199 1.00 0.36 C ATOM 3439 C MET A 257 3.401 -18.492 -2.377 1.00 0.57 C ATOM 3440 O MET A 257 4.403 -17.783 -2.252 1.00 -0.57 O ATOM 3441 CB MET A 257 3.036 -19.395 0.007 1.00 0.00 C ATOM 3442 CG MET A 257 2.226 -19.122 1.291 1.00 0.23 C ATOM 3443 SD MET A 257 2.536 -17.438 1.907 1.00 -0.46 S ATOM 3444 CE MET A 257 1.308 -17.360 3.221 1.00 0.23 C ATOM 0 H MET A 257 0.953 -20.203 -1.403 1.00 -0.73 H new ATOM 0 HA MET A 257 2.227 -17.692 -0.820 1.00 0.36 H new ATOM 0 HB2 MET A 257 3.073 -20.469 -0.178 1.00 0.00 H new ATOM 0 HB3 MET A 257 4.064 -19.060 0.147 1.00 0.00 H new ATOM 0 HG2 MET A 257 1.163 -19.250 1.089 1.00 0.23 H new ATOM 0 HG3 MET A 257 2.495 -19.849 2.057 1.00 0.23 H new ATOM 0 HE1 MET A 257 1.622 -16.633 3.970 1.00 0.23 H new ATOM 0 HE2 MET A 257 0.347 -17.059 2.804 1.00 0.23 H new ATOM 0 HE3 MET A 257 1.210 -18.341 3.686 1.00 0.23 H new ATOM 3454 N VAL A 258 3.059 -19.061 -3.603 1.00 -0.73 N ATOM 3455 CA VAL A 258 3.586 -18.400 -4.788 1.00 0.36 C ATOM 3456 C VAL A 258 2.672 -17.852 -5.863 1.00 0.57 C ATOM 3457 O VAL A 258 3.124 -17.341 -6.892 1.00 -0.57 O ATOM 3458 CB VAL A 258 4.815 -19.094 -5.409 1.00 0.00 C ATOM 3459 CG1 VAL A 258 5.905 -19.457 -4.400 1.00 0.00 C ATOM 3460 CG2 VAL A 258 4.392 -20.340 -6.196 1.00 0.00 C ATOM 0 H VAL A 258 2.481 -19.888 -3.752 1.00 -0.73 H new ATOM 0 HA VAL A 258 3.873 -17.479 -4.280 1.00 0.36 H new ATOM 0 HB VAL A 258 5.256 -18.359 -6.082 1.00 0.00 H new ATOM 0 HG11 VAL A 258 6.733 -19.941 -4.918 1.00 0.00 H new ATOM 0 HG12 VAL A 258 6.263 -18.552 -3.909 1.00 0.00 H new ATOM 0 HG13 VAL A 258 5.497 -20.138 -3.653 1.00 0.00 H new ATOM 0 HG21 VAL A 258 5.274 -20.815 -6.626 1.00 0.00 H new ATOM 0 HG22 VAL A 258 3.892 -21.041 -5.527 1.00 0.00 H new ATOM 0 HG23 VAL A 258 3.709 -20.051 -6.995 1.00 0.00 H new ATOM 3470 N ILE A 259 1.438 -17.540 -5.369 1.00 -0.73 N ATOM 3471 CA ILE A 259 1.006 -16.183 -5.515 1.00 0.36 C ATOM 3472 C ILE A 259 0.944 -15.296 -4.183 1.00 0.57 C ATOM 3473 O ILE A 259 0.025 -14.544 -3.892 1.00 -0.57 O ATOM 3474 CB ILE A 259 -0.335 -16.132 -6.197 1.00 0.00 C ATOM 3475 CG1 ILE A 259 -0.653 -17.213 -7.241 1.00 0.00 C ATOM 3476 CG2 ILE A 259 -0.398 -14.743 -6.825 1.00 0.00 C ATOM 3477 CD1 ILE A 259 -2.116 -17.176 -7.671 1.00 0.00 C ATOM 0 H ILE A 259 0.792 -18.179 -4.905 1.00 -0.73 H new ATOM 0 HA ILE A 259 1.794 -15.731 -6.118 1.00 0.36 H new ATOM 0 HB ILE A 259 -1.095 -16.336 -5.442 1.00 0.00 H new ATOM 0 HG12 ILE A 259 -0.015 -17.074 -8.113 1.00 0.00 H new ATOM 0 HG13 ILE A 259 -0.420 -18.195 -6.829 1.00 0.00 H new ATOM 0 HG21 ILE A 259 -1.348 -14.622 -7.345 1.00 0.00 H new ATOM 0 HG22 ILE A 259 -0.312 -13.987 -6.045 1.00 0.00 H new ATOM 0 HG23 ILE A 259 0.421 -14.627 -7.535 1.00 0.00 H new ATOM 0 HD11 ILE A 259 -2.298 -17.957 -8.410 1.00 0.00 H new ATOM 0 HD12 ILE A 259 -2.755 -17.342 -6.803 1.00 0.00 H new ATOM 0 HD13 ILE A 259 -2.342 -16.203 -8.108 1.00 0.00 H new ATOM 3489 N ALA A 260 2.143 -15.160 -3.553 1.00 -0.73 N ATOM 3490 CA ALA A 260 2.410 -14.364 -2.317 1.00 0.36 C ATOM 3491 C ALA A 260 3.902 -13.985 -2.334 1.00 0.57 C ATOM 3492 O ALA A 260 4.392 -13.012 -1.783 1.00 -0.57 O ATOM 3493 CB ALA A 260 2.041 -15.000 -1.004 1.00 0.00 C ATOM 0 H ALA A 260 2.984 -15.619 -3.904 1.00 -0.73 H new ATOM 0 HA ALA A 260 1.746 -13.501 -2.359 1.00 0.36 H new ATOM 0 HB1 ALA A 260 2.286 -14.319 -0.189 1.00 0.00 H new ATOM 0 HB2 ALA A 260 0.972 -15.213 -0.991 1.00 0.00 H new ATOM 0 HB3 ALA A 260 2.598 -15.929 -0.881 1.00 0.00 H new ATOM 3499 N PHE A 261 4.582 -14.905 -3.107 1.00 -0.73 N ATOM 3500 CA PHE A 261 5.407 -14.452 -4.208 1.00 0.36 C ATOM 3501 C PHE A 261 4.565 -13.541 -5.093 1.00 0.57 C ATOM 3502 O PHE A 261 4.545 -12.320 -4.920 1.00 -0.57 O ATOM 3503 CB PHE A 261 6.122 -15.615 -4.888 1.00 0.14 C ATOM 3504 CG PHE A 261 7.123 -15.232 -5.946 1.00 -0.14 C ATOM 3505 CD1 PHE A 261 8.213 -14.408 -5.639 1.00 -0.15 C ATOM 3506 CD2 PHE A 261 7.004 -15.749 -7.244 1.00 -0.15 C ATOM 3507 CE1 PHE A 261 9.153 -14.088 -6.618 1.00 -0.15 C ATOM 3508 CE2 PHE A 261 7.954 -15.438 -8.216 1.00 -0.15 C ATOM 3509 CZ PHE A 261 9.024 -14.602 -7.906 1.00 -0.15 C ATOM 0 H PHE A 261 4.556 -15.915 -2.969 1.00 -0.73 H new ATOM 0 HA PHE A 261 6.243 -13.841 -3.867 1.00 0.36 H new ATOM 0 HB2 PHE A 261 6.633 -16.201 -4.124 1.00 0.14 H new ATOM 0 HB3 PHE A 261 5.373 -16.265 -5.340 1.00 0.14 H new ATOM 0 HD1 PHE A 261 8.326 -14.018 -4.638 1.00 -0.15 H new ATOM 0 HD2 PHE A 261 6.172 -16.391 -7.492 1.00 -0.15 H new ATOM 0 HE1 PHE A 261 9.983 -13.440 -6.377 1.00 -0.15 H new ATOM 0 HE2 PHE A 261 7.860 -15.846 -9.211 1.00 -0.15 H new ATOM 0 HZ PHE A 261 9.753 -14.353 -8.663 1.00 -0.15 H new ATOM 3519 N LEU A 262 3.668 -14.111 -5.974 1.00 -0.73 N ATOM 3520 CA LEU A 262 3.459 -13.298 -7.166 1.00 0.36 C ATOM 3521 C LEU A 262 2.661 -12.040 -6.911 1.00 0.57 C ATOM 3522 O LEU A 262 2.700 -11.077 -7.667 1.00 -0.57 O ATOM 3523 CB LEU A 262 3.057 -14.098 -8.420 1.00 0.00 C ATOM 3524 CG LEU A 262 1.760 -13.754 -9.203 1.00 0.00 C ATOM 3525 CD1 LEU A 262 1.870 -12.586 -10.180 1.00 0.00 C ATOM 3526 CD2 LEU A 262 1.345 -14.982 -10.023 1.00 0.00 C ATOM 0 H LEU A 262 3.162 -14.992 -5.887 1.00 -0.73 H new ATOM 0 HA LEU A 262 4.448 -12.923 -7.430 1.00 0.36 H new ATOM 0 HB2 LEU A 262 3.885 -14.025 -9.125 1.00 0.00 H new ATOM 0 HB3 LEU A 262 2.983 -15.144 -8.122 1.00 0.00 H new ATOM 0 HG LEU A 262 1.037 -13.462 -8.441 1.00 0.00 H new ATOM 0 HD11 LEU A 262 0.910 -12.432 -10.672 1.00 0.00 H new ATOM 0 HD12 LEU A 262 2.149 -11.683 -9.637 1.00 0.00 H new ATOM 0 HD13 LEU A 262 2.630 -12.808 -10.929 1.00 0.00 H new ATOM 0 HD21 LEU A 262 0.435 -14.757 -10.579 1.00 0.00 H new ATOM 0 HD22 LEU A 262 2.142 -15.240 -10.720 1.00 0.00 H new ATOM 0 HD23 LEU A 262 1.162 -15.822 -9.353 1.00 0.00 H new ATOM 3538 N ILE A 263 1.881 -12.101 -5.774 1.00 -0.73 N ATOM 3539 CA ILE A 263 0.601 -11.421 -5.875 1.00 0.36 C ATOM 3540 C ILE A 263 0.813 -9.922 -6.150 1.00 0.57 C ATOM 3541 O ILE A 263 0.169 -9.270 -6.962 1.00 -0.57 O ATOM 3542 CB ILE A 263 -0.291 -11.626 -4.638 1.00 0.00 C ATOM 3543 CG1 ILE A 263 -1.567 -10.760 -4.665 1.00 0.00 C ATOM 3544 CG2 ILE A 263 0.479 -11.453 -3.325 1.00 0.00 C ATOM 3545 CD1 ILE A 263 -2.589 -11.146 -3.602 1.00 0.00 C ATOM 0 H ILE A 263 2.104 -12.562 -4.892 1.00 -0.73 H new ATOM 0 HA ILE A 263 0.071 -11.871 -6.714 1.00 0.36 H new ATOM 0 HB ILE A 263 -0.619 -12.664 -4.684 1.00 0.00 H new ATOM 0 HG12 ILE A 263 -1.290 -9.715 -4.528 1.00 0.00 H new ATOM 0 HG13 ILE A 263 -2.030 -10.841 -5.648 1.00 0.00 H new ATOM 0 HG21 ILE A 263 -0.197 -11.608 -2.484 1.00 0.00 H new ATOM 0 HG22 ILE A 263 1.289 -12.181 -3.279 1.00 0.00 H new ATOM 0 HG23 ILE A 263 0.894 -10.446 -3.276 1.00 0.00 H new ATOM 0 HD11 ILE A 263 -3.460 -10.495 -3.681 1.00 0.00 H new ATOM 0 HD12 ILE A 263 -2.895 -12.181 -3.751 1.00 0.00 H new ATOM 0 HD13 ILE A 263 -2.144 -11.038 -2.613 1.00 0.00 H new ATOM 3557 N CYS A 264 1.750 -9.387 -5.293 1.00 -0.73 N ATOM 3558 CA CYS A 264 2.465 -8.183 -5.653 1.00 0.36 C ATOM 3559 C CYS A 264 3.745 -8.583 -6.384 1.00 0.57 C ATOM 3560 O CYS A 264 4.139 -8.042 -7.412 1.00 -0.57 O ATOM 3561 CB CYS A 264 3.024 -7.503 -4.432 1.00 0.23 C ATOM 3562 SG CYS A 264 1.724 -6.821 -3.389 1.00 -0.41 S ATOM 0 H CYS A 264 1.997 -9.781 -4.385 1.00 -0.73 H new ATOM 0 HA CYS A 264 1.771 -7.559 -6.217 1.00 0.36 H new ATOM 0 HB2 CYS A 264 3.614 -8.217 -3.857 1.00 0.23 H new ATOM 0 HB3 CYS A 264 3.700 -6.705 -4.738 1.00 0.23 H new ATOM 0 HG CYS A 264 2.226 -5.909 -2.611 1.00 -0.41 H new ATOM 3568 N TRP A 265 4.534 -9.473 -5.697 1.00 -0.73 N ATOM 3569 CA TRP A 265 6.004 -9.521 -5.710 1.00 0.36 C ATOM 3570 C TRP A 265 6.413 -10.508 -6.771 1.00 0.57 C ATOM 3571 O TRP A 265 7.468 -11.131 -6.766 1.00 -0.57 O ATOM 3572 CB TRP A 265 6.501 -9.962 -4.321 1.00 0.18 C ATOM 3573 CG TRP A 265 6.060 -9.062 -3.227 1.00 -0.18 C ATOM 3574 CD1 TRP A 265 5.475 -9.445 -2.033 1.00 -0.30 C ATOM 3575 CD2 TRP A 265 5.988 -7.663 -3.306 1.00 0.00 C ATOM 3576 NE1 TRP A 265 4.883 -8.334 -1.498 1.00 0.03 N ATOM 3577 CE2 TRP A 265 5.028 -7.280 -2.366 1.00 -0.15 C ATOM 3578 CE3 TRP A 265 6.564 -6.709 -4.143 1.00 -0.15 C ATOM 3579 CZ2 TRP A 265 4.474 -5.994 -2.340 1.00 -0.15 C ATOM 3580 CZ3 TRP A 265 6.158 -5.388 -3.972 1.00 -0.15 C ATOM 3581 CH2 TRP A 265 5.091 -5.039 -3.142 1.00 -0.15 C ATOM 0 H TRP A 265 4.130 -10.196 -5.102 1.00 -0.73 H new ATOM 0 HA TRP A 265 6.438 -8.546 -5.931 1.00 0.36 H new ATOM 0 HB2 TRP A 265 6.143 -10.971 -4.118 1.00 0.18 H new ATOM 0 HB3 TRP A 265 7.590 -10.006 -4.329 1.00 0.18 H new ATOM 0 HD1 TRP A 265 5.484 -10.436 -1.604 1.00 -0.30 H new ATOM 0 HE1 TRP A 265 4.408 -8.295 -0.596 1.00 0.03 H new ATOM 0 HE3 TRP A 265 7.293 -6.982 -4.891 1.00 -0.15 H new ATOM 0 HZ2 TRP A 265 3.615 -5.756 -1.731 1.00 -0.15 H new ATOM 0 HZ3 TRP A 265 6.686 -4.607 -4.499 1.00 -0.15 H new ATOM 0 HH2 TRP A 265 4.741 -4.017 -3.122 1.00 -0.15 H new ATOM 3592 N LEU A 266 5.602 -10.379 -7.882 1.00 -0.73 N ATOM 3593 CA LEU A 266 6.177 -10.468 -9.184 1.00 0.36 C ATOM 3594 C LEU A 266 5.964 -9.166 -10.004 1.00 0.57 C ATOM 3595 O LEU A 266 6.976 -8.543 -10.370 1.00 -0.57 O ATOM 3596 CB LEU A 266 5.793 -11.855 -9.699 1.00 0.00 C ATOM 3597 CG LEU A 266 6.486 -12.309 -10.991 1.00 0.00 C ATOM 3598 CD1 LEU A 266 6.045 -13.737 -11.329 1.00 0.00 C ATOM 3599 CD2 LEU A 266 6.199 -11.408 -12.191 1.00 0.00 C ATOM 0 H LEU A 266 4.595 -10.220 -7.857 1.00 -0.73 H new ATOM 0 HA LEU A 266 7.265 -10.459 -9.250 1.00 0.36 H new ATOM 0 HB2 LEU A 266 6.011 -12.584 -8.918 1.00 0.00 H new ATOM 0 HB3 LEU A 266 4.715 -11.875 -9.862 1.00 0.00 H new ATOM 0 HG LEU A 266 7.558 -12.255 -10.801 1.00 0.00 H new ATOM 0 HD11 LEU A 266 6.536 -14.062 -12.246 1.00 0.00 H new ATOM 0 HD12 LEU A 266 6.321 -14.406 -10.514 1.00 0.00 H new ATOM 0 HD13 LEU A 266 4.964 -13.761 -11.468 1.00 0.00 H new ATOM 0 HD21 LEU A 266 6.722 -11.791 -13.067 1.00 0.00 H new ATOM 0 HD22 LEU A 266 5.127 -11.393 -12.386 1.00 0.00 H new ATOM 0 HD23 LEU A 266 6.543 -10.396 -11.977 1.00 0.00 H new ATOM 3611 N PRO A 267 4.730 -8.621 -10.237 1.00 -0.66 N ATOM 3612 CA PRO A 267 4.609 -7.346 -10.970 1.00 0.36 C ATOM 3613 C PRO A 267 5.324 -6.137 -10.316 1.00 0.57 C ATOM 3614 O PRO A 267 5.518 -5.082 -10.909 1.00 -0.57 O ATOM 3615 CB PRO A 267 3.102 -7.096 -11.013 1.00 0.00 C ATOM 3616 CG PRO A 267 2.520 -8.500 -11.038 1.00 0.00 C ATOM 3617 CD PRO A 267 3.430 -9.251 -10.086 1.00 0.30 C ATOM 0 HA PRO A 267 5.093 -7.433 -11.943 1.00 0.36 H new ATOM 0 HB2 PRO A 267 2.762 -6.534 -10.143 1.00 0.00 H new ATOM 0 HB3 PRO A 267 2.813 -6.524 -11.895 1.00 0.00 H new ATOM 0 HG2 PRO A 267 1.483 -8.515 -10.704 1.00 