USER MOD reduce.3.24.130724 H: found=0, std=0, add=1507, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1494 hydrogens (0 hets) HEADER UNKNOWN FUNCTION 31-JAN-07 2JNQ TITLE SOLUTION STRUCTURE OF A KLBA INTEIN PRECURSOR FROM TITLE 2 METHANOCOCCUS JANNASCHII COMPND MOL_ID: 1; COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN MJ0781; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: MJA KLBA INTEIN, RESIDUES 1-180; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; SOURCE 3 ORGANISM_TAXID: 2190; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 7 EXPRESSION_SYSTEM_PLASMID: PMJAKLBA KEYWDS PROTEIN, UNKNOWN FUNCTION EXPDTA SOLUTION NMR AUTHOR M.A.JOHNSON,M.W.SOUTHWORTH,T.HERRMANN,L.BRACE,F.B.PERLER, AUTHOR 2 K.A.WUTHRICH REVDAT 2 24-FEB-09 2JNQ 1 VERSN REVDAT 1 10-JUL-07 2JNQ 0 JRNL AUTH M.A.JOHNSON,M.W.SOUTHWORTH,T.HERRMANN,L.BRACE, JRNL AUTH 2 F.B.PERLER,K.WUTHRICH JRNL TITL NMR STRUCTURE OF A KLBA INTEIN PRECURSOR FROM JRNL TITL 2 METHANOCOCCUS JANNASCHII JRNL REF PROTEIN SCI. V. 16 1316 2007 JRNL REFN ISSN 0961-8368 JRNL PMID 17586768 JRNL DOI 10.1110/PS.072816707 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : OPAL 1.2 REMARK 3 AUTHORS : LUGINBUHL, GUNTERT, BILLETER AND WUTHRICH REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2JNQ COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 05-FEB-07. REMARK 100 THE RCSB ID CODE IS RCSB100062. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 308 REMARK 210 PH : 5.3 REMARK 210 IONIC STRENGTH : 0.12 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 2 MM [U-98% 15N] KLBA INTEIN REMARK 210 PRECURSOR, 20 MM SODIUM REMARK 210 PHOSPHATE, 100 MM SODIUM REMARK 210 CHLORIDE, 2 MM SODIUM AZIDE, REMARK 210 90% H2O, 10% D2O; 2 MM [U-98% REMARK 210 13C, U-98% 15N] KLBA INTEIN REMARK 210 PRECURSOR, 20 MM SODIUM REMARK 210 PHOSPHATE, 100 MM SODIUM REMARK 210 CHLORIDE, 2 MM SODIUM AZIDE, REMARK 210 90% H2O, 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D 1H-15N NOESY, 3D 1H-13C REMARK 210 NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ REMARK 210 SPECTROMETER MODEL : DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : ATNOS/CANDID 1.2, CYANA 1.0.3 REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : TARGET FUNCTION REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 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 ARG A 95 CD - NE - CZ ANGL. DEV. = 8.7 DEGREES REMARK 500 ARG A 95 NE - CZ - NH1 ANGL. DEV. = 3.5 DEGREES 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 HIS A 5 -174.21 60.96 REMARK 500 ASP A 6 84.52 58.44 REMARK 500 TYR A 16 76.89 47.60 REMARK 500 SER A 18 0.24 -61.45 REMARK 500 ILE A 22 66.99 35.74 REMARK 500 TYR A 36 43.10 -90.24 REMARK 500 ILE A 40 95.77 -59.44 REMARK 500 ASN A 45 2.63 -68.86 REMARK 500 PHE A 47 -100.21 -86.54 REMARK 500 ASN A 56 -6.35 61.57 REMARK 500 SER A 61 -166.47 -107.47 REMARK 500 SER A 66 10.40 -149.04 REMARK 500 ASN A 93 20.11 -72.34 REMARK 500 ARG A 94 27.14 49.11 REMARK 500 ASP A 102 39.37 -91.69 REMARK 500 LYS A 109 78.13 -109.20 REMARK 500 VAL A 123 -1.44 -58.96 REMARK 500 LYS A 131 -145.60 -125.20 REMARK 500 ASN A 132 -82.04 -59.94 REMARK 500 ILE A 141 -88.55 29.34 REMARK 500 ASN A 149 24.32 -146.79 REMARK 500 ASN A 168 -85.13 68.33 REMARK 500 SER A 176 -149.68 -149.25 REMARK 500 SER A 177 -106.32 -149.39 REMARK 500 THR A 179 -172.03 68.23 REMARK 500 LEU A 180 81.65 -67.64 REMARK 500 HIS A 183 92.68 31.73 REMARK 500 HIS A 185 -128.22 -128.77 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 ASP A 71 LYS A 72 140.96 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 15061 RELATED DB: BMRB REMARK 900 RELATED ID: 2JMZ RELATED DB: PDB REMARK 900 ENSEMBLE OF CONFORMERS DBREF 2JNQ A 1 180 UNP Q58191 Y781_METJA 398 577 SEQADV 2JNQ ALA A 175 UNP Q58191 ASN 572 ENGINEERED SEQADV 2JNQ SER A 176 UNP Q58191 CYS 573 ENGINEERED SEQADV 2JNQ HIS A 181 UNP Q58191 EXPRESSION TAG SEQADV 2JNQ HIS A 182 UNP Q58191 EXPRESSION TAG SEQADV 2JNQ HIS A 183 UNP Q58191 EXPRESSION TAG SEQADV 2JNQ HIS A 184 UNP Q58191 EXPRESSION TAG SEQADV 2JNQ HIS A 185 UNP Q58191 EXPRESSION TAG SEQADV 2JNQ HIS A 186 UNP Q58191 EXPRESSION TAG SEQRES 1 A 186 MET ASN THR GLY HIS ASP GLY ALA LEU ALA TYR ASP GLU SEQRES 2 A 186 PRO ILE TYR LEU SER ASP GLY ASN ILE ILE ASN ILE GLY SEQRES 3 A 186 GLU PHE VAL ASP LYS PHE PHE LYS LYS TYR LYS ASN SER SEQRES 4 A 186 ILE LYS LYS GLU ASP ASN GLY PHE GLY TRP ILE ASP ILE SEQRES 5 A 186 GLY ASN GLU ASN ILE TYR ILE LYS SER PHE ASN LYS LEU SEQRES 6 A 186 SER LEU ILE ILE GLU ASP LYS ARG ILE LEU ARG VAL TRP SEQRES 7 A 186 ARG LYS LYS TYR SER GLY LYS LEU ILE LYS ILE THR THR SEQRES 8 A 186 LYS ASN ARG ARG GLU ILE THR LEU THR HIS ASP HIS PRO SEQRES 9 A 186 VAL TYR ILE SER LYS THR GLY GLU VAL LEU GLU ILE ASN SEQRES 10 A 186 ALA GLU MET VAL LYS VAL GLY ASP TYR ILE TYR ILE PRO SEQRES 11 A 186 LYS ASN ASN THR ILE ASN LEU ASP GLU VAL ILE LYS VAL SEQRES 12 A 186 GLU THR VAL ASP TYR ASN GLY HIS ILE TYR ASP LEU THR SEQRES 13 A 186 VAL GLU ASP ASN HIS THR TYR ILE ALA GLY LYS ASN GLU SEQRES 14 A 186 GLY PHE ALA VAL SER ALA SER SER GLY THR LEU HIS HIS SEQRES 15 A 186 HIS HIS HIS HIS HELIX 1 1 ASN A 24 TYR A 36 1 13 HELIX 2 2 GLU A 119 VAL A 121 5 3 SHEET 1 A 4 LEU A 9 ALA A 10 0 SHEET 2 A 4 ILE A 152 THR A 156 -1 O TYR A 153 N LEU A 9 SHEET 3 A 4 ARG A 76 LYS A 80 -1 N TRP A 78 O ASP A 154 SHEET 4 A 4 TRP A 49 ASP A 51 -1 N ILE A 50 O VAL A 77 SHEET 1 B 2 TYR A 58 LYS A 60 0 SHEET 2 B 2 ASP A 71 ARG A 73 -1 O LYS A 72 N ILE A 59 SHEET 1 C 2 GLY A 84 ILE A 87 0 SHEET 2 C 2 THR A 145 TYR A 148 -1 O TYR A 148 N GLY A 84 SHEET 1 D 2 PRO A 104 LYS A 109 0 SHEET 2 D 2 GLU A 112 ASN A 117 -1 O GLU A 112 N LYS A 109 SHEET 1 E 2 TYR A 126 PRO A 130 0 SHEET 2 E 2 ILE A 135 GLU A 139 -1 O ASN A 136 N ILE A 129 SHEET 1 F 2 THR A 162 ALA A 165 0 SHEET 2 F 2 PHE A 171 SER A 174 -1 O PHE A 171 N ALA A 165 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 161 HIS :FLIP no HD1:sc= -1.18 F(o=-2.7,f=-0.59) USER MOD Set 1.2: A 177 SER OG : rot -144:sc= 0.77 USER MOD Set 1.3: A 183 HIS : no HE2:sc= -0.181 K(o=-0.59,f=-6) USER MOD Set 2.1: A 160 ASN :FLIP amide:sc= 0.158 F(o=-0.1!,f=1.4) USER MOD Set 2.2: A 162 THR OG1 : rot 108:sc= 1.22 USER MOD Set 3.1: A 132 ASN : amide:sc= -1.48! C(o=-1!,f=-4.2!) USER MOD Set 3.2: A 133 ASN : amide:sc= 0.47 K(o=-1,f=-4.9) USER MOD Set 4.1: A 106 TYR OH : rot 30:sc= 0 USER MOD Set 4.2: A 174 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 100 THR OG1 : rot 160:sc= 0.485 USER MOD Set 5.2: A 103 HIS : no HE2:sc= -2.18! K(o=-1.7!,f=-4.3) USER MOD Set 6.1: A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 83 SER OG : rot 180:sc= 0 USER MOD Set 7.1: A 63 ASN : amide:sc= 0.946 K(o=2.1,f=-8.3!) USER MOD Set 7.2: A 72 LYS NZ :NH3+ 177:sc= 1.12 (180deg=0) USER MOD Set 8.1: A 11 TYR OH : rot 180:sc= 0 USER MOD Set 8.2: A 24 ASN : amide:sc= 0.503 K(o=0.5,f=-0.8) USER MOD Single : A 1 MET CE :methyl -173:sc= 0 (180deg=-0.0518) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0218) USER MOD Single : A 2 ASN : amide:sc= -0.105 K(o=-0.11,f=-1.1) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.553 X(o=-0.55,f=-0.54) USER MOD Single : A 16 TYR OH : rot -25:sc= 0.858 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 150:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 ASN : amide:sc= -0.161 K(o=-0.16,f=-4.6!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0859) USER MOD Single : A 45 ASN : amide:sc= 0.808 K(o=0.81,f=0) USER MOD Single : A 54 ASN : amide:sc= 0.28 X(o=0.28,f=0) USER MOD Single : A 56 ASN : amide:sc= 0.701 K(o=0.7,f=0) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 14:sc= 0.362 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 163:sc= 1.27 (180deg=0.43) USER MOD Single : A 90 THR OG1 : rot -130:sc= 0 USER MOD Single : A 91 THR OG1 : rot 84:sc= 1.12 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN :FLIP amide:sc= -0.0251 F(o=-1.4!,f=-0.025) USER MOD Single : A 98 THR OG1 : rot 72:sc= 0.678 USER MOD Single : A 101 HIS : no HD1:sc= -0.29 X(o=-0.29,f=-0.28) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= -1.89! C(o=-1.9!,f=-3.8!) USER MOD Single : A 120 MET CE :methyl 167:sc= 0 (180deg=-0.333) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 THR OG1 : rot 180:sc=-0.00597 USER MOD Single : A 136 ASN : amide:sc= -0.168! X(o=-0.17!,f=-0.0033) USER MOD Single : A 142 LYS NZ :NH3+ -117:sc= 0.143 (180deg=-1.21!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 60:sc= 1.25 USER MOD Single : A 149 ASN :FLIP amide:sc= -0.35 F(o=-0.95,f=-0.35) USER MOD Single : A 151 HIS : no HD1:sc= -0.784 X(o=-0.78,f=-0.5) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 THR OG1 : rot -160:sc= 0.464 USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 LYS NZ :NH3+ -163:sc= 0.441 (180deg=0.265) USER MOD Single : A 168 ASN : amide:sc= 0.974 K(o=0.97,f=-0.026) USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD Single : A 179 THR OG1 : rot -44:sc= 0.00289 USER MOD Single : A 181 HIS : no HD1:sc= -0.946 X(o=-0.95,f=-0.48) USER MOD Single : A 182 HIS : no HD1:sc= -0.0114 X(o=-0.011,f=-0.12) USER MOD Single : A 184 HIS : no HD1:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 185 HIS : no HE2:sc= 0.059 K(o=0.059,f=-3!) USER MOD Single : A 186 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.526 1.252 21.921 1.00 43.02 N ATOM 2 CA MET A 1 1.333 0.195 20.916 1.00 25.24 C ATOM 3 C MET A 1 -0.162 0.010 20.774 1.00 72.43 C ATOM 4 O MET A 1 -0.824 -0.244 21.777 1.00 42.01 O ATOM 5 CB MET A 1 2.026 -1.113 21.331 1.00 63.33 C ATOM 6 CG MET A 1 3.529 -1.035 21.042 1.00 32.14 C ATOM 7 SD MET A 1 4.589 -2.340 21.714 1.00 41.32 S ATOM 8 CE MET A 1 4.487 -1.982 23.487 1.00 41.52 C ATOM 0 H1 MET A 1 2.532 1.515 21.960 1.00 43.02 H new ATOM 0 H2 MET A 1 0.960 2.085 21.662 1.00 43.02 H new ATOM 0 H3 MET A 1 1.223 0.904 22.853 1.00 43.02 H new ATOM 0 HA MET A 1 1.783 0.477 19.964 1.00 25.24 H new ATOM 0 HB2 MET A 1 1.862 -1.298 22.393 1.00 63.33 H new ATOM 0 HB3 MET A 1 1.588 -1.952 20.790 1.00 63.33 H new ATOM 0 HG2 MET A 1 3.661 -1.020 19.960 1.00 32.14 H new ATOM 0 HG3 MET A 1 3.893 -0.080 21.421 1.00 32.14 H new ATOM 0 HE1 MET A 1 5.185 -2.621 24.028 1.00 41.52 H new ATOM 0 HE2 MET A 1 4.742 -0.937 23.662 1.00 41.52 H new ATOM 0 HE3 MET A 1 3.473 -2.172 23.839 1.00 41.52 H new ATOM 18 N ASN A 2 -0.710 0.218 19.576 1.00 0.11 N ATOM 19 CA ASN A 2 -2.152 0.172 19.347 1.00 13.24 C ATOM 20 C ASN A 2 -2.622 -1.268 19.141 1.00 11.24 C ATOM 21 O ASN A 2 -1.820 -2.205 19.114 1.00 73.12 O ATOM 22 CB ASN A 2 -2.527 1.106 18.172 1.00 33.15 C ATOM 23 CG ASN A 2 -3.136 2.422 18.649 1.00 14.32 C ATOM 24 OD1 ASN A 2 -2.962 2.844 19.788 1.00 13.31 O ATOM 25 ND2 ASN A 2 -3.879 3.111 17.801 1.00 2.52 N ATOM 0 H ASN A 2 -0.166 0.423 18.738 1.00 0.11 H new ATOM 0 HA ASN A 2 -2.675 0.539 20.230 1.00 13.24 H new ATOM 0 HB2 ASN A 2 -1.637 1.314 17.578 1.00 33.15 H new ATOM 0 HB3 ASN A 2 -3.235 0.597 17.518 1.00 33.15 H new ATOM 0 HD21 ASN A 2 -4.305 3.990 18.094 1.00 2.52 H new ATOM 0 HD22 ASN A 2 -4.026 2.764 16.853 1.00 2.52 H new ATOM 32 N THR A 3 -3.937 -1.461 19.052 1.00 20.35 N ATOM 33 CA THR A 3 -4.560 -2.724 18.668 1.00 0.22 C ATOM 34 C THR A 3 -4.533 -2.835 17.139 1.00 71.33 C ATOM 35 O THR A 3 -3.865 -3.716 16.590 1.00 14.35 O ATOM 36 CB THR A 3 -5.992 -2.762 19.229 1.00 21.34 C ATOM 37 OG1 THR A 3 -5.985 -2.375 20.583 1.00 2.33 O ATOM 38 CG2 THR A 3 -6.617 -4.153 19.152 1.00 43.42 C ATOM 0 H THR A 3 -4.614 -0.724 19.250 1.00 20.35 H new ATOM 0 HA THR A 3 -4.020 -3.577 19.078 1.00 0.22 H new ATOM 0 HB THR A 3 -6.581 -2.078 18.618 1.00 21.34 H new ATOM 0 HG1 THR A 3 -6.899 -2.399 20.935 1.00 2.33 H new ATOM 0 HG21 THR A 3 -7.627 -4.121 19.561 1.00 43.42 H new ATOM 0 HG22 THR A 3 -6.657 -4.477 18.112 1.00 43.42 H new ATOM 0 HG23 THR A 3 -6.014 -4.855 19.728 1.00 43.42 H new ATOM 46 N GLY A 4 -5.225 -1.912 16.455 1.00 22.24 N ATOM 47 CA GLY A 4 -5.181 -1.746 15.018 1.00 65.24 C ATOM 48 C GLY A 4 -3.858 -1.100 14.615 1.00 63.41 C ATOM 49 O GLY A 4 -2.831 -1.266 15.281 1.00 40.51 O ATOM 0 H GLY A 4 -5.847 -1.246 16.913 1.00 22.24 H new ATOM 0 HA2 GLY A 4 -5.289 -2.713 14.527 1.00 65.24 H new ATOM 0 HA3 GLY A 4 -6.015 -1.126 14.688 1.00 65.24 H new ATOM 53 N HIS A 5 -3.896 -0.350 13.514 1.00 24.45 N ATOM 54 CA HIS A 5 -2.716 0.128 12.792 1.00 25.54 C ATOM 55 C HIS A 5 -1.878 -1.066 12.280 1.00 72.31 C ATOM 56 O HIS A 5 -2.311 -2.218 12.395 1.00 4.02 O ATOM 57 CB HIS A 5 -1.940 1.127 13.674 1.00 2.54 C ATOM 58 CG HIS A 5 -1.077 2.105 12.926 1.00 65.24 C ATOM 59 ND1 HIS A 5 0.280 2.294 13.096 1.00 15.44 N ATOM 60 CD2 HIS A 5 -1.524 3.042 12.036 1.00 40.44 C ATOM 61 CE1 HIS A 5 0.645 3.314 12.302 1.00 52.31 C ATOM 62 NE2 HIS A 5 -0.421 3.808 11.654 1.00 31.20 N ATOM 0 H HIS A 5 -4.772 -0.050 13.087 1.00 24.45 H new ATOM 0 HA HIS A 5 -3.007 0.678 11.897 1.00 25.54 H new ATOM 0 HB2 HIS A 5 -2.655 1.686 14.278 1.00 2.54 H new ATOM 0 HB3 HIS A 5 -1.311 0.565 14.364 1.00 2.54 H new ATOM 0 HD2 HIS A 5 -2.540 3.166 11.693 1.00 40.44 H new ATOM 0 HE1 HIS A 5 1.654 3.684 12.200 1.00 52.31 H new ATOM 0 HE2 HIS A 5 -0.425 4.595 11.005 1.00 31.20 H new ATOM 70 N ASP A 6 -0.702 -0.808 11.700 1.00 65.32 N ATOM 71 CA ASP A 6 0.180 -1.792 11.053 1.00 13.32 C ATOM 72 C ASP A 6 -0.540 -2.520 9.905 1.00 42.03 C ATOM 73 O ASP A 6 -1.093 -3.616 10.065 1.00 22.42 O ATOM 74 CB ASP A 6 0.801 -2.767 12.075 1.00 0.21 C ATOM 75 CG ASP A 6 2.129 -2.291 12.647 1.00 4.32 C ATOM 76 OD1 ASP A 6 3.066 -2.057 11.852 1.00 1.05 O ATOM 77 OD2 ASP A 6 2.315 -2.285 13.888 1.00 61.43 O ATOM 0 H ASP A 6 -0.318 0.136 11.666 1.00 65.32 H new ATOM 0 HA ASP A 6 1.012 -1.246 10.608 1.00 13.32 H new ATOM 0 HB2 ASP A 6 0.097 -2.919 12.893 1.00 0.21 H new ATOM 0 HB3 ASP A 6 0.948 -3.735 11.597 1.00 0.21 H new ATOM 82 N GLY A 7 -0.537 -1.901 8.724 1.00 73.33 N ATOM 83 CA GLY A 7 -1.223 -2.365 7.524 1.00 23.32 C ATOM 84 C GLY A 7 -0.332 -3.215 6.623 1.00 65.32 C ATOM 85 O GLY A 7 0.726 -3.695 7.041 1.00 35.32 O ATOM 0 H GLY A 7 -0.035 -1.026 8.574 1.00 73.33 H new ATOM 0 HA2 GLY A 7 -2.098 -2.946 7.814 1.00 23.32 H new ATOM 0 HA3 GLY A 7 -1.584 -1.504 6.962 1.00 23.32 H new ATOM 89 N ALA A 8 -0.832 -3.473 5.411 1.00 4.22 N ATOM 90 CA ALA A 8 -0.131 -3.985 4.237 1.00 20.22 C ATOM 91 C ALA A 8 -1.141 -4.043 3.079 1.00 60.23 C ATOM 92 O ALA A 8 -2.355 -3.919 3.301 1.00 32.21 O ATOM 93 CB ALA A 8 0.434 -5.382 4.500 1.00 32.34 C ATOM 0 H ALA A 8 -1.820 -3.315 5.213 1.00 4.22 H new ATOM 0 HA ALA A 8 0.706 -3.330 3.994 1.00 20.22 H new ATOM 0 HB1 ALA A 8 0.951 -5.739 3.609 1.00 32.34 H new ATOM 0 HB2 ALA A 8 1.135 -5.340 5.334 1.00 32.34 H new ATOM 0 HB3 ALA A 8 -0.381 -6.064 4.745 1.00 32.34 H new ATOM 99 N LEU A 9 -0.663 -4.306 1.864 1.00 4.50 N ATOM 100 CA LEU A 9 -1.430 -4.401 0.624 1.00 24.40 C ATOM 101 C LEU A 9 -1.470 -5.851 0.134 1.00 60.42 C ATOM 102 O LEU A 9 -0.585 -6.645 0.471 1.00 1.10 O ATOM 103 CB LEU A 9 -0.752 -3.531 -0.437 1.00 60.41 C ATOM 104 CG LEU A 9 -1.069 -2.031 -0.308 1.00 12.22 C ATOM 105 CD1 LEU A 9 -0.058 -1.325 0.605 1.00 3.32 C ATOM 106 CD2 LEU A 9 -1.056 -1.388 -1.685 1.00 12.32 C ATOM 0 H LEU A 9 0.332 -4.468 1.710 1.00 4.50 H new ATOM 0 HA LEU A 9 -2.450 -4.061 0.802 1.00 24.40 H new ATOM 0 HB2 LEU A 9 0.327 -3.671 -0.373 1.00 60.41 H new ATOM 0 HB3 LEU A 9 -1.060 -3.874 -1.425 1.00 60.41 H new ATOM 0 HG LEU A 9 -2.058 -1.927 0.139 1.00 12.22 H new ATOM 0 HD11 LEU A 9 -0.309 -0.267 0.676 1.00 3.32 H new ATOM 0 HD12 LEU A 9 -0.090 -1.773 1.598 1.00 3.32 H new ATOM 0 HD13 LEU A 9 0.944 -1.433 0.190 1.00 3.32 H new ATOM 0 HD21 LEU A 9 -1.281 -0.325 -1.593 1.00 12.32 H new ATOM 0 HD22 LEU A 9 -0.071 -1.513 -2.136 1.00 12.32 H new ATOM 0 HD23 LEU A 9 -1.807 -1.864 -2.316 1.00 12.32 H new ATOM 118 N ALA A 10 -2.481 -6.198 -0.677 1.00 62.23 N ATOM 119 CA ALA A 10 -2.540 -7.495 -1.346 