0.00 H new ATOM 0 HG3 PRO A 267 2.538 -8.929 -12.040 1.00 0.00 H new ATOM 0 HD2 PRO A 267 3.073 -9.179 -9.059 1.00 0.30 H new ATOM 0 HD3 PRO A 267 3.473 -10.311 -10.335 1.00 0.30 H new ATOM 3625 N TYR A 268 5.671 -6.304 -9.008 1.00 -0.73 N ATOM 3626 CA TYR A 268 6.251 -5.291 -8.109 1.00 0.36 C ATOM 3627 C TYR A 268 7.722 -5.595 -7.792 1.00 0.57 C ATOM 3628 O TYR A 268 8.560 -4.709 -7.623 1.00 -0.57 O ATOM 3629 CB TYR A 268 5.519 -5.449 -6.809 1.00 0.14 C ATOM 3630 CG TYR A 268 4.462 -4.414 -6.525 1.00 -0.14 C ATOM 3631 CD1 TYR A 268 3.190 -4.416 -7.075 1.00 -0.15 C ATOM 3632 CD2 TYR A 268 4.774 -3.385 -5.617 1.00 -0.15 C ATOM 3633 CE1 TYR A 268 2.235 -3.498 -6.594 1.00 -0.15 C ATOM 3634 CE2 TYR A 268 3.823 -2.527 -5.093 1.00 -0.15 C ATOM 3635 CZ TYR A 268 2.529 -2.635 -5.534 1.00 0.08 C ATOM 3636 OH TYR A 268 1.552 -1.939 -4.881 1.00 -0.53 O ATOM 0 H TYR A 268 5.543 -7.200 -8.538 1.00 -0.73 H new ATOM 0 HA TYR A 268 6.175 -4.306 -8.569 1.00 0.36 H new ATOM 0 HB2 TYR A 268 5.051 -6.433 -6.794 1.00 0.14 H new ATOM 0 HB3 TYR A 268 6.247 -5.430 -5.998 1.00 0.14 H new ATOM 0 HD1 TYR A 268 2.934 -5.111 -7.861 1.00 -0.15 H new ATOM 0 HD2 TYR A 268 5.803 -3.259 -5.315 1.00 -0.15 H new ATOM 0 HE1 TYR A 268 1.258 -3.460 -7.053 1.00 -0.15 H new ATOM 0 HE2 TYR A 268 4.094 -1.789 -4.353 1.00 -0.15 H new ATOM 0 HH TYR A 268 1.228 -1.214 -5.455 1.00 -0.53 H new ATOM 3646 N ALA A 269 8.088 -6.928 -7.650 1.00 -0.73 N ATOM 3647 CA ALA A 269 9.544 -7.167 -7.672 1.00 0.36 C ATOM 3648 C ALA A 269 10.067 -6.454 -8.946 1.00 0.57 C ATOM 3649 O ALA A 269 11.130 -5.842 -8.977 1.00 -0.57 O ATOM 3650 CB ALA A 269 9.867 -8.647 -7.701 1.00 0.00 C ATOM 0 H ALA A 269 7.474 -7.735 -7.536 1.00 -0.73 H new ATOM 0 HA ALA A 269 10.020 -6.780 -6.771 1.00 0.36 H new ATOM 0 HB1 ALA A 269 10.948 -8.783 -7.717 1.00 0.00 H new ATOM 0 HB2 ALA A 269 9.454 -9.127 -6.814 1.00 0.00 H new ATOM 0 HB3 ALA A 269 9.432 -9.097 -8.593 1.00 0.00 H new ATOM 3656 N GLY A 270 9.163 -6.520 -9.996 1.00 -0.73 N ATOM 3657 CA GLY A 270 9.268 -5.593 -11.110 1.00 0.36 C ATOM 3658 C GLY A 270 9.077 -4.098 -10.735 1.00 0.57 C ATOM 3659 O GLY A 270 10.021 -3.356 -10.446 1.00 -0.57 O ATOM 0 H GLY A 270 8.396 -7.190 -10.061 1.00 -0.73 H new ATOM 0 HA2 GLY A 270 10.247 -5.714 -11.574 1.00 0.36 H new ATOM 0 HA3 GLY A 270 8.524 -5.863 -11.860 1.00 0.36 H new ATOM 3663 N VAL A 271 7.779 -3.648 -10.683 1.00 -0.73 N ATOM 3664 CA VAL A 271 7.380 -2.252 -10.476 1.00 0.36 C ATOM 3665 C VAL A 271 7.413 -1.897 -8.957 1.00 0.57 C ATOM 3666 O VAL A 271 6.612 -1.150 -8.407 1.00 -0.57 O ATOM 3667 CB VAL A 271 6.014 -1.912 -11.131 1.00 0.00 C ATOM 3668 CG1 VAL A 271 5.751 -0.397 -11.175 1.00 0.00 C ATOM 3669 CG2 VAL A 271 5.920 -2.418 -12.580 1.00 0.00 C ATOM 0 H VAL A 271 6.982 -4.275 -10.788 1.00 -0.73 H new ATOM 0 HA VAL A 271 8.110 -1.623 -10.987 1.00 0.36 H new ATOM 0 HB VAL A 271 5.275 -2.411 -10.504 1.00 0.00 H new ATOM 0 HG11 VAL A 271 4.784 -0.209 -11.642 1.00 0.00 H new ATOM 0 HG12 VAL A 271 5.748 0.001 -10.160 1.00 0.00 H new ATOM 0 HG13 VAL A 271 6.535 0.092 -11.754 1.00 0.00 H new ATOM 0 HG21 VAL A 271 4.947 -2.156 -12.994 1.00 0.00 H new ATOM 0 HG22 VAL A 271 6.705 -1.956 -13.178 1.00 0.00 H new ATOM 0 HG23 VAL A 271 6.041 -3.501 -12.596 1.00 0.00 H new ATOM 3679 N ALA A 272 8.556 -2.282 -8.293 1.00 -0.73 N ATOM 3680 CA ALA A 272 8.877 -1.884 -6.916 1.00 0.36 C ATOM 3681 C ALA A 272 10.405 -1.793 -6.769 1.00 0.57 C ATOM 3682 O ALA A 272 10.935 -0.932 -6.067 1.00 -0.57 O ATOM 3683 CB ALA A 272 8.345 -2.743 -5.798 1.00 0.00 C ATOM 0 H ALA A 272 9.267 -2.878 -8.717 1.00 -0.73 H new ATOM 0 HA ALA A 272 8.362 -0.931 -6.794 1.00 0.36 H new ATOM 0 HB1 ALA A 272 8.660 -2.329 -4.840 1.00 0.00 H new ATOM 0 HB2 ALA A 272 7.256 -2.766 -5.843 1.00 0.00 H new ATOM 0 HB3 ALA A 272 8.734 -3.756 -5.901 1.00 0.00 H new ATOM 3689 N PHE A 273 11.145 -2.766 -7.431 1.00 -0.73 N ATOM 3690 CA PHE A 273 12.594 -2.564 -7.647 1.00 0.36 C ATOM 3691 C PHE A 273 12.710 -1.337 -8.553 1.00 0.57 C ATOM 3692 O PHE A 273 13.261 -0.292 -8.224 1.00 -0.57 O ATOM 3693 CB PHE A 273 13.229 -3.793 -8.307 1.00 0.14 C ATOM 3694 CG PHE A 273 14.706 -3.783 -8.637 1.00 -0.14 C ATOM 3695 CD1 PHE A 273 15.585 -2.754 -8.281 1.00 -0.15 C ATOM 3696 CD2 PHE A 273 15.221 -4.880 -9.347 1.00 -0.15 C ATOM 3697 CE1 PHE A 273 16.937 -2.812 -8.633 1.00 -0.15 C ATOM 3698 CE2 PHE A 273 16.571 -4.940 -9.698 1.00 -0.15 C ATOM 3699 CZ PHE A 273 17.429 -3.903 -9.341 1.00 -0.15 C ATOM 0 H PHE A 273 10.767 -3.640 -7.796 1.00 -0.73 H new ATOM 0 HA PHE A 273 13.121 -2.417 -6.704 1.00 0.36 H new ATOM 0 HB2 PHE A 273 13.046 -4.646 -7.653 1.00 0.14 H new ATOM 0 HB3 PHE A 273 12.688 -3.981 -9.235 1.00 0.14 H new ATOM 0 HD1 PHE A 273 15.214 -1.904 -7.727 1.00 -0.15 H new ATOM 0 HD2 PHE A 273 14.563 -5.690 -9.626 1.00 -0.15 H new ATOM 0 HE1 PHE A 273 17.601 -2.007 -8.354 1.00 -0.15 H new ATOM 0 HE2 PHE A 273 16.950 -5.790 -10.246 1.00 -0.15 H new ATOM 0 HZ PHE A 273 18.473 -3.946 -9.613 1.00 -0.15 H new ATOM 3709 N TYR A 274 12.084 -1.519 -9.750 1.00 -0.73 N ATOM 3710 CA TYR A 274 11.820 -0.438 -10.675 1.00 0.36 C ATOM 3711 C TYR A 274 10.331 -0.151 -10.473 1.00 0.57 C ATOM 3712 O TYR A 274 9.525 0.026 -11.385 1.00 -0.57 O ATOM 3713 CB TYR A 274 12.157 -0.955 -12.071 1.00 0.14 C ATOM 3714 CG TYR A 274 13.445 -0.373 -12.602 1.00 -0.14 C ATOM 3715 CD1 TYR A 274 14.678 -0.776 -12.066 1.00 -0.15 C ATOM 3716 CD2 TYR A 274 13.420 0.603 -13.606 1.00 -0.15 C ATOM 3717 CE1 TYR A 274 15.866 -0.206 -12.522 1.00 -0.15 C ATOM 3718 CE2 TYR A 274 14.609 1.167 -14.068 1.00 -0.15 C ATOM 3719 CZ TYR A 274 15.820 0.765 -13.516 1.00 0.08 C ATOM 3720 OH TYR A 274 16.959 1.369 -13.963 1.00 -0.53 O ATOM 0 H TYR A 274 11.758 -2.428 -10.078 1.00 -0.73 H new ATOM 0 HA TYR A 274 12.399 0.474 -10.529 1.00 0.36 H new ATOM 0 HB2 TYR A 274 12.236 -2.042 -12.044 1.00 0.14 H new ATOM 0 HB3 TYR A 274 11.342 -0.711 -12.753 1.00 0.14 H new ATOM 0 HD1 TYR A 274 14.707 -1.532 -11.296 1.00 -0.15 H new ATOM 0 HD2 TYR A 274 12.476 0.920 -14.024 1.00 -0.15 H new ATOM 0 HE1 TYR A 274 16.814 -0.516 -12.107 1.00 -0.15 H new ATOM 0 HE2 TYR A 274 14.589 1.912 -14.850 1.00 -0.15 H new ATOM 0 HH TYR A 274 16.732 2.020 -14.660 1.00 -0.53 H new ATOM 3730 N ILE A 275 9.932 0.073 -9.140 1.00 -0.73 N ATOM 3731 CA ILE A 275 9.803 1.495 -8.845 1.00 0.36 C ATOM 3732 C ILE A 275 10.988 2.182 -8.139 1.00 0.57 C ATOM 3733 O ILE A 275 11.319 3.322 -8.476 1.00 -0.57 O ATOM 3734 CB ILE A 275 8.430 1.909 -8.230 1.00 0.00 C ATOM 3735 CG1 ILE A 275 7.946 3.297 -8.722 1.00 0.00 C ATOM 3736 CG2 ILE A 275 8.412 1.928 -6.700 1.00 0.00 C ATOM 3737 CD1 ILE A 275 7.536 3.325 -10.187 1.00 0.00 C ATOM 0 H ILE A 275 9.736 -0.606 -8.405 1.00 -0.73 H new ATOM 0 HA ILE A 275 9.838 1.905 -9.854 1.00 0.36 H new ATOM 0 HB ILE A 275 7.755 1.128 -8.580 1.00 0.00 H new ATOM 0 HG12 ILE A 275 7.099 3.612 -8.112 1.00 0.00 H new ATOM 0 HG13 ILE A 275 8.742 4.025 -8.564 1.00 0.00 H new ATOM 0 HG21 ILE A 275 7.423 2.225 -6.351 1.00 0.00 H new ATOM 0 HG22 ILE A 275 8.646 0.933 -6.321 1.00 0.00 H new ATOM 0 HG23 ILE A 275 9.154 2.639 -6.336 1.00 0.00 H new ATOM 0 HD11 ILE A 275 7.210 4.330 -10.454 1.00 0.00 H new ATOM 0 HD12 ILE A 275 8.386 3.042 -10.808 1.00 0.00 H new ATOM 0 HD13 ILE A 275 6.718 2.623 -10.349 1.00 0.00 H new ATOM 3749 N PHE A 276 11.517 1.573 -7.023 1.00 -0.73 N ATOM 3750 CA PHE A 276 12.248 2.306 -5.945 1.00 0.36 C ATOM 3751 C PHE A 276 13.756 2.493 -6.154 1.00 0.57 C ATOM 3752 O PHE A 276 14.530 2.869 -5.283 1.00 -0.57 O ATOM 3753 CB PHE A 276 11.602 2.034 -4.583 1.00 0.14 C ATOM 3754 CG PHE A 276 11.390 3.237 -3.684 1.00 -0.14 C ATOM 3755 CD1 PHE A 276 12.458 3.916 -3.096 1.00 -0.15 C ATOM 3756 CD2 PHE A 276 10.087 3.709 -3.434 1.00 -0.15 C ATOM 3757 CE1 PHE A 276 12.239 5.054 -2.318 1.00 -0.15 C ATOM 3758 CE2 PHE A 276 9.866 4.836 -2.641 1.00 -0.15 C ATOM 3759 CZ PHE A 276 10.945 5.512 -2.086 1.00 -0.15 C ATOM 0 H PHE A 276 11.445 0.570 -6.854 1.00 -0.73 H new ATOM 0 HA PHE A 276 12.105 3.385 -6.007 1.00 0.36 H new ATOM 0 HB2 PHE A 276 10.635 1.560 -4.752 1.00 0.14 H new ATOM 0 HB3 PHE A 276 12.222 1.314 -4.049 1.00 0.14 H new ATOM 0 HD1 PHE A 276 13.466 3.557 -3.245 1.00 -0.15 H new ATOM 0 HD2 PHE A 276 9.243 3.189 -3.864 1.00 -0.15 H new ATOM 0 HE1 PHE A 276 13.079 5.583 -1.893 1.00 -0.15 H new ATOM 0 HE2 PHE A 276 8.859 5.181 -2.459 1.00 -0.15 H new ATOM 0 HZ PHE A 276 10.781 6.389 -1.477 1.00 -0.15 H new ATOM 3769 N THR A 277 14.064 2.564 -7.496 1.00 -0.73 N ATOM 3770 CA THR A 277 14.852 3.679 -8.022 1.00 0.36 C ATOM 3771 C THR A 277 14.208 5.067 -7.679 1.00 0.57 C ATOM 3772 O THR A 277 14.789 6.133 -7.854 1.00 -0.57 O ATOM 3773 CB THR A 277 14.972 3.560 -9.558 1.00 0.28 C ATOM 3774 OG1 THR A 277 13.734 3.094 -10.143 1.00 -0.68 O ATOM 3775 CG2 THR A 277 16.056 2.567 -9.954 1.00 0.00 C ATOM 0 H THR A 277 13.778 1.875 -8.191 1.00 -0.73 H new ATOM 0 HA THR A 277 15.835 3.627 -7.553 1.00 0.36 H new ATOM 0 HB THR A 277 15.218 4.557 -9.924 1.00 0.28 H new ATOM 0 HG1 THR A 277 12.984 3.346 -9.565 1.00 -0.68 H new ATOM 0 HG21 THR A 277 16.115 2.507 -11.041 1.00 0.00 H new ATOM 0 HG22 THR A 277 17.015 2.898 -9.557 1.00 0.00 H new ATOM 0 HG23 THR A 277 15.815 1.584 -9.549 1.00 0.00 H new ATOM 3783 N HIS A 278 12.873 5.054 -7.339 1.00 -0.73 N ATOM 3784 CA HIS A 278 12.036 6.052 -6.625 1.00 0.36 C ATOM 3785 C HIS A 278 11.413 7.085 -7.565 1.00 0.57 C ATOM 3786 O HIS A 278 10.606 7.944 -7.226 1.00 -0.57 O ATOM 3787 CB HIS A 278 12.669 6.709 -5.386 1.00 0.18 C ATOM 3788 CG HIS A 278 13.261 8.053 -5.651 1.00 -0.33 C ATOM 3789 ND1 HIS A 278 14.525 8.228 -6.139 1.00 0.03 N ATOM 3790 CD2 HIS A 278 12.750 9.331 -5.556 1.00 0.08 C ATOM 3791 CE1 HIS A 278 14.673 9.545 -6.445 1.00 0.04 C ATOM 3792 NE2 HIS A 278 13.613 10.244 -6.106 1.00 -0.57 N ATOM 0 H HIS A 278 12.306 4.246 -7.594 1.00 -0.73 H new ATOM 0 HA HIS A 278 11.232 5.442 -6.214 1.00 0.36 H new ATOM 0 HB2 HIS A 278 11.910 6.804 -4.609 1.00 0.18 H new ATOM 0 HB3 HIS A 278 13.445 6.051 -4.995 1.00 0.18 H new ATOM 0 HD1 HIS A 278 15.231 7.501 -6.253 1.00 0.03 H new ATOM 0 HD2 HIS A 278 11.799 9.579 -5.109 1.00 0.08 H new ATOM 0 HE1 HIS A 278 15.553 9.965 -6.909 1.00 0.04 H new ATOM 3800 N GLN A 279 11.952 6.986 -8.827 1.00 -0.73 N ATOM 3801 CA GLN A 279 12.303 8.203 -9.541 1.00 0.36 C ATOM 3802 C GLN A 279 11.018 8.769 -10.131 1.00 0.57 C ATOM 3803 O GLN A 279 10.544 8.454 -11.216 1.00 -0.57 O ATOM 3804 CB GLN A 279 13.339 7.843 -10.596 1.00 0.00 C ATOM 3805 CG GLN A 279 13.911 9.038 -11.354 1.00 0.06 C ATOM 3806 CD GLN A 279 13.050 9.541 -12.490 1.00 0.57 C