1.00 34.11 C ATOM 120 C ALA A 10 -1.416 -7.620 -2.361 1.00 4.00 C ATOM 121 O ALA A 10 -0.924 -6.630 -2.882 1.00 15.24 O ATOM 122 CB ALA A 10 -3.863 -7.713 -2.089 1.00 4.11 C ATOM 0 H ALA A 10 -3.273 -5.588 -0.883 1.00 62.23 H new ATOM 0 HA ALA A 10 -2.446 -8.245 -0.561 1.00 34.11 H new ATOM 0 HB1 ALA A 10 -3.854 -8.692 -2.568 1.00 4.11 H new ATOM 0 HB2 ALA A 10 -4.690 -7.663 -1.381 1.00 4.11 H new ATOM 0 HB3 ALA A 10 -3.987 -6.939 -2.847 1.00 4.11 H new ATOM 128 N TYR A 11 -1.098 -8.865 -2.705 1.00 11.23 N ATOM 129 CA TYR A 11 -0.060 -9.247 -3.645 1.00 1.21 C ATOM 130 C TYR A 11 -0.175 -8.558 -5.019 1.00 41.03 C ATOM 131 O TYR A 11 0.857 -8.243 -5.618 1.00 34.11 O ATOM 132 CB TYR A 11 -0.127 -10.778 -3.764 1.00 34.52 C ATOM 133 CG TYR A 11 0.731 -11.336 -4.869 1.00 72.41 C ATOM 134 CD1 TYR A 11 0.212 -11.375 -6.172 1.00 25.12 C ATOM 135 CD2 TYR A 11 2.057 -11.719 -4.621 1.00 42.03 C ATOM 136 CE1 TYR A 11 1.033 -11.764 -7.243 1.00 4.43 C ATOM 137 CE2 TYR A 11 2.898 -12.067 -5.689 1.00 45.34 C ATOM 138 CZ TYR A 11 2.393 -12.083 -7.009 1.00 12.03 C ATOM 139 OH TYR A 11 3.227 -12.366 -8.047 1.00 62.12 O ATOM 0 H TYR A 11 -1.584 -9.672 -2.314 1.00 11.23 H new ATOM 0 HA TYR A 11 0.909 -8.915 -3.272 1.00 1.21 H new ATOM 0 HB2 TYR A 11 0.181 -11.221 -2.817 1.00 34.52 H new ATOM 0 HB3 TYR A 11 -1.162 -11.076 -3.933 1.00 34.52 H new ATOM 0 HD1 TYR A 11 -0.818 -11.106 -6.351 1.00 25.12 H new ATOM 0 HD2 TYR A 11 2.431 -11.746 -3.608 1.00 42.03 H new ATOM 0 HE1 TYR A 11 0.628 -11.820 -8.243 1.00 4.43 H new ATOM 0 HE2 TYR A 11 3.931 -12.322 -5.502 1.00 45.34 H new ATOM 0 HH TYR A 11 4.124 -12.561 -7.703 1.00 62.12 H new ATOM 149 N ASP A 12 -1.394 -8.346 -5.526 1.00 31.42 N ATOM 150 CA ASP A 12 -1.698 -7.888 -6.884 1.00 44.32 C ATOM 151 C ASP A 12 -2.281 -6.461 -6.869 1.00 32.22 C ATOM 152 O ASP A 12 -3.169 -6.114 -7.655 1.00 21.11 O ATOM 153 CB ASP A 12 -2.591 -8.902 -7.628 1.00 5.01 C ATOM 154 CG ASP A 12 -4.056 -8.865 -7.199 1.00 43.31 C ATOM 155 OD1 ASP A 12 -4.365 -9.121 -6.017 1.00 53.44 O ATOM 156 OD2 ASP A 12 -4.929 -8.586 -8.063 1.00 62.23 O ATOM 0 H ASP A 12 -2.237 -8.497 -4.972 1.00 31.42 H new ATOM 0 HA ASP A 12 -0.767 -7.833 -7.448 1.00 44.32 H new ATOM 0 HB2 ASP A 12 -2.531 -8.708 -8.699 1.00 5.01 H new ATOM 0 HB3 ASP A 12 -2.199 -9.906 -7.464 1.00 5.01 H new ATOM 161 N GLU A 13 -1.821 -5.635 -5.928 1.00 5.05 N ATOM 162 CA GLU A 13 -1.965 -4.184 -5.970 1.00 23.40 C ATOM 163 C GLU A 13 -0.782 -3.624 -6.781 1.00 14.22 C ATOM 164 O GLU A 13 0.369 -3.910 -6.436 1.00 13.31 O ATOM 165 CB GLU A 13 -1.911 -3.603 -4.548 1.00 33.51 C ATOM 166 CG GLU A 13 -3.079 -4.027 -3.646 1.00 40.53 C ATOM 167 CD GLU A 13 -4.314 -3.130 -3.775 1.00 12.00 C ATOM 168 OE1 GLU A 13 -4.443 -2.153 -3.018 1.00 2.41 O ATOM 169 OE2 GLU A 13 -5.215 -3.478 -4.573 1.00 5.00 O ATOM 0 H GLU A 13 -1.328 -5.966 -5.099 1.00 5.05 H new ATOM 0 HA GLU A 13 -2.920 -3.916 -6.422 1.00 23.40 H new ATOM 0 HB2 GLU A 13 -0.976 -3.909 -4.079 1.00 33.51 H new ATOM 0 HB3 GLU A 13 -1.894 -2.515 -4.613 1.00 33.51 H new ATOM 0 HG2 GLU A 13 -3.359 -5.052 -3.887 1.00 40.53 H new ATOM 0 HG3 GLU A 13 -2.745 -4.023 -2.608 1.00 40.53 H new ATOM 176 N PRO A 14 -1.016 -2.849 -7.852 1.00 60.43 N ATOM 177 CA PRO A 14 0.019 -2.026 -8.463 1.00 31.15 C ATOM 178 C PRO A 14 0.596 -0.961 -7.508 1.00 31.30 C ATOM 179 O PRO A 14 -0.064 -0.497 -6.572 1.00 11.04 O ATOM 180 CB PRO A 14 -0.611 -1.393 -9.707 1.00 14.33 C ATOM 181 CG PRO A 14 -1.871 -2.216 -9.982 1.00 3.05 C ATOM 182 CD PRO A 14 -2.228 -2.868 -8.648 1.00 32.45 C ATOM 0 HA PRO A 14 0.878 -2.645 -8.723 1.00 31.15 H new ATOM 0 HB2 PRO A 14 -0.855 -0.345 -9.535 1.00 14.33 H new ATOM 0 HB3 PRO A 14 0.073 -1.426 -10.555 1.00 14.33 H new ATOM 0 HG2 PRO A 14 -2.683 -1.583 -10.340 1.00 3.05 H new ATOM 0 HG3 PRO A 14 -1.690 -2.967 -10.751 1.00 3.05 H new ATOM 0 HD2 PRO A 14 -3.029 -2.322 -8.150 1.00 32.45 H new ATOM 0 HD3 PRO A 14 -2.581 -3.889 -8.796 1.00 32.45 H new ATOM 190 N ILE A 15 1.823 -0.517 -7.807 1.00 12.22 N ATOM 191 CA ILE A 15 2.632 0.389 -6.981 1.00 20.51 C ATOM 192 C ILE A 15 3.135 1.625 -7.737 1.00 75.43 C ATOM 193 O ILE A 15 3.721 2.506 -7.123 1.00 62.32 O ATOM 194 CB ILE A 15 3.811 -0.379 -6.345 1.00 31.12 C ATOM 195 CG1 ILE A 15 4.751 -1.023 -7.386 1.00 32.23 C ATOM 196 CG2 ILE A 15 3.264 -1.455 -5.404 1.00 34.33 C ATOM 197 CD1 ILE A 15 6.104 -1.467 -6.832 1.00 74.12 C ATOM 0 H ILE A 15 2.299 -0.790 -8.667 1.00 12.22 H new ATOM 0 HA ILE A 15 1.974 0.764 -6.198 1.00 20.51 H new ATOM 0 HB ILE A 15 4.408 0.348 -5.795 1.00 31.12 H new ATOM 0 HG12 ILE A 15 4.251 -1.887 -7.823 1.00 32.23 H new ATOM 0 HG13 ILE A 15 4.920 -0.311 -8.194 1.00 32.23 H new ATOM 0 HG21 ILE A 15 4.093 -2.000 -4.953 1.00 34.33 H new ATOM 0 HG22 ILE A 15 2.669 -0.985 -4.621 1.00 34.33 H new ATOM 0 HG23 ILE A 15 2.639 -2.148 -5.968 1.00 34.33 H new ATOM 0 HD11 ILE A 15 6.698 -1.908 -7.633 1.00 74.12 H new ATOM 0 HD12 ILE A 15 6.630 -0.605 -6.422 1.00 74.12 H new ATOM 0 HD13 ILE A 15 5.950 -2.206 -6.045 1.00 74.12 H new ATOM 209 N TYR A 16 2.893 1.714 -9.049 1.00 43.01 N ATOM 210 CA TYR A 16 3.128 2.895 -9.882 1.00 5.14 C ATOM 211 C TYR A 16 4.508 3.518 -9.666 1.00 25.31 C ATOM 212 O TYR A 16 4.660 4.573 -9.046 1.00 43.45 O ATOM 213 CB TYR A 16 2.012 3.932 -9.700 1.00 12.40 C ATOM 214 CG TYR A 16 0.621 3.350 -9.703 1.00 32.40 C ATOM 215 CD1 TYR A 16 0.091 2.854 -8.500 1.00 74.21 C ATOM 216 CD2 TYR A 16 -0.132 3.284 -10.890 1.00 72.23 C ATOM 217 CE1 TYR A 16 -1.163 2.243 -8.492 1.00 24.54 C ATOM 218 CE2 TYR A 16 -1.401 2.672 -10.883 1.00 53.51 C ATOM 219 CZ TYR A 16 -1.891 2.109 -9.690 1.00 1.42 C ATOM 220 OH TYR A 16 -3.069 1.445 -9.686 1.00 1.23 O ATOM 0 H TYR A 16 2.512 0.931 -9.581 1.00 43.01 H new ATOM 0 HA TYR A 16 3.110 2.550 -10.916 1.00 5.14 H new ATOM 0 HB2 TYR A 16 2.171 4.459 -8.759 1.00 12.40 H new ATOM 0 HB3 TYR A 16 2.086 4.672 -10.497 1.00 12.40 H new ATOM 0 HD1 TYR A 16 0.654 2.946 -7.583 1.00 74.21 H new ATOM 0 HD2 TYR A 16 0.262 3.702 -11.805 1.00 72.23 H new ATOM 0 HE1 TYR A 16 -1.576 1.872 -7.566 1.00 24.54 H new ATOM 0 HE2 TYR A 16 -1.993 2.635 -11.786 1.00 53.51 H new ATOM 0 HH TYR A 16 -3.083 0.808 -8.942 1.00 1.23 H new ATOM 230 N LEU A 17 5.530 2.881 -10.242 1.00 20.20 N ATOM 231 CA LEU A 17 6.853 3.468 -10.326 1.00 4.41 C ATOM 232 C LEU A 17 6.770 4.862 -10.949 1.00 0.00 C ATOM 233 O LEU A 17 5.868 5.119 -11.757 1.00 0.30 O ATOM 234 CB LEU A 17 7.735 2.562 -11.185 1.00 43.21 C ATOM 235 CG LEU A 17 8.243 1.283 -10.499 1.00 52.32 C ATOM 236 CD1 LEU A 17 9.543 1.543 -9.759 1.00 63.13 C ATOM 237 CD2 LEU A 17 7.290 0.564 -9.542 1.00 53.24 C ATOM 0 H LEU A 17 5.457 1.952 -10.657 1.00 20.20 H new ATOM 0 HA LEU A 17 7.280 3.562 -9.328 1.00 4.41 H new ATOM 0 HB2 LEU A 17 7.174 2.277 -12.075 1.00 43.21 H new ATOM 0 HB3 LEU A 17 8.596 3.138 -11.523 1.00 43.21 H new ATOM 0 HG LEU A 17 8.366 0.607 -11.345 1.00 52.32 H new ATOM 0 HD11 LEU A 17 9.881 0.623 -9.283 1.00 63.13 H new ATOM 0 HD12 LEU A 17 10.300 1.886 -10.464 1.00 63.13 H new ATOM 0 HD13 LEU A 17 9.382 2.307 -8.999 1.00 63.13 H new ATOM 0 HD21 LEU A 17 7.782 -0.319 -9.134 1.00 53.24 H new ATOM 0 HD22 LEU A 17 7.016 1.236 -8.728 1.00 53.24 H new ATOM 0 HD23 LEU A 17 6.392 0.262 -10.081 1.00 53.24 H new ATOM 249 N SER A 18 7.791 5.682 -10.732 1.00 24.30 N ATOM 250 CA SER A 18 8.022 6.936 -11.452 1.00 73.34 C ATOM 251 C SER A 18 8.227 6.711 -12.963 1.00 51.45 C ATOM 252 O SER A 18 8.500 7.657 -13.697 1.00 3.51 O ATOM 253 CB SER A 18 9.180 7.694 -10.789 1.00 11.10 C ATOM 254 OG SER A 18 8.795 8.995 -10.389 1.00 21.10 O ATOM 0 H SER A 18 8.505 5.490 -10.029 1.00 24.30 H new ATOM 0 HA SER A 18 7.129 7.558 -11.383 1.00 73.34 H new ATOM 0 HB2 SER A 18 9.530 7.136 -9.921 1.00 11.10 H new ATOM 0 HB3 SER A 18 10.017 7.760 -11.484 1.00 11.10 H new ATOM 0 HG SER A 18 9.557 9.447 -9.970 1.00 21.10 H new ATOM 260 N ASP A 19 8.169 5.461 -13.425 1.00 3.11 N ATOM 261 CA ASP A 19 8.269 5.037 -14.818 1.00 24.40 C ATOM 262 C ASP A 19 6.992 4.336 -15.284 1.00 40.15 C ATOM 263 O ASP A 19 6.773 4.199 -16.485 1.00 41.33 O ATOM 264 CB ASP A 19 9.434 4.059 -14.957 1.00 51.02 C ATOM 265 CG ASP A 19 10.775 4.741 -14.720 1.00 34.11 C ATOM 266 OD1 ASP A 19 11.125 5.022 -13.551 1.00 4.23 O ATOM 267 OD2 ASP A 19 11.510 4.948 -15.704 1.00 11.43 O ATOM 0 H ASP A 19 8.043 4.669 -12.794 1.00 3.11 H new ATOM 0 HA ASP A 19 8.424 5.925 -15.432 1.00 24.40 H new ATOM 0 HB2 ASP A 19 9.310 3.243 -14.245 1.00 51.02 H new ATOM 0 HB3 ASP A 19 9.421 3.618 -15.954 1.00 51.02 H new ATOM 272 N GLY A 20 6.138 3.897 -14.353 1.00 25.43 N ATOM 273 CA GLY A 20 4.800 3.417 -14.647 1.00 20.12 C ATOM 274 C GLY A 20 4.772 1.931 -14.962 1.00 11.30 C ATOM 275 O GLY A 20 4.025 1.500 -15.831 1.00 12.05 O ATOM 0 H GLY A 20 6.369 3.868 -13.360 1.00 25.43 H new ATOM 0 HA2 GLY A 20 4.150 3.617 -13.795 1.00 20.12 H new ATOM 0 HA3 GLY A 20 4.396 3.972 -15.493 1.00 20.12 H new ATOM 279 N ASN A 21 5.573 1.119 -14.264 1.00 52.23 N ATOM 280 CA ASN A 21 5.811 -0.263 -14.654 1.00 52.01 C ATOM 281 C ASN A 21 4.584 -1.185 -14.538 1.00 51.52 C ATOM 282 O ASN A 21 4.618 -2.280 -15.088 1.00 72.54 O ATOM 283 CB ASN A 21 6.986 -0.817 -13.833 1.00 54.34 C ATOM 284 CG ASN A 21 8.247 -0.969 -14.678 1.00 21.13 C ATOM 285 OD1 ASN A 21 8.533 -2.027 -15.234 1.00 23.52 O ATOM 286 ND2 ASN A 21 9.036 0.086 -14.798 1.00 35.13 N ATOM 0 H ASN A 21 6.069 1.404 -13.419 1.00 52.23 H new ATOM 0 HA ASN A 21 6.049 -0.251 -15.718 1.00 52.01 H new ATOM 0 HB2 ASN A 21 7.189 -0.151 -12.994 1.00 54.34 H new ATOM 0 HB3 ASN A 21 6.711 -1.785 -13.413 1.00 54.34 H new ATOM 0 HD21 ASN A 21 9.888 0.025 -15.355 1.00 35.13 H new ATOM 0 HD22 ASN A 21 8.792 0.961 -14.334 1.00 35.13 H new ATOM 293 N ILE A 22 3.546 -0.761 -13.801 1.00 1.44 N ATOM 294 CA ILE A 22 2.320 -1.487 -13.434 1.00 14.11 C ATOM 295 C ILE A 22 2.626 -2.970 -13.194 1.00 1.13 C ATOM 296 O ILE A 22 2.177 -3.886 -13.885 1.00 62.23 O ATOM 297 CB ILE A 22 1.135 -1.158 -14.378 1.00 25.40 C ATOM 298 CG1 ILE A 22 0.732 0.336 -14.292 1.00 23.33 C ATOM 299 CG2 ILE A 22 -0.122 -2.003 -14.097 1.00 20.43 C ATOM 300 CD1 ILE A 22 0.102 0.800 -12.973 1.00 62.43 C ATOM 0 H ILE A 22 3.543 0.182 -13.412 1.00 1.44 H new ATOM 0 HA ILE A 22 1.952 -1.129 -12.473 1.00 14.11 H new ATOM 0 HB ILE A 22 1.502 -1.398 -15.376 1.00 25.40 H new ATOM 0 HG12 ILE A 22 1.620 0.940 -14.477 1.00 23.33 H new ATOM 0 HG13 ILE A 22 0.030 0.547 -15.098 1.00 23.33 H new ATOM 0 HG21 ILE A 22 -0.912 -1.722 -14.793 1.00 20.43 H new ATOM 0 HG22 ILE A 22 0.114 -3.060 -14.224 1.00 20.43 H new ATOM 0 HG23 ILE A 22 -0.458 -1.826 -13.075 1.00 20.43 H new ATOM 0 HD11 ILE A 22 -0.136 1.862 -13.037 1.00 62.43 H new ATOM 0 HD12 ILE A 22 -0.811 0.234 -12.787 1.00 62.43 H new ATOM 0 HD13 ILE A 22 0.804 0.634 -12.156 1.00 62.43 H new ATOM 312 N ILE A 23 3.385 -3.169 -12.128 1.00 32.42 N ATOM 313 CA ILE A 23 3.825 -4.431 -11.572 1.00 11.10 C ATOM 314 C ILE A 23 3.092 -4.664 -10.250 1.00 21.11 C ATOM 315 O ILE A 23 2.803 -3.710 -9.521 1.00 35.33 O ATOM 316 CB ILE A 23 5.367 -4.351 -11.419 1.00 61.23 C ATOM 317 CG1 ILE A 23 6.022 -5.314 -12.415 1.00 54.05 C ATOM 318 CG2 ILE A 23 5.888 -4.524 -9.985 1.00 63.42 C ATOM 319 CD1 ILE A 23 7.547 -5.228 -12.491 1.00 63.33 C ATOM 0 H ILE A 23 3.737 -2.380 -11.585 1.00 32.42 H new ATOM 0 HA ILE A 23 3.592 -5.283 -12.211 1.00 11.10 H new ATOM 0 HB ILE A 23 5.660 -3.329 -11.658 1.00 61.23 H new ATOM 0 HG12 ILE A 23 5.744 -6.333 -12.148 1.00 54.05 H new ATOM 0 HG13 ILE A 23 5.613 -5.121 -13.407 1.00 54.05 H new ATOM 0 HG21 ILE A 23 6.976 -4.452 -9.982 1.00 63.42 H new ATOM 0 HG22 ILE A 23 5.471 -3.743 -9.350 1.00 63.42 H new ATOM 0 HG23 ILE A 23 5.588 -5.500 -9.604 1.00 63.42 H new ATOM 0 HD11 ILE A 23 7.916 -5.947 -13.222 1.00 63.33 H new ATOM 0 HD12 ILE A 23 7.840 -4.222 -12.791 1.00 63.33 H new ATOM 0 HD13 ILE A 23 7.973 -5.453 -11.513 1.00 63.33 H new ATOM 331 N ASN A 24 2.925 -5.943 -9.932 1.00 55.41 N ATOM 332 CA ASN A 24 2.398 -6.505 -8.687 1.00 33.51 C ATOM 333 C ASN A 24 3.369 -6.154 -7.572 1.00 53.01 C ATOM 334 O ASN A 24 4.554 -6.486 -7.678 1.00 61.42 O ATOM 335 CB ASN A 24 2.347 -8.050 -8.780 1.00 34.53 C ATOM 336 CG ASN A 24 1.514 -8.672 -9.897 1.00 5.20 C ATOM 337 OD1 ASN A 24 1.029 -8.016 -10.813 1.00 24.21 O ATOM 338 ND2 ASN A 24 1.394 -9.983 -9.886 1.00 54.34 N ATOM 0 H ASN A 24 3.175 -6.678 -10.593 1.00 55.41 H new ATOM 0 HA ASN A 24 1.399 -6.109 -8.504 1.00 33.51 H new ATOM 0 HB2 ASN A 24 3.370 -8.412 -8.884 1.00 34.53 H new ATOM 0 HB3 ASN A 24 1.970 -8.430 -7.831 1.00 34.53 H new ATOM 0 HD21 ASN A 24 0.897 -10.456 -10.641 1.00 54.34 H new ATOM 0 HD22 ASN A 24 1.798 -10.526 -9.123 1.00 54.34 H new ATOM 345 N ILE A 25 2.881 -5.551 -6.489 1.00 74.35 N ATOM 346 CA ILE A 25 3.671 -5.294 -5.292 1.00 44.33 C ATOM 347 C ILE A 25 4.381 -6.559 -4.809 1.00 5.41 C ATOM 348 O ILE A 25 5.557 -6.502 -4.445 1.00 41.02 O ATOM 349 CB ILE A 25 2.770 -4.670 -4.208 1.00 11.52 C ATOM 350 CG1 ILE A 25 3.603 -4.151 -3.015 1.00 34.42 C ATOM 351 CG2 ILE A 25 1.648 -5.591 -3.725 1.00 11.11 C ATOM 352 CD1 ILE A 25 2.759 -3.383 -1.990 1.00 52.32 C ATOM 0 H ILE A 25 1.917 -5.225 -6.420 1.00 74.35 H new ATOM 0 HA ILE A 25 4.460 -4.580 -5.527 1.00 44.33 H new ATOM 0 HB ILE A 25 2.279 -3.826 -4.692 1.00 11.52 H new ATOM 0 HG12 ILE A 25 4.087 -4.994 -2.522 1.00 34.42 H new ATOM 0 HG13 ILE A 25 4.395 -3.501 -3.386 1.00 34.42 H new ATOM 0 HG21 ILE A 25 1.059 -5.079 -2.964 1.00 11.11 H new ATOM 0 HG22 ILE A 25 1.005 -5.853 -4.565 1.00 11.11 H new ATOM 0 HG23 ILE A 25 2.079 -6.498 -3.301 1.00 11.11 H new ATOM 0 HD11 ILE A 25 3.397 -3.043 -1.175 1.00 52.32 H new ATOM 0 HD12 ILE A 25 2.296 -2.522 -2.472 1.00 52.32 H new ATOM 0 HD13 ILE A 25 1.983 -4.038 -1.594 1.00 52.32 H new ATOM 364 N GLY A 26 3.693 -7.702 -4.841 1.00 13.52 N ATOM 365 CA GLY A 26 4.245 -8.933 -4.326 1.00 72.11 C ATOM 366 C GLY A 26 5.396 -9.421 -5.189 1.00 63.31 C ATOM 367 O GLY A 26 6.408 -9.842 -4.645 1.00 42.14 O ATOM 0 H GLY A 26 2.751 -7.789 -5.222 1.00 13.52 H new ATOM 0 HA2 GLY A 26 4.592 -8.780 -3.304 1.00 72.11 H new ATOM 0 HA3 GLY A 26 3.467 -9.696 -4.287 1.00 72.11 H new ATOM 371 N GLU A 27 5.281 -9.338 -6.518 1.00 72.21 N ATOM 372 CA GLU A 27 6.364 -9.707 -7.428 1.00 60.31 C ATOM 373 C GLU A 27 7.553 -8.759 -7.265 1.00 15.34 C ATOM 374 O GLU A 27 8.704 -9.193 -7.300 1.00 35.42 O ATOM 375 CB GLU A 27 5.863 -9.688 -8.873 1.00 31.43 C ATOM 376 CG GLU A 27 6.889 -10.267 -9.861 1.00 14.51 C ATOM 377 CD GLU A 27 6.992 -11.800 -9.784 1.00 62.23 C ATOM 378 OE1 GLU A 27 7.540 -12.356 -8.814 1.00 32.23 O ATOM 379 OE2 GLU A 27 6.492 -12.511 -10.689 1.00 34.54 O ATOM 0 H GLU A 27 4.437 -9.014 -6.990 1.00 72.21 H new ATOM 0 HA GLU A 27 6.696 -10.716 -7.182 1.00 60.31 H new ATOM 0 HB2 GLU A 27 4.937 -10.259 -8.940 1.00 31.43 H new ATOM 0 HB3 GLU A 27 5.627 -8.663 -9.159 1.00 31.43 H new ATOM 0 HG2 GLU A 27 6.614 -9.976 -10.875 1.00 14.51 H new ATOM 0 HG3 GLU A 27 7.867 -9.831 -9.659 1.00 14.51 H new ATOM 386 N PHE A 28 7.271 -7.460 -7.114 1.00 71.45 N ATOM 387 CA PHE A 28 8.278 -6.424 -6.949 1.00 33.42 C ATOM 388 C PHE A 28 9.133 -6.758 -5.741 1.00 33.32 C ATOM 389 O PHE A 28 10.344 -6.911 -5.880 1.00 24.34 O ATOM 390 CB PHE A 28 7.589 -5.066 -6.798 1.00 43.13 C ATOM 391 CG PHE A 28 8.509 -3.875 -6.652 1.00 12.05 C ATOM 392 CD1 PHE A 28 9.145 -3.328 -7.783 1.00 12.20 C ATOM 393 CD2 PHE A 28 8.633 -3.245 -5.398 1.00 34.20 C ATOM 394 CE1 PHE A 28 9.862 -2.125 -7.670 1.00 23.11 C ATOM 395 CE2 PHE A 28 9.331 -2.029 -5.294 1.00 60.24 C ATOM 396 CZ PHE A 28 9.925 -1.456 -6.434 1.00 21.31 C ATOM 0 H PHE A 28 6.317 -7.100 -7.104 1.00 71.45 H new ATOM 0 HA PHE A 28 8.926 -6.373 -7.824 1.00 33.42 H new ATOM 0 HB2 PHE A 28 6.951 -4.904 -7.667 1.00 43.13 H new ATOM 0 HB3 PHE A 28 6.936 -5.106 -5.926 1.00 43.13 H new ATOM 0 HD1 PHE A 28 9.082 -3.832 -8.736 1.00 12.20 H new ATOM 0 HD2 PHE A 28 8.193 -3.694 -4.520 1.00 34.20 H new ATOM 0 HE1 PHE A 28 10.365 -1.714 -8.533 1.00 23.11 H new ATOM 0 HE2 PHE A 28 9.412 -1.534 -4.338 1.00 60.24 H new ATOM 0 HZ PHE A 28 10.429 -0.504 -6.360 1.00 21.31 H new ATOM 406 N VAL A 29 8.495 -6.910 -4.580 1.00 11.20 N ATOM 407 CA VAL A 29 9.154 -7.323 -3.363 1.00 54.23 C ATOM 408 C VAL A 29 9.864 -8.655 -3.605 1.00 71.23 C ATOM 409 O VAL A 29 11.048 -8.774 -3.284 1.00 4.04 O ATOM 410 CB VAL A 29 8.136 -7.352 -2.207 1.00 12.41 C ATOM 411 CG1 VAL A 29 8.735 -8.008 -0.959 1.00 14.41 C ATOM 412 CG2 VAL A 29 7.679 -5.922 -1.867 1.00 12.44 C ATOM 0 H VAL A 29 7.495 -6.745 -4.468 1.00 11.20 H new ATOM 0 HA VAL A 29 9.924 -6.610 -3.067 1.00 54.23 H new ATOM 0 HB VAL A 29 7.279 -7.942 -2.531 1.00 12.41 H new ATOM 0 HG11 VAL A 29 7.994 -8.014 -0.160 1.00 14.41 H new ATOM 0 HG12 VAL A 29 9.027 -9.032 -1.191 1.00 14.41 H new ATOM 0 HG13 VAL A 29 9.611 -7.445 -0.637 1.00 14.41 H new ATOM 0 HG21 VAL A 29 6.960 -5.955 -1.049 1.00 12.44 H new ATOM 0 HG22 VAL A 29 8.541 -5.326 -1.569 1.00 12.44 H new ATOM 0 HG23 VAL A 29 7.212 -5.471 -2.743 1.00 12.44 H new ATOM 422 N ASP A 30 9.187 -9.672 -4.150 1.00 44.23 N ATOM 423 CA ASP A 30 9.768 -11.007 -4.127 1.00 21.22 C ATOM 424 C ASP A 30 11.013 -11.098 -4.978 1.00 23.30 C ATOM 425 O ASP A 30 11.923 -11.820 -4.594 1.00 52.24 O ATOM 426 CB ASP A 30 8.832 -12.127 -4.580 1.00 4.00 C ATOM 427 CG ASP A 30 9.086 -13.403 -3.780 1.00 13.10 C ATOM 428 OD1 ASP A 30 8.938 -13.397 -2.526 1.00 72.23 O ATOM 429 OD2 ASP A 30 9.332 -14.495 -4.358 1.00 25.31 O ATOM 0 H ASP A 30 8.272 -9.598 -4.595 1.00 44.23 H new ATOM 0 HA ASP A 30 9.994 -11.156 -3.071 1.00 21.22 H new ATOM 0 HB2 ASP A 30 7.796 -11.814 -4.454 1.00 4.00 H new ATOM 0 HB3 ASP A 30 8.979 -12.323 -5.642 1.00 4.00 H new ATOM 434 N LYS A 31 11.110 -10.350 -6.082 1.00 51.12 N ATOM 435 CA LYS A 31 12.328 -10.272 -6.888 1.00 11.15 C ATOM 436 C LYS A 31 13.518 -10.022 -5.961 1.00 24.21 C ATOM 437 O LYS A 31 14.531 -10.718 -6.070 1.00 4.11 O ATOM 438 CB LYS A 31 12.170 -9.228 -8.027 1.00 41.44 C ATOM 439 CG LYS A 31 13.316 -8.205 -8.096 1.00 65.42 C ATOM 440 CD LYS A 31 13.400 -7.350 -9.369 1.00 40.34 C ATOM 441 CE LYS A 31 14.675 -6.489 -9.349 1.00 5.21 C ATOM 442 NZ LYS A 31 14.793 -5.564 -10.502 1.00 23.25 N ATOM 0 H LYS A 31 10.343 -9.781 -6.441 1.00 51.12 H new ATOM 0 HA LYS A 31 12.516 -11.216 -7.400 1.00 11.15 H new ATOM 0 HB2 LYS A 31 12.105 -9.752 -8.981 1.00 41.44 H new ATOM 0 HB3 LYS A 31 11.228 -8.696 -7.891 1.00 41.44 H new ATOM 0 HG2 LYS A 31 13.226 -7.535 -7.241 1.00 65.42 H new ATOM 0 HG3 LYS A 31 14.258 -8.741 -7.983 1.00 65.42 H new ATOM 0 HD2 LYS A 31 13.401 -7.994 -10.249 1.00 40.34 H new ATOM 0 HD3 LYS A 31 12.521 -6.709 -9.444 1.00 40.34 H new ATOM 0 HE2 LYS A 31 14.695 -5.909 -8.427 1.00 5.21 H new ATOM 0 HE3 LYS A 31 15.545 -7.146 -9.332 1.00 5.21 H new ATOM 0 HZ1 LYS A 31 15.675 -5.018 -10.420 1.00 23.25 H new ATOM 0 HZ2 LYS A 31 14.805 -6.111 -11.386 1.00 23.25 H new ATOM 0 HZ3 LYS A 31 13.982 -4.913 -10.509 1.00 23.25 H new ATOM 456 N PHE A 32 13.386 -9.068 -5.041 1.00 1.51 N ATOM 457 CA PHE A 32 14.439 -8.705 -4.115 1.00 52.23 C ATOM 458 C PHE A 32 14.644 -9.856 -3.143 1.00 34.44 C ATOM 459 O PHE A 32 15.774 -10.260 -2.922 1.00 21.33 O ATOM 460 CB PHE A 32 14.096 -7.386 -3.406 1.00 52.13 C ATOM 461 CG PHE A 32 13.761 -6.242 -4.350 1.00 0.20 C ATOM 462 CD1 PHE A 32 14.648 -5.885 -5.384 1.00 15.33 C ATOM 463 CD2 PHE A 32 12.547 -5.543 -4.211 1.00 34.33 C ATOM 464 CE1 PHE A 32 14.302 -4.862 -6.280 1.00 75.55 C ATOM 465 CE2 PHE A 32 12.201 -4.526 -5.117 1.00 73.33 C ATOM 466 CZ PHE A 32 13.072 -4.196 -6.167 1.00 24.33 C ATOM 0 H PHE A 32 12.532 -8.523 -4.922 1.00 1.51 H new ATOM 0 HA PHE A 32 15.376 -8.534 -4.645 1.00 52.23 H new ATOM 0 HB2 PHE A 32 13.249 -7.553 -2.740 1.00 52.13 H new ATOM 0 HB3 PHE A 32 14.939 -7.092 -2.781 1.00 52.13 H new ATOM 0 HD1 PHE A 32 15.593 -6.398 -5.487 1.00 15.33 H new ATOM 0 HD2 PHE A 32 11.876 -5.790 -3.402 1.00 34.33 H new ATOM 0 HE1 PHE A 32 14.990 -4.584 -7.065 1.00 75.55 H new ATOM 0 HE2 PHE A 32 11.265 -3.999 -5.005 1.00 73.33 H new ATOM 0 HZ PHE A 32 12.798 -3.435 -6.883 1.00 24.33 H new ATOM 476 N PHE A 33 13.581 -10.463 -2.620 1.00 41.12 N ATOM 477 CA PHE A 33 13.677 -11.606 -1.715 1.00 62.12 C ATOM 478 C PHE A 33 14.301 -12.837 -2.400 1.00 12.04 C ATOM 479 O PHE A 33 14.824 -13.719 -1.715 1.00 51.34 O ATOM 480 CB PHE A 33 12.293 -11.921 -1.135 1.00 14.25 C ATOM 481 CG PHE A 33 11.825 -10.977 -0.035 1.00 44.31 C ATOM 482 CD1 PHE A 33 11.785 -9.588 -0.248 1.00 31.24 C ATOM 483 CD2 PHE A 33 11.462 -11.472 1.232 1.00 71.32 C ATOM 484 CE1 PHE A 33 11.469 -8.705 0.786 1.00 11.24 C ATOM 485 CE2 PHE A 33 11.074 -10.589 2.257 1.00 71.31 C ATOM 486 CZ PHE A 33 11.084 -9.199 2.044 1.00 62.14 C ATOM 0 H PHE A 33 12.622 -10.174 -2.814 1.00 41.12 H new ATOM 0 HA PHE A 33 14.348 -11.341 -0.898 1.00 62.12 H new ATOM 0 HB2 PHE A 33 11.563 -11.901 -1.945 1.00 14.25 H new ATOM 0 HB3 PHE A 33 12.304 -12.937 -0.741 1.00 14.25 H new ATOM 0 HD1 PHE A 33 12.003 -9.196 -1.231 1.00 31.24 H new ATOM 0 HD2 PHE A 33 11.481 -12.536 1.419 1.00 71.32 H new ATOM 0 HE1 PHE A 33 11.521 -7.639 0.619 1.00 11.24 H new ATOM 0 HE2 PHE A 33 10.766 -10.982 3.215 1.00 71.31 H new ATOM 0 HZ PHE A 33 10.800 -8.521 2.835 1.00 62.14 H new ATOM 496 N LYS A 34 14.269 -12.927 -3.732 1.00 72.14 N ATOM 497 CA LYS A 34 14.836 -14.020 -4.519 1.00 54.34 C ATOM 498 C LYS A 34 16.255 -13.724 -4.990 1.00 14.02 C ATOM 499 O LYS A 34 16.974 -14.673 -5.290 1.00 40.01 O ATOM 500 CB LYS A 34 13.949 -14.320 -5.732 1.00 62.22 C ATOM 501 CG LYS A 34 12.596 -14.908 -5.313 1.00 32.11 C ATOM 502 CD LYS A 34 11.869 -15.599 -6.466 1.00 43.15 C ATOM 503 CE LYS A 34 12.319 -17.062 -6.538 1.00 15.22 C ATOM 504 NZ LYS A 34 11.191 -17.949 -6.874 1.00 53.41 N ATOM 0 H LYS A 34 13.830 -12.212 -4.312 1.00 72.14 H new ATOM 0 HA LYS A 34 14.878 -14.890 -3.864 1.00 54.34 H new ATOM 0 HB2 LYS A 34 13.788 -13.404 -6.300 1.00 62.22 H new ATOM 0 HB3 LYS A 34 14.461 -15.019 -6.393 1.00 62.22 H new ATOM 0 HG2 LYS A 34 12.750 -15.624 -4.506 1.00 32.11 H new ATOM 0 HG3 LYS A 34 11.966 -14.112 -4.917 1.00 32.11 H new ATOM 0 HD2 LYS A 34 10.791 -15.544 -6.317 1.00 43.15 H new ATOM 0 HD3 LYS A 34 12.087 -15.092 -7.406 1.00 43.15 H new ATOM 0 HE2 LYS A 34 13.104 -17.168 -7.287 1.00 15.22 H new ATOM 0 HE3 LYS A 34 12.748 -17.361 -5.582 1.00 15.22 H new ATOM 0 HZ1 LYS A 34 11.524 -18.933 -6.916 1.00 53.41 H new ATOM 0 HZ2 LYS A 34 10.454 -17.864 -6.146 1.00 53.41 H new ATOM 0 HZ3 LYS A 34 10.798 -17.677 -7.798 1.00 53.41 H new ATOM 518 N LYS A 35 16.703 -12.464 -5.036 1.00 64.11 N ATOM 519 CA LYS A 35 18.094 -12.156 -5.339 1.00 0.40 C ATOM 520 C LYS A 35 18.828 -12.013 -4.030 1.00 15.11 C ATOM 521 O LYS A 35 19.840 -12.672 -3.797 1.00 74.33 O ATOM 522 CB LYS A 35 18.182 -10.896 -6.216 1.00 3.51 C ATOM 523 CG LYS A 35 18.850 -11.214 -7.561 1.00 32.42 C ATOM 524 CD LYS A 35 20.325 -10.798 -7.605 1.00 15.14 C ATOM 525 CE LYS A 35 21.151 -11.545 -6.555 1.00 31.14 C ATOM 526 NZ LYS A 35 22.539 -11.778 -6.987 1.00 61.21 N ATOM 0 H LYS A 35 16.118 -11.646 -4.866 1.00 64.11 H new ATOM 0 HA LYS A 35 18.561 -12.955 -5.914 1.00 0.40 H new ATOM 0 HB2 LYS A 35 17.183 -10.496 -6.387 1.00 3.51 H new ATOM 0 HB3 LYS A 35 18.750 -10.124 -5.696 1.00 3.51 H new ATOM 0 HG2 LYS A 35 18.773 -12.284 -7.756 1.00 32.42 H new ATOM 0 HG3 LYS A 35 18.310 -10.705 -8.359 1.00 32.42 H new ATOM 0 HD2 LYS A 35 20.731 -10.997 -8.597 1.00 15.14 H new ATOM 0 HD3 LYS A 35 20.406 -9.724 -7.437 1.00 15.14 H new ATOM 0 HE2 LYS A 35 21.154 -10.973 -5.627 1.00 31.14 H new ATOM 0 HE3 LYS A 35 20.676 -12.502 -6.338 1.00 31.14 H new ATOM 0 HZ1 LYS A 35 23.054 -12.287 -6.240 1.00 61.21 H new ATOM 0 HZ2 LYS A 35 22.541 -12.347 -7.858 1.00 61.21 H new ATOM 0 HZ3 LYS A 35 23.004 -10.866 -7.168 1.00 61.21 H new ATOM 540 N TYR A 36 18.292 -11.173 -3.159 1.00 63.44 N ATOM 541 CA TYR A 36 18.843 -10.780 -1.886 1.00 1.21 C ATOM 542 C TYR A 36 18.330 -11.751 -0.822 1.00 71.43 C ATOM 543 O TYR A 36 17.951 -11.360 0.278 1.00 55.05 O ATOM 544 CB TYR A 36 18.473 -9.308 -1.618 1.00 62.11 C ATOM 545 CG TYR A 36 18.517 -8.328 -2.779 1.00 55.51 C ATOM 546 CD1 TYR A 36 19.366 -8.527 -3.880 1.00 14.02 C ATOM 547 CD2 TYR A 36 17.697 -7.189 -2.741 1.00 2.01 C ATOM 548 CE1 TYR A 36 19.405 -7.601 -4.934 1.00 21.35 C ATOM 549 CE2 TYR A 36 17.711 -6.261 -3.794 1.00 11.11 C ATOM 550 CZ TYR A 36 18.575 -6.462 -4.889 1.00 63.24 C ATOM 551 OH TYR A 36 18.593 -5.560 -5.898 1.00 71.44 O ATOM 0 H TYR A 36 17.397 -10.720 -3.343 1.00 63.44 H new ATOM 0 HA TYR A 36 19.932 -10.834 -1.871 1.00 1.21 H new ATOM 0 HB2 TYR A 36 17.464 -9.289 -1.206 1.00 62.11 H new ATOM 0 HB3 TYR A 36 19.141 -8.934 -0.842 1.00 62.11 H new ATOM 0 HD1 TYR A 36 19.996 -9.403 -3.916 1.00 14.02 H new ATOM 0 HD2 TYR A 36 17.049 -7.025 -1.893 1.00 2.01 H new ATOM 0 HE1 TYR A 36 20.066 -7.760 -5.773 1.00 21.35 H new ATOM 0 HE2 TYR A 36 17.063 -5.397 -3.765 1.00 11.11 H new ATOM 0 HH TYR A 36 17.711 -5.141 -5.978 1.00 71.44 H new ATOM 561 N LYS A 37 18.324 -13.048 -1.140 1.00 33.12 N ATOM 562 CA LYS A 37 17.933 -14.143 -0.260 1.00 12.54 C ATOM 563 C LYS A 37 18.745 -14.063 1.029 1.00 62.22 C ATOM 564 O LYS A 37 18.219 -14.191 2.135 1.00 31.13 O ATOM 565 CB LYS A 37 18.181 -15.494 -0.956 1.00 53.44 C ATOM 566 CG LYS A 37 17.703 -15.563 -2.417 1.00 41.25 C ATOM 567 CD LYS A 37 18.140 -16.836 -3.147 1.00 31.22 C ATOM 568 CE LYS A 37 17.244 -18.021 -2.774 1.00 14.40 C ATOM 569 NZ LYS A 37 17.640 -19.248 -3.491 1.00 11.02 N ATOM 0 H LYS A 37 18.606 -13.375 -2.064 1.00 33.12 H new ATOM 0 HA LYS A 37 16.871 -14.061 -0.028 1.00 12.54 H new ATOM 0 HB2 LYS A 37 19.249 -15.711 -0.927 1.00 53.44 H new ATOM 0 HB3 LYS A 37 17.680 -16.277 -0.387 1.00 53.44 H new ATOM 0 HG2 LYS A 37 16.615 -15.498 -2.438 1.00 41.25 H new ATOM 0 HG3 LYS A 37 18.085 -14.696 -2.956 1.00 41.25 H new ATOM 0 HD2 LYS A 37 18.102 -16.672 -4.224 1.00 31.22 H new ATOM 0 HD3 LYS A 37 19.175 -17.066 -2.896 1.00 31.22 H new ATOM 0 HE2 LYS A 37 17.297 -18.194 -1.699 1.00 14.40 H new ATOM 0 HE3 LYS A 37 16.207 -17.781 -3.007 1.00 14.40 H new ATOM 0 HZ1 LYS A 37 17.012 -20.030 -3.214 1.00 11.02 H new ATOM 0 HZ2 LYS A 37 17.565 -19.090 -4.516 1.00 11.02 H new ATOM 0 HZ3 LYS A 37 18.622 -19.490 -3.249 1.00 11.02 H new ATOM 583 N ASN A 38 20.038 -13.779 0.884 1.00 3.42 N ATOM 584 CA ASN A 38 20.953 -13.598 1.994 1.00 73.42 C ATOM 585 C ASN A 38 20.594 -12.376 2.833 1.00 2.40 C ATOM 586 O ASN A 38 20.780 -12.379 4.044 1.00 34.21 O ATOM 587 CB ASN A 38 22.398 -13.570 1.476 1.00 15.35 C ATOM 588 CG ASN A 38 22.753 -12.467 0.480 1.00 53.44 C ATOM 589 OD1 ASN A 38 21.994 -11.532 0.222 1.00 12.02 O ATOM 590 ND2 ASN A 38 23.913 -12.570 -0.140 1.00 25.15 N ATOM 0 H ASN A 38 20.481 -13.668 -0.028 1.00 3.42 H new ATOM 0 HA ASN A 38 20.862 -14.448 2.670 1.00 73.42 H new ATOM 0 HB2 ASN A 38 23.064 -13.480 2.334 1.00 15.35 H new ATOM 0 HB3 ASN A 38 22.609 -14.531 1.008 1.00 15.35 H new ATOM 0 HD21 ASN A 38 24.183 -11.874 -0.835 1.00 25.15 H new ATOM 0 HD22 ASN A 38 24.540 -13.345 0.076 1.00 25.15 H new ATOM 597 N SER A 39 19.969 -11.386 2.215 1.00 13.02 N ATOM 598 CA SER A 39 19.598 -10.115 2.803 1.00 71.23 C ATOM 599 C SER A 39 18.202 -10.158 3.457 1.00 61.41 C ATOM 600 O SER A 39 17.841 -9.178 4.102 1.00 51.22 O ATOM 601 CB SER A 39 19.678 -9.083 1.669 1.00 20.42 C ATOM 602 OG SER A 39 20.207 -7.820 2.036 1.00 12.24 O ATOM 0 H SER A 39 19.693 -11.455 1.235 1.00 13.02 H new ATOM 0 HA SER A 39 20.273 -9.852 3.617 1.00 71.23 H new ATOM 0 HB2 SER A 39 20.290 -9.496 0.867 1.00 20.42 H new ATOM 0 HB3 SER A 39 18.677 -8.935 1.263 1.00 20.42 H new ATOM 0 HG SER A 39 20.221 -7.231 1.253 1.00 12.24 H new ATOM 608 N ILE A 40 17.425 -11.255 3.355 1.00 33.42 N ATOM 609 CA ILE A 40 16.136 -11.421 4.049 1.00 54.02 C ATOM 610 C ILE A 40 16.367 -11.318 5.565 1.00 4.53 C ATOM 611 O ILE A 40 16.705 -12.321 6.207 1.00 13.13 O ATOM 612 CB ILE A 40 15.406 -12.745 3.668 1.00 0.34 C ATOM 613 CG1 ILE A 40 15.156 -12.952 2.158 1.00 43.33 C ATOM 614 CG2 ILE A 40 14.028 -12.790 4.365 1.00 20.52 C ATOM 615 CD1 ILE A 40 14.832 -14.409 1.796 1.00 63.41 C ATOM 0 H ILE A 40 17.680 -12.059 2.781 1.00 33.42 H new ATOM 0 HA ILE A 40 15.470 -10.621 3.725 1.00 54.02 H new ATOM 0 HB ILE A 40 16.081 -13.536 3.993 1.00 0.34 H new ATOM 0 HG12 ILE A 40 14.332 -12.313 1.841 1.00 43.33 H new ATOM 0 HG13 ILE A 40 16.038 -12.633 1.603 1.00 43.33 H new ATOM 0 HG21 ILE A 40 13.516 -13.715 4.100 1.00 20.52 H new ATOM 0 HG22 ILE A 40 14.165 -12.748 5.446 1.00 20.52 H new ATOM 0 HG23 ILE A 40 13.429 -11.938 4.042 1.00 20.52 H new ATOM 0 HD11 ILE A 40 14.667 -14.489 0.722 1.00 63.41 H new ATOM 0 HD12 ILE A 40 15.666 -15.049 2.083 1.00 63.41 H new ATOM 0 HD13 ILE A 40 13.933 -14.724 2.326 1.00 63.41 H new ATOM 627 N LYS A 41 16.172 -10.138 6.166 1.00 72.43 N ATOM 628 CA LYS A 41 16.128 -10.020 7.618 1.00 3.13 C ATOM 629 C LYS A 41 14.745 -10.427 8.051 1.00 0.00 C ATOM 630 O LYS A 41 13.764 -10.076 7.396 1.00 60.11 O ATOM 631 CB LYS A 41 16.439 -8.586 8.079 1.00 63.24 C ATOM 632 CG LYS A 41 16.479 -8.382 9.601 1.00 31.14 C ATOM 633 CD LYS A 41 17.546 -9.257 10.271 1.00 60.13 C ATOM 634 CE LYS A 41 17.578 -9.014 11.779 1.00 71.11 C ATOM 635 NZ LYS A 41 18.295 -10.099 12.475 1.00 72.22 N ATOM 0 H LYS A 41 16.043 -9.258 5.667 1.00 72.43 H new ATOM 0 HA LYS A 41 16.885 -10.661 8.069 1.00 3.13 H new ATOM 0 HB2 LYS A 41 17.402 -8.289 7.663 1.00 63.24 H new ATOM 0 HB3 LYS A 41 15.689 -7.916 7.658 1.00 63.24 H new ATOM 0 HG2 LYS A 41 16.680 -7.333 9.821 1.00 31.14 H new ATOM 0 HG3 LYS A 41 15.502 -8.615 10.024 1.00 31.14 H new ATOM 0 HD2 LYS A 41 17.338 -10.308 10.072 1.00 60.13 H new ATOM 0 HD3 LYS A 41 18.524 -9.038 9.842 1.00 60.13 H new ATOM 0 HE2 LYS A 41 18.064 -8.061 11.987 1.00 71.11 H new ATOM 0 HE3 LYS A 41 16.560 -8.943 12.161 1.00 71.11 H new ATOM 0 HZ1 LYS A 41 18.302 -9.910 13.498 1.00 72.22 H new ATOM 0 HZ2 LYS A 41 17.816 -11.004 12.294 1.00 72.22 H new ATOM 0 HZ3 LYS A 41 19.273 -10.149 12.125 1.00 72.22 H new ATOM 649 N LYS A 42 14.643 -11.107 9.183 1.00 44.01 N ATOM 650 CA LYS A 42 13.377 -11.272 9.882 1.00 61.34 C ATOM 651 C LYS A 42 13.424 -10.401 11.123 1.00 0.33 C ATOM 652 O LYS A 42 14.491 -10.206 11.701 1.00 15.23 O ATOM 653 CB LYS A 42 13.125 -12.724 10.293 1.00 0.02 C ATOM 654 CG LYS A 42 13.086 -13.788 9.190 1.00 51.44 C ATOM 655 CD LYS A 42 12.412 -13.430 7.864 1.00 43.51 C ATOM 656 CE LYS A 42 12.095 -14.685 7.022 1.00 64.42 C ATOM 657 NZ LYS A 42 13.114 -15.770 7.096 1.00 14.21 N ATOM 0 H LYS A 42 15.434 -11.559 9.642 1.00 44.01 H new ATOM 0 HA LYS A 42 12.566 -10.984 9.214 1.00 61.34 H new ATOM 0 HB2 LYS A 42 13.900 -13.009 11.004 1.00 0.02 H new ATOM 0 HB3 LYS A 42 12.175 -12.760 10.826 1.00 0.02 H new ATOM 0 HG2 LYS A 42 14.113 -14.081 8.973 1.00 51.44 H new ATOM 0 HG3 LYS A 42 12.583 -14.667 9.593 1.00 51.44 H new ATOM 0 HD2 LYS A 42 11.490 -12.883 8.061 1.00 43.51 H new ATOM 0 HD3 LYS A 42 13.061 -12.765 7.294 1.00 43.51 H new ATOM 0 HE2 LYS A 42 11.135 -15.087 7.345 1.00 64.42 H new ATOM 0 HE3 LYS A 42 11.981 -14.385 5.980 1.00 64.42 H new ATOM 0 HZ1 LYS A 42 12.896 -16.500 6.388 1.00 14.21 H new ATOM 0 HZ2 LYS A 42 14.057 -15.374 6.906 1.00 14.21 H new ATOM 0 HZ3 LYS A 42 13.101 -16.194 8.046 1.00 14.21 H new ATOM 671 N GLU A 43 12.260 -9.930 11.541 1.00 74.24 N ATOM 672 CA GLU A 43 12.077 -9.232 12.794 1.00 71.23 C ATOM 673 C GLU A 43 12.008 -10.255 13.919 1.00 22.44 C ATOM 674 O GLU A 43 11.857 -11.456 13.671 1.00 0.32 O ATOM 675 CB GLU A 43 10.764 -8.424 12.729 1.00 23.41 C ATOM 676 CG GLU A 43 10.998 -6.936 12.459 1.00 35.13 C ATOM 677 CD GLU A 43 11.679 -6.219 13.629 1.00 52.43 C ATOM 678 OE1 GLU A 43 12.162 -6.893 14.574 1.00 42.42 O ATOM 679 OE2 GLU A 43 11.808 -4.980 13.560 1.00 60.32 O ATOM 0 H GLU A 43 11.399 -10.027 11.003 1.00 