ATOM 3807 OE1 GLN A 279 12.945 8.960 -13.567 1.00 -0.57 O ATOM 3808 NE2 GLN A 279 12.424 10.732 -12.264 1.00 -0.80 N ATOM 0 H GLN A 279 12.134 6.114 -9.324 1.00 -0.73 H new ATOM 0 HA GLN A 279 12.743 8.967 -8.900 1.00 0.36 H new ATOM 0 HB2 GLN A 279 14.158 7.308 -10.115 1.00 0.00 H new ATOM 0 HB3 GLN A 279 12.887 7.157 -11.312 1.00 0.00 H new ATOM 0 HG2 GLN A 279 14.071 9.854 -10.649 1.00 0.06 H new ATOM 0 HG3 GLN A 279 14.888 8.764 -11.752 1.00 0.06 H new ATOM 0 HE21 GLN A 279 12.524 11.198 -11.362 1.00 -0.80 H new ATOM 0 HE22 GLN A 279 11.856 11.157 -12.997 1.00 -0.80 H new ATOM 3817 N GLY A 280 10.431 9.646 -9.252 1.00 -0.73 N ATOM 3818 CA GLY A 280 9.193 10.285 -9.549 1.00 0.36 C ATOM 3819 C GLY A 280 9.459 11.752 -9.813 1.00 0.57 C ATOM 3820 O GLY A 280 10.236 12.159 -10.672 1.00 -0.57 O ATOM 0 H GLY A 280 10.828 9.897 -8.347 1.00 -0.73 H new ATOM 0 HA2 GLY A 280 8.727 9.822 -10.419 1.00 0.36 H new ATOM 0 HA3 GLY A 280 8.498 10.170 -8.717 1.00 0.36 H new ATOM 3824 N SER A 281 8.714 12.562 -8.984 1.00 -0.73 N ATOM 3825 CA SER A 281 8.757 14.018 -9.108 1.00 0.36 C ATOM 3826 C SER A 281 8.294 14.425 -10.521 1.00 0.57 C ATOM 3827 O SER A 281 8.858 15.286 -11.198 1.00 -0.57 O ATOM 3828 CB SER A 281 10.122 14.610 -8.744 1.00 0.28 C ATOM 3829 OG SER A 281 10.387 14.349 -7.360 1.00 -0.68 O ATOM 0 H SER A 281 8.098 12.216 -8.248 1.00 -0.73 H new ATOM 0 HA SER A 281 8.067 14.442 -8.378 1.00 0.36 H new ATOM 0 HB2 SER A 281 10.902 14.171 -9.366 1.00 0.28 H new ATOM 0 HB3 SER A 281 10.130 15.683 -8.933 1.00 0.28 H new ATOM 0 HG SER A 281 11.260 14.723 -7.118 1.00 -0.68 H new ATOM 3835 N ASP A 282 7.163 13.822 -11.029 1.00 -0.73 N ATOM 3836 CA ASP A 282 5.889 13.683 -10.282 1.00 0.36 C ATOM 3837 C ASP A 282 5.256 12.285 -10.502 1.00 0.57 C ATOM 3838 O ASP A 282 4.079 12.048 -10.234 1.00 -0.57 O ATOM 3839 CB ASP A 282 4.969 14.804 -10.760 1.00 -0.11 C ATOM 3840 CG ASP A 282 3.600 14.905 -10.137 1.00 0.91 C ATOM 3841 OD1 ASP A 282 3.501 15.104 -8.893 1.00 -0.90 O ATOM 3842 OD2 ASP A 282 2.619 14.915 -10.939 1.00 -0.90 O ATOM 0 H ASP A 282 7.125 13.424 -11.968 1.00 -0.73 H new ATOM 0 HA ASP A 282 6.059 13.766 -9.209 1.00 0.36 H new ATOM 0 HB2 ASP A 282 5.482 15.751 -10.595 1.00 -0.11 H new ATOM 0 HB3 ASP A 282 4.839 14.695 -11.837 1.00 -0.11 H new ATOM 3847 N PHE A 283 6.128 11.289 -10.904 1.00 -0.73 N ATOM 3848 CA PHE A 283 5.627 10.027 -11.473 1.00 0.36 C ATOM 3849 C PHE A 283 6.181 8.685 -10.877 1.00 0.57 C ATOM 3850 O PHE A 283 6.194 7.636 -11.524 1.00 -0.57 O ATOM 3851 CB PHE A 283 5.687 10.040 -13.017 1.00 0.14 C ATOM 3852 CG PHE A 283 7.023 10.439 -13.601 1.00 -0.14 C ATOM 3853 CD1 PHE A 283 8.099 9.543 -13.617 1.00 -0.15 C ATOM 3854 CD2 PHE A 283 7.205 11.725 -14.134 1.00 -0.15 C ATOM 3855 CE1 PHE A 283 9.329 9.924 -14.156 1.00 -0.15 C ATOM 3856 CE2 PHE A 283 8.437 12.105 -14.667 1.00 -0.15 C ATOM 3857 CZ PHE A 283 9.498 11.202 -14.683 1.00 -0.15 C ATOM 0 H PHE A 283 7.144 11.354 -10.838 1.00 -0.73 H new ATOM 0 HA PHE A 283 4.588 10.012 -11.143 1.00 0.36 H new ATOM 0 HB2 PHE A 283 5.429 9.047 -13.384 1.00 0.14 H new ATOM 0 HB3 PHE A 283 4.925 10.725 -13.389 1.00 0.14 H new ATOM 0 HD1 PHE A 283 7.976 8.550 -13.210 1.00 -0.15 H new ATOM 0 HD2 PHE A 283 6.384 12.426 -14.131 1.00 -0.15 H new ATOM 0 HE1 PHE A 283 10.152 9.225 -14.164 1.00 -0.15 H new ATOM 0 HE2 PHE A 283 8.568 13.099 -15.067 1.00 -0.15 H new ATOM 0 HZ PHE A 283 10.450 11.493 -15.103 1.00 -0.15 H new ATOM 3867 N GLY A 284 6.503 8.689 -9.531 1.00 -0.73 N ATOM 3868 CA GLY A 284 6.953 7.474 -8.854 1.00 0.36 C ATOM 3869 C GLY A 284 7.130 7.401 -7.321 1.00 0.57 C ATOM 3870 O GLY A 284 7.867 6.510 -6.866 1.00 -0.57 O ATOM 0 H GLY A 284 6.451 9.514 -8.933 1.00 -0.73 H new ATOM 0 HA2 GLY A 284 6.251 6.686 -9.126 1.00 0.36 H new ATOM 0 HA3 GLY A 284 7.915 7.209 -9.293 1.00 0.36 H new ATOM 3874 N PRO A 285 6.433 8.223 -6.447 1.00 -0.66 N ATOM 3875 CA PRO A 285 5.080 8.763 -6.657 1.00 0.36 C ATOM 3876 C PRO A 285 4.966 10.069 -7.473 1.00 0.57 C ATOM 3877 O PRO A 285 5.965 10.725 -7.787 1.00 -0.57 O ATOM 3878 CB PRO A 285 4.550 9.086 -5.241 1.00 0.00 C ATOM 3879 CG PRO A 285 5.777 9.020 -4.346 1.00 0.00 C ATOM 3880 CD PRO A 285 6.635 7.982 -5.029 1.00 0.30 C ATOM 0 HA PRO A 285 4.534 8.016 -7.233 1.00 0.36 H new ATOM 0 HB2 PRO A 285 4.087 10.072 -5.207 1.00 0.00 H new ATOM 0 HB3 PRO A 285 3.792 8.367 -4.928 1.00 0.00 H new ATOM 0 HG2 PRO A 285 6.283 9.983 -4.281 1.00 0.00 H new ATOM 0 HG3 PRO A 285 5.520 8.726 -3.328 1.00 0.00 H new ATOM 0 HD2 PRO A 285 7.684 8.089 -4.753 1.00 0.30 H new ATOM 0 HD3 PRO A 285 6.334 6.972 -4.751 1.00 0.30 H new ATOM 3888 N ILE A 286 3.720 10.525 -7.841 1.00 -0.73 N ATOM 3889 CA ILE A 286 2.479 9.752 -7.798 1.00 0.36 C ATOM 3890 C ILE A 286 2.494 8.691 -8.917 1.00 0.57 C ATOM 3891 O ILE A 286 3.323 8.695 -9.819 1.00 -0.57 O ATOM 3892 CB ILE A 286 1.197 10.615 -7.752 1.00 0.00 C ATOM 3893 CG1 ILE A 286 1.011 11.625 -8.901 1.00 0.00 C ATOM 3894 CG2 ILE A 286 1.129 11.370 -6.414 1.00 0.00 C ATOM 3895 CD1 ILE A 286 0.811 10.989 -10.266 1.00 0.00 C ATOM 0 H ILE A 286 3.575 11.475 -8.183 1.00 -0.73 H new ATOM 0 HA ILE A 286 2.441 9.227 -6.843 1.00 0.36 H new ATOM 0 HB ILE A 286 0.386 9.897 -7.868 1.00 0.00 H new ATOM 0 HG12 ILE A 286 0.151 12.257 -8.678 1.00 0.00 H new ATOM 0 HG13 ILE A 286 1.884 12.277 -8.941 1.00 0.00 H new ATOM 0 HG21 ILE A 286 0.224 11.977 -6.385 1.00 0.00 H new ATOM 0 HG22 ILE A 286 1.112 10.654 -5.593 1.00 0.00 H new ATOM 0 HG23 ILE A 286 2.002 12.015 -6.315 1.00 0.00 H new ATOM 0 HD11 ILE A 286 0.688 11.770 -11.017 1.00 0.00 H new ATOM 0 HD12 ILE A 286 1.680 10.380 -10.515 1.00 0.00 H new ATOM 0 HD13 ILE A 286 -0.079 10.360 -10.247 1.00 0.00 H new ATOM 3907 N PHE A 287 1.563 7.682 -8.781 1.00 -0.73 N ATOM 3908 CA PHE A 287 1.883 6.315 -9.244 1.00 0.36 C ATOM 3909 C PHE A 287 2.715 5.719 -8.075 1.00 0.57 C ATOM 3910 O PHE A 287 3.903 5.939 -7.887 1.00 -0.57 O ATOM 3911 CB PHE A 287 2.582 6.186 -10.605 1.00 0.14 C ATOM 3912 CG PHE A 287 2.516 4.790 -11.194 1.00 -0.14 C ATOM 3913 CD1 PHE A 287 1.292 4.186 -11.514 1.00 -0.15 C ATOM 3914 CD2 PHE A 287 3.703 4.103 -11.480 1.00 -0.15 C ATOM 3915 CE1 PHE A 287 1.258 2.911 -12.082 1.00 -0.15 C ATOM 3916 CE2 PHE A 287 3.668 2.828 -12.046 1.00 -0.15 C ATOM 3917 CZ PHE A 287 2.446 2.228 -12.341 1.00 -0.15 C ATOM 0 H PHE A 287 0.635 7.797 -8.373 1.00 -0.73 H new ATOM 0 HA PHE A 287 0.962 5.772 -9.457 1.00 0.36 H new ATOM 0 HB2 PHE A 287 2.128 6.888 -11.305 1.00 0.14 H new ATOM 0 HB3 PHE A 287 3.627 6.476 -10.496 1.00 0.14 H new ATOM 0 HD1 PHE A 287 0.368 4.711 -11.320 1.00 -0.15 H new ATOM 0 HD2 PHE A 287 4.654 4.565 -11.260 1.00 -0.15 H new ATOM 0 HE1 PHE A 287 0.310 2.453 -12.321 1.00 -0.15 H new ATOM 0 HE2 PHE A 287 4.590 2.306 -12.256 1.00 -0.15 H new ATOM 0 HZ PHE A 287 2.419 1.237 -12.769 1.00 -0.15 H new ATOM 3927 N MET A 288 1.935 5.055 -7.153 1.00 -0.73 N ATOM 3928 CA MET A 288 1.920 5.271 -5.699 1.00 0.36 C ATOM 3929 C MET A 288 0.842 6.354 -5.545 1.00 0.57 C ATOM 3930 O MET A 288 1.089 7.557 -5.595 1.00 -0.57 O ATOM 3931 CB MET A 288 3.248 5.543 -4.979 1.00 0.00 C ATOM 3932 CG MET A 288 3.021 5.973 -3.524 1.00 0.23 C ATOM 3933 SD MET A 288 4.519 5.716 -2.523 1.00 -0.46 S ATOM 3934 CE MET A 288 3.875 6.236 -0.908 1.00 0.23 C ATOM 0 H MET A 288 1.279 4.328 -7.438 1.00 -0.73 H new ATOM 0 HA MET A 288 1.701 4.344 -5.170 1.00 0.36 H new ATOM 0 HB2 MET A 288 3.866 4.645 -5.002 1.00 0.00 H new ATOM 0 HB3 MET A 288 3.797 6.322 -5.508 1.00 0.00 H new ATOM 0 HG2 MET A 288 2.735 7.024 -3.493 1.00 0.23 H new ATOM 0 HG3 MET A 288 2.194 5.405 -3.099 1.00 0.23 H new ATOM 0 HE1 MET A 288 4.660 6.147 -0.157 1.00 0.23 H new ATOM 0 HE2 MET A 288 3.544 7.273 -0.965 1.00 0.23 H new ATOM 0 HE3 MET A 288 3.034 5.601 -0.630 1.00 0.23 H new ATOM 3944 N THR A 289 -0.476 5.978 -5.552 1.00 -0.73 N ATOM 3945 CA THR A 289 -1.058 4.622 -5.457 1.00 0.36 C ATOM 3946 C THR A 289 -0.924 3.804 -6.775 1.00 0.57 C ATOM 3947 O THR A 289 -0.490 4.300 -7.810 1.00 -0.57 O ATOM 3948 CB THR A 289 -2.515 4.646 -4.955 1.00 0.28 C ATOM 3949 OG1 THR A 289 -2.849 3.355 -4.431 1.00 -0.68 O ATOM 3950 CG2 THR A 289 -3.537 5.045 -6.011 1.00 0.00 C ATOM 0 H THR A 289 -1.209 6.683 -5.631 1.00 -0.73 H new ATOM 0 HA THR A 289 -0.462 4.101 -4.708 1.00 0.36 H new ATOM 0 HB THR A 289 -2.563 5.417 -4.186 1.00 0.28 H new ATOM 0 HG1 THR A 289 -3.774 3.362 -4.108 1.00 -0.68 H new ATOM 0 HG21 THR A 289 -4.535 5.036 -5.573 1.00 0.00 H new ATOM 0 HG22 THR A 289 -3.310 6.046 -6.377 1.00 0.00 H new ATOM 0 HG23 THR A 289 -3.498 4.339 -6.840 1.00 0.00 H new ATOM 3958 N ILE A 290 -1.240 2.477 -6.656 1.00 -0.73 N ATOM 3959 CA ILE A 290 -0.863 1.384 -7.577 1.00 0.36 C ATOM 3960 C ILE A 290 0.469 0.822 -7.022 1.00 0.57 C ATOM 3961 O ILE A 290 0.368 -0.061 -6.158 1.00 -0.57 O ATOM 3962 CB ILE A 290 -1.029 1.599 -9.080 1.00 0.00 C ATOM 3963 CG1 ILE A 290 -2.418 2.156 -9.473 1.00 0.00 C ATOM 3964 CG2 ILE A 290 -0.754 0.294 -9.843 1.00 0.00 C ATOM 3965 CD1 ILE A 290 -3.614 1.327 -9.015 1.00 0.00 C ATOM 0 H ILE A 290 -1.794 2.136 -5.870 1.00 -0.73 H new ATOM 0 HA ILE A 290 -1.618 0.598 -7.573 1.00 0.36 H new ATOM 0 HB ILE A 290 -0.296 2.356 -9.360 1.00 0.00 H new ATOM 0 HG12 ILE A 290 -2.516 3.161 -9.062 1.00 0.00 H new ATOM 0 HG13 ILE A 290 -2.458 2.250 -10.558 1.00 0.00 H new ATOM 0 HG21 ILE A 290 -0.877 0.465 -10.912 1.00 0.00 H new ATOM 0 HG22 ILE A 290 0.265 -0.037 -9.643 1.00 0.00 H new ATOM 0 HG23 ILE A 290 -1.455 -0.474 -9.516 1.00 0.00 H new ATOM 0 HD11 ILE A 290 -4.536 1.807 -9.343 1.00 0.00 H new ATOM 0 HD12 ILE A 290 -3.551 0.328 -9.447 1.00 0.00 H new ATOM 0 HD13 ILE A 290 -3.610 1.253 -7.928 1.00 0.00 H new ATOM 3977 N PRO A 291 1.658 1.494 -7.182 1.00 -0.66 N ATOM 3978 CA PRO A 291 2.857 1.202 -6.360 1.00 0.36 C ATOM 3979 C PRO A 291 2.720 1.107 -4.828 1.00 0.57 C ATOM 3980 O PRO A 291 3.572 0.553 -4.136 1.00 -0.57 O ATOM 3981 CB PRO A 291 3.734 2.387 -6.753 1.00 0.00 C ATOM 3982 CG PRO A 291 3.608 2.352 -8.261 1.00 0.00 C ATOM 3983 CD PRO A 291 2.117 2.059 -8.457 1.00 0.30 C ATOM 0 HA PRO A 291 3.214 0.192 -6.562 1.00 0.36 H new ATOM 0 HB2 PRO A 291 3.373 3.325 -6.331 1.00 0.00 H new ATOM 0 HB3 PRO A 291 4.765 2.264 -6.422 1.00 0.00 H new ATOM 0 HG2 PRO A 291 3.900 3.299 -8.716 1.00 0.00 H new ATOM 0 HG3 PRO A 291 4.236 1.579 -8.704 1.00 0.00 H new ATOM 0 HD2 PRO A 291 1.568 2.967 -8.704 1.00 0.30 H new ATOM 0 HD3 PRO A 291 1.959 1.358 -9.277 1.00 0.30 H new ATOM 3991 N ALA A 292 1.618 1.696 -4.250 1.00 -0.73 N ATOM 3992 CA ALA A 292 1.304 1.484 -2.834 1.00 0.36 C ATOM 3993 C ALA A 292 -0.121 0.876 -2.666 1.00 0.57 C ATOM 3994 O ALA A 292 -0.647 0.784 -1.557 1.00 -0.57 O ATOM 3995 CB ALA A 292 1.409 2.789 -2.061 1.00 0.00 C ATOM 0 H ALA A 292 0.963 2.301 -4.746 1.00 -0.73 H new ATOM 0 HA ALA A 292 2.031 0.778 -2.431 1.00 0.36 H new ATOM 0 HB1 ALA A 292 1.172 2.611 -1.012 1.00 0.00 H new ATOM 0 HB2 ALA A 292 2.423 3.180 -2.143 1.00 0.00 H new ATOM 0 HB3 ALA A 292 0.707 3.514 -2.473 1.00 0.00 H new ATOM 4001 N PHE A 293 -0.765 0.403 -3.804 1.00 -0.73 N ATOM 4002 CA PHE A 293 -2.094 -0.231 -3.682 1.00 0.36 C ATOM 4003 C PHE A 293 -1.973 -1.703 -3.292 1.00 0.57 C ATOM 4004 O PHE A 293 -2.692 -2.199 -2.424 1.00 -0.57 O ATOM 4005 CB PHE A 293 -2.924 -0.173 -4.974 1.00 0.14 C ATOM 4006 CG PHE A 293 -4.373 -0.589 -4.848 1.00 -0.14 C ATOM 4007 CD1 PHE A 293 -5.239 0.069 -3.963 1.00 -0.15 C ATOM 4008 CD2 PHE A 293 -4.888 -1.605 -5.668 1.00 -0.15 C ATOM 4009 CE1 PHE A 293 -6.587 -0.289 -3.895 1.00 -0.15 C ATOM 4010 CE2 PHE A 293 -6.237 -1.956 -5.602 1.00 -0.15 C ATOM 4011 CZ PHE A 293 -7.085 -1.300 -4.714 1.00 -0.15 C ATOM 0 H PHE A 293 -0.391 0.455 -4.752 1.00 -0.73 H new ATOM 0 HA PHE A 293 -2.602 0.344 -2.908 1.00 0.36 H new ATOM 0 HB2 PHE A 293 -2.891 0.846 -5.359 1.00 0.14 H new ATOM 0 HB3 PHE A 293 -2.447 -0.810 -5.718 1.00 0.14 H new ATOM 0 HD1 PHE A 293 -4.861 0.858 -3.330 1.00 -0.15 H new ATOM 0 HD2 PHE A 293 -4.234 -2.120 -6.356 1.00 -0.15 H new ATOM 0 HE1 PHE A 293 -7.245 0.219 -3.206 1.00 -0.15 H new ATOM 0 HE2 PHE A 293 -6.623 -2.737 -6.240 1.00 -0.15 H new ATOM 0 HZ PHE A 293 -8.128 -1.575 -4.660 1.00 -0.15 H new ATOM 4021 N PHE A 294 -1.117 -2.495 -4.025 1.00 -0.73 N ATOM 4022 CA PHE A 294 -1.220 -3.949 -3.865 1.00 0.36 C ATOM 4023 C PHE A 294 -0.553 -4.405 -2.557 1.00 0.57 C ATOM 4024 O PHE A 294 -0.809 -5.500 -2.062 1.00 -0.57 O ATOM 4025 CB PHE A 294 -0.716 -4.772 -5.043 1.00 0.14 C ATOM 4026 CG PHE A 294 -1.626 -4.712 -6.246 1.00 -0.14 C ATOM 4027 CD1 PHE A 294 -1.595 -3.636 -7.143 1.00 -0.15 C ATOM 4028 CD2 PHE A 294 -2.523 -5.764 -6.480 1.00 -0.15 C ATOM 4029 CE1 PHE A 294 -2.431 -3.626 -8.262 1.00 -0.15 C ATOM 4030 CE2 PHE A 294 -3.365 -5.748 -7.590 1.00 -0.15 C ATOM 4031 CZ PHE A 294 -3.317 -4.679 -8.482 1.00 -0.15 C ATOM 0 H PHE A 294 -0.408 -2.163 -4.678 1.00 -0.73 H new ATOM 0 HA PHE A 294 -2.291 -4.147 -3.824 1.00 0.36 H new ATOM 0 HB2 PHE A 294 0.275 -4.418 -5.327 1.00 0.14 H new ATOM 0 HB3 PHE A 294 -0.606 -5.811 -4.731 1.00 0.14 H new ATOM 0 HD1 PHE A 294 -0.921 -2.810 -6.968 1.00 -0.15 H new ATOM 0 HD2 PHE A 294 -2.562 -6.596 -5.792 1.00 -0.15 H new ATOM 0 HE1 PHE A 294 -2.391 -2.801 -8.958 1.00 -0.15 H new ATOM 0 HE2 PHE A 294 -4.054 -6.563 -7.759 1.00 -0.15 H new ATOM 0 HZ PHE A 294 -3.967 -4.666 -9.345 1.00 -0.15 H new ATOM 4041 N ALA A 295 0.301 -3.509 -1.946 1.00 -0.73 N ATOM 4042 CA ALA A 295 0.703 -3.679 -0.537 1.00 0.36 C ATOM 4043 C ALA A 295 -0.158 -2.813 0.392 1.00 0.57 C ATOM 4044 O ALA A 295 0.240 -2.310 1.431 1.00 -0.57 O ATOM 4045 CB ALA A 295 2.177 -3.384 -0.350 1.00 0.00 C ATOM 0 H ALA A 295 0.702 -2.693 -2.408 1.00 -0.73 H new ATOM 0 HA ALA A 295 0.537 -4.722 -0.267 1.00 0.36 H new ATOM 0 HB1 ALA A 295 2.445 -3.517 0.698 1.00 0.00 H new ATOM 0 HB2 ALA A 295 2.765 -4.066 -0.964 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.383 -2.356 -0.649 1.00 0.00 H new ATOM 4051 N LYS A 296 -1.451 -2.844 0.023 1.00 0.00 N ATOM 4052 CA LYS A 296 -2.514 -2.384 0.901 1.00 0.00 C ATOM 4053 C LYS A 296 -3.731 -3.298 0.744 1.00 0.00 C ATOM 4054 O LYS A 296 -4.544 -3.414 1.659 1.00 0.00 O ATOM 4055 CB LYS A 296 -2.817 -0.907 0.645 1.00 0.00 C ATOM 4056 CG LYS A 296 -2.515 -0.062 1.885 1.00 0.00 C ATOM 4057 CD LYS A 296 -1.074 0.452 1.860 1.00 0.00 C ATOM 4058 CE LYS A 296 -0.077 -0.707 1.899 1.00 0.00 C ATOM 4059 NZ LYS A 296 1.201 -0.308 1.288 1.00 0.00 N ATOM 0 H LYS A 296 -1.774 -3.186 -0.882 1.00 0.00 H new ATOM 0 HA LYS A 296 -2.201 -2.446 1.943 1.00 0.00 H new ATOM 0 HB2 LYS A 296 -2.222 -0.551 -0.196 1.00 0.00 H new ATOM 0 HB3 LYS A 296 -3.864 -0.790 0.367 1.00 0.00 H new ATOM 0 HG2 LYS A 296 -3.205 0.781 1.932 1.00 0.00 H new ATOM 0 HG3 LYS A 296 -2.677 -0.657 2.784 1.00 0.00 H new ATOM 0 HD2 LYS A 296 -0.912 1.046 0.960 1.00 0.00 H new ATOM 0 HD3 LYS A 296 -0.904 1.111 2.712 1.00 0.00 H new ATOM 0 HE2 LYS A 296 0.088 -1.018 2.931 1.00 0.00 H new ATOM 0 HE3 LYS A 296 -0.488 -1.566 1.369 1.00 0.00 H new ATOM 4071 N THR A 297 -3.615 -4.069 -0.744 1.00 -0.73 N ATOM 4072 CA THR A 297 -4.265 -5.357 -1.031 1.00 0.36 C ATOM 4073 C THR A 297 -3.260 -6.527 -0.800 1.00 0.57 C ATOM 4074 O THR A 297 -3.427 -7.649 -1.271 1.00 -0.57 O ATOM 4075 CB THR A 297 -4.773 -5.414 -2.483 1.00 0.28 C ATOM 4076 OG1 THR A 297 -5.147 -4.096 -2.907 1.00 -0.68 O ATOM 4077 CG2 THR A 297 -5.971 -6.339 -2.653 1.00 0.00 C ATOM 0 H THR A 297 -3.089 -3.689 -1.531 1.00 -0.73 H new ATOM 0 HA THR A 297 -5.115 -5.456 -0.356 1.00 0.36 H new ATOM 0 HB THR A 297 -3.959 -5.810 -3.091 1.00 0.28 H new ATOM 0 HG1 THR A 297 -5.372 -4.111 -3.861 1.00 -0.68 H new ATOM 0 HG21 THR A 297 -6.285 -6.339 -3.697 1.00 0.00 H new ATOM 0 HG22 THR A 297 -5.694 -7.351 -2.357 1.00 0.00 H new ATOM 0 HG23 THR A 297 -6.792 -5.990 -2.027 1.00 0.00 H new ATOM 4085 N SER A 298 -2.264 -6.253 0.112 1.00 -0.73 N ATOM 4086 CA SER A 298 -1.485 -7.268 0.836 1.00 0.36 C ATOM 4087 C SER A 298 -1.366 -6.796 2.296 1.00 0.57 C ATOM 4088 O SER A 298 -0.550 -7.260 3.081 1.00 -0.57 O ATOM 4089 CB SER A 298 -0.096 -7.572 0.293 1.00 0.28 C ATOM 4090 OG SER A 298 -0.131 -7.976 -1.070 1.00 -0.68 O ATOM 0 H SER A 298 -1.993 -5.300 0.352 1.00 -0.73 H new ATOM 0 HA SER A 298 -2.027 -8.207 0.719 1.00 0.36 H new ATOM 0 HB2 SER A 298 0.533 -6.687 0.392 1.00 0.28 H new ATOM 0 HB3 SER A 298 0.363 -8.359 0.892 1.00 0.28 H new ATOM 0 HG SER A 298 0.536 -7.470 -1.579 1.00 -0.68 H new ATOM 4096 N ALA A 299 -2.367 -5.908 2.643 1.00 -0.73 N ATOM 4097 CA ALA A 299 -2.813 -5.712 4.039 1.00 0.36 C ATOM 4098 C ALA A 299 -4.144 -6.467 4.277 1.00 0.57 C ATOM 4099 O ALA A 299 -4.932 -6.225 5.184 1.00 -0.57 O ATOM 4100 CB ALA A 299 -3.046 -4.238 4.325 1.00 0.00 C ATOM 0 H ALA A 299 -2.864 -5.330 1.965 1.00 -0.73 H new ATOM 0 HA ALA A 299 -2.034 -6.095 4.698 1.00 0.36 H new ATOM 0 HB1 ALA A 299 -3.374 -4.115 5.357 1.00 0.00 H new ATOM 0 HB2 ALA A 299 -2.119 -3.686 4.170 1.00 0.00 H new ATOM 0 HB3 ALA A 299 -3.813 -3.854 3.653 1.00 0.00 H new ATOM 4106 N VAL A 300 -4.373 -7.465 3.353 1.00 -0.73 N ATOM 4107 CA VAL A 300 -5.567 -8.280 3.354 1.00 0.36 C ATOM 4108 C VAL A 300 -5.272 -9.703 3.828 1.00 0.57 C ATOM 4109 O VAL A 300 -5.151 -10.716 3.138 1.00 -0.57 O ATOM 4110 CB VAL A 300 -6.317 -8.248 2.025 1.00 0.00 C ATOM 4111 CG1 VAL A 300 -6.885 -6.855 1.746 1.00 0.00 C ATOM 4112 CG2 VAL A 300 -5.502 -8.744 0.835 1.00 0.00 C ATOM 0 H VAL A 300 -3.718 -7.697 2.607 1.00 -0.73 H new ATOM 0 HA VAL A 300 -6.248 -7.833 4.078 1.00 0.36 H new ATOM 0 HB VAL A 300 -7.138 -8.956 2.140 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -7.414 -6.862 0.793 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -7.576 -6.577 2.542 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -6.071 -6.132 1.704 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -6.108 -8.689 -0.069 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -4.615 -8.121 0.716 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -5.200 -9.777 1.006 1.00 0.00 H new ATOM 4122 N TYR A 301 -5.256 -9.763 5.196 1.00 -0.73 N ATOM 4123 CA TYR A 301 -4.808 -10.947 5.888 1.00 0.36 C ATOM 4124 C TYR A 301 -5.889 -12.041 5.999 1.00 0.57 C ATOM 4125 O TYR A 301 -5.821 -12.998 6.754 1.00 -0.57 O ATOM 4126 CB TYR A 301 -4.059 -10.603 7.164 1.00 0.14 C ATOM 4127 CG TYR A 301 -2.595 -10.586 6.835 1.00 -0.14 C ATOM 4128 CD1 TYR A 301 -2.065 -9.487 6.143 1.00 -0.15 C ATOM 4129 CD2 TYR A 301 -1.831 -11.732 7.021 1.00 -0.15 C ATOM 4130 CE1 TYR A 301 -0.797 -9.554 5.585 1.00 -0.15 C ATOM 4131 CE2 TYR A 301 -0.574 -11.795 6.445 1.00 -0.15 C ATOM 4132 CZ TYR A 301 -0.067 -10.724 5.720 1.00 0.08 C ATOM 4133 OH TYR A 301 1.165 -10.849 5.152 1.00 -0.53 O ATOM 0 H TYR A 301 -5.550 -9.000 5.806 1.00 -0.73 H new ATOM 0 HA TYR A 301 -4.059 -11.435 5.264 1.00 0.36 H new ATOM 0 HB2 TYR A 301 -4.378 -9.633 7.546 1.00 0.14 H new ATOM 0 HB3 TYR A 301 -4.269 -11.337 7.942 1.00 0.14 H new ATOM 0 HD1 TYR A 301 -2.648 -8.583 6.044 1.00 -0.15 H new ATOM 0 HD2 TYR A 301 -2.211 -12.558 7.604 1.00 -0.15 H new ATOM 0 HE1 TYR A 301 -0.385 -8.708 5.054 1.00 -0.15 H new ATOM 0 HE2 TYR A 301 0.021 -12.689 6.561 1.00 -0.15 H new ATOM 0 HH TYR A 301 1.529 -11.737 5.352 1.00 -0.53 H new ATOM 4143 N ASN A 302 -6.818 -11.984 4.997 1.00 -0.73 N ATOM 4144 CA ASN A 302 -8.074 -12.692 4.919 1.00 0.36 C ATOM 4145 C ASN A 302 -7.990 -13.991 4.218 1.00 0.57 C ATOM 4146 O ASN A 302 -8.093 -15.078 4.791 1.00 -0.57 O ATOM 4147 CB ASN A 302 -9.084 -11.693 4.485 1.00 0.06 C ATOM 4148 CG ASN A 302 -10.382 -12.296 4.073 1.00 0.57 C ATOM 4149 OD1 ASN A 302 -10.845 -13.355 4.465 1.00 -0.57 O ATOM 4150 ND2 ASN A 302 -11.010 -11.564 3.110 1.00 -0.80 N ATOM 0 H ASN A 302 -6.670 -11.392 4.179 1.00 -0.73 H new ATOM 0 HA ASN A 302 -8.408 -13.077 5.883 1.00 0.36 H new ATOM 0 HB2 ASN A 302 -9.262 -10.991 5.300 1.00 0.06 H new ATOM 0 HB3 ASN A 302 -8.679 -11.118 3.652 1.00 0.06 H new ATOM 0 HD21 ASN A 302 -11.883 -11.899 2.703 1.00 -0.80 H new ATOM 0 HD22 ASN A 302 -10.607 -10.681 2.796 1.00 -0.80 H new ATOM 4157 N PRO A 303 -7.612 -13.918 2.933 1.00 -0.66 N ATOM 4158 CA PRO A 303 -7.229 -15.142 2.356 1.00 0.36 C ATOM 4159 C PRO A 303 -5.798 -15.535 2.763 1.00 0.57 C ATOM 4160 O PRO A 303 -5.206 -16.490 2.270 1.00 -0.57 O ATOM 4161 CB PRO A 303 -7.391 -14.832 0.923 1.00 0.00 C ATOM 4162 CG PRO A 303 -7.029 -13.380 0.742 1.00 0.00 C ATOM 4163 CD PRO A 303 -7.596 -12.811 2.008 1.00 0.30 C ATOM 0 HA PRO A 303 -7.807 -16.012 2.669 1.00 0.36 H new ATOM 0 HB2 PRO A 303 -6.747 -15.468 0.316 1.00 0.00 H new ATOM 0 HB3 PRO A 303 -8.416 -15.017 0.602 1.00 0.00 H new ATOM 0 HG2 PRO A 303 -5.953 -13.226 0.661 1.00 0.00 H new ATOM 0 HG3 PRO A 303 -7.481 -12.946 -0.149 1.00 0.00 H new ATOM 0 HD2 PRO A 303 -6.983 -11.991 2.383 1.00 0.30 H new ATOM 0 HD3 PRO A 303 -8.598 -12.413 1.849 1.00 0.30 H new ATOM 4171 N VAL A 304 -5.298 -14.799 3.811 1.00 -0.73 N ATOM 4172 CA VAL A 304 -4.113 -15.239 4.536 1.00 0.36 C ATOM 4173 C VAL A 304 -4.313 -15.389 6.067 1.00 0.57 C ATOM 4174 O VAL A 304 -3.377 -15.463 6.857 1.00 -0.57 O ATOM 4175 CB VAL A 304 -2.844 -14.602 3.954 1.00 0.00 C ATOM 4176 CG1 VAL A 304 -3.079 -13.134 3.596 1.00 0.00 C ATOM 4177 CG2 VAL A 304 -1.564 -14.813 4.753 1.00 0.00 C ATOM 0 H VAL A 