74.24 H new ATOM 0 HA GLU A 43 12.908 -8.551 12.977 1.00 71.23 H new ATOM 0 HB2 GLU A 43 10.128 -8.835 11.945 1.00 23.41 H new ATOM 0 HB3 GLU A 43 10.225 -8.538 13.670 1.00 23.41 H new ATOM 0 HG2 GLU A 43 11.612 -6.826 11.565 1.00 35.13 H new ATOM 0 HG3 GLU A 43 10.042 -6.455 12.251 1.00 35.13 H new ATOM 686 N ASP A 44 12.037 -9.764 15.154 1.00 20.53 N ATOM 687 CA ASP A 44 11.744 -10.558 16.348 1.00 21.41 C ATOM 688 C ASP A 44 10.318 -11.091 16.287 1.00 54.51 C ATOM 689 O ASP A 44 10.063 -12.266 16.528 1.00 52.24 O ATOM 690 CB ASP A 44 11.896 -9.715 17.609 1.00 11.33 C ATOM 691 CG ASP A 44 11.751 -10.598 18.847 1.00 42.53 C ATOM 692 OD1 ASP A 44 12.703 -11.375 19.096 1.00 0.03 O ATOM 693 OD2 ASP A 44 10.721 -10.460 19.550 1.00 23.22 O ATOM 0 H ASP A 44 12.267 -8.792 15.359 1.00 20.53 H new ATOM 0 HA ASP A 44 12.451 -11.387 16.380 1.00 21.41 H new ATOM 0 HB2 ASP A 44 12.869 -9.225 17.614 1.00 11.33 H new ATOM 0 HB3 ASP A 44 11.142 -8.928 17.623 1.00 11.33 H new ATOM 698 N ASN A 45 9.386 -10.231 15.863 1.00 34.10 N ATOM 699 CA ASN A 45 7.990 -10.575 15.596 1.00 31.53 C ATOM 700 C ASN A 45 7.832 -11.486 14.360 1.00 3.24 C ATOM 701 O ASN A 45 6.716 -11.796 13.954 1.00 33.31 O ATOM 702 CB ASN A 45 7.165 -9.286 15.450 1.00 32.25 C ATOM 703 CG ASN A 45 5.778 -9.411 16.075 1.00 24.34 C ATOM 704 OD1 ASN A 45 5.433 -8.646 16.970 1.00 15.23 O ATOM 705 ND2 ASN A 45 4.979 -10.373 15.660 1.00 75.52 N ATOM 0 H ASN A 45 9.591 -9.247 15.692 1.00 34.10 H new ATOM 0 HA ASN A 45 7.615 -11.149 16.443 1.00 31.53 H new ATOM 0 HB2 ASN A 45 7.699 -8.460 15.920 1.00 32.25 H new ATOM 0 HB3 ASN A 45 7.064 -9.040 14.393 1.00 32.25 H new ATOM 0 HD21 ASN A 45 4.059 -10.490 16.084 1.00 75.52 H new ATOM 0 HD22 ASN A 45 5.281 -11.001 14.915 1.00 75.52 H new ATOM 712 N GLY A 46 8.936 -11.892 13.726 1.00 22.12 N ATOM 713 CA GLY A 46 8.999 -12.911 12.690 1.00 21.10 C ATOM 714 C GLY A 46 8.344 -12.434 11.404 1.00 20.12 C ATOM 715 O GLY A 46 7.519 -13.131 10.814 1.00 0.04 O ATOM 0 H GLY A 46 9.852 -11.495 13.936 1.00 22.12 H new ATOM 0 HA2 GLY A 46 10.040 -13.171 12.496 1.00 21.10 H new ATOM 0 HA3 GLY A 46 8.504 -13.817 13.038 1.00 21.10 H new ATOM 719 N PHE A 47 8.677 -11.207 11.002 1.00 20.11 N ATOM 720 CA PHE A 47 8.076 -10.553 9.852 1.00 54.43 C ATOM 721 C PHE A 47 8.843 -10.954 8.585 1.00 62.25 C ATOM 722 O PHE A 47 8.720 -12.086 8.109 1.00 31.31 O ATOM 723 CB PHE A 47 8.002 -9.039 10.139 1.00 43.02 C ATOM 724 CG PHE A 47 6.761 -8.380 9.597 1.00 33.33 C ATOM 725 CD1 PHE A 47 6.587 -8.134 8.222 1.00 43.02 C ATOM 726 CD2 PHE A 47 5.758 -8.011 10.507 1.00 45.04 C ATOM 727 CE1 PHE A 47 5.431 -7.474 7.774 1.00 2.21 C ATOM 728 CE2 PHE A 47 4.613 -7.342 10.055 1.00 60.43 C ATOM 729 CZ PHE A 47 4.449 -7.057 8.689 1.00 25.43 C ATOM 0 H PHE A 47 9.380 -10.638 11.474 1.00 20.11 H new ATOM 0 HA PHE A 47 7.050 -10.873 9.672 1.00 54.43 H new ATOM 0 HB2 PHE A 47 8.046 -8.880 11.216 1.00 43.02 H new ATOM 0 HB3 PHE A 47 8.878 -8.553 9.709 1.00 43.02 H new ATOM 0 HD1 PHE A 47 7.339 -8.451 7.515 1.00 43.02 H new ATOM 0 HD2 PHE A 47 5.869 -8.243 11.556 1.00 45.04 H new ATOM 0 HE1 PHE A 47 5.296 -7.286 6.719 1.00 2.21 H new ATOM 0 HE2 PHE A 47 3.852 -7.044 10.761 1.00 60.43 H new ATOM 0 HZ PHE A 47 3.576 -6.522 8.345 1.00 25.43 H new ATOM 739 N GLY A 48 9.735 -10.091 8.103 1.00 52.11 N ATOM 740 CA GLY A 48 10.577 -10.287 6.943 1.00 43.12 C ATOM 741 C GLY A 48 10.620 -8.984 6.143 1.00 71.11 C ATOM 742 O GLY A 48 9.592 -8.560 5.615 1.00 31.50 O ATOM 0 H GLY A 48 9.892 -9.185 8.544 1.00 52.11 H new ATOM 0 HA2 GLY A 48 11.582 -10.575 7.250 1.00 43.12 H new ATOM 0 HA3 GLY A 48 10.188 -11.097 6.326 1.00 43.12 H new ATOM 746 N TRP A 49 11.785 -8.330 6.098 1.00 24.15 N ATOM 747 CA TRP A 49 12.041 -7.073 5.404 1.00 33.44 C ATOM 748 C TRP A 49 13.388 -7.183 4.683 1.00 32.21 C ATOM 749 O TRP A 49 14.217 -8.020 5.058 1.00 64.21 O ATOM 750 CB TRP A 49 11.983 -5.860 6.363 1.00 22.22 C ATOM 751 CG TRP A 49 13.017 -5.699 7.439 1.00 32.20 C ATOM 752 CD1 TRP A 49 12.773 -5.777 8.764 1.00 11.31 C ATOM 753 CD2 TRP A 49 14.405 -5.251 7.325 1.00 34.45 C ATOM 754 NE1 TRP A 49 13.927 -5.508 9.470 1.00 3.40 N ATOM 755 CE2 TRP A 49 14.983 -5.228 8.626 1.00 20.42 C ATOM 756 CE3 TRP A 49 15.226 -4.817 6.264 1.00 73.31 C ATOM 757 CZ2 TRP A 49 16.339 -4.926 8.832 1.00 34.54 C ATOM 758 CZ3 TRP A 49 16.585 -4.508 6.451 1.00 71.24 C ATOM 759 CH2 TRP A 49 17.151 -4.603 7.733 1.00 22.33 C ATOM 0 H TRP A 49 12.616 -8.686 6.571 1.00 24.15 H new ATOM 0 HA TRP A 49 11.256 -6.897 4.668 1.00 33.44 H new ATOM 0 HB2 TRP A 49 12.013 -4.960 5.748 1.00 22.22 H new ATOM 0 HB3 TRP A 49 11.009 -5.880 6.851 1.00 22.22 H new ATOM 0 HD1 TRP A 49 11.817 -6.015 9.206 1.00 11.31 H new ATOM 0 HE1 TRP A 49 13.992 -5.515 10.488 1.00 3.40 H new ATOM 0 HE3 TRP A 49 14.798 -4.719 5.277 1.00 73.31 H new ATOM 0 HZ2 TRP A 49 16.754 -4.942 9.829 1.00 34.54 H new ATOM 0 HZ3 TRP A 49 17.191 -4.199 5.612 1.00 71.24 H new ATOM 0 HH2 TRP A 49 18.208 -4.428 7.873 1.00 22.33 H new ATOM 770 N ILE A 50 13.617 -6.343 3.669 1.00 13.53 N ATOM 771 CA ILE A 50 14.909 -6.161 2.998 1.00 23.30 C ATOM 772 C ILE A 50 15.031 -4.667 2.675 1.00 23.45 C ATOM 773 O ILE A 50 14.021 -4.035 2.356 1.00 35.20 O ATOM 774 CB ILE A 50 15.016 -7.038 1.723 1.00 21.30 C ATOM 775 CG1 ILE A 50 14.760 -8.517 2.044 1.00 72.22 C ATOM 776 CG2 ILE A 50 16.420 -6.937 1.108 1.00 14.13 C ATOM 777 CD1 ILE A 50 14.920 -9.462 0.856 1.00 11.32 C ATOM 0 H ILE A 50 12.884 -5.751 3.279 1.00 13.53 H new ATOM 0 HA ILE A 50 15.729 -6.480 3.642 1.00 23.30 H new ATOM 0 HB ILE A 50 14.265 -6.670 1.024 1.00 21.30 H new ATOM 0 HG12 ILE A 50 15.445 -8.828 2.833 1.00 72.22 H new ATOM 0 HG13 ILE A 50 13.750 -8.620 2.440 1.00 72.22 H new ATOM 0 HG21 ILE A 50 16.472 -7.560 0.215 1.00 14.13 H new ATOM 0 HG22 ILE A 50 16.626 -5.901 0.840 1.00 14.13 H new ATOM 0 HG23 ILE A 50 17.160 -7.278 1.832 1.00 14.13 H new ATOM 0 HD11 ILE A 50 14.720 -10.485 1.175 1.00 11.32 H new ATOM 0 HD12 ILE A 50 14.216 -9.183 0.072 1.00 11.32 H new ATOM 0 HD13 ILE A 50 15.938 -9.394 0.471 1.00 11.32 H new ATOM 789 N ASP A 51 16.232 -4.095 2.796 1.00 0.25 N ATOM 790 CA ASP A 51 16.571 -2.788 2.247 1.00 32.31 C ATOM 791 C ASP A 51 16.716 -2.915 0.739 1.00 0.42 C ATOM 792 O ASP A 51 17.388 -3.819 0.234 1.00 44.05 O ATOM 793 CB ASP A 51 17.858 -2.232 2.881 1.00 5.40 C ATOM 794 CG ASP A 51 18.970 -1.978 1.848 1.00 12.12 C ATOM 795 OD1 ASP A 51 18.884 -1.016 1.045 1.00 52.54 O ATOM 796 OD2 ASP A 51 19.857 -2.861 1.793 1.00 73.13 O ATOM 0 H ASP A 51 17.007 -4.539 3.288 1.00 0.25 H new ATOM 0 HA ASP A 51 15.773 -2.082 2.479 1.00 32.31 H new ATOM 0 HB2 ASP A 51 17.629 -1.300 3.399 1.00 5.40 H new ATOM 0 HB3 ASP A 51 18.220 -2.934 3.633 1.00 5.40 H new ATOM 801 N ILE A 52 16.104 -1.985 0.021 1.00 53.41 N ATOM 802 CA ILE A 52 16.270 -1.879 -1.417 1.00 31.43 C ATOM 803 C ILE A 52 16.616 -0.442 -1.815 1.00 35.41 C ATOM 804 O ILE A 52 16.665 -0.152 -3.005 1.00 71.54 O ATOM 805 CB ILE A 52 15.089 -2.547 -2.162 1.00 21.41 C ATOM 806 CG1 ILE A 52 13.718 -1.872 -1.982 1.00 61.42 C ATOM 807 CG2 ILE A 52 14.936 -4.019 -1.734 1.00 23.45 C ATOM 808 CD1 ILE A 52 13.635 -0.529 -2.695 1.00 14.12 C ATOM 0 H ILE A 52 15.479 -1.284 0.420 1.00 53.41 H new ATOM 0 HA ILE A 52 17.134 -2.455 -1.748 1.00 31.43 H new ATOM 0 HB ILE A 52 15.362 -2.445 -3.212 1.00 21.41 H new ATOM 0 HG12 ILE A 52 12.938 -2.532 -2.363 1.00 61.42 H new ATOM 0 HG13 ILE A 52 13.523 -1.729 -0.919 1.00 61.42 H new ATOM 0 HG21 ILE A 52 14.100 -4.469 -2.270 1.00 23.45 H new ATOM 0 HG22 ILE A 52 15.851 -4.563 -1.967 1.00 23.45 H new ATOM 0 HG23 ILE A 52 14.748 -4.068 -0.661 1.00 23.45 H new ATOM 0 HD11 ILE A 52 12.648 -0.094 -2.537 1.00 14.12 H new ATOM 0 HD12 ILE A 52 14.396 0.142 -2.296 1.00 14.12 H new ATOM 0 HD13 ILE A 52 13.802 -0.673 -3.763 1.00 14.12 H new ATOM 820 N GLY A 53 16.962 0.436 -0.862 1.00 34.22 N ATOM 821 CA GLY A 53 17.504 1.763 -1.154 1.00 21.13 C ATOM 822 C GLY A 53 18.723 1.699 -2.084 1.00 1.00 C ATOM 823 O GLY A 53 19.054 2.671 -2.773 1.00 21.14 O ATOM 0 H GLY A 53 16.872 0.241 0.135 1.00 34.22 H new ATOM 0 HA2 GLY A 53 16.730 2.377 -1.614 1.00 21.13 H new ATOM 0 HA3 GLY A 53 17.786 2.252 -0.221 1.00 21.13 H new ATOM 827 N ASN A 54 19.394 0.546 -2.129 1.00 2.21 N ATOM 828 CA ASN A 54 20.539 0.282 -2.991 1.00 43.54 C ATOM 829 C ASN A 54 20.137 0.091 -4.454 1.00 31.44 C ATOM 830 O ASN A 54 20.949 0.377 -5.329 1.00 20.22 O ATOM 831 CB ASN A 54 21.293 -0.964 -2.508 1.00 22.24 C ATOM 832 CG ASN A 54 22.079 -0.711 -1.230 1.00 51.11 C ATOM 833 OD1 ASN A 54 23.301 -0.738 -1.233 1.00 1.51 O ATOM 834 ND2 ASN A 54 21.411 -0.450 -0.123 1.00 1.14 N ATOM 0 H ASN A 54 19.144 -0.253 -1.546 1.00 2.21 H new ATOM 0 HA ASN A 54 21.185 1.158 -2.933 1.00 43.54 H new ATOM 0 HB2 ASN A 54 20.582 -1.772 -2.339 1.00 22.24 H new ATOM 0 HB3 ASN A 54 21.975 -1.298 -3.290 1.00 22.24 H new ATOM 0 HD21 ASN A 54 21.914 -0.267 0.745 1.00 1.14 H new ATOM 0 HD22 ASN A 54 20.391 -0.431 -0.135 1.00 1.14 H new ATOM 841 N GLU A 55 18.900 -0.332 -4.747 1.00 40.23 N ATOM 842 CA GLU A 55 18.366 -0.288 -6.111 1.00 23.42 C ATOM 843 C GLU A 55 18.156 1.157 -6.559 1.00 0.53 C ATOM 844 O GLU A 55 18.113 1.428 -7.756 1.00 23.24 O ATOM 845 CB GLU A 55 17.012 -1.006 -6.218 1.00 55.01 C ATOM 846 CG GLU A 55 17.078 -2.524 -6.375 1.00 21.40 C ATOM 847 CD GLU A 55 17.421 -2.944 -7.819 1.00 73.22 C ATOM 848 OE1 GLU A 55 18.571 -2.684 -8.242 1.00 60.15 O ATOM 849 OE2 GLU A 55 16.543 -3.477 -8.544 1.00 51.02 O ATOM 0 H GLU A 55 18.251 -0.709 -4.056 1.00 40.23 H new ATOM 0 HA GLU A 55 19.097 -0.789 -6.745 1.00 23.42 H new ATOM 0 HB2 GLU A 55 16.428 -0.776 -5.327 1.00 55.01 H new ATOM 0 HB3 GLU A 55 16.469 -0.594 -7.069 1.00 55.01 H new ATOM 0 HG2 GLU A 55 17.827 -2.926 -5.693 1.00 21.40 H new ATOM 0 HG3 GLU A 55 16.121 -2.959 -6.089 1.00 21.40 H new ATOM 856 N ASN A 56 18.005 2.098 -5.617 1.00 22.50 N ATOM 857 CA ASN A 56 17.756 3.523 -5.874 1.00 51.22 C ATOM 858 C ASN A 56 16.444 3.830 -6.630 1.00 23.25 C ATOM 859 O ASN A 56 16.136 5.006 -6.797 1.00 55.32 O ATOM 860 CB ASN A 56 18.911 4.220 -6.631 1.00 53.35 C ATOM 861 CG ASN A 56 20.345 3.872 -6.261 1.00 64.41 C ATOM 862 OD1 ASN A 56 21.241 3.969 -7.092 1.00 72.43 O ATOM 863 ND2 ASN A 56 20.639 3.537 -5.013 1.00 15.11 N ATOM 0 H ASN A 56 18.055 1.881 -4.622 1.00 22.50 H new ATOM 0 HA ASN A 56 17.672 3.926 -4.865 1.00 51.22 H new ATOM 0 HB2 ASN A 56 18.784 4.010 -7.693 1.00 53.35 H new ATOM 0 HB3 ASN A 56 18.789 5.295 -6.502 1.00 53.35 H new ATOM 0 HD21 ASN A 56 21.608 3.361 -4.747 1.00 15.11 H new ATOM 0 HD22 ASN A 56 19.896 3.455 -4.318 1.00 15.11 H new ATOM 870 N ILE A 57 15.706 2.815 -7.105 1.00 22.31 N ATOM 871 CA ILE A 57 14.523 2.877 -7.978 1.00 14.12 C ATOM 872 C ILE A 57 13.540 3.950 -7.496 1.00 62.23 C ATOM 873 O ILE A 57 13.307 4.032 -6.290 1.00 62.11 O ATOM 874 CB ILE A 57 13.884 1.457 -8.000 1.00 5.05 C ATOM 875 CG1 ILE A 57 14.640 0.537 -8.981 1.00 33.21 C ATOM 876 CG2 ILE A 57 12.383 1.450 -8.335 1.00 24.30 C ATOM 877 CD1 ILE A 57 14.299 -0.957 -8.854 1.00 4.41 C ATOM 0 H ILE A 57 15.940 1.851 -6.869 1.00 22.31 H new ATOM 0 HA ILE A 57 14.804 3.165 -8.991 1.00 14.12 H new ATOM 0 HB ILE A 57 13.976 1.080 -6.981 1.00 5.05 H new ATOM 0 HG12 ILE A 57 14.424 0.860 -10.000 1.00 33.21 H new ATOM 0 HG13 ILE A 57 15.711 0.666 -8.826 1.00 33.21 H new ATOM 0 HG21 ILE A 57 12.014 0.424 -8.330 1.00 24.30 H new ATOM 0 HG22 ILE A 57 11.841 2.034 -7.591 1.00 24.30 H new ATOM 0 HG23 ILE A 57 12.228 1.887 -9.322 1.00 24.30 H new ATOM 0 HD11 ILE A 57 14.877 -1.525 -9.582 1.00 4.41 H new ATOM 0 HD12 ILE A 57 14.542 -1.302 -7.849 1.00 4.41 H new ATOM 0 HD13 ILE A 57 13.235 -1.105 -9.041 1.00 4.41 H new ATOM 889 N TYR A 58 12.856 4.665 -8.398 1.00 43.22 N ATOM 890 CA TYR A 58 11.908 5.705 -8.020 1.00 22.31 C ATOM 891 C TYR A 58 10.462 5.237 -8.148 1.00 14.15 C ATOM 892 O TYR A 58 10.040 4.684 -9.168 1.00 54.14 O ATOM 893 CB TYR A 58 12.134 6.952 -8.869 1.00 2.54 C ATOM 894 CG TYR A 58 13.425 7.662 -8.530 1.00 45.01 C ATOM 895 CD1 TYR A 58 13.434 8.573 -7.461 1.00 55.21 C ATOM 896 CD2 TYR A 58 14.618 7.386 -9.228 1.00 1.44 C ATOM 897 CE1 TYR A 58 14.621 9.216 -7.092 1.00 63.51 C ATOM 898 CE2 TYR A 58 15.815 8.033 -8.858 1.00 35.54 C ATOM 899 CZ TYR A 58 15.827 8.946 -7.778 1.00 13.20 C ATOM 900 OH TYR A 58 16.983 9.559 -7.390 1.00 63.12 O ATOM 0 H TYR A 58 12.948 4.535 -9.405 1.00 43.22 H new ATOM 0 HA TYR A 58 12.082 5.942 -6.970 1.00 22.31 H new ATOM 0 HB2 TYR A 58 12.144 6.673 -9.923 1.00 2.54 H new ATOM 0 HB3 TYR A 58 11.299 7.638 -8.729 1.00 2.54 H new ATOM 0 HD1 TYR A 58 12.521 8.778 -6.922 1.00 55.21 H new ATOM 0 HD2 TYR A 58 14.615 6.680 -10.045 1.00 1.44 H new ATOM 0 HE1 TYR A 58 14.616 9.924 -6.277 1.00 63.51 H new ATOM 0 HE2 TYR A 58 16.726 7.831 -9.401 1.00 35.54 H new ATOM 0 HH TYR A 58 17.719 9.263 -7.965 1.00 63.12 H new ATOM 910 N ILE A 59 9.669 5.540 -7.128 1.00 31.15 N ATOM 911 CA ILE A 59 8.231 5.350 -7.084 1.00 61.43 C ATOM 912 C ILE A 59 7.578 6.721 -7.267 1.00 2.22 C ATOM 913 O ILE A 59 8.136 7.739 -6.841 1.00 71.14 O ATOM 914 CB ILE A 59 7.844 4.610 -5.779 1.00 23.30 C ATOM 915 CG1 ILE A 59 6.324 4.373 -5.704 1.00 42.03 C ATOM 916 CG2 ILE A 59 8.340 5.340 -4.518 1.00 32.35 C ATOM 917 CD1 ILE A 59 5.914 3.274 -4.721 1.00 11.02 C ATOM 0 H ILE A 59 10.034 5.946 -6.266 1.00 31.15 H new ATOM 0 HA ILE A 59 7.866 4.711 -7.888 1.00 61.43 H new ATOM 0 HB ILE A 59 8.347 3.643 -5.810 1.00 23.30 H new ATOM 0 HG12 ILE A 59 5.835 5.304 -5.417 1.00 42.03 H new ATOM 0 HG13 ILE A 59 5.957 4.113 -6.697 1.00 42.03 H new ATOM 0 HG21 ILE A 59 8.042 4.779 -3.632 1.00 32.35 H new ATOM 0 HG22 ILE A 59 9.427 5.421 -4.548 1.00 32.35 H new ATOM 0 HG23 ILE A 59 7.903 6.338 -4.480 1.00 32.35 H new ATOM 0 HD11 ILE A 59 4.829 3.168 -4.726 1.00 11.02 H new ATOM 0 HD12 ILE A 59 6.372 2.331 -5.018 1.00 11.02 H new ATOM 0 HD13 ILE A 59 6.248 3.540 -3.718 1.00 11.02 H new ATOM 929 N LYS A 60 6.393 6.766 -7.886 1.00 31.11 N ATOM 930 CA LYS A 60 5.575 7.966 -7.818 1.00 20.20 C ATOM 931 C LYS A 60 5.073 8.062 -6.392 1.00 0.41 C ATOM 932 O LYS A 60 4.294 7.213 -5.960 1.00 24.13 O ATOM 933 CB LYS A 60 4.394 7.922 -8.790 1.00 12.13 C ATOM 934 CG LYS A 60 4.795 8.298 -10.220 1.00 65.25 C ATOM 935 CD LYS A 60 3.728 9.145 -10.927 1.00 31.55 C ATOM 936 CE LYS A 60 4.386 9.901 -12.078 1.00 65.41 C ATOM 937 NZ LYS A 60 3.442 10.814 -12.739 1.00 13.22 N ATOM 0 H LYS A 60 5.992 6.000 -8.427 1.00 31.11 H new ATOM 0 HA LYS A 60 6.169 8.835 -8.103 1.00 20.20 H new ATOM 0 HB2 LYS A 60 3.964 6.920 -8.788 1.00 12.13 H new ATOM 0 HB3 LYS A 60 3.617 8.603 -8.443 1.00 12.13 H new ATOM 0 HG2 LYS A 60 5.735 8.849 -10.197 1.00 65.25 H new ATOM 0 HG3 LYS A 60 4.972 7.389 -10.795 1.00 65.25 H new ATOM 0 HD2 LYS A 60 2.927 8.508 -11.302 1.00 31.55 H new ATOM 0 HD3 LYS A 60 3.275 9.845 -10.225 1.00 31.55 H new ATOM 0 HE2 LYS A 60 5.237 10.468 -11.701 1.00 65.41 H new ATOM 0 HE3 LYS A 60 4.774 9.189 -12.806 1.00 65.41 H new ATOM 0 HZ1 LYS A 60 3.925 11.310 -13.515 1.00 13.22 H new ATOM 0 HZ2 LYS A 60 2.642 10.270 -13.120 1.00 13.22 H new ATOM 0 HZ3 LYS A 60 3.091 11.509 -12.050 1.00 13.22 H new ATOM 951 N SER A 61 5.529 9.069 -5.667 1.00 40.42 N ATOM 952 CA SER A 61 5.083 9.346 -4.324 1.00 0.42 C ATOM 953 C SER A 61 4.207 10.595 -4.389 1.00 62.23 C ATOM 954 O SER A 61 3.732 11.009 -5.454 1.00 71.12 O ATOM 955 CB SER A 61 6.322 9.450 -3.422 1.00 44.35 C ATOM 956 OG SER A 61 5.962 9.119 -2.103 1.00 44.02 O ATOM 0 H SER A 61 6.232 9.725 -6.007 1.00 40.42 H new ATOM 0 HA SER A 61 4.468 8.560 -3.886 1.00 0.42 H new ATOM 0 HB2 SER A 61 7.103 8.779 -3.778 1.00 44.35 H new ATOM 0 HB3 SER A 61 6.729 10.460 -3.458 1.00 44.35 H new ATOM 0 HG SER A 61 6.750 9.182 -1.523 1.00 44.02 H new ATOM 962 N PHE A 62 3.927 11.172 -3.231 1.00 43.11 N ATOM 963 CA PHE A 62 3.352 12.490 -3.095 1.00 22.33 C ATOM 964 C PHE A 62 3.851 13.053 -1.760 1.00 51.33 C ATOM 965 O PHE A 62 4.274 12.284 -0.889 1.00 53.22 O ATOM 966 CB PHE A 62 1.822 12.379 -3.214 1.00 52.42 C ATOM 967 CG PHE A 62 1.041 12.529 -1.935 1.00 33.31 C ATOM 968 CD1 PHE A 62 0.782 11.394 -1.147 1.00 64.34 C ATOM 969 CD2 PHE A 62 0.589 13.799 -1.531 1.00 52.03 C ATOM 970 CE1 PHE A 62 0.066 11.531 0.051 1.00 62.43 C ATOM 971 CE2 PHE A 62 -0.105 13.935 -0.319 1.00 74.42 C ATOM 972 CZ PHE A 62 -0.352 12.802 0.463 1.00 13.24 C ATOM 0 H PHE A 62 4.101 10.717 -2.335 1.00 43.11 H new ATOM 0 HA PHE A 62 3.656 13.183 -3.880 1.00 22.33 H new ATOM 0 HB2 PHE A 62 1.477 13.138 -3.916 1.00 52.42 H new ATOM 0 HB3 PHE A 62 1.582 11.409 -3.650 1.00 52.42 H new ATOM 0 HD1 PHE A 62 1.132 10.422 -1.462 1.00 64.34 H new ATOM 0 HD2 PHE A 62 0.775 14.664 -2.150 1.00 52.03 H new ATOM 0 HE1 PHE A 62 -0.161 10.662 0.651 1.00 62.43 H new ATOM 0 HE2 PHE A 62 -0.446 14.907 0.007 1.00 74.42 H new ATOM 0 HZ PHE A 62 -0.875 12.910 1.402 1.00 13.24 H new ATOM 982 N ASN A 63 3.810 14.374 -1.594 1.00 13.40 N ATOM 983 CA ASN A 63 4.202 15.074 -0.384 1.00 5.33 C ATOM 984 C ASN A 63 2.995 15.740 0.260 1.00 74.43 C ATOM 985 O ASN A 63 2.403 16.664 -0.301 1.00 53.34 O ATOM 986 CB ASN A 63 5.307 16.095 -0.679 1.00 33.34 C ATOM 987 CG ASN A 63 6.701 15.499 -0.594 1.00 53.23 C ATOM 988 OD1 ASN A 63 6.911 14.289 -0.611 1.00 71.44 O ATOM 989 ND2 ASN A 63 7.692 16.355 -0.509 1.00 53.33 N ATOM 0 H ASN A 63 3.490 15.004 -2.329 1.00 13.40 H new ATOM 0 HA ASN A 63 4.603 14.346 0.322 1.00 5.33 H new ATOM 0 HB2 ASN A 63 5.155 16.510 -1.676 1.00 33.34 H new ATOM 0 HB3 ASN A 63 5.228 16.922 0.026 1.00 33.34 H new ATOM 0 HD21 ASN A 63 8.653 16.018 -0.456 1.00 53.33 H new ATOM 0 HD22 ASN A 63 7.501 17.357 -0.496 1.00 53.33 H new ATOM 996 N LYS A 64 2.660 15.301 1.474 1.00 12.23 N ATOM 997 CA LYS A 64 1.552 15.805 2.294 1.00 41.01 C ATOM 998 C LYS A 64 1.644 17.302 2.572 1.00 42.33 C ATOM 999 O LYS A 64 0.622 17.961 2.758 1.00 72.24 O ATOM 1000 CB LYS A 64 1.450 15.019 3.618 1.00 53.12 C ATOM 1001 CG LYS A 64 0.092 15.288 4.289 1.00 71.34 C ATOM 1002 CD LYS A 64 -0.288 14.312 5.419 1.00 54.21 C ATOM 1003 CE LYS A 64 -0.223 14.853 6.850 1.00 63.24 C ATOM 1004 NZ LYS A 64 1.072 14.613 7.512 1.00 3.34 N ATOM 0 H LYS A 64 3.175 14.551 1.935 1.00 12.23 H new ATOM 0 HA LYS A 64 0.645 15.649 1.711 1.00 41.01 H new ATOM 0 HB2 LYS A 64 1.565 13.952 3.426 1.00 53.12 H new ATOM 0 HB3 LYS A 64 2.259 15.312 4.287 1.00 53.12 H new ATOM 0 HG2 LYS A 64 0.099 16.301 4.693 1.00 71.34 H new ATOM 0 HG3 LYS A 64 -0.685 15.254 3.525 1.00 71.34 H new ATOM 0 HD2 LYS A 64 -1.303 13.958 5.235 1.00 54.21 H new ATOM 0 HD3 LYS A 64 0.369 13.445 5.354 1.00 54.21 H new ATOM 0 HE2 LYS A 64 -0.420 15.925 6.834 1.00 63.24 H new ATOM 0 HE3 LYS A 64 -1.015 14.392 7.440 1.00 63.24 H new ATOM 0 HZ1 LYS A 64 1.047 15.004 8.475 1.00 3.34 H new ATOM 0 HZ2 LYS A 64 1.254 13.590 7.558 1.00 3.34 H new ATOM 0 HZ3 LYS A 64 1.830 15.076 6.970 1.00 3.34 H new ATOM 1018 N LEU A 65 2.861 17.841 2.562 1.00 11.25 N ATOM 1019 CA LEU A 65 3.181 19.213 2.909 1.00 41.43 C ATOM 1020 C LEU A 65 2.494 20.224 1.987 1.00 23.43 C ATOM 1021 O LEU A 65 2.290 21.359 2.413 1.00 51.41 O ATOM 1022 CB LEU A 65 4.715 19.373 2.905 1.00 40.24 C ATOM 1023 CG LEU A 65 5.303 19.427 4.328 1.00 54.02 C ATOM 1024 CD1 LEU A 65 6.792 19.076 4.316 1.00 44.03 C ATOM 1025 CD2 LEU A 65 5.119 20.803 4.984 1.00 35.14 C ATOM 0 H LEU A 65 3.686 17.303 2.298 1.00 11.25 H new ATOM 0 HA LEU A 65 2.797 19.427 3.906 1.00 41.43 H new ATOM 0 HB2 LEU A 65 5.163 18.542 2.361 1.00 40.24 H new ATOM 0 HB3 LEU A 65 4.981 20.284 2.370 1.00 40.24 H new ATOM 0 HG LEU A 65 4.754 18.691 4.915 1.00 54.02 H new ATOM 0 HD11 LEU A 65 7.185 19.121 5.332 1.00 44.03 H new ATOM 0 HD12 LEU A 65 6.925 18.069 3.920 1.00 44.03 H new ATOM 0 HD13 LEU A 65 7.328 19.787 3.688 1.00 44.03 H new ATOM 0 HD21 LEU A 65 5.550 20.789 5.985 1.00 35.14 H new ATOM 0 HD22 LEU A 65 5.620 21.562 4.384 1.00 35.14 H new ATOM 0 HD23 LEU A 65 4.056 21.036 5.050 1.00 35.14 H new ATOM 1037 N SER A 66 2.095 19.823 0.778 1.00 31.22 N ATOM 1038 CA SER A 66 1.294 20.636 -0.133 1.00 14.35 C ATOM 1039 C SER A 66 0.377 19.788 -1.022 1.00 34.41 C ATOM 1040 O SER A 66 -0.213 20.313 -1.963 1.00 12.33 O ATOM 1041 CB SER A 66 2.251 21.498 -0.964 1.00 64.22 C ATOM 1042 OG SER A 66 2.748 22.584 -0.213 1.00 3.51 O ATOM 0 H SER A 66 2.326 18.904 0.399 1.00 31.22 H new ATOM 0 HA SER A 66 0.626 21.273 0.446 1.00 14.35 H new ATOM 0 HB2 SER A 66 3.082 20.886 -1.316 1.00 64.22 H new ATOM 0 HB3 SER A 66 1.733 21.871 -1.848 1.00 64.22 H new ATOM 0 HG SER A 66 2.554 22.441 0.737 1.00 3.51 H new ATOM 1048 N LEU A 67 0.236 18.485 -0.750 1.00 72.52 N ATOM 1049 CA LEU A 67 -0.557 17.558 -1.555 1.00 11.41 C ATOM 1050 C LEU A 67 -0.094 17.624 -3.020 1.00 44.22 C ATOM 1051 O LEU A 67 -0.873 17.799 -3.962 1.00 20.21 O ATOM 1052 CB LEU A 67 -2.068 17.784 -1.330 1.00 3.14 C ATOM 1053 CG LEU A 67 -2.500 17.963 0.147 1.00 72.12 C ATOM 1054 CD1 LEU A 67 -3.930 18.491 0.243 1.00 44.42 C ATOM 1055 CD2 LEU A 67 -2.372 16.689 0.983 1.00 22.50 C ATOM 0 H LEU A 67 0.680 18.040 0.053 1.00 72.52 H new ATOM 0 HA LEU A 67 -0.389 16.530 -1.235 1.00 11.41 H new ATOM 0 HB2 LEU A 67 -2.373 18.668 -1.890 1.00 3.14 H new ATOM 0 HB3 LEU A 67 -2.611 16.937 -1.750 1.00 3.14 H new ATOM 0 HG LEU A 67 -1.806 18.693 0.563 1.00 72.12 H new ATOM 0 HD11 LEU A 67 -4.206 18.607 1.291 1.00 44.42 H new ATOM 0 HD12 LEU A 67 -3.996 19.457 -0.258 1.00 44.42 H new ATOM 0 HD13 LEU A 67 -4.611 17.787 -0.236 1.00 44.42 H new ATOM 0 HD21 LEU A 67 -2.692 16.891 2.005 1.00 22.50 H new ATOM 0 HD22 LEU A 67 -2.999 15.908 0.554 1.00 22.50 H new ATOM 0 HD23 LEU A 67 -1.333 16.359 0.987 1.00 22.50 H new ATOM 1067 N ILE A 68 1.224 17.525 -3.208 1.00 24.21 N ATOM 1068 CA ILE A 68 1.890 17.590 -4.504 1.00 2.10 C ATOM 1069 C ILE A 68 2.394 16.203 -4.860 1.00 64.32 C ATOM 1070 O ILE A 68 2.708 15.408 -3.975 1.00 31.21 O ATOM 1071 CB ILE A 68 3.039 18.621 -4.488 1.00 3.00 C ATOM 1072 CG1 ILE A 68 4.101 18.256 -3.429 1.00 11.10 C ATOM 1073 CG2 ILE A 68 2.478 20.043 -4.326 1.00 4.40 C ATOM 1074 CD1 ILE A 68 5.226 19.283 -3.299 1.00 11.02 C ATOM 0 H ILE A 68 1.876 17.393 -2.434 1.00 24.21 H new ATOM 0 HA ILE A 68 1.182 17.922 -5.263 1.00 2.10 H new ATOM 0 HB ILE A 68 3.556 18.596 -5.447 1.00 3.00 H new ATOM 0 HG12 ILE A 68 3.611 18.144 -2.462 1.00 11.10 H new ATOM 0 HG13 ILE A 68 4.534 17.288 -3.681 1.00 11.10 H new ATOM 0 HG21 ILE A 68 3.300 20.759 -4.316 1.00 4.40 H new ATOM 0 HG22 ILE A 68 1.810 20.268 -5.158 1.00 4.40 H new ATOM 0 HG23 ILE A 68 1.926 20.112 -3.389 1.00 4.40 H new ATOM 0 HD11 ILE A 68 5.932 18.955 -2.536 1.00 11.02 H new ATOM 0 HD12 ILE A 68 5.743 19.379 -4.254 1.00 11.02 H new ATOM 0 HD13 ILE A 68 4.807 20.248 -3.015 1.00 11.02 H new ATOM 1086 N ILE A 69 2.487 15.928 -6.153 1.00 13.03 N ATOM 1087 CA ILE A 69 2.991 14.689 -6.701 1.00 33.33 C ATOM 1088 C ILE A 69 4.447 14.953 -7.071 1.00 2.40 C ATOM 1089 O ILE A 69 4.726 15.868 -7.846 1.00 12.30 O ATOM 1090 CB ILE A 69 2.092 14.269 -7.887 1.00 11.12 C ATOM 1091 CG1 ILE A 69 0.799 13.571 -7.405 1.00 52.14 C ATOM 1092 CG2 ILE A 69 2.839 13.290 -8.804 1.00 13.03 C ATOM 1093 CD1 ILE A 69 -0.151 14.381 -6.519 1.00 32.21 C ATOM 0 H ILE A 69 2.201 16.592 -6.873 1.00 13.03 H new ATOM 0 HA ILE A 69 2.964 13.851 -6.005 1.00 33.33 H new ATOM 0 HB ILE A 69 1.833 15.181 -8.424 1.00 11.12 H new ATOM 0 HG12 ILE A 69 0.244 13.246 -8.285 1.00 52.14 H new ATOM 0 HG13 ILE A 69 1.085 12.672 -6.859 1.00 52.14 H new ATOM 0 HG21 ILE A 69 2.193 13.004 -9.634 1.00 13.03 H new ATOM 0 HG22 ILE A 69 3.738 13.769 -9.192 1.00 13.03 H new ATOM 0 HG23 ILE A 69 3.117 12.401 -8.238 1.00 13.03 H new ATOM 0 HD11 ILE A 69 -1.014 13.769 -6.256 1.00 32.21 H new ATOM 0 HD12 ILE A 69 0.369 14.685 -5.610 1.00 32.21 H new ATOM 0 HD13 ILE A 69 -0.485 15.267 -7.059 1.00 32.21 H new ATOM 1105 N GLU A 70 5.350 14.139 -6.527 1.00 62.35 N ATOM 1106 CA GLU A 70 6.777 14.130 -6.821 1.00 24.12 C ATOM 1107 C GLU A 70 7.251 12.668 -6.800 1.00 40.21 C ATOM 1108 O GLU A 70 6.452 11.749 -6.582 1.00 11.41 O ATOM 1109 CB GLU A 70 7.566 14.984 -5.810 1.00 60.43 C ATOM 1110 CG GLU A 70 7.183 16.470 -5.806 1.00 0.44 C ATOM 1111 CD GLU A 70 8.309 17.339 -5.239 1.00 23.14 C ATOM 1112 OE1 GLU A 70 9.227 17.690 -6.019 1.00 12.45 O ATOM 1113 OE2 GLU A 70 8.281 17.698 -4.035 1.00 45.52 O ATOM 0 H GLU A 70 5.091 13.435 -5.836 1.00 62.35 H new ATOM 0 HA GLU A 70 6.956 14.570 -7.802 1.00 24.12 H new ATOM 0 HB2 GLU A 70 7.412 14.578 -4.810 1.00 60.43 H new ATOM 0 HB3 GLU A 70 8.630 14.895 -6.029 1.00 60.43 H new ATOM 0 HG2 GLU A 70 6.952 16.790 -6.822 1.00 0.44 H new ATOM 0 HG3 GLU A 70 6.279 16.612 -5.214 1.00 0.44 H new ATOM 1120 N ASP A 71 8.531 12.423 -7.054 1.00 22.14 N ATOM 1121 CA ASP A 71 9.168 11.121 -6.859 1.00 31.44 C ATOM 1122 C ASP A 71 9.496 10.895 -5.375 1.00 5.12 C ATOM 1123 O ASP A 71 9.517 11.842 -4.578 1.00 31.40 O ATOM 1124 CB ASP A 71 10.483 11.081 -7.655 1.00 73.41 C ATOM 1125 CG ASP A 71 11.568 11.929 -6.983 1.00 14.33 C ATOM 1126 OD1 ASP A 71 11.526 13.167 -7.150 1.00 24.23 O ATOM 1127 OD2 ASP A 71 12.424 11.374 -6.260 1.00 2.10 O ATOM 0 H ASP A 71 9.169 13.135 -7.408 1.00 22.14 H new ATOM 0 HA ASP A 71 8.483 10.345 -7.200 1.00 31.44 H new ATOM 0 HB2 ASP A 71 10.826 10.050 -7.742 1.00 73.41 H new ATOM 0 HB3 ASP A 71 10.309 11.446 -8.667 1.00 73.41 H new ATOM 1132 N LYS A 72 9.867 9.658 -5.029 1.00 21.53 N ATOM 1133 CA LYS A 72 10.923 9.360 -4.052 1.00 24.23 C ATOM 1134 C LYS A 72 11.469 7.962 -4.367 1.00 75.23 C ATOM 1135 O LYS A 72 10.919 7.279 -5.233 1.00 32.50 O ATOM 1136 CB LYS A 72 10.393 9.411 -2.604 1.00 62.51 C ATOM 1137 CG LYS A 72 11.333 10.177 -1.663 1.00 31.31 C ATOM 1138 CD LYS A 72 11.195 11.702 -1.729 1.00 42.44 C ATOM 1139 CE LYS A 72 9.771 12.112 -1.327 1.00 0.11 C ATOM 1140 NZ LYS A 72 9.608 13.568 -1.205 1.00 5.33 N ATOM 0 H LYS A 72 9.437 8.822 -5.425 1.00 21.53 H new ATOM 0 HA LYS A 72 11.709 10.112 -4.128 1.00 24.23 H new ATOM 0 HB2 LYS A 72 9.411 9.884 -2.596 1.00 62.51 H new ATOM 0 HB3 LYS A 72 10.261 8.395 -2.233 1.00 62.51 H new ATOM 0 HG2 LYS A 72 11.146 9.852 -0.640 1.00 31.31 H new ATOM 0 HG3 LYS A 72 12.362 9.907 -1.900 1.00 31.31 H new ATOM 0 HD2 LYS A 72 11.920 12.171 -1.064 1.00 42.44 H new ATOM 0 HD3 LYS A 72 11.414 12.053 -2.738 1.00 42.44 H new ATOM 0 HE2 LYS A 72 9.067 11.733 -2.068 1.00 0.11 H new ATOM 0 HE3 LYS A 72 9.518 11.642 -0.377 1.00 0.11 H new ATOM 0 HZ1 LYS A 72 8.617 13.789 -0.982 1.00 5.33 H new ATOM 0 HZ2 LYS A 72 10.222 13.923 -0.444 1.00 5.33 H new ATOM 0 HZ3 LYS A 72 9.870 14.023 -2.103 1.00 5.33 H new ATOM 1154 N ARG A 73 12.506 7.496 -3.664 1.00 33.11 N ATOM 1155 CA ARG A 73 12.967 6.126 -3.687 1.00 34.20 C ATOM 1156 C ARG A 73 12.542 5.442 -2.385 1.00 73.11 C ATOM 1157 O ARG A 73 12.649 6.054 -1.325 1.00 40.31 O ATOM 1158 CB ARG A 73 14.488 6.176 -3.884 1.00 74.53 C ATOM 1159 CG ARG A 73 15.350 6.104 -2.611 1.00 13.53 C ATOM 1160 CD ARG A 73 16.811 6.422 -2.927 1.00 21.41 C ATOM 1161 NE ARG A 73 17.071 7.851 -2.675 1.00 12.02 N ATOM 1162 CZ ARG A 73 18.088 8.562 -3.164 1.00 11.21 C ATOM 1163 NH1 ARG A 73 19.021 7.985 -3.903 1.00 44.21 N ATOM 1164 NH2 ARG A 73 18.205 9.856 -2.908 1.00 52.12 N ATOM 0 H ARG A 73 13.058 8.091 -3.046 1.00 33.11 H new ATOM 0 HA ARG A 73 12.534 5.540 -4.498 1.00 34.20 H new ATOM 0 HB2 ARG A 73 14.774 5.351 -4.537 1.00 74.53 H new ATOM 0 HB3 ARG A 73 14.733 7.099 -4.410 1.00 74.53 H new ATOM 0 HG2 ARG A 73 14.972 6.808 -1.870 1.00 13.53 H new ATOM 0 HG3 ARG A 73 15.276 5.109 -2.172 1.00 13.53 H new ATOM 0 HD2 ARG A 73 17.469 5.808 -2.312 1.00 21.41 H new ATOM 0 HD3 ARG A 73 17.030 6.180 -3.967 1.00 21.41 H new ATOM 0 HE ARG A 73 16.412 8.342 -2.071 1.00 12.02 H new ATOM 0 HH11 ARG A 73 18.967 6.986 -4.104 1.00 44.21 H new ATOM 0 HH12 ARG A 73 19.794 8.539 -4.272 1.00 44.21 H new ATOM 0 HH21 ARG A 73 17.510 10.326 -2.328 1.00 52.12 H new ATOM 0 HH22 ARG A 73 18.990 10.383 -3.291 1.00 52.12 H new ATOM 1178 N ILE A 74 12.043 4.210 -2.425 1.00 0.25 N ATOM 1179 CA ILE A 74 11.778 3.376 -1.243 1.00 20.13 C ATOM 1180 C ILE A 74 13.123 3.011 -0.620 1.00 71.42 C ATOM 1181 O ILE A 74 14.144 2.964 -1.310 1.00 52.22 O ATOM 1182 CB ILE A 74 11.051 2.094 -1.733 1.00 52.12 C ATOM 1183 CG1 ILE A 74 9.676 2.380 -2.380 1.00 23.22 C ATOM 1184 CG2 ILE A 74 10.881 0.999 -0.663 1.00 64.23 C ATOM 1185 CD1 ILE A 74 9.306 1.322 -3.433 1.00 34.24 C ATOM 0 H ILE A 74 11.803 3.746 -3.301 1.00 0.25 H new ATOM 0 HA ILE A 74 11.163 3.892 -0.506 1.00 20.13 H new ATOM 0 HB ILE A 74 11.733 1.710 -2.492 1.00 52.12 H new ATOM 0 HG12 ILE A 74 8.909 2.405 -1.606 1.00 23.22 H new ATOM 0 HG13 ILE A 74 9.692 3.365 -2.846 1.00 23.22 H new ATOM 0 HG21 ILE A 74 10.363 0.143 -1.097 1.00 64.23 H new ATOM 0 HG22 ILE A 74 11.861 0.686 -0.304 1.00 64.23 H new ATOM 0 HG23 ILE A 74 10.298 1.392 0.170 1.00 64.23 H new ATOM 0 HD11 ILE A 74 8.333 1.561 -3.863 1.00 34.24 H new ATOM 0 HD12 ILE A 74 10.059 1.314 -4.221 1.00 34.24 H new ATOM 0 HD13 ILE A 74 9.264 0.340 -2.963 1.00 34.24 H new ATOM 1197 N LEU A 75 13.110 2.674 0.672 1.00 31.21 N ATOM 1198 CA LEU A 75 14.320 2.400 1.440 1.00 62.13 C ATOM 1199 C LEU A 75 14.325 0.952 1.954 1.00 24.31 C ATOM 1200 O LEU A 75 15.323 0.254 1.785 1.00 40.13 O ATOM 1201 CB LEU A 75 14.476 3.482 2.526 1.00 43.24 C ATOM 1202 CG LEU A 75 14.487 4.924 1.943 1.00 64.43 C ATOM 1203 CD1 LEU A 75 14.340 5.947 3.056 1.00 74.11 C ATOM 1204 CD2 LEU A 75 15.732 5.270 1.126 1.00 25.20 C ATOM 0 H LEU A 75 12.252 2.584 1.216 1.00 31.21 H new ATOM 0 HA LEU A 75 15.208 2.464 0.811 1.00 62.13 H new ATOM 0 HB2 LEU A 75 13.660 3.391 3.243 1.00 43.24 H new ATOM 0 HB3 LEU A 75 15.402 3.309 3.074 1.00 43.24 H new ATOM 0 HG LEU A 75 13.639 4.956 1.259 1.00 64.43 H new ATOM 0 HD11 LEU A 75 14.350 6.951 2.631 1.00 74.11 H new ATOM 0 HD12 LEU A 75 13.398 5.783 3.579 1.00 74.11 H new ATOM 0 HD13 LEU A 75 15.167 5.842 3.758 1.00 74.11 H new ATOM 0 HD21 LEU A 75 15.654 6.293 0.759 1.00 25.20 H new ATOM 0 HD22 LEU A 75 16.617 5.177 1.755 1.00 25.20 H new ATOM 0 HD23 LEU A 75 15.814 4.587 0.281 1.00 25.20 H new ATOM 1216 N ARG A 76 13.207 0.433 2.481 1.00 4.03 N ATOM 1217 CA ARG A 76 13.011 -0.993 2.794 1.00 73.14 C ATOM 1218 C ARG A 76 11.611 -1.412 2.375 1.00 63.22 C ATOM 1219 O ARG A 76 10.742 -0.566 2.165 1.00 41.52 O ATOM 1220 CB ARG A 76 13.236 -1.310 4.299 1.00 0.10 C ATOM 1221 CG ARG A 76 14.653 -1.159 4.886 1.00 11.15 C ATOM 1222 CD ARG A 76 14.611 -1.304 6.418 1.00 1.24 C ATOM 1223 NE ARG A 76 15.949 -1.447 7.021 1.00 52.04 N ATOM 1224 CZ ARG A 76 16.509 -0.639 7.934 1.00 13.02 C ATOM 1225 NH1 ARG A 76 15.868 0.421 8.416 1.00 3.25 N ATOM 1226 NH2 ARG A 76 17.736 -0.889 8.382 1.00 74.42 N ATOM 0 H ARG A 76 12.394 1.005 2.707 1.00 4.03 H new ATOM 0 HA ARG A 76 13.757 -1.560 2.237 1.00 73.14 H new ATOM 0 HB2 ARG A 76 12.570 -0.667 4.875 1.00 0.10 H new ATOM 0 HB3 ARG A 76 12.915 -2.337 4.471 1.00 0.10 H new ATOM 0 HG2 ARG A 76 15.314 -1.914 4.460 1.00 11.15 H new ATOM 0 HG3 ARG A 76 15.065 -0.186 4.616 1.00 11.15 H new ATOM 0 HD2 ARG A 76 14.117 -0.432 6.846 1.00 1.24 H new ATOM 0 HD3 ARG A 76 14.007 -2.173 6.679 1.00 1.24 H new ATOM 0 HE ARG A 76 16.507 -2.243 6.712 1.00 52.04 H new ATOM 0 HH11 ARG A 76 14.925 0.638 8.092 1.00 3.25 H new ATOM 0 HH12 ARG A 76 16.319 1.018 9.110 1.00 3.25 H new ATOM 0 HH21 ARG A 76 18.252 -1.696 8.031 1.00 74.42 H new ATOM 0 HH22 ARG A 76 18.161 -0.274 9.076 1.00 74.42 H new ATOM 1240 N VAL A 77 11.381 -2.718 2.303 1.00 53.01 N ATOM 1241 CA VAL A 77 10.078 -3.320 2.048 1.00 40.34 C ATOM 1242 C VAL A 77 9.801 -4.364 3.116 1.00 53.51 C ATOM 1243 O VAL A 77 10.735 -4.790 3.793 1.00 32.41 O ATOM 1244 CB VAL A 77 10.012 -3.953 0.647 1.00 0.25 C ATOM 1245 CG1 VAL A 77 10.801 -3.232 -0.427 1.00 53.14 C ATOM 1246 CG2 VAL A 77 10.517 -5.396 0.592 1.00 4.52 C ATOM 0 H VAL A 