304 -5.704 -13.925 4.145 1.00 -0.73 H new ATOM 0 HA VAL A 304 -3.917 -16.295 4.349 1.00 0.36 H new ATOM 0 HB VAL A 304 -2.652 -15.159 3.037 1.00 0.00 H new ATOM 0 HG11 VAL A 304 -2.163 -12.708 3.186 1.00 0.00 H new ATOM 0 HG12 VAL A 304 -3.875 -13.063 2.855 1.00 0.00 H new ATOM 0 HG13 VAL A 304 -3.366 -12.583 4.491 1.00 0.00 H new ATOM 0 HG21 VAL A 304 -0.734 -14.319 4.247 1.00 0.00 H new ATOM 0 HG22 VAL A 304 -1.684 -14.391 5.751 1.00 0.00 H new ATOM 0 HG23 VAL A 304 -1.357 -15.880 4.833 1.00 0.00 H new ATOM 4187 N ILE A 305 -5.612 -15.758 6.403 1.00 -0.73 N ATOM 4188 CA ILE A 305 -5.900 -16.365 7.714 1.00 0.36 C ATOM 4189 C ILE A 305 -6.442 -17.796 7.604 1.00 0.57 C ATOM 4190 O ILE A 305 -6.828 -18.409 8.596 1.00 -0.57 O ATOM 4191 CB ILE A 305 -6.955 -15.666 8.598 1.00 0.00 C ATOM 4192 CG1 ILE A 305 -8.187 -15.327 7.755 1.00 0.00 C ATOM 4193 CG2 ILE A 305 -6.360 -14.553 9.443 1.00 0.00 C ATOM 4194 CD1 ILE A 305 -9.493 -15.205 8.521 1.00 0.00 C ATOM 0 H ILE A 305 -6.423 -15.641 5.795 1.00 -0.73 H new ATOM 0 HA ILE A 305 -4.913 -16.285 8.170 1.00 0.36 H new ATOM 0 HB ILE A 305 -7.322 -16.346 9.367 1.00 0.00 H new ATOM 0 HG12 ILE A 305 -8.002 -14.387 7.235 1.00 0.00 H new ATOM 0 HG13 ILE A 305 -8.305 -16.095 6.991 1.00 0.00 H new ATOM 0 HG21 ILE A 305 -7.144 -14.095 10.045 1.00 0.00 H new ATOM 0 HG22 ILE A 305 -5.593 -14.964 10.099 1.00 0.00 H new ATOM 0 HG23 ILE A 305 -5.916 -13.800 8.792 1.00 0.00 H new ATOM 0 HD11 ILE A 305 -10.300 -14.963 7.829 1.00 0.00 H new ATOM 0 HD12 ILE A 305 -9.713 -16.150 9.018 1.00 0.00 H new ATOM 0 HD13 ILE A 305 -9.405 -14.415 9.266 1.00 0.00 H new ATOM 4206 N TYR A 306 -6.519 -18.370 6.372 1.00 -0.73 N ATOM 4207 CA TYR A 306 -7.386 -19.538 6.151 1.00 0.36 C ATOM 4208 C TYR A 306 -6.601 -20.649 5.386 1.00 0.57 C ATOM 4209 O TYR A 306 -7.206 -21.471 4.683 1.00 -0.57 O ATOM 4210 CB TYR A 306 -8.581 -19.080 5.263 1.00 0.14 C ATOM 4211 CG TYR A 306 -8.473 -19.106 3.739 1.00 -0.14 C ATOM 4212 CD1 TYR A 306 -7.406 -18.594 2.990 1.00 -0.15 C ATOM 4213 CD2 TYR A 306 -9.570 -19.669 3.036 1.00 -0.15 C ATOM 4214 CE1 TYR A 306 -7.466 -18.651 1.571 1.00 -0.15 C ATOM 4215 CE2 TYR A 306 -9.619 -19.735 1.641 1.00 -0.15 C ATOM 4216 CZ TYR A 306 -8.576 -19.201 0.917 1.00 0.08 C ATOM 4217 OH TYR A 306 -8.607 -19.247 -0.446 1.00 -0.53 O ATOM 0 H TYR A 306 -6.007 -18.050 5.550 1.00 -0.73 H new ATOM 0 HA TYR A 306 -7.728 -19.933 7.108 1.00 0.36 H new ATOM 0 HB2 TYR A 306 -9.438 -19.697 5.535 1.00 0.14 H new ATOM 0 HB3 TYR A 306 -8.821 -18.056 5.551 1.00 0.14 H new ATOM 0 HD1 TYR A 306 -6.549 -18.161 3.484 1.00 -0.15 H new ATOM 0 HD2 TYR A 306 -10.401 -20.063 3.603 1.00 -0.15 H new ATOM 0 HE1 TYR A 306 -6.643 -18.264 0.988 1.00 -0.15 H new ATOM 0 HE2 TYR A 306 -10.458 -20.196 1.141 1.00 -0.15 H new ATOM 0 HH TYR A 306 -7.693 -19.326 -0.792 1.00 -0.53 H new ATOM 4227 N ILE A 307 -5.269 -20.941 5.498 1.00 -0.73 N ATOM 4228 CA ILE A 307 -4.097 -20.376 6.490 1.00 0.36 C ATOM 4229 C ILE A 307 -4.621 -20.183 7.989 1.00 0.57 C ATOM 4230 O ILE A 307 -3.957 -19.596 8.847 1.00 -0.57 O ATOM 4231 CB ILE A 307 -3.428 -19.069 5.753 1.00 0.00 C ATOM 4232 CG1 ILE A 307 -2.785 -19.598 4.429 1.00 0.00 C ATOM 4233 CG2 ILE A 307 -2.311 -18.519 6.657 1.00 0.00 C ATOM 4234 CD1 ILE A 307 -2.076 -18.555 3.572 1.00 0.00 C ATOM 0 HA ILE A 307 -3.293 -21.097 6.639 1.00 0.36 H new ATOM 0 HB ILE A 307 -4.163 -18.287 5.562 1.00 0.00 H new ATOM 0 HG12 ILE A 307 -2.069 -20.380 4.682 1.00 0.00 H new ATOM 0 HG13 ILE A 307 -3.567 -20.064 3.829 1.00 0.00 H new ATOM 0 HG21 ILE A 307 -1.855 -17.650 6.183 1.00 0.00 H new ATOM 0 HG22 ILE A 307 -2.732 -18.229 7.620 1.00 0.00 H new ATOM 0 HG23 ILE A 307 -1.554 -19.288 6.809 1.00 0.00 H new ATOM 0 HD11 ILE A 307 -1.669 -19.032 2.681 1.00 0.00 H new ATOM 0 HD12 ILE A 307 -2.786 -17.782 3.277 1.00 0.00 H new ATOM 0 HD13 ILE A 307 -1.266 -18.104 4.144 1.00 0.00 H new ATOM 4246 N MET A 308 -5.732 -20.918 8.390 1.00 -0.73 N ATOM 4247 CA MET A 308 -6.011 -21.124 9.858 1.00 0.36 C ATOM 4248 C MET A 308 -6.496 -22.530 9.925 1.00 0.57 C ATOM 4249 O MET A 308 -6.397 -23.124 11.000 1.00 -0.57 O ATOM 4250 CB MET A 308 -7.133 -20.308 10.540 1.00 0.00 C ATOM 4251 CG MET A 308 -8.527 -20.338 9.915 1.00 0.23 C ATOM 4252 SD MET A 308 -9.790 -19.562 10.978 1.00 -0.46 S ATOM 4253 CE MET A 308 -9.113 -17.899 11.099 1.00 0.23 C ATOM 0 H MET A 308 -6.404 -21.349 7.756 1.00 -0.73 H new ATOM 0 HA MET A 308 -5.096 -20.829 10.372 1.00 0.36 H new ATOM 0 HB2 MET A 308 -7.221 -20.658 11.569 1.00 0.00 H new ATOM 0 HB3 MET A 308 -6.809 -19.268 10.583 1.00 0.00 H new ATOM 0 HG2 MET A 308 -8.501 -19.825 8.954 1.00 0.23 H new ATOM 0 HG3 MET A 308 -8.810 -21.372 9.717 1.00 0.23 H new ATOM 0 HE1 MET A 308 -9.926 -17.183 11.222 1.00 0.23 H new ATOM 0 HE2 MET A 308 -8.444 -17.840 11.958 1.00 0.23 H new ATOM 0 HE3 MET A 308 -8.558 -17.665 10.190 1.00 0.23 H new ATOM 4263 N MET A 309 -7.056 -23.179 8.870 1.00 -0.73 N ATOM 4264 CA MET A 309 -6.111 -23.955 7.959 1.00 0.36 C ATOM 4265 C MET A 309 -5.312 -25.108 8.579 1.00 0.57 C ATOM 4266 O MET A 309 -5.198 -26.208 8.067 1.00 -0.57 O ATOM 4267 CB MET A 309 -4.660 -23.237 8.057 1.00 0.00 C ATOM 4268 CG MET A 309 -4.365 -22.296 6.873 1.00 0.23 C ATOM 4269 SD MET A 309 -5.215 -22.669 5.334 1.00 -0.46 S ATOM 4270 CE MET A 309 -3.889 -22.479 4.117 1.00 0.23 C ATOM 0 H MET A 309 -8.046 -23.199 8.627 1.00 -0.73 H new ATOM 0 HA MET A 309 -6.757 -24.117 7.096 1.00 0.36 H new ATOM 0 HB2 MET A 309 -4.605 -22.669 8.986 1.00 0.00 H new ATOM 0 HB3 MET A 309 -3.886 -24.003 8.105 1.00 0.00 H new ATOM 0 HG2 MET A 309 -4.624 -21.280 7.170 1.00 0.23 H new ATOM 0 HG3 MET A 309 -3.292 -22.309 6.684 1.00 0.23 H new ATOM 0 HE1 MET A 309 -4.143 -21.677 3.424 1.00 0.23 H new ATOM 0 HE2 MET A 309 -2.958 -22.235 4.628 1.00 0.23 H new ATOM 0 HE3 MET A 309 -3.766 -23.411 3.565 1.00 0.23 H new ATOM 4280 N ASN A 310 -4.642 -24.579 9.712 1.00 -0.73 N ATOM 4281 CA ASN A 310 -3.062 -24.104 9.863 1.00 0.36 C ATOM 4282 C ASN A 310 -2.896 -24.096 11.424 1.00 0.57 C ATOM 4283 O ASN A 310 -1.896 -24.471 12.034 1.00 -0.57 O ATOM 4284 CB ASN A 310 -2.567 -22.654 9.433 1.00 0.06 C ATOM 4285 CG ASN A 310 -1.023 -22.810 9.358 1.00 0.57 C ATOM 4286 OD1 ASN A 310 -0.433 -23.807 9.774 1.00 -0.57 O ATOM 4287 ND2 ASN A 310 -0.295 -21.792 8.823 1.00 -0.80 N ATOM 0 H ASN A 310 -5.146 -24.447 10.589 1.00 -0.73 H new ATOM 0 HA ASN A 310 -2.500 -24.763 9.201 1.00 0.36 H new ATOM 0 HB2 ASN A 310 -2.988 -22.354 8.473 1.00 0.06 H new ATOM 0 HB3 ASN A 310 -2.860 -21.897 10.161 1.00 0.06 H new ATOM 0 HD22 ASN A 310 -0.766 -20.958 8.473 1.00 -0.80 H new ATOM 4294 N LYS A 311 -4.030 -23.674 12.119 1.00 -0.73 N ATOM 4295 CA LYS A 311 -4.255 -24.496 13.409 1.00 0.36 C ATOM 4296 C LYS A 311 -5.577 -25.323 13.498 1.00 0.57 C ATOM 4297 O LYS A 311 -5.769 -26.152 14.384 1.00 -0.57 O ATOM 4298 CB LYS A 311 -4.333 -23.462 14.617 1.00 0.00 C ATOM 4299 CG LYS A 311 -3.726 -24.209 15.828 1.00 0.00 C ATOM 4300 CD LYS A 311 -4.009 -23.497 17.146 1.00 0.00 C ATOM 4301 CE LYS A 311 -3.421 -22.098 17.189 1.00 0.50 C ATOM 4302 NZ LYS A 311 -1.937 -22.164 17.110 1.00 -0.85 N ATOM 0 H LYS A 311 -4.686 -22.929 11.885 1.00 -0.73 H new ATOM 0 HA LYS A 311 -3.432 -25.211 13.429 1.00 0.36 H new ATOM 0 HB2 LYS A 311 -3.774 -22.553 14.394 1.00 0.00 H new ATOM 0 HB3 LYS A 311 -5.363 -23.163 14.814 1.00 0.00 H new ATOM 0 HG2 LYS A 311 -4.131 -25.220 15.869 1.00 0.00 H new ATOM 0 HG3 LYS A 311 -2.649 -24.303 15.692 1.00 0.00 H new ATOM 0 HD2 LYS A 311 -5.087 -23.440 17.300 1.00 0.00 H new ATOM 0 HD3 LYS A 311 -3.600 -24.085 17.968 1.00 0.00 H new ATOM 0 HE2 LYS A 311 -3.811 -21.506 16.361 1.00 0.50 H new ATOM 0 HE3 LYS A 311 -3.722 -21.597 18.109 1.00 0.50 H new ATOM 0 HZ1 LYS A 311 -1.524 -21.429 17.719 1.00 -0.85 H new ATOM 0 HZ2 LYS A 311 -1.614 -23.100 17.429 1.00 -0.85 H new ATOM 0 HZ3 LYS A 311 -1.634 -22.009 16.127 1.00 -0.85 H new ATOM 4316 N GLN A 312 -6.558 -24.924 12.639 1.00 -0.73 N ATOM 4317 CA GLN A 312 -8.015 -25.453 12.811 1.00 0.36 C ATOM 4318 C GLN A 312 -8.415 -25.437 11.312 1.00 0.57 C ATOM 4319 O GLN A 312 -9.065 -24.582 10.728 1.00 -0.57 O ATOM 4320 CB GLN A 312 -8.688 -24.532 13.863 1.00 0.00 C ATOM 4321 CG GLN A 312 -10.144 -24.122 13.566 1.00 0.06 C ATOM 4322 CD GLN A 312 -10.151 -22.696 12.942 1.00 0.57 C ATOM 4323 OE1 GLN A 312 -9.511 -21.765 13.443 1.00 -0.57 O ATOM 4324 NE2 GLN A 312 -10.862 -22.539 11.761 1.00 -0.80 N ATOM 0 H GLN A 312 -6.420 -24.282 11.858 1.00 -0.73 H new ATOM 0 HA GLN A 312 -8.266 -26.430 13.224 1.00 0.36 H new ATOM 0 HB2 GLN A 312 -8.663 -25.037 14.829 1.00 0.00 H new ATOM 0 HB3 GLN A 312 -8.089 -23.627 13.961 1.00 0.00 H new ATOM 0 HG2 GLN A 312 -10.604 -24.835 12.882 1.00 0.06 H new ATOM 0 HG3 GLN A 312 -10.733 -24.135 14.483 1.00 0.06 H new ATOM 0 HE21 GLN A 312 -11.382 -23.325 11.370 1.00 -0.80 H new ATOM 0 HE22 GLN A 312 -10.865 -21.638 11.284 1.00 -0.80 H new ATOM 4333 N PHE A 313 -7.713 -26.425 10.669 1.00 -0.73 N ATOM 4334 CA PHE A 313 -8.043 -27.343 9.546 1.00 0.36 C ATOM 4335 C PHE A 313 -7.107 -28.482 9.945 1.00 0.57 C ATOM 4336 O PHE A 313 -6.949 -29.395 9.121 1.00 -0.57 O ATOM 4337 CB PHE A 313 -7.324 -26.608 8.097 1.00 0.14 C ATOM 4338 CG PHE A 313 -6.507 -27.670 7.297 1.00 -0.14 C ATOM 4339 CD1 PHE A 313 -5.330 -28.181 7.836 1.00 -0.15 C ATOM 4340 CD2 PHE A 313 -6.489 -27.478 5.912 1.00 -0.15 C ATOM 4341 CE1 PHE A 313 -4.256 -27.404 7.470 1.00 -0.15 C ATOM 4342 CE2 PHE A 313 -5.249 -27.256 5.310 1.00 -0.15 C ATOM 4343 CZ PHE A 313 -4.125 -27.093 6.122 1.00 -0.15 C ATOM 0 H PHE A 313 -6.761 -26.616 10.982 1.00 -0.73 H new ATOM 0 HA PHE A 313 -9.092 -27.584 9.376 1.00 0.36 H new ATOM 0 HB2 PHE A 313 -8.109 -26.192 7.465 1.00 0.14 H new ATOM 0 HB3 PHE A 313 -6.674 -25.781 8.385 1.00 0.14 H new ATOM 0 HD1 PHE A 313 -5.269 -29.064 8.455 1.00 -0.15 H new ATOM 0 HD2 PHE A 313 -7.399 -27.501 5.331 1.00 -0.15 H new ATOM 0 HE1 PHE A 313 -3.544 -27.050 8.200 1.00 -0.15 H new ATOM 0 HE2 PHE A 313 -5.161 -27.211 4.235 1.00 -0.15 H new ATOM 0 HZ PHE A 313 -3.189 -26.738 5.717 1.00 -0.15 H new ATOM 4353 N ARG A 314 -6.511 -28.515 11.198 1.00 -0.73 N ATOM 4354 CA ARG A 314 -5.813 -29.856 11.632 1.00 0.36 C ATOM 4355 C ARG A 314 -5.418 -29.452 13.107 1.00 0.57 C ATOM 4356 O ARG A 314 -4.429 -28.810 13.455 1.00 -0.57 O ATOM 4357 CB ARG A 314 -4.553 -30.050 10.599 1.00 0.00 C ATOM 4358 CG ARG A 314 -3.687 -31.303 10.986 1.00 0.00 C ATOM 4359 CD ARG A 314 -2.284 -31.350 10.223 1.00 0.33 C ATOM 4360 NE ARG A 314 -1.518 -30.057 10.173 1.00 -0.84 N ATOM 4361 CZ ARG A 314 -0.220 -29.824 9.968 1.00 1.20 C