77 12.121 -3.410 2.425 1.00 53.01 H new ATOM 0 HA VAL A 77 9.318 -2.540 2.085 1.00 40.34 H new ATOM 0 HB VAL A 77 8.942 -3.886 0.449 1.00 0.25 H new ATOM 0 HG11 VAL A 77 10.689 -3.757 -1.375 1.00 53.14 H new ATOM 0 HG12 VAL A 77 10.428 -2.213 -0.530 1.00 53.14 H new ATOM 0 HG13 VAL A 77 11.855 -3.206 -0.149 1.00 53.14 H new ATOM 0 HG21 VAL A 77 10.438 -5.771 -0.429 1.00 4.52 H new ATOM 0 HG22 VAL A 77 11.559 -5.429 0.911 1.00 4.52 H new ATOM 0 HG23 VAL A 77 9.915 -6.018 1.254 1.00 4.52 H new ATOM 1256 N TRP A 78 8.564 -4.846 3.190 1.00 31.11 N ATOM 1257 CA TRP A 78 8.127 -5.858 4.131 1.00 74.31 C ATOM 1258 C TRP A 78 7.263 -6.884 3.399 1.00 40.31 C ATOM 1259 O TRP A 78 6.635 -6.561 2.386 1.00 40.22 O ATOM 1260 CB TRP A 78 7.330 -5.170 5.243 1.00 53.43 C ATOM 1261 CG TRP A 78 8.043 -4.078 5.985 1.00 40.04 C ATOM 1262 CD1 TRP A 78 8.273 -2.818 5.541 1.00 33.52 C ATOM 1263 CD2 TRP A 78 8.629 -4.142 7.316 1.00 51.03 C ATOM 1264 NE1 TRP A 78 8.911 -2.093 6.529 1.00 63.43 N ATOM 1265 CE2 TRP A 78 9.182 -2.870 7.635 1.00 32.34 C ATOM 1266 CE3 TRP A 78 8.767 -5.164 8.276 1.00 12.41 C ATOM 1267 CZ2 TRP A 78 9.850 -2.632 8.848 1.00 73.45 C ATOM 1268 CZ3 TRP A 78 9.377 -4.920 9.520 1.00 34.32 C ATOM 1269 CH2 TRP A 78 9.930 -3.659 9.803 1.00 1.23 C ATOM 0 H TRP A 78 7.817 -4.528 2.573 1.00 31.11 H new ATOM 0 HA TRP A 78 8.980 -6.376 4.569 1.00 74.31 H new ATOM 0 HB2 TRP A 78 6.422 -4.753 4.807 1.00 53.43 H new ATOM 0 HB3 TRP A 78 7.019 -5.928 5.962 1.00 53.43 H new ATOM 0 HD1 TRP A 78 8.000 -2.440 4.567 1.00 33.52 H new ATOM 0 HE1 TRP A 78 9.152 -1.105 6.450 1.00 63.43 H new ATOM 0 HE3 TRP A 78 8.397 -6.154 8.053 1.00 12.41 H new ATOM 0 HZ2 TRP A 78 10.298 -1.669 9.044 1.00 73.45 H new ATOM 0 HZ3 TRP A 78 9.421 -5.705 10.261 1.00 34.32 H new ATOM 0 HH2 TRP A 78 10.415 -3.480 10.751 1.00 1.23 H new ATOM 1280 N ARG A 79 7.188 -8.105 3.933 1.00 73.11 N ATOM 1281 CA ARG A 79 6.222 -9.126 3.534 1.00 12.24 C ATOM 1282 C ARG A 79 5.732 -9.812 4.798 1.00 23.12 C ATOM 1283 O ARG A 79 6.532 -10.092 5.693 1.00 1.42 O ATOM 1284 CB ARG A 79 6.871 -10.117 2.546 1.00 4.00 C ATOM 1285 CG ARG A 79 6.008 -11.355 2.204 1.00 53.15 C ATOM 1286 CD ARG A 79 6.276 -12.555 3.114 1.00 73.24 C ATOM 1287 NE ARG A 79 7.586 -13.170 2.855 1.00 60.23 N ATOM 1288 CZ ARG A 79 8.202 -14.013 3.691 1.00 74.22 C ATOM 1289 NH1 ARG A 79 7.768 -14.183 4.944 1.00 0.02 N ATOM 1290 NH2 ARG A 79 9.254 -14.703 3.267 1.00 21.14 N ATOM 0 H ARG A 79 7.815 -8.417 4.674 1.00 73.11 H new ATOM 0 HA ARG A 79 5.372 -8.684 3.014 1.00 12.24 H new ATOM 0 HB2 ARG A 79 7.103 -9.587 1.622 1.00 4.00 H new ATOM 0 HB3 ARG A 79 7.818 -10.457 2.965 1.00 4.00 H new ATOM 0 HG2 ARG A 79 4.954 -11.084 2.274 1.00 53.15 H new ATOM 0 HG3 ARG A 79 6.195 -11.644 1.170 1.00 53.15 H new ATOM 0 HD2 ARG A 79 6.226 -12.237 4.155 1.00 73.24 H new ATOM 0 HD3 ARG A 79 5.493 -13.299 2.970 1.00 73.24 H new ATOM 0 HE ARG A 79 8.056 -12.939 1.980 1.00 60.23 H new ATOM 0 HH11 ARG A 79 6.954 -13.665 5.277 1.00 0.02 H new ATOM 0 HH12 ARG A 79 8.250 -14.830 5.567 1.00 0.02 H new ATOM 0 HH21 ARG A 79 9.587 -14.588 2.310 1.00 21.14 H new ATOM 0 HH22 ARG A 79 9.729 -15.348 3.898 1.00 21.14 H new ATOM 1304 N LYS A 80 4.459 -10.198 4.827 1.00 62.32 N ATOM 1305 CA LYS A 80 3.866 -11.056 5.840 1.00 25.40 C ATOM 1306 C LYS A 80 2.895 -11.993 5.142 1.00 21.44 C ATOM 1307 O LYS A 80 2.576 -11.803 3.966 1.00 61.45 O ATOM 1308 CB LYS A 80 3.153 -10.214 6.916 1.00 32.44 C ATOM 1309 CG LYS A 80 3.656 -10.613 8.308 1.00 12.51 C ATOM 1310 CD LYS A 80 2.709 -10.126 9.409 1.00 62.13 C ATOM 1311 CE LYS A 80 3.210 -10.544 10.789 1.00 34.42 C ATOM 1312 NZ LYS A 80 2.979 -11.976 11.058 1.00 2.34 N ATOM 0 H LYS A 80 3.788 -9.908 4.115 1.00 62.32 H new ATOM 0 HA LYS A 80 4.637 -11.634 6.349 1.00 25.40 H new ATOM 0 HB2 LYS A 80 3.338 -9.154 6.743 1.00 32.44 H new ATOM 0 HB3 LYS A 80 2.075 -10.364 6.852 1.00 32.44 H new ATOM 0 HG2 LYS A 80 3.753 -11.697 8.364 1.00 12.51 H new ATOM 0 HG3 LYS A 80 4.650 -10.195 8.470 1.00 12.51 H new ATOM 0 HD2 LYS A 80 2.622 -9.040 9.364 1.00 62.13 H new ATOM 0 HD3 LYS A 80 1.712 -10.533 9.242 1.00 62.13 H new ATOM 0 HE2 LYS A 80 4.276 -10.329 10.867 1.00 34.42 H new ATOM 0 HE3 LYS A 80 2.708 -9.948 11.551 1.00 34.42 H new ATOM 0 HZ1 LYS A 80 3.335 -12.213 12.006 1.00 2.34 H new ATOM 0 HZ2 LYS A 80 1.960 -12.178 11.011 1.00 2.34 H new ATOM 0 HZ3 LYS A 80 3.479 -12.548 10.347 1.00 2.34 H new ATOM 1326 N LYS A 81 2.399 -13.015 5.833 1.00 61.44 N ATOM 1327 CA LYS A 81 1.320 -13.847 5.319 1.00 22.20 C ATOM 1328 C LYS A 81 0.040 -13.456 6.029 1.00 2.02 C ATOM 1329 O LYS A 81 0.079 -13.108 7.211 1.00 42.23 O ATOM 1330 CB LYS A 81 1.628 -15.329 5.518 1.00 1.14 C ATOM 1331 CG LYS A 81 0.744 -16.172 4.576 1.00 24.50 C ATOM 1332 CD LYS A 81 0.272 -17.485 5.189 1.00 1.42 C ATOM 1333 CE LYS A 81 -1.175 -17.777 4.755 1.00 45.42 C ATOM 1334 NZ LYS A 81 -1.804 -18.808 5.601 1.00 20.40 N ATOM 0 H LYS A 81 2.732 -13.287 6.758 1.00 61.44 H new ATOM 0 HA LYS A 81 1.210 -13.688 4.246 1.00 22.20 H new ATOM 0 HB2 LYS A 81 2.681 -15.522 5.315 1.00 1.14 H new ATOM 0 HB3 LYS A 81 1.446 -15.613 6.555 1.00 1.14 H new ATOM 0 HG2 LYS A 81 -0.126 -15.583 4.286 1.00 24.50 H new ATOM 0 HG3 LYS A 81 1.302 -16.387 3.665 1.00 24.50 H new ATOM 0 HD2 LYS A 81 0.926 -18.299 4.875 1.00 1.42 H new ATOM 0 HD3 LYS A 81 0.331 -17.430 6.276 1.00 1.42 H new ATOM 0 HE2 LYS A 81 -1.761 -16.859 4.804 1.00 45.42 H new ATOM 0 HE3 LYS A 81 -1.183 -18.105 3.716 1.00 45.42 H new ATOM 0 HZ1 LYS A 81 -2.778 -18.976 5.277 1.00 20.40 H new ATOM 0 HZ2 LYS A 81 -1.259 -19.691 5.535 1.00 20.40 H new ATOM 0 HZ3 LYS A 81 -1.819 -18.484 6.589 1.00 20.40 H new ATOM 1348 N TYR A 82 -1.068 -13.563 5.311 1.00 62.32 N ATOM 1349 CA TYR A 82 -2.377 -13.132 5.716 1.00 65.12 C ATOM 1350 C TYR A 82 -3.377 -14.105 5.123 1.00 62.24 C ATOM 1351 O TYR A 82 -3.158 -14.623 4.023 1.00 61.23 O ATOM 1352 CB TYR A 82 -2.549 -11.734 5.130 1.00 34.24 C ATOM 1353 CG TYR A 82 -3.944 -11.168 5.157 1.00 4.24 C ATOM 1354 CD1 TYR A 82 -4.856 -11.486 4.136 1.00 13.34 C ATOM 1355 CD2 TYR A 82 -4.321 -10.323 6.211 1.00 72.42 C ATOM 1356 CE1 TYR A 82 -6.180 -11.020 4.224 1.00 12.05 C ATOM 1357 CE2 TYR A 82 -5.633 -9.837 6.294 1.00 45.43 C ATOM 1358 CZ TYR A 82 -6.572 -10.196 5.306 1.00 32.14 C ATOM 1359 OH TYR A 82 -7.846 -9.733 5.380 1.00 14.02 O ATOM 0 H TYR A 82 -1.066 -13.978 4.379 1.00 62.32 H new ATOM 0 HA TYR A 82 -2.519 -13.106 6.796 1.00 65.12 H new ATOM 0 HB2 TYR A 82 -1.892 -11.053 5.671 1.00 34.24 H new ATOM 0 HB3 TYR A 82 -2.207 -11.752 4.095 1.00 34.24 H new ATOM 0 HD1 TYR A 82 -4.543 -12.083 3.292 1.00 13.34 H new ATOM 0 HD2 TYR A 82 -3.597 -10.045 6.962 1.00 72.42 H new ATOM 0 HE1 TYR A 82 -6.899 -11.291 3.465 1.00 12.05 H new ATOM 0 HE2 TYR A 82 -5.923 -9.191 7.110 1.00 45.43 H new ATOM 0 HH TYR A 82 -7.948 -9.183 6.185 1.00 14.02 H new ATOM 1369 N SER A 83 -4.494 -14.304 5.815 1.00 71.43 N ATOM 1370 CA SER A 83 -5.700 -14.833 5.218 1.00 4.40 C ATOM 1371 C SER A 83 -6.871 -14.131 5.918 1.00 62.44 C ATOM 1372 O SER A 83 -6.864 -14.042 7.152 1.00 55.14 O ATOM 1373 CB SER A 83 -5.759 -16.363 5.343 1.00 11.14 C ATOM 1374 OG SER A 83 -4.500 -17.007 5.201 1.00 75.14 O ATOM 0 H SER A 83 -4.581 -14.100 6.810 1.00 71.43 H new ATOM 0 HA SER A 83 -5.737 -14.638 4.146 1.00 4.40 H new ATOM 0 HB2 SER A 83 -6.179 -16.621 6.315 1.00 11.14 H new ATOM 0 HB3 SER A 83 -6.441 -16.752 4.587 1.00 11.14 H new ATOM 0 HG SER A 83 -4.616 -17.976 5.294 1.00 75.14 H new ATOM 1380 N GLY A 84 -7.851 -13.605 5.186 1.00 23.12 N ATOM 1381 CA GLY A 84 -8.944 -12.839 5.775 1.00 61.34 C ATOM 1382 C GLY A 84 -9.717 -12.100 4.692 1.00 1.30 C ATOM 1383 O GLY A 84 -9.526 -12.366 3.503 1.00 52.03 O ATOM 0 H GLY A 84 -7.909 -13.698 4.172 1.00 23.12 H new ATOM 0 HA2 GLY A 84 -9.613 -13.507 6.317 1.00 61.34 H new ATOM 0 HA3 GLY A 84 -8.549 -12.127 6.499 1.00 61.34 H new ATOM 1387 N LYS A 85 -10.608 -11.192 5.098 1.00 33.33 N ATOM 1388 CA LYS A 85 -11.364 -10.358 4.174 1.00 63.12 C ATOM 1389 C LYS A 85 -10.685 -9.000 4.062 1.00 31.31 C ATOM 1390 O LYS A 85 -10.524 -8.321 5.078 1.00 51.44 O ATOM 1391 CB LYS A 85 -12.857 -10.280 4.546 1.00 51.23 C ATOM 1392 CG LYS A 85 -13.204 -9.581 5.881 1.00 33.15 C ATOM 1393 CD LYS A 85 -14.046 -10.460 6.813 1.00 55.42 C ATOM 1394 CE LYS A 85 -13.149 -11.523 7.459 1.00 3.51 C ATOM 1395 NZ LYS A 85 -13.922 -12.493 8.251 1.00 54.15 N ATOM 0 H LYS A 85 -10.822 -11.018 6.080 1.00 33.33 H new ATOM 0 HA LYS A 85 -11.359 -10.814 3.184 1.00 63.12 H new ATOM 0 HB2 LYS A 85 -13.381 -9.761 3.744 1.00 51.23 H new ATOM 0 HB3 LYS A 85 -13.253 -11.295 4.580 1.00 51.23 H new ATOM 0 HG2 LYS A 85 -12.281 -9.301 6.389 1.00 33.15 H new ATOM 0 HG3 LYS A 85 -13.746 -8.658 5.672 1.00 33.15 H new ATOM 0 HD2 LYS A 85 -14.515 -9.848 7.583 1.00 55.42 H new ATOM 0 HD3 LYS A 85 -14.849 -10.938 6.253 1.00 55.42 H new ATOM 0 HE2 LYS A 85 -12.595 -12.050 6.682 1.00 3.51 H new ATOM 0 HE3 LYS A 85 -12.414 -11.036 8.100 1.00 3.51 H new ATOM 0 HZ1 LYS A 85 -13.276 -13.193 8.669 1.00 54.15 H new ATOM 0 HZ2 LYS A 85 -14.431 -11.995 9.009 1.00 54.15 H new ATOM 0 HZ3 LYS A 85 -14.606 -12.978 7.635 1.00 54.15 H new ATOM 1409 N LEU A 86 -10.317 -8.565 2.858 1.00 22.41 N ATOM 1410 CA LEU A 86 -9.737 -7.236 2.642 1.00 14.24 C ATOM 1411 C LEU A 86 -10.812 -6.326 2.066 1.00 0.20 C ATOM 1412 O LEU A 86 -11.689 -6.793 1.344 1.00 53.04 O ATOM 1413 CB LEU A 86 -8.532 -7.307 1.698 1.00 54.24 C ATOM 1414 CG LEU A 86 -7.330 -8.092 2.244 1.00 72.45 C ATOM 1415 CD1 LEU A 86 -6.300 -8.253 1.128 1.00 52.44 C ATOM 1416 CD2 LEU A 86 -6.657 -7.397 3.428 1.00 1.43 C ATOM 0 H LEU A 86 -10.411 -9.119 2.007 1.00 22.41 H new ATOM 0 HA LEU A 86 -9.383 -6.838 3.593 1.00 14.24 H new ATOM 0 HB2 LEU A 86 -8.850 -7.763 0.760 1.00 54.24 H new ATOM 0 HB3 LEU A 86 -8.210 -6.292 1.466 1.00 54.24 H new ATOM 0 HG LEU A 86 -7.702 -9.055 2.593 1.00 72.45 H new ATOM 0 HD11 LEU A 86 -5.441 -8.809 1.503 1.00 52.44 H new ATOM 0 HD12 LEU A 86 -6.748 -8.795 0.295 1.00 52.44 H new ATOM 0 HD13 LEU A 86 -5.975 -7.270 0.788 1.00 52.44 H new ATOM 0 HD21 LEU A 86 -5.815 -7.998 3.772 1.00 1.43 H new ATOM 0 HD22 LEU A 86 -6.300 -6.415 3.118 1.00 1.43 H new ATOM 0 HD23 LEU A 86 -7.376 -7.283 4.239 1.00 1.43 H new ATOM 1428 N ILE A 87 -10.731 -5.038 2.374 1.00 53.04 N ATOM 1429 CA ILE A 87 -11.684 -3.999 1.994 1.00 41.23 C ATOM 1430 C ILE A 87 -11.379 -3.621 0.542 1.00 20.25 C ATOM 1431 O ILE A 87 -10.200 -3.489 0.187 1.00 25.32 O ATOM 1432 CB ILE A 87 -11.539 -2.791 2.960 1.00 64.42 C ATOM 1433 CG1 ILE A 87 -11.676 -3.140 4.460 1.00 13.14 C ATOM 1434 CG2 ILE A 87 -12.535 -1.673 2.635 1.00 13.25 C ATOM 1435 CD1 ILE A 87 -13.089 -3.522 4.932 1.00 63.54 C ATOM 0 H ILE A 87 -9.957 -4.668 2.926 1.00 53.04 H new ATOM 0 HA ILE A 87 -12.716 -4.341 2.066 1.00 41.23 H new ATOM 0 HB ILE A 87 -10.516 -2.455 2.792 1.00 64.42 H new ATOM 0 HG12 ILE A 87 -11.003 -3.967 4.684 1.00 13.14 H new ATOM 0 HG13 ILE A 87 -11.337 -2.285 5.045 1.00 13.14 H new ATOM 0 HG21 ILE A 87 -12.398 -0.849 3.335 1.00 13.25 H new ATOM 0 HG22 ILE A 87 -12.364 -1.318 1.619 1.00 13.25 H new ATOM 0 HG23 ILE A 87 -13.552 -2.056 2.720 1.00 13.25 H new ATOM 0 HD11 ILE A 87 -13.068 -3.747 5.998 1.00 63.54 H new ATOM 0 HD12 ILE A 87 -13.771 -2.691 4.749 1.00 63.54 H new ATOM 0 HD13 ILE A 87 -13.431 -4.399 4.383 1.00 63.54 H new ATOM 1447 N LYS A 88 -12.418 -3.416 -0.284 1.00 2.40 N ATOM 1448 CA LYS A 88 -12.276 -3.129 -1.714 1.00 2.11 C ATOM 1449 C LYS A 88 -12.944 -1.809 -2.117 1.00 72.12 C ATOM 1450 O LYS A 88 -13.684 -1.779 -3.109 1.00 23.41 O ATOM 1451 CB LYS A 88 -12.750 -4.344 -2.535 1.00 22.11 C ATOM 1452 CG LYS A 88 -12.123 -4.350 -3.942 1.00 61.34 C ATOM 1453 CD LYS A 88 -12.777 -5.400 -4.850 1.00 52.33 C ATOM 1454 CE LYS A 88 -12.185 -5.443 -6.265 1.00 44.21 C ATOM 1455 NZ LYS A 88 -10.723 -5.661 -6.296 1.00 63.25 N ATOM 0 H LYS A 88 -13.388 -3.446 0.029 1.00 2.40 H new ATOM 0 HA LYS A 88 -11.221 -2.974 -1.940 1.00 2.11 H new ATOM 0 HB2 LYS A 88 -12.485 -5.264 -2.013 1.00 22.11 H new ATOM 0 HB3 LYS A 88 -13.837 -4.327 -2.619 1.00 22.11 H new ATOM 0 HG2 LYS A 88 -12.229 -3.363 -4.392 1.00 61.34 H new ATOM 0 HG3 LYS A 88 -11.055 -4.551 -3.864 1.00 61.34 H new ATOM 0 HD2 LYS A 88 -12.670 -6.383 -4.391 1.00 52.33 H new ATOM 0 HD3 LYS A 88 -13.845 -5.194 -4.918 1.00 52.33 H new ATOM 0 HE2 LYS A 88 -12.673 -6.238 -6.829 1.00 44.21 H new ATOM 0 HE3 LYS A 88 -12.414 -4.506 -6.773 1.00 44.21 H new ATOM 0 HZ1 LYS A 88 -10.437 -5.963 -7.249 1.00 63.25 H new ATOM 0 HZ2 LYS A 88 -10.235 -4.776 -6.052 1.00 63.25 H new ATOM 0 HZ3 LYS A 88 -10.467 -6.398 -5.608 1.00 63.25 H new ATOM 1469 N ILE A 89 -12.771 -0.740 -1.329 1.00 5.54 N ATOM 1470 CA ILE A 89 -13.392 0.581 -1.486 1.00 52.41 C ATOM 1471 C ILE A 89 -13.252 0.957 -2.939 1.00 55.45 C ATOM 1472 O ILE A 89 -12.126 1.054 -3.413 1.00 44.32 O ATOM 1473 CB ILE A 89 -12.712 1.622 -0.563 1.00 20.44 C ATOM 1474 CG1 ILE A 89 -13.278 1.494 0.866 1.00 43.13 C ATOM 1475 CG2 ILE A 89 -12.890 3.079 -1.036 1.00 22.14 C ATOM 1476 CD1 ILE A 89 -12.278 1.942 1.934 1.00 32.30 C ATOM 0 H ILE A 89 -12.156 -0.777 -0.516 1.00 5.54 H new ATOM 0 HA ILE A 89 -14.443 0.557 -1.199 1.00 52.41 H new ATOM 0 HB ILE A 89 -11.645 1.402 -0.591 1.00 20.44 H new ATOM 0 HG12 ILE A 89 -14.186 2.092 0.949 1.00 43.13 H new ATOM 0 HG13 ILE A 89 -13.561 0.458 1.050 1.00 43.13 H new ATOM 0 HG21 ILE A 89 -12.387 3.751 -0.341 1.00 22.14 H new ATOM 0 HG22 ILE A 89 -12.457 3.194 -2.030 1.00 22.14 H new ATOM 0 HG23 ILE A 89 -13.952 3.323 -1.073 1.00 22.14 H new ATOM 0 HD11 ILE A 89 -12.726 1.832 2.921 1.00 32.30 H new ATOM 0 HD12 ILE A 89 -11.380 1.327 1.872 1.00 32.30 H new ATOM 0 HD13 ILE A 89 -12.014 2.987 1.770 1.00 32.30 H new ATOM 1488 N THR A 90 -14.364 1.072 -3.659 1.00 0.00 N ATOM 1489 CA THR A 90 -14.308 1.534 -5.031 1.00 51.03 C ATOM 1490 C THR A 90 -14.462 3.063 -4.990 1.00 60.45 C ATOM 1491 O THR A 90 -14.829 3.617 -3.956 1.00 74.32 O ATOM 1492 CB THR A 90 -15.397 0.793 -5.823 1.00 40.31 C ATOM 1493 OG1 THR A 90 -15.443 -0.566 -5.414 1.00 62.34 O ATOM 1494 CG2 THR A 90 -15.195 0.765 -7.341 1.00 23.41 C ATOM 0 H THR A 90 -15.300 0.854 -3.316 1.00 0.00 H new ATOM 0 HA THR A 90 -13.368 1.319 -5.539 1.00 51.03 H new ATOM 0 HB THR A 90 -16.310 1.350 -5.611 1.00 40.31 H new ATOM 0 HG1 THR A 90 -15.420 -1.146 -6.203 1.00 62.34 H new ATOM 0 HG21 THR A 90 -16.016 0.220 -7.807 1.00 23.41 H new ATOM 0 HG22 THR A 90 -15.173 1.785 -7.724 1.00 23.41 H new ATOM 0 HG23 THR A 90 -14.252 0.270 -7.574 1.00 23.41 H new ATOM 1502 N THR A 91 -14.229 3.759 -6.098 1.00 34.53 N ATOM 1503 CA THR A 91 -14.809 5.089 -6.288 1.00 40.41 C ATOM 1504 C THR A 91 -15.400 5.176 -7.699 1.00 0.23 C ATOM 1505 O THR A 91 -15.198 4.271 -8.520 1.00 21.50 O ATOM 1506 CB THR A 91 -13.784 6.209 -6.009 1.00 71.12 C ATOM 1507 OG1 THR A 91 -12.847 6.314 -7.062 1.00 41.14 O ATOM 1508 CG2 THR A 91 -13.001 6.075 -4.702 1.00 72.31 C ATOM 0 H THR A 91 -13.650 3.432 -6.871 1.00 34.53 H new ATOM 0 HA THR A 91 -15.610 5.239 -5.564 1.00 40.41 H new ATOM 0 HB THR A 91 -14.402 7.103 -5.923 1.00 71.12 H new ATOM 0 HG1 THR A 91 -13.217 6.876 -7.775 1.00 41.14 H new ATOM 0 HG21 THR A 91 -12.310 6.912 -4.604 1.00 72.31 H new ATOM 0 HG22 THR A 91 -13.694 6.077 -3.861 1.00 72.31 H new ATOM 0 HG23 THR A 91 -12.440 5.140 -4.708 1.00 72.31 H new ATOM 1516 N LYS A 92 -16.125 6.255 -8.018 1.00 2.52 N ATOM 1517 CA LYS A 92 -16.831 6.413 -9.283 1.00 71.24 C ATOM 1518 C LYS A 92 -15.906 6.210 -10.484 1.00 3.20 C ATOM 1519 O LYS A 92 -16.310 5.567 -11.451 1.00 43.12 O ATOM 1520 CB LYS A 92 -17.451 7.808 -9.278 1.00 60.32 C ATOM 1521 CG LYS A 92 -18.320 8.129 -10.504 1.00 53.42 C ATOM 1522 CD LYS A 92 -17.925 9.489 -11.084 1.00 4.43 C ATOM 1523 CE LYS A 92 -16.662 9.379 -11.950 1.00 11.14 C ATOM 1524 NZ LYS A 92 -16.319 10.665 -12.587 1.00 52.53 N ATOM 0 H LYS A 92 -16.236 7.052 -7.391 