ATOM 4362 NH1 ARG A 314 0.623 -30.777 9.675 1.00 -0.97 N ATOM 4363 NH2 ARG A 314 0.273 -28.583 10.115 1.00 -0.97 N ATOM 0 H ARG A 314 -6.481 -27.749 11.871 1.00 -0.73 H new ATOM 0 HA ARG A 314 -6.360 -30.799 11.605 1.00 0.36 H new ATOM 0 HB2 ARG A 314 -4.928 -30.164 9.582 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -3.929 -29.156 10.611 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.510 -31.297 12.061 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -4.248 -32.210 10.760 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -1.657 -32.102 10.702 1.00 0.33 H new ATOM 0 HD3 ARG A 314 -2.460 -31.685 9.201 1.00 0.33 H new ATOM 0 HE ARG A 314 -2.083 -29.221 10.320 1.00 -0.84 H new ATOM 0 HH11 ARG A 314 0.297 -31.740 9.596 1.00 -0.97 H new ATOM 0 HH12 ARG A 314 1.608 -30.558 9.525 1.00 -0.97 H new ATOM 0 HH21 ARG A 314 -0.345 -27.817 10.384 1.00 -0.97 H new ATOM 0 HH22 ARG A 314 1.265 -28.407 9.958 1.00 -0.97 H new ATOM 4377 N ASN A 315 -6.349 -29.547 14.089 1.00 -0.73 N ATOM 4378 CA ASN A 315 -7.159 -30.764 14.285 1.00 0.36 C ATOM 4379 C ASN A 315 -8.175 -30.973 13.183 1.00 0.57 C ATOM 4380 O ASN A 315 -8.744 -30.027 12.652 1.00 -0.57 O ATOM 4381 CB ASN A 315 -8.172 -30.542 15.446 1.00 0.06 C ATOM 4382 CG ASN A 315 -8.812 -29.046 15.321 1.00 0.57 C ATOM 4383 OD1 ASN A 315 -8.243 -28.123 15.938 1.00 -0.57 O ATOM 4384 ND2 ASN A 315 -9.891 -28.655 14.490 1.00 -0.80 N ATOM 0 H ASN A 315 -6.553 -28.798 14.751 1.00 -0.73 H new ATOM 0 HA ASN A 315 -6.420 -31.557 14.395 1.00 0.36 H new ATOM 0 HB2 ASN A 315 -8.961 -31.293 15.405 1.00 0.06 H new ATOM 0 HB3 ASN A 315 -7.672 -30.658 16.408 1.00 0.06 H new ATOM 0 HD21 ASN A 315 -10.156 -27.672 14.427 1.00 -0.80 H new ATOM 0 HD22 ASN A 315 -10.403 -29.357 13.955 1.00 -0.80 H new ATOM 4391 N CYS A 316 -8.378 -32.271 12.821 1.00 -0.73 N ATOM 4392 CA CYS A 316 -9.672 -32.666 12.231 1.00 0.36 C ATOM 4393 C CYS A 316 -9.422 -34.163 11.944 1.00 0.57 C ATOM 4394 O CYS A 316 -9.076 -34.935 12.838 1.00 -0.57 O ATOM 4395 CB CYS A 316 -9.982 -31.849 10.974 1.00 0.23 C ATOM 4396 SG CYS A 316 -8.518 -31.684 9.908 1.00 -0.41 S ATOM 0 H CYS A 316 -7.695 -33.022 12.923 1.00 -0.73 H new ATOM 0 HA CYS A 316 -10.543 -32.491 12.863 1.00 0.36 H new ATOM 0 HB2 CYS A 316 -10.787 -32.328 10.417 1.00 0.23 H new ATOM 0 HB3 CYS A 316 -10.338 -30.859 11.261 1.00 0.23 H new ATOM 0 HG CYS A 316 -8.375 -30.440 9.557 1.00 -0.41 H new ATOM 4402 N MET A 317 -9.518 -34.581 10.629 1.00 -0.73 N ATOM 4403 CA MET A 317 -10.165 -35.927 10.332 1.00 0.36 C ATOM 4404 C MET A 317 -11.674 -35.758 10.767 1.00 0.57 C ATOM 4405 O MET A 317 -11.957 -34.932 11.647 1.00 -0.57 O ATOM 4406 CB MET A 317 -9.642 -36.966 11.418 1.00 0.00 C ATOM 4407 CG MET A 317 -8.767 -38.001 10.687 1.00 0.23 C ATOM 4408 SD MET A 317 -7.439 -38.606 11.776 1.00 -0.46 S ATOM 4409 CE MET A 317 -6.752 -39.873 10.685 1.00 0.23 C ATOM 0 H MET A 317 -9.188 -34.059 9.817 1.00 -0.73 H new ATOM 0 HA MET A 317 -9.984 -36.229 9.300 1.00 0.36 H new ATOM 0 HB2 MET A 317 -9.067 -36.456 12.191 1.00 0.00 H new ATOM 0 HB3 MET A 317 -10.480 -37.455 11.915 1.00 0.00 H new ATOM 0 HG2 MET A 317 -9.383 -38.838 10.358 1.00 0.23 H new ATOM 0 HG3 MET A 317 -8.335 -37.552 9.793 1.00 0.23 H new ATOM 0 HE1 MET A 317 -5.772 -40.177 11.052 1.00 0.23 H new ATOM 0 HE2 MET A 317 -7.417 -40.737 10.667 1.00 0.23 H new ATOM 0 HE3 MET A 317 -6.653 -39.470 9.677 1.00 0.23 H new ATOM 4419 N VAL A 318 -12.670 -36.553 10.235 1.00 -0.73 N ATOM 4420 CA VAL A 318 -14.024 -36.405 10.814 1.00 0.36 C ATOM 4421 C VAL A 318 -15.118 -36.528 9.718 1.00 0.57 C ATOM 4422 O VAL A 318 -14.915 -37.141 8.670 1.00 -0.57 O ATOM 4423 CB VAL A 318 -14.171 -34.880 11.241 1.00 0.00 C ATOM 4424 CG1 VAL A 318 -13.874 -34.733 12.735 1.00 0.00 C ATOM 4425 CG2 VAL A 318 -13.236 -33.966 10.430 1.00 0.00 C ATOM 0 H VAL A 318 -12.565 -37.233 9.482 1.00 -0.73 H new ATOM 0 HA VAL A 318 -14.137 -37.148 11.603 1.00 0.36 H new ATOM 0 HB VAL A 318 -15.196 -34.572 11.034 1.00 0.00 H new ATOM 0 HG11 VAL A 318 -13.975 -33.687 13.025 1.00 0.00 H new ATOM 0 HG12 VAL A 318 -14.577 -35.338 13.307 1.00 0.00 H new ATOM 0 HG13 VAL A 318 -12.857 -35.069 12.939 1.00 0.00 H new ATOM 0 HG21 VAL A 318 -13.367 -32.933 10.752 1.00 0.00 H new ATOM 0 HG22 VAL A 318 -12.201 -34.268 10.592 1.00 0.00 H new ATOM 0 HG23 VAL A 318 -13.476 -34.049 9.370 1.00 0.00 H new ATOM 4435 N THR A 319 -16.340 -35.966 10.045 1.00 -0.73 N ATOM 4436 CA THR A 319 -17.545 -36.186 9.256 1.00 0.36 C ATOM 4437 C THR A 319 -18.043 -35.012 8.381 1.00 0.57 C ATOM 4438 O THR A 319 -18.870 -35.224 7.486 1.00 -0.57 O ATOM 4439 CB THR A 319 -18.685 -36.743 10.145 1.00 0.28 C ATOM 4440 OG1 THR A 319 -19.591 -37.538 9.363 1.00 -0.68 O ATOM 4441 CG2 THR A 319 -19.495 -35.710 10.917 1.00 0.00 C ATOM 0 H THR A 319 -16.481 -35.363 10.855 1.00 -0.73 H new ATOM 0 HA THR A 319 -17.235 -36.926 8.518 1.00 0.36 H new ATOM 0 HB THR A 319 -18.162 -37.337 10.894 1.00 0.28 H new ATOM 0 HG1 THR A 319 -19.702 -37.132 8.478 1.00 -0.68 H new ATOM 0 HG21 THR A 319 -20.263 -36.214 11.503 1.00 0.00 H new ATOM 0 HG22 THR A 319 -18.835 -35.155 11.584 1.00 0.00 H new ATOM 0 HG23 THR A 319 -19.967 -35.021 10.217 1.00 0.00 H new ATOM 4449 N THR A 320 -17.631 -33.737 8.682 1.00 -0.73 N ATOM 4450 CA THR A 320 -18.164 -32.545 7.970 1.00 0.36 C ATOM 4451 C THR A 320 -17.241 -31.362 8.328 1.00 0.57 C ATOM 4452 O THR A 320 -17.261 -30.795 9.415 1.00 -0.57 O ATOM 4453 CB THR A 320 -19.650 -32.289 8.352 1.00 0.28 C ATOM 4454 OG1 THR A 320 -20.518 -33.143 7.569 1.00 -0.68 O ATOM 4455 CG2 THR A 320 -20.155 -30.880 8.062 1.00 0.00 C ATOM 0 H THR A 320 -16.942 -33.520 9.402 1.00 -0.73 H new ATOM 0 HA THR A 320 -18.166 -32.692 6.890 1.00 0.36 H new ATOM 0 HB THR A 320 -19.677 -32.476 9.426 1.00 0.28 H new ATOM 0 HG1 THR A 320 -20.009 -33.913 7.240 1.00 -0.68 H new ATOM 0 HG21 THR A 320 -21.200 -30.799 8.362 1.00 0.00 H new ATOM 0 HG22 THR A 320 -19.560 -30.158 8.621 1.00 0.00 H new ATOM 0 HG23 THR A 320 -20.067 -30.674 6.995 1.00 0.00 H new ATOM 4463 N LEU A 321 -16.261 -30.984 7.439 1.00 -0.73 N ATOM 4464 CA LEU A 321 -16.616 -30.569 6.053 1.00 0.36 C ATOM 4465 C LEU A 321 -15.321 -30.558 5.208 1.00 0.57 C ATOM 4466 O LEU A 321 -14.752 -31.612 4.915 1.00 -0.57 O ATOM 4467 CB LEU A 321 -17.394 -29.236 6.048 1.00 0.00 C ATOM 4468 CG LEU A 321 -17.884 -28.741 4.664 1.00 0.00 C ATOM 4469 CD1 LEU A 321 -18.662 -29.797 3.881 1.00 0.00 C ATOM 4470 CD2 LEU A 321 -18.734 -27.480 4.843 1.00 0.00 C ATOM 0 H LEU A 321 -15.264 -30.961 7.653 1.00 -0.73 H new ATOM 0 HA LEU A 321 -17.303 -31.281 5.595 1.00 0.36 H new ATOM 0 HB2 LEU A 321 -18.260 -29.341 6.702 1.00 0.00 H new ATOM 0 HB3 LEU A 321 -16.758 -28.465 6.483 1.00 0.00 H new ATOM 0 HG LEU A 321 -16.995 -28.519 4.073 1.00 0.00 H new ATOM 0 HD11 LEU A 321 -18.974 -29.382 2.923 1.00 0.00 H new ATOM 0 HD12 LEU A 321 -18.026 -30.666 3.711 1.00 0.00 H new ATOM 0 HD13 LEU A 321 -19.542 -30.097 4.450 1.00 0.00 H new ATOM 0 HD21 LEU A 321 -19.078 -27.132 3.869 1.00 0.00 H new ATOM 0 HD22 LEU A 321 -19.594 -27.708 5.472 1.00 0.00 H new ATOM 0 HD23 LEU A 321 -18.135 -26.701 5.315 1.00 0.00 H new ATOM 4482 N CYS A 322 -14.774 -29.343 4.828 1.00 -0.73 N ATOM 4483 CA CYS A 322 -13.483 -29.425 4.026 1.00 0.36 C ATOM 4484 C CYS A 322 -12.647 -28.217 4.564 1.00 0.57 C ATOM 4485 O CYS A 322 -12.835 -27.725 5.678 1.00 -0.57 O ATOM 4486 CB CYS A 322 -13.816 -29.271 2.536 1.00 0.23 C ATOM 4487 SG CYS A 322 -12.467 -29.872 1.436 1.00 -0.41 S ATOM 0 H CYS A 322 -15.143 -28.413 5.028 1.00 -0.73 H new ATOM 0 HA CYS A 322 -12.943 -30.367 4.128 1.00 0.36 H new ATOM 0 HB2 CYS A 322 -14.731 -29.821 2.314 1.00 0.23 H new ATOM 0 HB3 CYS A 322 -14.014 -28.221 2.320 1.00 0.23 H new ATOM 0 HG CYS A 322 -12.817 -29.714 0.194 1.00 -0.41 H new ATOM 4493 N CYS A 323 -11.539 -27.825 3.815 1.00 -0.73 N ATOM 4494 CA CYS A 323 -10.446 -27.102 4.478 1.00 0.36 C ATOM 4495 C CYS A 323 -9.842 -27.869 5.672 1.00 0.57 C ATOM 4496 O CYS A 323 -9.015 -27.347 6.431 1.00 -0.57 O ATOM 4497 CB CYS A 323 -10.785 -25.654 4.860 1.00 0.23 C ATOM 4498 SG CYS A 323 -11.277 -24.669 3.388 1.00 -0.41 S ATOM 0 H CYS A 323 -11.412 -27.998 2.818 1.00 -0.73 H new ATOM 0 HA CYS A 323 -9.675 -27.039 3.710 1.00 0.36 H new ATOM 0 HB2 CYS A 323 -11.594 -25.649 5.590 1.00 0.23 H new ATOM 0 HB3 CYS A 323 -9.922 -25.191 5.338 1.00 0.23 H new ATOM 0 HG CYS A 323 -11.557 -23.453 3.753 1.00 -0.41 H new ATOM 4504 N GLY A 324 -10.111 -29.203 5.832 1.00 -0.73 N ATOM 4505 CA GLY A 324 -10.166 -30.228 4.775 1.00 0.36 C ATOM 4506 C GLY A 324 -8.766 -30.827 4.781 1.00 0.57 C ATOM 4507 O GLY A 324 -7.778 -30.082 4.766 1.00 -0.57 O ATOM 0 H GLY A 324 -10.303 -29.597 6.753 1.00 -0.73 H new ATOM 0 HA2 GLY A 324 -10.925 -30.981 4.987 1.00 0.36 H new ATOM 0 HA3 GLY A 324 -10.411 -29.792 3.807 1.00 0.36 H new ATOM 4511 N LYS A 325 -8.671 -32.197 4.839 1.00 -0.73 N ATOM 4512 CA LYS A 325 -7.509 -32.876 5.479 1.00 0.36 C ATOM 4513 C LYS A 325 -7.404 -34.403 5.218 1.00 0.57 C ATOM 4514 O LYS A 325 -6.776 -35.180 5.932 1.00 -0.57 O ATOM 4515 CB LYS A 325 -7.343 -32.492 7.024 1.00 0.00 C ATOM 4516 CG LYS A 325 -5.946 -31.960 7.375 1.00 0.00 C ATOM 4517 CD LYS A 325 -5.514 -30.881 6.423 1.00 0.00 C ATOM 4518 CE LYS A 325 -5.400 -29.449 6.859 1.00 0.50 C ATOM 4519 NZ LYS A 325 -6.758 -28.879 6.766 1.00 -0.85 N ATOM 0 H LYS A 325 -9.372 -32.832 4.458 1.00 -0.73 H new ATOM 0 HA LYS A 325 -6.644 -32.467 4.956 1.00 0.36 H new ATOM 0 HB2 LYS A 325 -8.086 -31.739 7.285 1.00 0.00 H new ATOM 0 HB3 LYS A 325 -7.552 -33.371 7.633 1.00 0.00 H new ATOM 0 HG2 LYS A 325 -5.949 -31.569 8.393 1.00 0.00 H new ATOM 0 HG3 LYS A 325 -5.227 -32.779 7.350 1.00 0.00 H new ATOM 0 HD2 LYS A 325 -4.538 -31.173 6.036 1.00 0.00 H new ATOM 0 HD3 LYS A 325 -6.209 -30.902 5.584 1.00 0.00 H new ATOM 0 HE2 LYS A 325 -5.019 -29.382 7.878 1.00 0.50 H new ATOM 0 HE3 LYS A 325 -4.704 -28.903 6.222 1.00 0.50 H new ATOM 0 HZ3 LYS A 325 -6.737 -27.881 7.059 1.00 -0.85 H new ATOM 4533 N ASN A 326 -7.877 -34.754 3.971 1.00 -0.73 N ATOM 4534 CA ASN A 326 -7.832 -36.165 3.501 1.00 0.36 C ATOM 4535 C ASN A 326 -8.499 -36.101 2.090 1.00 0.57 C ATOM 4536 O ASN A 326 -8.185 -36.891 1.197 1.00 -0.57 O ATOM 4537 CB ASN A 326 -8.662 -37.093 4.460 1.00 0.06 C ATOM 4538 CG ASN A 326 -8.202 -38.545 4.198 1.00 0.57 C ATOM 4539 OD1 ASN A 326 -7.774 -39.246 5.116 1.00 -0.57 O ATOM 4540 ND2 ASN A 326 -8.322 -39.134 2.931 1.00 -0.80 N ATOM 0 H ASN A 326 -8.278 -34.095 3.303 1.00 -0.73 H new ATOM 0 HA ASN A 326 -6.822 -36.574 3.478 1.00 0.36 H new ATOM 0 HB2 ASN A 326 -8.495 -36.818 5.502 