1.00 2.52 H new ATOM 0 HA LYS A 92 -17.605 5.651 -9.380 1.00 71.24 H new ATOM 0 HB2 LYS A 92 -18.059 7.917 -8.380 1.00 60.32 H new ATOM 0 HB3 LYS A 92 -16.651 8.546 -9.213 1.00 60.32 H new ATOM 0 HG2 LYS A 92 -18.198 7.353 -11.260 1.00 53.42 H new ATOM 0 HG3 LYS A 92 -19.373 8.137 -10.222 1.00 53.42 H new ATOM 0 HD2 LYS A 92 -18.746 9.884 -11.682 1.00 4.43 H new ATOM 0 HD3 LYS A 92 -17.752 10.197 -10.273 1.00 4.43 H new ATOM 0 HE2 LYS A 92 -15.827 9.045 -11.334 1.00 11.14 H new ATOM 0 HE3 LYS A 92 -16.814 8.622 -12.719 1.00 11.14 H new ATOM 0 HZ1 LYS A 92 -15.461 10.549 -13.163 1.00 52.53 H new ATOM 0 HZ2 LYS A 92 -17.105 10.972 -13.195 1.00 52.53 H new ATOM 0 HZ3 LYS A 92 -16.149 11.382 -11.853 1.00 52.53 H new ATOM 1538 N ASN A 93 -14.657 6.685 -10.409 1.00 11.00 N ATOM 1539 CA ASN A 93 -13.603 6.585 -11.422 1.00 21.44 C ATOM 1540 C ASN A 93 -13.037 5.159 -11.543 1.00 12.20 C ATOM 1541 O ASN A 93 -11.909 4.962 -12.005 1.00 75.11 O ATOM 1542 CB ASN A 93 -12.498 7.603 -11.085 1.00 32.40 C ATOM 1543 CG ASN A 93 -12.897 9.003 -11.515 1.00 11.22 C ATOM 1544 OD1 ASN A 93 -13.522 9.775 -10.648 1.00 73.41 O flip ATOM 1545 ND2 ASN A 93 -12.699 9.386 -12.661 1.00 2.13 N flip ATOM 0 H ASN A 93 -14.335 7.184 -9.580 1.00 11.00 H new ATOM 0 HA ASN A 93 -14.032 6.816 -12.397 1.00 21.44 H new ATOM 0 HB2 ASN A 93 -12.302 7.590 -10.013 1.00 32.40 H new ATOM 0 HB3 ASN A 93 -11.571 7.317 -11.582 1.00 32.40 H new ATOM 0 HD21 ASN A 93 -12.215 8.781 -13.324 1.00 2.13 H new ATOM 0 HD22 ASN A 93 -13.019 10.310 -12.952 1.00 2.13 H new ATOM 1552 N ARG A 94 -13.790 4.159 -11.077 1.00 35.21 N ATOM 1553 CA ARG A 94 -13.443 2.749 -10.967 1.00 42.24 C ATOM 1554 C ARG A 94 -12.089 2.516 -10.297 1.00 15.24 C ATOM 1555 O ARG A 94 -11.420 1.520 -10.583 1.00 54.03 O ATOM 1556 CB ARG A 94 -13.509 2.031 -12.328 1.00 73.23 C ATOM 1557 CG ARG A 94 -14.688 2.333 -13.258 1.00 22.44 C ATOM 1558 CD ARG A 94 -16.053 1.903 -12.717 1.00 23.20 C ATOM 1559 NE ARG A 94 -17.036 1.842 -13.813 1.00 73.31 N ATOM 1560 CZ ARG A 94 -18.304 1.425 -13.725 1.00 63.42 C ATOM 1561 NH1 ARG A 94 -18.858 1.177 -12.549 1.00 72.52 N ATOM 1562 NH2 ARG A 94 -19.022 1.240 -14.825 1.00 34.51 N ATOM 0 H ARG A 94 -14.736 4.335 -10.740 1.00 35.21 H new ATOM 0 HA ARG A 94 -14.199 2.312 -10.315 1.00 42.24 H new ATOM 0 HB2 ARG A 94 -12.592 2.263 -12.870 1.00 73.23 H new ATOM 0 HB3 ARG A 94 -13.504 0.958 -12.137 1.00 73.23 H new ATOM 0 HG2 ARG A 94 -14.712 3.404 -13.457 1.00 22.44 H new ATOM 0 HG3 ARG A 94 -14.517 1.836 -14.213 1.00 22.44 H new ATOM 0 HD2 ARG A 94 -15.972 0.928 -12.236 1.00 23.20 H new ATOM 0 HD3 ARG A 94 -16.389 2.607 -11.955 1.00 23.20 H new ATOM 0 HE ARG A 94 -16.717 2.149 -14.732 1.00 73.31 H new ATOM 0 HH11 ARG A 94 -18.317 1.303 -11.694 1.00 72.52 H new ATOM 0 HH12 ARG A 94 -19.826 0.860 -12.498 1.00 72.52 H new ATOM 0 HH21 ARG A 94 -18.607 1.416 -15.740 1.00 34.51 H new ATOM 0 HH22 ARG A 94 -19.989 0.922 -14.756 1.00 34.51 H new ATOM 1576 N ARG A 95 -11.633 3.420 -9.431 1.00 0.22 N ATOM 1577 CA ARG A 95 -10.550 3.055 -8.539 1.00 53.54 C ATOM 1578 C ARG A 95 -11.048 1.990 -7.596 1.00 60.24 C ATOM 1579 O ARG A 95 -12.248 1.897 -7.356 1.00 21.14 O ATOM 1580 CB ARG A 95 -10.090 4.243 -7.714 1.00 52.31 C ATOM 1581 CG ARG A 95 -9.160 5.156 -8.504 1.00 54.14 C ATOM 1582 CD ARG A 95 -7.843 5.333 -7.765 1.00 60.42 C ATOM 1583 NE ARG A 95 -7.281 6.688 -7.871 1.00 64.32 N ATOM 1584 CZ ARG A 95 -7.247 7.573 -8.875 1.00 14.31 C ATOM 1585 NH1 ARG A 95 -7.712 7.323 -10.098 1.00 1.44 N ATOM 1586 NH2 ARG A 95 -6.700 8.756 -8.638 1.00 11.21 N ATOM 0 H ARG A 95 -11.984 4.373 -9.333 1.00 0.22 H new ATOM 0 HA ARG A 95 -9.712 2.700 -9.139 1.00 53.54 H new ATOM 0 HB2 ARG A 95 -10.958 4.811 -7.379 1.00 52.31 H new ATOM 0 HB3 ARG A 95 -9.577 3.888 -6.820 1.00 52.31 H new ATOM 0 HG2 ARG A 95 -8.977 4.733 -9.492 1.00 54.14 H new ATOM 0 HG3 ARG A 95 -9.633 6.126 -8.655 1.00 54.14 H new ATOM 0 HD2 ARG A 95 -7.993 5.093 -6.712 1.00 60.42 H new ATOM 0 HD3 ARG A 95 -7.119 4.618 -8.155 1.00 60.42 H new ATOM 0 HE ARG A 95 -6.831 7.016 -7.016 1.00 64.32 H new ATOM 0 HH11 ARG A 95 -8.123 6.414 -10.311 1.00 1.44 H new ATOM 0 HH12 ARG A 95 -7.657 8.040 -10.821 1.00 1.44 H new ATOM 0 HH21 ARG A 95 -6.322 8.967 -7.714 1.00 11.21 H new ATOM 0 HH22 ARG A 95 -6.656 9.455 -9.379 1.00 11.21 H new ATOM 1600 N GLU A 96 -10.099 1.272 -7.019 1.00 41.12 N ATOM 1601 CA GLU A 96 -10.273 0.381 -5.890 1.00 41.32 C ATOM 1602 C GLU A 96 -8.888 -0.044 -5.410 1.00 33.35 C ATOM 1603 O GLU A 96 -7.896 0.236 -6.091 1.00 1.43 O ATOM 1604 CB GLU A 96 -11.194 -0.804 -6.220 1.00 73.23 C ATOM 1605 CG GLU A 96 -10.936 -1.506 -7.564 1.00 13.13 C ATOM 1606 CD GLU A 96 -9.952 -2.677 -7.546 1.00 74.14 C ATOM 1607 OE1 GLU A 96 -9.645 -3.236 -6.473 1.00 41.13 O ATOM 1608 OE2 GLU A 96 -9.658 -3.180 -8.654 1.00 12.01 O ATOM 0 H GLU A 96 -9.133 1.299 -7.346 1.00 41.12 H new ATOM 0 HA GLU A 96 -10.784 0.900 -5.079 1.00 41.32 H new ATOM 0 HB2 GLU A 96 -11.102 -1.543 -5.424 1.00 73.23 H new ATOM 0 HB3 GLU A 96 -12.225 -0.451 -6.209 1.00 73.23 H new ATOM 0 HG2 GLU A 96 -11.890 -1.868 -7.948 1.00 13.13 H new ATOM 0 HG3 GLU A 96 -10.569 -0.763 -8.272 1.00 13.13 H new ATOM 1615 N ILE A 97 -8.820 -0.648 -4.224 1.00 64.44 N ATOM 1616 CA ILE A 97 -7.612 -1.099 -3.531 1.00 31.54 C ATOM 1617 C ILE A 97 -7.965 -2.363 -2.744 1.00 74.44 C ATOM 1618 O ILE A 97 -9.141 -2.722 -2.668 1.00 23.31 O ATOM 1619 CB ILE A 97 -7.069 0.015 -2.622 1.00 33.52 C ATOM 1620 CG1 ILE A 97 -8.102 0.397 -1.550 1.00 54.25 C ATOM 1621 CG2 ILE A 97 -6.625 1.180 -3.461 1.00 65.34 C ATOM 1622 CD1 ILE A 97 -7.932 1.801 -0.993 1.00 20.25 C ATOM 0 H ILE A 97 -9.663 -0.849 -3.686 1.00 64.44 H new ATOM 0 HA ILE A 97 -6.821 -1.332 -4.243 1.00 31.54 H new ATOM 0 HB ILE A 97 -6.194 -0.343 -2.080 1.00 33.52 H new ATOM 0 HG12 ILE A 97 -9.101 0.306 -1.976 1.00 54.25 H new ATOM 0 HG13 ILE A 97 -8.038 -0.318 -0.729 1.00 54.25 H new ATOM 0 HG21 ILE A 97 -6.240 1.969 -2.814 1.00 65.34 H new ATOM 0 HG22 ILE A 97 -5.841 0.857 -4.146 1.00 65.34 H new ATOM 0 HG23 ILE A 97 -7.472 1.560 -4.033 1.00 65.34 H new ATOM 0 HD11 ILE A 97 -8.700 1.990 -0.243 1.00 20.25 H new ATOM 0 HD12 ILE A 97 -6.947 1.894 -0.535 1.00 20.25 H new ATOM 0 HD13 ILE A 97 -8.027 2.527 -1.801 1.00 20.25 H new ATOM 1634 N THR A 98 -6.984 -3.010 -2.122 1.00 3.20 N ATOM 1635 CA THR A 98 -7.154 -4.315 -1.492 1.00 0.42 C ATOM 1636 C THR A 98 -6.339 -4.347 -0.189 1.00 41.43 C ATOM 1637 O THR A 98 -5.182 -4.787 -0.159 1.00 74.32 O ATOM 1638 CB THR A 98 -6.793 -5.437 -2.496 1.00 4.02 C ATOM 1639 OG1 THR A 98 -7.108 -5.132 -3.843 1.00 22.14 O ATOM 1640 CG2 THR A 98 -7.546 -6.729 -2.179 1.00 42.12 C ATOM 0 H THR A 98 -6.038 -2.638 -2.040 1.00 3.20 H new ATOM 0 HA THR A 98 -8.194 -4.491 -1.217 1.00 0.42 H new ATOM 0 HB THR A 98 -5.714 -5.545 -2.388 1.00 4.02 H new ATOM 0 HG1 THR A 98 -6.490 -4.448 -4.177 1.00 22.14 H new ATOM 0 HG21 THR A 98 -7.271 -7.497 -2.902 1.00 42.12 H new ATOM 0 HG22 THR A 98 -7.286 -7.065 -1.175 1.00 42.12 H new ATOM 0 HG23 THR A 98 -8.619 -6.547 -2.234 1.00 42.12 H new ATOM 1648 N LEU A 99 -6.926 -3.831 0.899 1.00 64.42 N ATOM 1649 CA LEU A 99 -6.221 -3.547 2.155 1.00 53.44 C ATOM 1650 C LEU A 99 -7.070 -3.862 3.388 1.00 64.25 C ATOM 1651 O LEU A 99 -8.225 -4.268 3.275 1.00 44.53 O ATOM 1652 CB LEU A 99 -5.658 -2.110 2.164 1.00 60.23 C ATOM 1653 CG LEU A 99 -6.574 -1.006 1.619 1.00 14.15 C ATOM 1654 CD1 LEU A 99 -7.966 -0.962 2.252 1.00 13.11 C ATOM 1655 CD2 LEU A 99 -5.944 0.369 1.796 1.00 64.45 C ATOM 0 H LEU A 99 -7.918 -3.596 0.931 1.00 64.42 H new ATOM 0 HA LEU A 99 -5.368 -4.223 2.211 1.00 53.44 H new ATOM 0 HB2 LEU A 99 -5.392 -1.855 3.190 1.00 60.23 H new ATOM 0 HB3 LEU A 99 -4.735 -2.103 1.584 1.00 60.23 H new ATOM 0 HG LEU A 99 -6.694 -1.259 0.565 1.00 14.15 H new ATOM 0 HD11 LEU A 99 -8.543 -0.152 1.806 1.00 13.11 H new ATOM 0 HD12 LEU A 99 -8.475 -1.910 2.077 1.00 13.11 H new ATOM 0 HD13 LEU A 99 -7.873 -0.793 3.325 1.00 13.11 H new ATOM 0 HD21 LEU A 99 -6.616 1.131 1.401 1.00 64.45 H new ATOM 0 HD22 LEU A 99 -5.768 0.555 2.856 1.00 64.45 H new ATOM 0 HD23 LEU A 99 -4.996 0.407 1.259 1.00 64.45 H new ATOM 1667 N THR A 100 -6.457 -3.739 4.560 1.00 34.23 N ATOM 1668 CA THR A 100 -7.003 -4.044 5.868 1.00 0.24 C ATOM 1669 C THR A 100 -8.141 -3.091 6.242 1.00 14.32 C ATOM 1670 O THR A 100 -8.361 -2.072 5.583 1.00 20.44 O ATOM 1671 CB THR A 100 -5.839 -3.977 6.879 1.00 34.21 C ATOM 1672 OG1 THR A 100 -4.774 -3.130 6.453 1.00 20.21 O ATOM 1673 CG2 THR A 100 -5.265 -5.370 7.119 1.00 13.22 C ATOM 0 H THR A 100 -5.497 -3.399 4.620 1.00 34.23 H new ATOM 0 HA THR A 100 -7.444 -5.041 5.871 1.00 0.24 H new ATOM 0 HB THR A 100 -6.262 -3.561 7.793 1.00 34.21 H new ATOM 0 HG1 THR A 100 -4.234 -2.868 7.228 1.00 20.21 H new ATOM 0 HG21 THR A 100 -4.445 -5.307 7.834 1.00 13.22 H new ATOM 0 HG22 THR A 100 -6.044 -6.021 7.516 1.00 13.22 H new ATOM 0 HG23 THR A 100 -4.896 -5.778 6.178 1.00 13.22 H new ATOM 1681 N HIS A 101 -8.872 -3.405 7.315 1.00 60.11 N ATOM 1682 CA HIS A 101 -9.965 -2.573 7.763 1.00 22.45 C ATOM 1683 C HIS A 101 -9.416 -1.445 8.639 1.00 15.01 C ATOM 1684 O HIS A 101 -9.896 -0.310 8.521 1.00 5.41 O ATOM 1685 CB HIS A 101 -11.044 -3.464 8.393 1.00 22.45 C ATOM 1686 CG HIS A 101 -10.569 -4.534 9.333 1.00 34.40 C ATOM 1687 ND1 HIS A 101 -10.552 -5.898 9.138 1.00 12.24 N ATOM 1688 CD2 HIS A 101 -10.139 -4.290 10.594 1.00 64.15 C ATOM 1689 CE1 HIS A 101 -10.116 -6.461 10.279 1.00 40.02 C ATOM 1690 NE2 HIS A 101 -9.862 -5.518 11.201 1.00 53.21 N ATOM 0 H HIS A 101 -8.716 -4.237 7.885 1.00 60.11 H new ATOM 0 HA HIS A 101 -10.468 -2.062 6.942 1.00 22.45 H new ATOM 0 HB2 HIS A 101 -11.743 -2.824 8.931 1.00 22.45 H new ATOM 0 HB3 HIS A 101 -11.604 -3.941 7.589 1.00 22.45 H new ATOM 0 HD2 HIS A 101 -10.029 -3.317 11.050 1.00 64.15 H new ATOM 0 HE1 HIS A 101 -9.988 -7.522 10.432 1.00 40.02 H new ATOM 0 HE2 HIS A 101 -9.532 -5.668 12.155 1.00 53.21 H new ATOM 1698 N ASP A 102 -8.346 -1.693 9.400 1.00 20.44 N ATOM 1699 CA ASP A 102 -7.670 -0.679 10.206 1.00 24.33 C ATOM 1700 C ASP A 102 -6.534 -0.023 9.416 1.00 14.43 C ATOM 1701 O ASP A 102 -5.426 0.152 9.939 1.00 44.32 O ATOM 1702 CB ASP A 102 -7.144 -1.222 11.545 1.00 12.04 C ATOM 1703 CG ASP A 102 -8.215 -1.846 12.424 1.00 51.31 C ATOM 1704 OD1 ASP A 102 -9.063 -1.113 12.984 1.00 1.34 O ATOM 1705 OD2 ASP A 102 -8.183 -3.078 12.613 1.00 51.53 O ATOM 0 H ASP A 102 -7.921 -2.617 9.473 1.00 20.44 H new ATOM 0 HA ASP A 102 -8.424 0.072 10.445 1.00 24.33 H new ATOM 0 HB2 ASP A 102 -6.373 -1.967 11.345 1.00 12.04 H new ATOM 0 HB3 ASP A 102 -6.668 -0.409 12.093 1.00 12.04 H new ATOM 1710 N HIS A 103 -6.736 0.236 8.125 1.00 32.20 N ATOM 1711 CA HIS A 103 -5.713 0.820 7.268 1.00 25.40 C ATOM 1712 C HIS A 103 -5.841 2.353 7.261 1.00 51.12 C ATOM 1713 O HIS A 103 -6.924 2.827 6.902 1.00 52.35 O ATOM 1714 CB HIS A 103 -5.857 0.231 5.864 1.00 4.01 C ATOM 1715 CG HIS A 103 -4.578 0.293 5.088 1.00 23.31 C ATOM 1716 ND1 HIS A 103 -3.732 -0.769 4.877 1.00 1.43 N ATOM 1717 CD2 HIS A 103 -4.112 1.363 4.378 1.00 65.11 C ATOM 1718 CE1 HIS A 103 -2.796 -0.362 4.005 1.00 74.11 C ATOM 1719 NE2 HIS A 103 -2.982 0.932 3.677 1.00 5.04 N ATOM 0 H HIS A 103 -7.616 0.045 7.646 1.00 32.20 H new ATOM 0 HA HIS A 103 -4.719 0.582 7.646 1.00 25.40 H new ATOM 0 HB2 HIS A 103 -6.184 -0.806 5.939 1.00 4.01 H new ATOM 0 HB3 HIS A 103 -6.634 0.772 5.323 1.00 4.01 H new ATOM 0 HD1 HIS A 103 -3.802 -1.693 5.303 1.00 1.43 H new ATOM 0 HD2 HIS A 103 -4.537 2.356 4.361 1.00 65.11 H new ATOM 0 HE1 HIS A 103 -2.003 -0.986 3.619 1.00 74.11 H new ATOM 1727 N PRO A 104 -4.800 3.132 7.623 1.00 63.11 N ATOM 1728 CA PRO A 104 -4.842 4.587 7.584 1.00 21.42 C ATOM 1729 C PRO A 104 -4.967 5.076 6.148 1.00 74.44 C ATOM 1730 O PRO A 104 -4.121 4.769 5.298 1.00 3.14 O ATOM 1731 CB PRO A 104 -3.534 5.097 8.200 1.00 2.23 C ATOM 1732 CG PRO A 104 -2.599 3.892 8.207 1.00 40.21 C ATOM 1733 CD PRO A 104 -3.534 2.687 8.182 1.00 14.43 C ATOM 0 HA PRO A 104 -5.704 4.959 8.139 1.00 21.42 H new ATOM 0 HB2 PRO A 104 -3.116 5.916 7.615 1.00 2.23 H new ATOM 0 HB3 PRO A 104 -3.695 5.476 9.209 1.00 2.23 H new ATOM 0 HG2 PRO A 104 -1.936 3.898 7.342 1.00 40.21 H new ATOM 0 HG3 PRO A 104 -1.966 3.885 9.094 1.00 40.21 H new ATOM 0 HD2 PRO A 104 -3.109 1.884 7.580 1.00 14.43 H new ATOM 0 HD3 PRO A 104 -3.676 2.290 9.187 1.00 14.43 H new ATOM 1741 N VAL A 105 -6.000 5.870 5.894 1.00 25.52 N ATOM 1742 CA VAL A 105 -6.245 6.570 4.645 1.00 21.20 C ATOM 1743 C VAL A 105 -6.803 7.962 4.973 1.00 33.51 C ATOM 1744 O VAL A 105 -7.087 8.268 6.137 1.00 74.24 O ATOM 1745 CB VAL A 105 -7.181 5.731 3.750 1.00 65.31 C ATOM 1746 CG1 VAL A 105 -6.512 4.422 3.297 1.00 12.22 C ATOM 1747 CG2 VAL A 105 -8.516 5.407 4.433 1.00 14.31 C ATOM 0 H VAL A 105 -6.724 6.050 6.590 1.00 25.52 H new ATOM 0 HA VAL A 105 -5.324 6.707 4.078 1.00 21.20 H new ATOM 0 HB VAL A 105 -7.386 6.350 2.877 1.00 65.31 H new ATOM 0 HG11 VAL A 105 -7.202 3.859 2.669 1.00 12.22 H new ATOM 0 HG12 VAL A 105 -5.610 4.652 2.730 1.00 12.22 H new ATOM 0 HG13 VAL A 105 -6.249 3.826 4.171 1.00 12.22 H new ATOM 0 HG21 VAL A 105 -9.135 4.815 3.759 1.00 14.31 H new ATOM 0 HG22 VAL A 105 -8.330 4.841 5.346 1.00 14.31 H new ATOM 0 HG23 VAL A 105 -9.033 6.334 4.680 1.00 14.31 H new ATOM 1757 N TYR A 106 -6.972 8.809 3.957 1.00 73.12 N ATOM 1758 CA TYR A 106 -7.383 10.193 4.138 1.00 45.42 C ATOM 1759 C TYR A 106 -8.761 10.427 3.550 1.00 72.12 C ATOM 1760 O TYR A 106 -9.140 9.806 2.552 1.00 12.13 O ATOM 1761 CB TYR A 106 -6.344 11.134 3.523 1.00 3.21 C ATOM 1762 CG TYR A 106 -4.975 10.926 4.129 1.00 60.12 C ATOM 1763 CD1 TYR A 106 -4.705 11.394 5.428 1.00 33.41 C ATOM 1764 CD2 TYR A 106 -4.006 10.183 3.430 1.00 55.01 C ATOM 1765 CE1 TYR A 106 -3.478 11.098 6.043 1.00 21.10 C ATOM 1766 CE2 TYR A 106 -2.784 9.883 4.049 1.00 61.53 C ATOM 1767 CZ TYR A 106 -2.520 10.315 5.367 1.00 60.42 C ATOM 1768 OH TYR A 106 -1.307 10.056 5.927 1.00 41.53 O ATOM 0 H TYR A 106 -6.826 8.548 2.982 1.00 73.12 H new ATOM 0 HA TYR A 106 -7.444 10.406 5.205 1.00 45.42 H new ATOM 0 HB2 TYR A 106 -6.295 10.969 2.447 1.00 3.21 H new ATOM 0 HB3 TYR A 106 -6.655 12.168 3.673 1.00 3.21 H new ATOM 0 HD1 TYR A 106 -5.443 11.982 5.953 1.00 33.41 H new ATOM 0 HD2 TYR A 106 -4.202 9.846 2.423 1.00 55.01 H new ATOM 0 HE1 TYR A 106 -3.268 11.470 7.035 1.00 21.10 H new ATOM 0 HE2 TYR A 106 -2.038 9.316 3.512 1.00 61.53 H new ATOM 0 HH TYR A 106 -1.394 10.041 6.903 1.00 41.53 H new ATOM 1778 N ILE A 107 -9.489 11.364 4.150 1.00 35.53 N ATOM 1779 CA ILE A 107 -10.839 11.741 3.768 1.00 22.45 C ATOM 1780 C ILE A 107 -10.982 13.255 3.818 1.00 14.20 C ATOM 1781 O ILE A 107 -10.165 13.947 4.432 1.00 4.23 O ATOM 1782 CB ILE A 107 -11.887 11.091 4.695 1.00 72.52 C ATOM 1783 CG1 ILE A 107 -11.585 11.370 6.186 1.00 3.50 C ATOM 1784 CG2 ILE A 107 -12.022 9.585 4.436 1.00 3.00 C ATOM 1785 CD1 ILE A 107 -12.844 11.724 6.975 1.00 65.42 C ATOM 0 H ILE A 107 -9.139 11.899 4.945 1.00 35.53 H new ATOM 0 HA ILE A 107 -11.016 11.385 2.753 1.00 22.45 H new ATOM 0 HB ILE A 107 -12.845 11.554 4.458 1.00 72.52 H new ATOM 0 HG12 ILE A 107 -11.115 10.492 6.630 1.00 3.50 H new ATOM 0 HG13 ILE A 107 -10.869 12.188 6.263 1.00 3.50 H new ATOM 0 HG21 ILE A 107 -12.770 9.166 5.109 1.00 3.00 H new ATOM 0 HG22 ILE A 107 -12.330 9.420 3.404 1.00 3.00 H new ATOM 0 HG23 ILE A 107 -11.063 9.098 4.611 1.00 3.00 H new ATOM 0 HD11 ILE A 107 -12.580 11.911 8.016 1.00 65.42 H new ATOM 0 HD12 ILE A 107 -13.300 12.618 6.550 1.00 65.42 H new ATOM 0 HD13 ILE A 107 -13.551 10.896 6.923 1.00 65.42 H new ATOM 1797 N SER A 108 -12.040 13.767 3.196 1.00 51.32 N ATOM 1798 CA SER A 108 -12.425 15.149 3.365 1.00 11.24 C ATOM 1799 C SER A 108 -13.186 15.282 4.686 1.00 43.25 C ATOM 1800 O SER A 108 -14.117 14.529 4.985 1.00 34.14 O ATOM 1801 CB SER A 108 -13.181 15.630 2.114 1.00 0.01 C ATOM 1802 OG