1.00 0.06 H new ATOM 0 HB3 ASN A 326 -9.730 -36.987 4.269 1.00 0.06 H new ATOM 0 HD21 ASN A 326 -8.059 -40.110 2.795 1.00 -0.80 H new ATOM 0 HD22 ASN A 326 -8.673 -38.586 2.145 1.00 -0.80 H new ATOM 4547 N PRO A 327 -9.445 -35.104 1.882 1.00 -0.66 N ATOM 4548 CA PRO A 327 -10.659 -34.968 2.695 1.00 0.36 C ATOM 4549 C PRO A 327 -11.701 -36.072 2.394 1.00 0.57 C ATOM 4550 O PRO A 327 -12.133 -36.281 1.261 1.00 -0.57 O ATOM 4551 CB PRO A 327 -11.258 -33.623 2.238 1.00 0.00 C ATOM 4552 CG PRO A 327 -10.601 -33.389 0.803 1.00 0.00 C ATOM 4553 CD PRO A 327 -9.721 -34.622 0.558 1.00 0.30 C ATOM 0 HA PRO A 327 -10.421 -35.035 3.757 1.00 0.36 H new ATOM 0 HB2 PRO A 327 -12.345 -33.668 2.179 1.00 0.00 H new ATOM 0 HB3 PRO A 327 -11.009 -32.818 2.929 1.00 0.00 H new ATOM 0 HG2 PRO A 327 -11.365 -33.291 0.032 1.00 0.00 H new ATOM 0 HG3 PRO A 327 -10.010 -32.473 0.785 1.00 0.00 H new ATOM 0 HD2 PRO A 327 -10.237 -35.371 -0.042 1.00 0.30 H new ATOM 0 HD3 PRO A 327 -8.806 -34.363 0.026 1.00 0.30 H new ATOM 4561 N LEU A 328 -12.142 -36.777 3.495 1.00 -0.73 N ATOM 4562 CA LEU A 328 -13.527 -37.303 3.463 1.00 0.36 C ATOM 4563 C LEU A 328 -14.353 -36.137 4.079 1.00 0.57 C ATOM 4564 O LEU A 328 -14.517 -35.090 3.447 1.00 -0.57 O ATOM 4565 CB LEU A 328 -13.632 -38.654 4.183 1.00 0.00 C ATOM 4566 CG LEU A 328 -13.125 -39.882 3.390 1.00 0.00 C ATOM 4567 CD1 LEU A 328 -13.928 -40.132 2.111 1.00 0.00 C ATOM 4568 CD2 LEU A 328 -11.633 -39.831 3.069 1.00 0.00 C ATOM 0 H LEU A 328 -11.602 -36.974 4.338 1.00 -0.73 H new ATOM 0 HA LEU A 328 -13.902 -37.554 2.471 1.00 0.36 H new ATOM 0 HB2 LEU A 328 -13.072 -38.591 5.116 1.00 0.00 H new ATOM 0 HB3 LEU A 328 -14.676 -38.822 4.448 1.00 0.00 H new ATOM 0 HG LEU A 328 -13.283 -40.723 4.065 1.00 0.00 H new ATOM 0 HD11 LEU A 328 -13.528 -41.005 1.595 1.00 0.00 H new ATOM 0 HD12 LEU A 328 -14.973 -40.308 2.366 1.00 0.00 H new ATOM 0 HD13 LEU A 328 -13.855 -39.261 1.460 1.00 0.00 H new ATOM 0 HD21 LEU A 328 -11.350 -40.724 2.512 1.00 0.00 H new ATOM 0 HD22 LEU A 328 -11.420 -38.947 2.469 1.00 0.00 H new ATOM 0 HD23 LEU A 328 -11.063 -39.786 3.997 1.00 0.00 H new ATOM 4580 N GLY A 329 -14.747 -36.267 5.391 1.00 -0.73 N ATOM 4581 CA GLY A 329 -15.068 -35.096 6.202 1.00 0.36 C ATOM 4582 C GLY A 329 -13.826 -34.755 7.031 1.00 0.57 C ATOM 4583 O GLY A 329 -12.765 -35.368 6.897 1.00 -0.57 O ATOM 0 H GLY A 329 -14.840 -37.159 5.876 1.00 -0.73 H new ATOM 0 HA2 GLY A 329 -15.348 -34.255 5.567 1.00 0.36 H new ATOM 0 HA3 GLY A 329 -15.918 -35.301 6.852 1.00 0.36 H new ATOM 4587 N ASP A 330 -13.964 -33.725 7.940 1.00 -0.73 N ATOM 4588 CA ASP A 330 -12.656 -33.142 8.501 1.00 0.36 C ATOM 4589 C ASP A 330 -13.206 -32.162 9.540 1.00 0.57 C ATOM 4590 O ASP A 330 -13.912 -31.215 9.184 1.00 -0.57 O ATOM 4591 CB ASP A 330 -12.002 -32.186 7.344 1.00 -0.11 C ATOM 4592 CG ASP A 330 -10.811 -33.030 7.014 1.00 0.91 C ATOM 4593 OD1 ASP A 330 -10.006 -33.279 7.954 1.00 -0.90 O ATOM 4594 OD2 ASP A 330 -10.646 -33.265 5.783 1.00 -0.90 O ATOM 0 H ASP A 330 -14.837 -33.316 8.274 1.00 -0.73 H new ATOM 0 HA ASP A 330 -11.941 -33.888 8.848 1.00 0.36 H new ATOM 0 HB2 ASP A 330 -12.665 -32.037 6.492 1.00 -0.11 H new ATOM 0 HB3 ASP A 330 -11.732 -31.197 7.714 1.00 -0.11 H new ATOM 4599 N ASP A 331 -12.989 -32.464 10.884 1.00 -0.73 N ATOM 4600 CA ASP A 331 -14.100 -31.774 11.809 1.00 0.36 C ATOM 4601 C ASP A 331 -13.304 -31.302 13.073 1.00 0.57 C ATOM 4602 O ASP A 331 -12.111 -30.950 12.988 1.00 -0.57 O ATOM 4603 CB ASP A 331 -15.148 -32.986 11.884 1.00 -0.11 C ATOM 4604 CG ASP A 331 -16.565 -32.469 11.905 1.00 0.91 C ATOM 4605 OD1 ASP A 331 -16.772 -31.419 12.548 1.00 -0.90 O ATOM 4606 OD2 ASP A 331 -17.351 -33.253 11.279 1.00 -0.90 O ATOM 0 HA ASP A 331 -14.655 -30.878 11.530 1.00 0.36 H new ATOM 0 HB2 ASP A 331 -15.010 -33.646 11.027 1.00 -0.11 H new ATOM 0 HB3 ASP A 331 -14.960 -33.581 12.778 1.00 -0.11 H new ATOM 4611 N GLU A 332 -13.803 -31.089 14.321 1.00 -0.73 N ATOM 4612 CA GLU A 332 -14.780 -32.026 15.047 1.00 0.36 C ATOM 4613 C GLU A 332 -13.929 -33.272 15.438 1.00 0.57 C ATOM 4614 O GLU A 332 -14.445 -34.271 15.947 1.00 -0.57 O ATOM 4615 CB GLU A 332 -16.002 -32.682 14.267 1.00 0.00 C ATOM 4616 CG GLU A 332 -17.163 -32.968 15.220 1.00 -0.11 C ATOM 4617 CD GLU A 332 -18.199 -33.818 14.470 1.00 0.91 C ATOM 4618 OE1 GLU A 332 -17.820 -34.974 14.120 1.00 -0.90 O ATOM 4619 OE2 GLU A 332 -19.314 -33.256 14.267 1.00 -0.90 O ATOM 0 H GLU A 332 -13.555 -30.269 14.874 1.00 -0.73 H new ATOM 0 HA GLU A 332 -15.222 -31.383 15.808 1.00 0.36 H new ATOM 0 HB2 GLU A 332 -16.334 -32.013 13.473 1.00 0.00 H new ATOM 0 HB3 GLU A 332 -15.680 -33.608 13.790 1.00 0.00 H new ATOM 0 HG2 GLU A 332 -16.807 -33.495 16.105 1.00 -0.11 H new ATOM 0 HG3 GLU A 332 -17.612 -32.036 15.563 1.00 -0.11 H new ATOM 4626 N ALA A 333 -12.545 -33.197 15.274 1.00 -0.73 N ATOM 4627 CA ALA A 333 -11.748 -34.271 15.901 1.00 0.36 C ATOM 4628 C ALA A 333 -10.438 -33.658 16.417 1.00 0.57 C ATOM 4629 O ALA A 333 -10.375 -32.475 16.749 1.00 -0.57 O ATOM 4630 CB ALA A 333 -11.610 -35.438 14.943 1.00 0.00 C ATOM 0 H ALA A 333 -12.031 -32.477 14.766 1.00 -0.73 H new ATOM 0 HA ALA A 333 -12.238 -34.703 16.774 1.00 0.36 H new ATOM 0 HB1 ALA A 333 -11.021 -36.226 15.412 1.00 0.00 H new ATOM 0 HB2 ALA A 333 -12.599 -35.823 14.694 1.00 0.00 H new ATOM 0 HB3 ALA A 333 -11.111 -35.105 14.033 1.00 0.00 H new ATOM 4636 N SER A 334 -9.384 -34.535 16.625 1.00 -0.73 N ATOM 4637 CA SER A 334 -8.167 -34.028 17.383 1.00 0.36 C ATOM 4638 C SER A 334 -8.504 -33.013 18.569 1.00 0.57 C ATOM 4639 O SER A 334 -9.457 -33.244 19.326 1.00 -0.57 O ATOM 4640 CB SER A 334 -7.188 -33.532 16.338 1.00 0.28 C ATOM 4641 OG SER A 334 -6.088 -32.766 16.814 1.00 -0.68 O ATOM 0 H SER A 334 -9.346 -35.505 16.313 1.00 -0.73 H new ATOM 0 HA SER A 334 -7.700 -34.832 17.952 1.00 0.36 H new ATOM 0 HB2 SER A 334 -6.796 -34.395 15.800 1.00 0.28 H new ATOM 0 HB3 SER A 334 -7.737 -32.929 15.615 1.00 0.28 H new ATOM 0 HG SER A 334 -5.660 -33.237 17.559 1.00 -0.68 H new ATOM 4647 N THR A 335 -7.667 -31.942 18.849 1.00 -0.73 N ATOM 4648 CA THR A 335 -8.104 -30.854 19.796 1.00 0.36 C ATOM 4649 C THR A 335 -6.892 -30.487 20.738 1.00 0.57 C ATOM 4650 O THR A 335 -6.822 -29.393 21.305 1.00 -0.57 O ATOM 4651 CB THR A 335 -8.515 -29.591 18.913 1.00 0.28 C ATOM 4652 OG1 THR A 335 -9.344 -29.878 17.762 1.00 -0.68 O ATOM 4653 CG2 THR A 335 -9.241 -28.509 19.707 1.00 0.00 C ATOM 0 H THR A 335 -6.736 -31.818 18.452 1.00 -0.73 H new ATOM 0 HA THR A 335 -8.946 -31.172 20.411 1.00 0.36 H new ATOM 0 HB THR A 335 -7.540 -29.245 18.570 1.00 0.28 H new ATOM 0 HG1 THR A 335 -9.636 -30.813 17.794 1.00 -0.68 H new ATOM 0 HG21 THR A 335 -9.492 -27.679 19.046 1.00 0.00 H new ATOM 0 HG22 THR A 335 -10.155 -28.922 20.133 1.00 0.00 H new ATOM 0 HG23 THR A 335 -8.596 -28.152 20.509 1.00 0.00 H new ATOM 4661 N THR A 336 -5.987 -31.485 21.103 1.00 -0.73 N ATOM 4662 CA THR A 336 -4.985 -31.235 22.228 1.00 0.36 C ATOM 4663 C THR A 336 -4.255 -32.576 22.432 1.00 0.57 C ATOM 4664 O THR A 336 -4.865 -33.608 22.697 1.00 -0.57 O ATOM 4665 CB THR A 336 -5.681 -30.850 23.619 1.00 0.28 C ATOM 4666 OG1 THR A 336 -5.893 -29.424 23.655 1.00 -0.68 O ATOM 4667 CG2 THR A 336 -4.783 -31.113 24.832 1.00 0.00 C ATOM 0 H THR A 336 -5.931 -32.406 20.669 1.00 -0.73 H new ATOM 0 HA THR A 336 -4.338 -30.402 21.951 1.00 0.36 H new ATOM 0 HB THR A 336 -6.589 -31.450 23.672 1.00 0.28 H new ATOM 0 HG1 THR A 336 -6.274 -29.128 22.802 1.00 -0.68 H new ATOM 0 HG21 THR A 336 -5.311 -30.832 25.743 1.00 0.00 H new ATOM 0 HG22 THR A 336 -4.527 -32.172 24.873 1.00 0.00 H new ATOM 0 HG23 THR A 336 -3.871 -30.522 24.744 1.00 0.00 H new ATOM 4675 N VAL A 337 -2.882 -32.563 22.242 1.00 -0.73 N ATOM 4676 CA VAL A 337 -2.075 -33.785 22.578 1.00 0.36 C ATOM 4677 C VAL A 337 -1.578 -34.697 21.403 1.00 0.57 C ATOM 4678 O VAL A 337 -0.621 -35.464 21.561 1.00 -0.57 O ATOM 4679 CB VAL A 337 -3.048 -34.805 23.343 1.00 0.00 C ATOM 4680 CG1 VAL A 337 -2.938 -36.248 22.830 1.00 0.00 C ATOM 4681 CG2 VAL A 337 -2.680 -34.802 24.838 1.00 0.00 C ATOM 0 H VAL A 337 -2.348 -31.772 21.882 1.00 -0.73 H new ATOM 0 HA VAL A 337 -1.213 -33.364 23.095 1.00 0.36 H new ATOM 0 HB VAL A 337 -4.069 -34.469 23.165 1.00 0.00 H new ATOM 0 HG11 VAL A 337 -3.622 -36.886 23.389 1.00 0.00 H new ATOM 0 HG12 VAL A 337 -3.197 -36.279 21.772 1.00 0.00 H new ATOM 0 HG13 VAL A 337 -1.917 -36.605 22.964 1.00 0.00 H new ATOM 0 HG21 VAL A 337 -3.332 -35.491 25.375 1.00 0.00 H new ATOM 0 HG22 VAL A 337 -1.643 -35.116 24.958 1.00 0.00 H new ATOM 0 HG23 VAL A 337 -2.804 -33.797 25.241 1.00 0.00 H new ATOM 4691 N SER A 338 -2.275 -34.877 20.245 1.00 -0.73 N ATOM 4692 CA SER A 338 -3.307 -33.946 19.638 1.00 0.36 C ATOM 4693 C SER A 338 -4.580 -34.808 19.437 1.00 0.57 C ATOM 4694 O SER A 338 -5.379 -34.521 18.543 1.00 -0.57 O ATOM 4695 CB SER A 338 -2.743 -33.473 18.280 1.00 0.28 C ATOM 4696 OG SER A 338 -2.866 -32.049 18.166 1.00 -0.68 O ATOM 0 H SER A 338 -2.136 -35.710 19.673 1.00 -0.73 H new ATOM 0 HA SER A 338 -3.534 -33.074 20.252 1.00 0.36 H new ATOM 0 HB2 SER A 338 -1.696 -33.764 18.191 1.00 0.28 H new ATOM 0 HB3 SER A 338 -3.280 -33.959 17.465 1.00 0.28 H new ATOM 0 HG SER A 338 -2.505 -31.757 17.303 1.00 -0.68 H new ATOM 4702 N LYS A 339 -4.869 -35.822 20.344 1.00 -0.73 N ATOM 4703 CA LYS A 339 -6.151 -36.707 20.023 1.00 0.36 C ATOM 4704 C LYS A 339 -5.850 -38.075 20.655 1.00 0.57 C ATOM 4705 O LYS A 339 -4.722 -38.569 20.603 1.00 -0.57 O ATOM 4706 CB LYS A 339 -6.291 -37.017 18.450 1.00 0.00 C ATOM 4707 CG LYS A 339 -5.103 -37.747 17.817 1.00 0.00 C ATOM 4708 CD LYS A 339 -5.479 -38.571 16.572 1.00 0.00 C ATOM 4709 CE LYS A 339 -5.811 -37.801 15.290 1.00 0.50 C ATOM 4710 NZ LYS A 339 -7.166 -37.253 15.269 1.00 -0.85 N ATOM 0 H LYS A 339 -4.346 -36.054 21.188 1.00 -0.73 H new ATOM 0 HA LYS A 339 -7.044 -36.193 20.379 1.00 0.36 H new ATOM 0 HB2 LYS A 339 -7.189 -37.615 18.293 1.00 0.00 H new ATOM 0 HB3 LYS A 339 -6.440 -36.075 17.923 1.00 0.00 H new ATOM 0 HG2 LYS A 339 -4.342 -37.016 17.543 1.00 0.00 H new ATOM 0 HG3 LYS A 339 -4.656 -38.409 18.559 1.00 0.00 H new ATOM 0 HD2 LYS A 339 -4.653 -39.248 16.354 1.00 0.00 H new ATOM 0 HD3 LYS A 339 -6.340 -39.190 16.825 1.00 0.00 H new ATOM 0 HE2 LYS A 339 -5.097 -36.986 15.171 1.00 0.50 H new ATOM 0 HE3 LYS A 339 -5.683 -38.464 14.435 1.00 0.50 H new ATOM 4724 N THR A 340 -6.906 -38.782 21.162 1.00 -0.73 N ATOM 4725 CA THR A 340 -6.737 -40.296 21.367 1.00 0.36 C ATOM 4726 C THR A 340 -7.697 -40.979 20.358 1.00 0.57 C ATOM 4727 O THR A 340 -7.845 -42.197 20.282 1.00 -0.57 O ATOM 4728 CB THR A 340 -7.151 -40.664 22.813 1.00 0.28 C ATOM 4729 OG1 THR A 340 -8.185 -39.826 23.349 1.00 -0.68 O ATOM 4730 CG2 THR A 340 -5.956 -40.526 23.752 1.00 0.00 C ATOM 0 H THR A 340 -7.813 -38.393 21.422 1.00 -0.73 H new ATOM 0 HA THR A 340 -5.706 -40.614 21.212 1.00 0.36 H new ATOM 0 HB THR A 340 -7.521 -41.687 22.751 1.00 0.28 H new ATOM 0 HG1 THR A 340 -8.845 -39.633 22.650 1.00 -0.68 H new ATOM 0 HG21 THR A 340 -6.258 -40.787 24.766 1.00 0.00 H new ATOM 0 HG22 THR A 340 -5.159 -41.195 23.427 1.00 0.00 H new ATOM 0 HG23 THR A 340 -5.596 -39.497 23.734 1.00 0.00 H new ATOM 4738 N GLU A 341 -8.319 -40.103 19.492 1.00 -0.73 N ATOM 4739 CA GLU A 341 -9.616 -40.515 18.740 1.00 0.36 C ATOM 4740 C GLU A 341 -9.715 -39.230 17.902 1.00 0.57 C ATOM 4741 O GLU A 341 -8.773 -38.444 17.724 1.00 -0.57 O ATOM 4742 CB GLU A 341 -10.827 -40.731 19.786 1.00 0.00 C ATOM 4743 CG GLU A 341 -11.503 -39.441 20.283 1.00 -0.11 C ATOM 4744 CD GLU A 341 -10.601 -38.318 20.751 1.00 0.91 C ATOM 4745 OE1 GLU A 341 -9.607 -38.608 21.475 1.00 -0.90 O ATOM 4746 OE2 GLU A 341 -10.905 -37.158 20.340 1.00 -0.90 O ATOM 0 H GLU A 341 -7.988 -39.160 19.290 1.00 -0.73 H new ATOM 0 HA GLU A 341 -9.635 -41.447 18.175 1.00 0.36 H new ATOM 0 HB2 GLU A 341 -11.583 -41.360 19.317 1.00 0.00 H new ATOM 0 HB3 GLU A 341 -10.447 -41.278 20.649 1.00 0.00 H new ATOM 0 HG2 GLU A 341 -12.129 -39.057 19.478 1.00 -0.11 H new ATOM 0 HG3 GLU A 341 -12.168 -39.704 21.106 1.00 -0.11 H new ATOM 4753 N THR A 342 -10.849 -38.916 17.247 1.00 -0.73 N ATOM 4754 CA THR A 342 -11.425 -39.742 16.168 1.00 0.36 C ATOM 4755 C THR A 342 -10.775 -39.362 14.808 1.00 0.57 C ATOM 4756 O THR A 342 -11.116 -39.873 13.745 1.00 -0.57 O ATOM 4757 CB THR A 342 -12.943 -39.489 16.114 1.00 0.28 C ATOM 4758 OG1 THR A 342 -13.513 -39.861 17.378 1.00 -0.68 O ATOM 4759 CG2 THR A 342 -13.697 -40.284 15.059 1.00 0.00 C ATOM 0 H THR A 342 -11.394 -38.079 17.452 1.00 -0.73 H new ATOM 0 HA THR A 342 -11.232 -40.797 16.363 1.00 0.36 H new ATOM 0 HB THR A 342 -13.047 -38.433 15.866 1.00 0.28 H new ATOM 0 HG1 THR A 342 -14.480 -39.704 17.360 1.00 -0.68 H new ATOM 0 HG21 THR A 342 -14.757 -40.034 15.103 1.00 0.00 H new ATOM 0 HG22 THR A 342 -13.307 -40.039 14.071 1.00 0.00 H new ATOM 0 HG23 THR A 342 -13.568 -41.350 15.245 1.00 0.00 H new ATOM 4767 N SER A 343 -9.745 -38.455 14.878 1.00 -0.73 N ATOM 4768 CA SER A 343 -9.111 -37.796 13.687 1.00 0.36 C ATOM 4769 C SER A 343 -7.758 -37.397 14.385 1.00 0.57 C ATOM 4770 O SER A 343 -7.724 -36.494 15.226 1.00 -0.57 O ATOM 4771 CB SER A 343 -9.949 -36.622 13.143 1.00 0.28 C ATOM 4772 OG SER A 343 -10.048 -35.520 14.040 1.00 -0.68 O ATOM 0 H SER A 343 -9.333 -38.162 15.764 1.00 -0.73 H new ATOM 0 HA SER A 343 -9.002 -38.388 12.779 1.00 0.36 H new ATOM 0 HB2 SER A 343 -9.510 -36.278 12.207 1.00 0.28 H new ATOM 0 HB3 SER A 343 -10.952 -36.981 12.911 1.00 0.28 H new ATOM 0 HG SER A 343 -9.305 -34.901 13.881 1.00 -0.68 H new ATOM 4778 N GLN A 344 -6.709 -38.308 14.292 1.00 -0.73 N ATOM 4779 CA GLN A 344 -5.953 -38.776 15.606 1.00 0.36 C ATOM 4780 C GLN A 344 -4.452 -38.852 15.199 1.00 0.57 C ATOM 4781 O GLN A 344 -4.022 -38.506 14.100 1.00 -0.57 O ATOM 4782 CB GLN A 344 -6.551 -40.237 15.945 1.00 0.00 C ATOM 4783 CG GLN A 344 -6.161 -40.828 17.301 1.00 0.06 C ATOM 4784 CD GLN A 344 -5.149 -41.943 17.235 1.00 0.57 C ATOM 4785 OE1 GLN A 344 -4.275 -41.997 16.378 1.00 -0.57 O ATOM 4786 NE2 GLN A 344 -5.205 -42.830 18.265 1.00 -0.80 N ATOM 0 H GLN A 344 -6.368 -38.719 13.423 1.00 -0.73 H new ATOM 0 HA GLN A 344 -6.069 -38.126 16.474 1.00 0.36 H new ATOM 0 HB2 GLN A 344 -7.638 -40.182 15.895 1.00 0.00 H new ATOM 0 HB3 GLN A 344 -6.231 -40.928 15.165 1.00 0.00 H new ATOM 0 HG2 GLN A 344 -5.762 -40.031 17.928 1.00 0.06 H new ATOM 0 HG3 GLN A 344 -7.060 -41.200 17.792 1.00 0.06 H new ATOM 0 HE21 GLN A 344 -5.946 -42.756 18.962 1.00 -0.80 H new ATOM 0 HE22 GLN A 344 -4.506 -43.569 18.341 1.00 -0.80 H new ATOM 4795 N VAL A 345 -3.562 -39.211 16.194 1.00 -0.73 N ATOM 4796 CA VAL A 345 -3.040 -38.145 17.107 1.00 0.36 C ATOM 4797 C VAL A 345 -2.093 -37.140 16.357 1.00 0.57 C ATOM 4798 O VAL A 345 -1.890 -36.024 16.846 1.00 -0.57 O ATOM 4799 CB VAL A 345 -1.991 -38.892 18.154 1.00 0.00 C ATOM 4800 CG1 VAL A 345 -1.647 -37.993 19.330 1.00 0.00 C ATOM 4801 CG2 VAL A 345 -2.550 -40.205 18.717 1.00 0.00 C ATOM 0 H VAL A 345 -3.219 -40.155 16.370 1.00 -0.73 H new ATOM 0 HA VAL A 345 -3.898 -37.639 17.549 1.00 0.36 H new ATOM 0 HB VAL A 345 -1.100 -39.107 17.564 1.00 0.00 H new ATOM 0 HG11 VAL A 345 -0.958 -38.513 19.996 1.00 0.00 H new ATOM 0 HG12 VAL A 345 -1.178 -37.079 18.965 1.00 0.00 H new ATOM 0 HG13 VAL A 345 -2.557 -37.741 19.874 1.00 0.00 H new ATOM 0 HG21 VAL A 345 -1.822 -40.649 19.395 1.00 0.00 H new ATOM 0 HG22 VAL A 345 -3.475 -40.004 19.258 1.00 0.00 H new ATOM 0 HG23 VAL A 345 -2.752 -40.895 17.898 1.00 0.00 H new ATOM 4811 N ALA A 346 -1.392 -37.599 15.256 1.00 -0.73 N ATOM 4812 CA ALA A 346 -0.669 -36.690 14.360 1.00 0.36 C ATOM 4813 C ALA A 346 -1.720 -36.242 13.322 1.00 0.57 C ATOM 4814 O ALA A 346 -1.898 -36.813 12.247 1.00 -0.57 O ATOM 4815 CB ALA A 346 0.486 -37.417 13.692 1.00 0.00 C ATOM 0 H ALA A 346 -1.329 -38.583 14.994 1.00 -0.73 H new ATOM 0 HA ALA A 346 -0.234 -35.841 14.887 1.00 0.36 H new ATOM 0 HB1 ALA A 346 1.014 -36.731 13.030 1.00 0.00 H new ATOM 0 HB2 ALA A 346 1.173 -37.786 14.454 1.00 0.00 H new ATOM 0 HB3 ALA A 346 0.101 -38.256 13.113 1.00 0.00 H new ATOM 4821 N PRO A 347 -2.605 -35.297 13.797 1.00 -0.66 N ATOM 4822 CA PRO A 347 -4.041 -35.327 13.369 1.00 0.36 C ATOM 4823 C PRO A 347 -4.182 -34.562 12.046 1.00 0.57 C ATOM 4824 O PRO A 347 -3.269 -33.858 11.606 1.00 -0.57 O ATOM 4825 CB PRO A 347 -4.644 -34.425 14.447 1.00 0.00 C ATOM 4826 CG PRO A 347 -3.546 -33.330 14.641 1.00 0.00 C ATOM 4827 CD PRO A 347 -2.161 -33.981 14.393 1.00 0.30 C ATOM 0 HA PRO A 347 -4.466 -36.324 13.254 1.00 0.36 H new ATOM 0 HB2 PRO A 347 -5.593 -33.994 14.128 1.00 0.00 H new ATOM 0 HB3 PRO A 347 -4.837 -34.972 15.370 1.00 0.00 H new ATOM 0 HG2 PRO A 347 -3.707 -32.504 13.948 1.00 0.00 H new ATOM 0 HG3 PRO A 347 -3.596 -32.916 15.648 1.00 0.00 H new ATOM 0 HD2 PRO A 347 -1.542 -33.400 13.710 1.00 0.30 H new ATOM 0 HD3 PRO A 347 -1.588 -34.109 15.312 1.00 0.30 H new ATOM 4835 N ALA A 348 -5.381 -34.508 11.403 1.00 -0.73 N ATOM 4836 CA ALA A 348 -6.391 -35.536 11.449 1.00 0.30 C ATOM 4837 CB ALA A 348 -5.948 -36.769 10.677 1.00 0.00 C ATOM 0 H ALA A 348 -5.654 -33.711 10.827 1.00 -0.73 H new ATOM 0 HB1 ALA A 348 -6.727 -37.529 10.727 1.00 0.00 H new ATOM 0 HB2 ALA A 348 -5.769 -36.501 9.636 1.00 0.00 H new ATOM 0 HB3 ALA A 348 -5.030 -37.161 11.114 1.00 0.00 H new TER 4843 ALA A 348 HETATM 4844 C1 RET A 400 9.341 -7.884 0.493 1.00 0.14 C HETATM 4845 C2 RET A 400 9.385 -9.083 -0.490 1.00 0.00 C HETATM 4846 C3 RET A 400 10.786 -9.302 -1.038 1.00 0.00 C HETATM 4847 C4 RET A 400 11.230 -8.080 -1.831 1.00 0.14 C HETATM 4848 C5 RET A 400 10.928 -6.764 -1.149 1.00 -0.28 C HETATM 4849 C6 RET A 400 10.109 -6.671 -0.072 1.00 -0.14 C HETATM 4850 C7 RET A 400 9.928 -5.391 0.607 1.00 -0.15 C HETATM 4851 C8 RET A 400 9.026 -4.474 0.223 1.00 -0.15 C HETATM 4852 C9 RET A 400 8.824 -3.139 0.783 1.00 -0.14 C HETATM 4853 C10 RET A 400 7.652 -2.521 0.532 1.00 -0.15 C HETATM 4854 C11 RET A 400 7.270 -1.175 0.898 1.00 -0.15 C HETATM 4855 C12 RET A 400 6.033 -0.666 1.047 1.00 -0.15 C HETATM 4856 C13 RET A 400 4.715 -1.311 1.046 1.00 -0.14 C HETATM 4857 C14 RET A 400 3.624 -0.522 0.983 1.00 -0.14 C HETATM 4858 C15 RET A 400 2.239 -1.030 1.078 1.00 0.33 C HETATM 4859 C16 RET A 400 9.966 -8.327 1.825 1.00 0.00 C HETATM 4860 C17 RET A 400 7.850 -7.555 0.730 1.00 0.00 C HETATM 4861 C18 RET A 400 11.649 -5.602 -1.776 1.00 0.14 C HETATM 4862 C19 RET A 400 9.959 -2.534 1.567 1.00 0.14 C HETATM 4863 C20 RET A 400 4.632 -2.797 1.254 1.00 0.14 C HETATM 0 H203 RET A 400 5.186 -3.306 0.466 1.00 0.14 H new HETATM 0 H202 RET A 400 5.061 -3.053 2.223 1.00 0.14 H new HETATM 0 H201 RET A 400 3.589 -3.111 1.225 1.00 0.14 H new HETATM 0 H193 RET A 400 10.192 -3.171 2.420 1.00 0.14 H new HETATM 0 H192 RET A 400 10.837 -2.448 0.928 1.00 0.14 H new HETATM 0 H191 RET A 400 9.670 -1.545 1.922 1.00 0.14 H new HETATM 0 H183 RET A 400 12.725 -5.767 -1.718 1.00 0.14 H new HETATM 0 H182 RET A 400 11.352 -5.510 -2.821 1.00 0.14 H new HETATM 0 H181 RET A 400 11.393 -4.685 -1.244 1.00 0.14 H new HETATM 0 H173 RET A 400 7.380 -7.295 -0.218 1.00 0.00 H new HETATM 0 H172 RET A 400 7.349 -8.424 1.157 1.00 0.00 H new HETATM 0 H171 RET A 400 7.768 -6.714 1.418 1.00 0.00 H new HETATM 0 H8 RET A 400 8.370 -4.757 -0.600 1.00 -0.15 H new HETATM 0 H7 RET A 400 10.557 -5.169 1.469 1.00 -0.15 H new HETATM 0 H42 RET A 400 12.303 -8.147 -2.012 1.00 0.14 H new HETATM 0 H41 RET A 400 10.741 -8.094 -2.805 1.00 0.14 H new HETATM 0 H32 RET A 400 11.481 -9.487 -0.219 1.00 0.00 H new HETATM 0 H31 RET A 400 10.802 -10.186 -1.676 1.00 0.00 H new HETATM 0 H22 RET A 400 9.047 -9.985 0.020 1.00 0.00 H new HETATM 0 H21 RET A 400 8.694 -8.905 -1.314 1.00 0.00 H new HETATM 0 H14 RET A 400 3.771 0.550 0.855 1.00 -0.14 H new HETATM 0 H12 RET A 400 6.005 0.414 1.194 1.00 -0.15 H new HETATM 0 H11 RET A 400 8.092 -0.482 1.077 1.00 -0.15 H new HETATM 0 H10 RET A 400 6.906 -3.103 -0.009 1.00 -0.15 H new CONECT 1145 2313 CONECT 1345 4859 CONECT 1346 4844 4859 CONECT 1347 4845 CONECT 2313 1145 CONECT 4059 4858 CONECT 4844 1346 4845 4849 4859 CONECT 4844 4860 CONECT 4845 1347 4844 4846 4864 CONECT 4845 4865 CONECT 4846 4845 4847 4866 4867 CONECT 4847 4846 4848 4868 4869 CONECT 4848 4847 4849 4861 CONECT 4849 4844 4848 4850 CONECT 4850 4849 4851 4870 CONECT 4851 4850 4852 4871 CONECT 4852 4851 4853 4862 CONECT 4853 4852 4854 4872 CONECT 4854 4853 4855 4873 CONECT 4855 4854 4856 4874 CONECT 4856 4855 4857 4863 CONECT 4857 4856 4858 4875 CONECT 4858 4059 4857 4876 CONECT 4859 1345 1346 4844 4877 CONECT 4859 4878 4879 CONECT 4860 4844 4880 4881 4882 CONECT 4861 4848 4883 4884 4885 CONECT 4862 4852 4886 4887 4888 CONECT 4863 4856 4889 4890 4891 CONECT 4864 4845 CONECT 4865 4845 CONECT 4866 4846 CONECT 4867 4846 CONECT 4868 4847 CONECT 4869 4847 CONECT 4870 4850 CONECT 4871 4851 CONECT 4872 4853 CONECT 4873 4854 CONECT 4874 4855 CONECT 4875 4857 CONECT 4876 4858 CONECT 4877 4859 CONECT 4878 4859 CONECT 4879 4859 CONECT 4880 4860 CONECT 4881 4860 CONECT 4882 4860 CONECT 4883 4861 CONECT 4884 4861 CONECT 4885 4861 CONECT 4886 4862 CONECT 4887 4862 CONECT 4888 4862 CONECT 4889 4863 CONECT 4890 4863 CONECT 4891 4863 END