SER A 108 -14.593 15.584 2.234 1.00 0.34 O ATOM 0 H SER A 108 -12.644 13.235 2.569 1.00 51.32 H new ATOM 0 HA SER A 108 -11.564 15.813 3.445 1.00 11.24 H new ATOM 0 HB2 SER A 108 -12.880 16.654 1.893 1.00 0.01 H new ATOM 0 HB3 SER A 108 -12.880 15.018 1.264 1.00 0.01 H new ATOM 0 HG SER A 108 -15.003 15.905 1.404 1.00 0.34 H new ATOM 1808 N LYS A 109 -12.783 16.283 5.466 1.00 0.13 N ATOM 1809 CA LYS A 109 -13.652 16.943 6.435 1.00 3.41 C ATOM 1810 C LYS A 109 -13.938 18.334 5.892 1.00 71.32 C ATOM 1811 O LYS A 109 -13.307 19.325 6.259 1.00 52.31 O ATOM 1812 CB LYS A 109 -13.049 16.915 7.845 1.00 5.22 C ATOM 1813 CG LYS A 109 -13.893 17.734 8.840 1.00 42.04 C ATOM 1814 CD LYS A 109 -13.772 17.288 10.300 1.00 0.03 C ATOM 1815 CE LYS A 109 -14.679 16.078 10.575 1.00 24.45 C ATOM 1816 NZ LYS A 109 -15.149 16.023 11.975 1.00 1.31 N ATOM 0 H LYS A 109 -11.836 16.661 5.442 1.00 0.13 H new ATOM 0 HA LYS A 109 -14.599 16.417 6.556 1.00 3.41 H new ATOM 0 HB2 LYS A 109 -12.978 15.884 8.190 1.00 5.22 H new ATOM 0 HB3 LYS A 109 -12.034 17.312 7.815 1.00 5.22 H new ATOM 0 HG2 LYS A 109 -13.599 18.781 8.769 1.00 42.04 H new ATOM 0 HG3 LYS A 109 -14.940 17.675 8.542 1.00 42.04 H new ATOM 0 HD2 LYS A 109 -12.736 17.031 10.522 1.00 0.03 H new ATOM 0 HD3 LYS A 109 -14.045 18.111 10.961 1.00 0.03 H new ATOM 0 HE2 LYS A 109 -15.540 16.116 9.908 1.00 24.45 H new ATOM 0 HE3 LYS A 109 -14.136 15.162 10.342 1.00 24.45 H new ATOM 0 HZ1 LYS A 109 -15.756 15.189 12.105 1.00 1.31 H new ATOM 0 HZ2 LYS A 109 -14.331 15.959 12.614 1.00 1.31 H new ATOM 0 HZ3 LYS A 109 -15.692 16.883 12.193 1.00 1.31 H new ATOM 1830 N THR A 110 -14.849 18.375 4.930 1.00 61.34 N ATOM 1831 CA THR A 110 -15.502 19.581 4.430 1.00 12.54 C ATOM 1832 C THR A 110 -14.520 20.595 3.817 1.00 71.35 C ATOM 1833 O THR A 110 -14.872 21.751 3.569 1.00 11.40 O ATOM 1834 CB THR A 110 -16.396 20.150 5.554 1.00 34.41 C ATOM 1835 OG1 THR A 110 -17.045 19.094 6.244 1.00 22.43 O ATOM 1836 CG2 THR A 110 -17.503 21.089 5.074 1.00 5.45 C ATOM 0 H THR A 110 -15.169 17.531 4.454 1.00 61.34 H new ATOM 0 HA THR A 110 -16.140 19.328 3.584 1.00 12.54 H new ATOM 0 HB THR A 110 -15.711 20.717 6.185 1.00 34.41 H new ATOM 0 HG1 THR A 110 -17.608 19.465 6.955 1.00 22.43 H new ATOM 0 HG21 THR A 110 -18.079 21.439 5.930 1.00 5.45 H new ATOM 0 HG22 THR A 110 -17.059 21.943 4.561 1.00 5.45 H new ATOM 0 HG23 THR A 110 -18.161 20.555 4.388 1.00 5.45 H new ATOM 1844 N GLY A 111 -13.290 20.178 3.521 1.00 2.20 N ATOM 1845 CA GLY A 111 -12.235 21.062 3.061 1.00 63.44 C ATOM 1846 C GLY A 111 -10.911 20.764 3.747 1.00 65.54 C ATOM 1847 O GLY A 111 -9.861 20.949 3.137 1.00 75.14 O ATOM 0 H GLY A 111 -13.000 19.203 3.597 1.00 2.20 H new ATOM 0 HA2 GLY A 111 -12.117 20.957 1.982 1.00 63.44 H new ATOM 0 HA3 GLY A 111 -12.519 22.097 3.252 1.00 63.44 H new ATOM 1851 N GLU A 112 -10.928 20.171 4.939 1.00 1.45 N ATOM 1852 CA GLU A 112 -9.734 19.765 5.670 1.00 51.21 C ATOM 1853 C GLU A 112 -9.403 18.327 5.252 1.00 32.21 C ATOM 1854 O GLU A 112 -10.315 17.543 4.969 1.00 32.31 O ATOM 1855 CB GLU A 112 -10.023 19.959 7.171 1.00 31.54 C ATOM 1856 CG GLU A 112 -9.261 19.012 8.085 1.00 31.42 C ATOM 1857 CD GLU A 112 -9.199 19.542 9.514 1.00 23.35 C ATOM 1858 OE1 GLU A 112 -10.156 19.327 10.289 1.00 42.45 O ATOM 1859 OE2 GLU A 112 -8.162 20.185 9.814 1.00 55.24 O ATOM 0 H GLU A 112 -11.794 19.955 5.433 1.00 1.45 H new ATOM 0 HA GLU A 112 -8.849 20.361 5.446 1.00 51.21 H new ATOM 0 HB2 GLU A 112 -9.779 20.985 7.446 1.00 31.54 H new ATOM 0 HB3 GLU A 112 -11.092 19.829 7.343 1.00 31.54 H new ATOM 0 HG2 GLU A 112 -9.742 18.034 8.079 1.00 31.42 H new ATOM 0 HG3 GLU A 112 -8.250 18.872 7.704 1.00 31.42 H new ATOM 1866 N VAL A 113 -8.123 17.984 5.135 1.00 41.31 N ATOM 1867 CA VAL A 113 -7.657 16.608 5.036 1.00 14.41 C ATOM 1868 C VAL A 113 -7.695 16.054 6.460 1.00 23.15 C ATOM 1869 O VAL A 113 -7.131 16.661 7.376 1.00 21.13 O ATOM 1870 CB VAL A 113 -6.233 16.553 4.433 1.00 40.02 C ATOM 1871 CG1 VAL A 113 -5.743 15.101 4.302 1.00 34.53 C ATOM 1872 CG2 VAL A 113 -6.173 17.179 3.026 1.00 13.30 C ATOM 0 H VAL A 113 -7.368 18.669 5.106 1.00 41.31 H new ATOM 0 HA VAL A 113 -8.283 16.012 4.372 1.00 14.41 H new ATOM 0 HB VAL A 113 -5.600 17.118 5.117 1.00 40.02 H new ATOM 0 HG11 VAL A 113 -4.740 15.093 3.876 1.00 34.53 H new ATOM 0 HG12 VAL A 113 -5.723 14.634 5.286 1.00 34.53 H new ATOM 0 HG13 VAL A 113 -6.419 14.546 3.651 1.00 34.53 H new ATOM 0 HG21 VAL A 113 -5.154 17.117 2.644 1.00 13.30 H new ATOM 0 HG22 VAL A 113 -6.844 16.639 2.359 1.00 13.30 H new ATOM 0 HG23 VAL A 113 -6.478 18.224 3.079 1.00 13.30 H new ATOM 1882 N LEU A 114 -8.366 14.918 6.646 1.00 13.34 N ATOM 1883 CA LEU A 114 -8.387 14.194 7.909 1.00 55.43 C ATOM 1884 C LEU A 114 -7.960 12.755 7.652 1.00 44.34 C ATOM 1885 O LEU A 114 -8.057 12.274 6.521 1.00 53.33 O ATOM 1886 CB LEU A 114 -9.794 14.258 8.524 1.00 74.12 C ATOM 1887 CG LEU A 114 -9.744 14.345 10.058 1.00 4.41 C ATOM 1888 CD1 LEU A 114 -9.414 15.772 10.513 1.00 51.34 C ATOM 1889 CD2 LEU A 114 -11.093 13.923 10.639 1.00 12.21 C ATOM 0 H LEU A 114 -8.916 14.472 5.912 1.00 13.34 H new ATOM 0 HA LEU A 114 -7.695 14.647 8.619 1.00 55.43 H new ATOM 0 HB2 LEU A 114 -10.325 15.124 8.128 1.00 74.12 H new ATOM 0 HB3 LEU A 114 -10.360 13.375 8.228 1.00 74.12 H new ATOM 0 HG LEU A 114 -8.961 13.677 10.417 1.00 4.41 H new ATOM 0 HD11 LEU A 114 -9.384 15.809 11.602 1.00 51.34 H new ATOM 0 HD12 LEU A 114 -8.444 16.066 10.113 1.00 51.34 H new ATOM 0 HD13 LEU A 114 -10.180 16.457 10.148 1.00 51.34 H new ATOM 0 HD21 LEU A 114 -11.056 13.985 11.727 1.00 12.21 H new ATOM 0 HD22 LEU A 114 -11.874 14.585 10.264 1.00 12.21 H new ATOM 0 HD23 LEU A 114 -11.313 12.898 10.341 1.00 12.21 H new ATOM 1901 N GLU A 115 -7.513 12.070 8.698 1.00 74.24 N ATOM 1902 CA GLU A 115 -6.886 10.759 8.660 1.00 12.51 C ATOM 1903 C GLU A 115 -7.719 9.777 9.487 1.00 11.10 C ATOM 1904 O GLU A 115 -7.961 10.039 10.669 1.00 3.02 O ATOM 1905 CB GLU A 115 -5.430 10.899 9.139 1.00 44.44 C ATOM 1906 CG GLU A 115 -5.182 11.627 10.480 1.00 0.33 C ATOM 1907 CD GLU A 115 -4.688 13.077 10.323 1.00 12.05 C ATOM 1908 OE1 GLU A 115 -5.333 13.921 9.671 1.00 3.20 O ATOM 1909 OE2 GLU A 115 -3.586 13.390 10.857 1.00 31.10 O ATOM 0 H GLU A 115 -7.583 12.437 9.647 1.00 74.24 H new ATOM 0 HA GLU A 115 -6.852 10.354 7.648 1.00 12.51 H new ATOM 0 HB2 GLU A 115 -5.005 9.898 9.217 1.00 44.44 H new ATOM 0 HB3 GLU A 115 -4.871 11.423 8.364 1.00 44.44 H new ATOM 0 HG2 GLU A 115 -6.107 11.629 11.057 1.00 0.33 H new ATOM 0 HG3 GLU A 115 -4.448 11.064 11.057 1.00 0.33 H new ATOM 1916 N ILE A 116 -8.233 8.708 8.861 1.00 62.23 N ATOM 1917 CA ILE A 116 -9.116 7.723 9.495 1.00 31.32 C ATOM 1918 C ILE A 116 -8.774 6.297 9.020 1.00 32.32 C ATOM 1919 O ILE A 116 -7.851 6.104 8.226 1.00 22.43 O ATOM 1920 CB ILE A 116 -10.618 8.092 9.319 1.00 22.12 C ATOM 1921 CG1 ILE A 116 -11.223 7.716 7.949 1.00 45.31 C ATOM 1922 CG2 ILE A 116 -10.899 9.577 9.628 1.00 41.03 C ATOM 1923 CD1 ILE A 116 -12.740 7.952 7.930 1.00 62.11 C ATOM 0 H ILE A 116 -8.042 8.502 7.881 1.00 62.23 H new ATOM 0 HA ILE A 116 -8.938 7.744 10.570 1.00 31.32 H new ATOM 0 HB ILE A 116 -11.122 7.470 10.059 1.00 22.12 H new ATOM 0 HG12 ILE A 116 -10.750 8.307 7.165 1.00 45.31 H new ATOM 0 HG13 ILE A 116 -11.012 6.669 7.730 1.00 45.31 H new ATOM 0 HG21 ILE A 116 -11.961 9.783 9.490 1.00 41.03 H new ATOM 0 HG22 ILE A 116 -10.618 9.794 10.659 1.00 41.03 H new ATOM 0 HG23 ILE A 116 -10.317 10.205 8.954 1.00 41.03 H new ATOM 0 HD11 ILE A 116 -13.139 7.679 6.953 1.00 62.11 H new ATOM 0 HD12 ILE A 116 -13.213 7.341 8.699 1.00 62.11 H new ATOM 0 HD13 ILE A 116 -12.947 9.004 8.125 1.00 62.11 H new ATOM 1935 N ASN A 117 -9.502 5.299 9.529 1.00 3.10 N ATOM 1936 CA ASN A 117 -9.454 3.890 9.128 1.00 2.40 C ATOM 1937 C ASN A 117 -10.294 3.657 7.876 1.00 63.22 C ATOM 1938 O ASN A 117 -11.440 4.102 7.832 1.00 3.10 O ATOM 1939 CB ASN A 117 -10.093 3.014 10.227 1.00 20.34 C ATOM 1940 CG ASN A 117 -9.112 2.283 11.119 1.00 2.00 C ATOM 1941 OD1 ASN A 117 -7.896 2.360 10.964 1.00 20.11 O ATOM 1942 ND2 ASN A 117 -9.640 1.487 12.030 1.00 20.23 N ATOM 0 H ASN A 117 -10.179 5.462 10.274 1.00 3.10 H new ATOM 0 HA ASN A 117 -8.408 3.637 8.955 1.00 2.40 H new ATOM 0 HB2 ASN A 117 -10.726 3.645 10.851 1.00 20.34 H new ATOM 0 HB3 ASN A 117 -10.744 2.280 9.752 1.00 20.34 H new ATOM 0 HD21 ASN A 117 -9.035 0.919 12.623 1.00 20.23 H new ATOM 0 HD22 ASN A 117 -10.653 1.440 12.141 1.00 20.23 H new ATOM 1949 N ALA A 118 -9.814 2.836 6.937 1.00 24.33 N ATOM 1950 CA ALA A 118 -10.530 2.411 5.741 1.00 25.22 C ATOM 1951 C ALA A 118 -11.946 1.900 6.033 1.00 44.43 C ATOM 1952 O ALA A 118 -12.868 2.224 5.286 1.00 20.42 O ATOM 1953 CB ALA A 118 -9.713 1.335 5.016 1.00 62.11 C ATOM 0 H ALA A 118 -8.878 2.436 6.996 1.00 24.33 H new ATOM 0 HA ALA A 118 -10.649 3.289 5.106 1.00 25.22 H new ATOM 0 HB1 ALA A 118 -10.246 1.015 4.121 1.00 62.11 H new ATOM 0 HB2 ALA A 118 -8.743 1.743 4.734 1.00 62.11 H new ATOM 0 HB3 ALA A 118 -9.569 0.481 5.677 1.00 62.11 H new ATOM 1959 N GLU A 119 -12.169 1.125 7.097 1.00 41.43 N ATOM 1960 CA GLU A 119 -13.510 0.608 7.379 1.00 22.34 C ATOM 1961 C GLU A 119 -14.540 1.707 7.678 1.00 61.45 C ATOM 1962 O GLU A 119 -15.738 1.454 7.562 1.00 72.41 O ATOM 1963 CB GLU A 119 -13.463 -0.435 8.500 1.00 12.14 C ATOM 1964 CG GLU A 119 -13.175 0.120 9.903 1.00 64.41 C ATOM 1965 CD GLU A 119 -13.545 -0.905 10.973 1.00 60.12 C ATOM 1966 OE1 GLU A 119 -12.820 -1.912 11.142 1.00 14.10 O ATOM 1967 OE2 GLU A 119 -14.605 -0.731 11.620 1.00 73.31 O ATOM 0 H GLU A 119 -11.452 0.845 7.767 1.00 41.43 H new ATOM 0 HA GLU A 119 -13.853 0.125 6.464 1.00 22.34 H new ATOM 0 HB2 GLU A 119 -14.417 -0.961 8.524 1.00 12.14 H new ATOM 0 HB3 GLU A 119 -12.699 -1.173 8.255 1.00 12.14 H new ATOM 0 HG2 GLU A 119 -12.119 0.378 9.988 1.00 64.41 H new ATOM 0 HG3 GLU A 119 -13.741 1.038 10.060 1.00 64.41 H new ATOM 1974 N MET A 120 -14.106 2.913 8.052 1.00 23.33 N ATOM 1975 CA MET A 120 -14.987 4.047 8.306 1.00 2.22 C ATOM 1976 C MET A 120 -15.327 4.790 7.001 1.00 41.43 C ATOM 1977 O MET A 120 -16.351 5.468 6.920 1.00 13.22 O ATOM 1978 CB MET A 120 -14.311 5.003 9.297 1.00 14.24 C ATOM 1979 CG MET A 120 -14.005 4.406 10.681 1.00 45.45 C ATOM 1980 SD MET A 120 -15.173 4.822 12.009 1.00 52.22 S ATOM 1981 CE MET A 120 -16.635 3.888 11.502 1.00 14.00 C ATOM 0 H MET A 120 -13.118 3.128 8.188 1.00 23.33 H new ATOM 0 HA MET A 120 -15.919 3.676 8.731 1.00 2.22 H new ATOM 0 HB2 MET A 120 -13.378 5.356 8.857 1.00 14.24 H new ATOM 0 HB3 MET A 120 -14.951 5.875 9.429 1.00 14.24 H new ATOM 0 HG2 MET A 120 -13.967 3.321 10.585 1.00 45.45 H new ATOM 0 HG3 MET A 120 -13.011 4.734 10.984 1.00 45.45 H new ATOM 0 HE1 MET A 120 -17.349 3.856 12.325 1.00 14.00 H new ATOM 0 HE2 MET A 120 -17.095 4.372 10.641 1.00 14.00 H new ATOM 0 HE3 MET A 120 -16.343 2.872 11.235 1.00 14.00 H new ATOM 1991 N VAL A 121 -14.481 4.651 5.976 1.00 34.51 N ATOM 1992 CA VAL A 121 -14.540 5.281 4.658 1.00 12.44 C ATOM 1993 C VAL A 121 -15.599 4.626 3.767 1.00 73.43 C ATOM 1994 O VAL A 121 -15.256 3.859 2.865 1.00 40.42 O ATOM 1995 CB VAL A 121 -13.148 5.356 3.999 1.00 41.41 C ATOM 1996 CG1 VAL A 121 -13.187 6.267 2.769 1.00 53.14 C ATOM 1997 CG2 VAL A 121 -12.101 5.963 4.931 1.00 65.13 C ATOM 0 H VAL A 121 -13.667 4.041 6.057 1.00 34.51 H new ATOM 0 HA VAL A 121 -14.861 6.314 4.795 1.00 12.44 H new ATOM 0 HB VAL A 121 -12.884 4.330 3.744 1.00 41.41 H new ATOM 0 HG11 VAL A 121 -12.197 6.309 2.316 1.00 53.14 H new ATOM 0 HG12 VAL A 121 -13.901 5.872 2.046 1.00 53.14 H new ATOM 0 HG13 VAL A 121 -13.492 7.270 3.068 1.00 53.14 H new ATOM 0 HG21 VAL A 121 -11.137 5.995 4.423 1.00 65.13 H new ATOM 0 HG22 VAL A 121 -12.401 6.974 5.205 1.00 65.13 H new ATOM 0 HG23 VAL A 121 -12.017 5.353 5.830 1.00 65.13 H new ATOM 2007 N LYS A 122 -16.874 4.710 4.149 1.00 11.40 N ATOM 2008 CA LYS A 122 -17.973 4.101 3.392 1.00 20.44 C ATOM 2009 C LYS A 122 -18.562 5.069 2.377 1.00 31.34 C ATOM 2010 O LYS A 122 -17.997 6.130 2.148 1.00 62.53 O ATOM 2011 CB LYS A 122 -19.002 3.511 4.365 1.00 12.31 C ATOM 2012 CG LYS A 122 -18.329 2.456 5.253 1.00 53.05 C ATOM 2013 CD LYS A 122 -18.912 1.035 5.129 1.00 5.30 C ATOM 2014 CE LYS A 122 -20.176 0.791 5.963 1.00 0.34 C ATOM 2015 NZ LYS A 122 -19.862 0.275 7.314 1.00 32.42 N ATOM 0 H LYS A 122 -17.176 5.201 4.991 1.00 11.40 H new ATOM 0 HA LYS A 122 -17.590 3.274 2.793 1.00 20.44 H new ATOM 0 HB2 LYS A 122 -19.428 4.302 4.982 1.00 12.31 H new ATOM 0 HB3 LYS A 122 -19.825 3.061 3.810 1.00 12.31 H new ATOM 0 HG2 LYS A 122 -17.267 2.420 5.008 1.00 53.05 H new ATOM 0 HG3 LYS A 122 -18.406 2.775 6.292 1.00 53.05 H new ATOM 0 HD2 LYS A 122 -19.140 0.840 4.081 1.00 5.30 H new ATOM 0 HD3 LYS A 122 -18.150 0.316 5.429 1.00 5.30 H new ATOM 0 HE2 LYS A 122 -20.736 1.722 6.052 1.00 0.34 H new ATOM 0 HE3 LYS A 122 -20.820 0.080 5.445 1.00 0.34 H new ATOM 0 HZ1 LYS A 122 -20.745 0.125 7.842 1.00 32.42 H new ATOM 0 HZ2 LYS A 122 -19.351 -0.627 7.231 1.00 32.42 H new ATOM 0 HZ3 LYS A 122 -19.269 0.964 7.820 1.00 32.42 H new ATOM 2029 N VAL A 123 -19.689 4.701 1.760 1.00 43.13 N ATOM 2030 CA VAL A 123 -20.410 5.443 0.720 1.00 0.34 C ATOM 2031 C VAL A 123 -20.864 6.847 1.166 1.00 2.00 C ATOM 2032 O VAL A 123 -21.462 7.578 0.381 1.00 15.44 O ATOM 2033 CB VAL A 123 -21.572 4.546 0.229 1.00 72.35 C ATOM 2034 CG1 VAL A 123 -22.618 4.242 1.314 1.00 2.14 C ATOM 2035 CG2 VAL A 123 -22.272 5.035 -1.041 1.00 33.13 C ATOM 0 H VAL A 123 -20.152 3.821 1.988 1.00 43.13 H new ATOM 0 HA VAL A 123 -19.736 5.656 -0.110 1.00 0.34 H new ATOM 0 HB VAL A 123 -21.060 3.618 -0.026 1.00 72.35 H new ATOM 0 HG11 VAL A 123 -23.401 3.609 0.897 1.00 2.14 H new ATOM 0 HG12 VAL A 123 -22.139 3.726 2.146 1.00 2.14 H new ATOM 0 HG13 VAL A 123 -23.056 5.175 1.669 1.00 2.14 H new ATOM 0 HG21 VAL A 123 -23.071 4.342 -1.306 1.00 33.13 H new ATOM 0 HG22 VAL A 123 -22.694 6.025 -0.866 1.00 33.13 H new ATOM 0 HG23 VAL A 123 -21.551 5.087 -1.857 1.00 33.13 H new ATOM 2045 N GLY A 124 -20.605 7.245 2.410 1.00 55.21 N ATOM 2046 CA GLY A 124 -20.862 8.576 2.923 1.00 54.03 C ATOM 2047 C GLY A 124 -19.573 9.302 3.279 1.00 53.34 C ATOM 2048 O GLY A 124 -19.671 10.356 3.905 1.00 41.45 O ATOM 0 H GLY A 124 -20.196 6.623 3.107 1.00 55.21 H new ATOM 0 HA2 GLY A 124 -21.411 9.153 2.179 1.00 54.03 H new ATOM 0 HA3 GLY A 124 -21.497 8.509 3.806 1.00 54.03 H new ATOM 2052 N ASP A 125 -18.381 8.791 2.942 1.00 41.45 N ATOM 2053 CA ASP A 125 -17.150 9.564 3.136 1.00 71.21 C ATOM 2054 C ASP A 125 -16.478 9.773 1.787 1.00 20.10 C ATOM 2055 O ASP A 125 -16.581 8.938 0.887 1.00 4.54 O ATOM 2056 CB ASP A 125 -16.223 8.905 4.172 1.00 24.41 C ATOM 2057 CG ASP A 125 -16.370 9.571 5.542 1.00 72.25 C ATOM 2058 OD1 ASP A 125 -16.060 10.780 5.637 1.00 63.13 O ATOM 2059 OD2 ASP A 125 -16.833 8.922 6.517 1.00 54.21 O ATOM 0 H ASP A 125 -18.245 7.863 2.541 1.00 41.45 H new ATOM 0 HA ASP A 125 -17.395 10.542 3.549 1.00 71.21 H new ATOM 0 HB2 ASP A 125 -16.458 7.844 4.253 1.00 24.41 H new ATOM 0 HB3 ASP A 125 -15.188 8.978 3.838 1.00 24.41 H new ATOM 2064 N TYR A 126 -15.807 10.912 1.643 1.00 1.44 N ATOM 2065 CA TYR A 126 -15.054 11.269 0.451 1.00 20.44 C ATOM 2066 C TYR A 126 -13.607 10.860 0.692 1.00 1.24 C ATOM 2067 O TYR A 126 -12.904 11.526 1.450 1.00 13.32 O ATOM 2068 CB TYR A 126 -15.210 12.769 0.125 1.00 22.42 C ATOM 2069 CG TYR A 126 -16.372 13.053 -0.806 1.00 45.21 C ATOM 2070 CD1 TYR A 126 -16.288 12.647 -2.147 1.00 74.41 C ATOM 2071 CD2 TYR A 126 -17.549 13.666 -0.345 1.00 55.54 C ATOM 2072 CE1 TYR A 126 -17.392 12.756 -2.996 1.00 75.22 C ATOM 2073 CE2 TYR A 126 -18.640 13.855 -1.215 1.00 43.03 C ATOM 2074 CZ TYR A 126 -18.573 13.386 -2.548 1.00 2.40 C ATOM 2075 OH TYR A 126 -19.604 13.563 -3.419 1.00 62.24 O ATOM 0 H TYR A 126 -15.773 11.627 2.370 1.00 1.44 H new ATOM 0 HA TYR A 126 -15.433 10.745 -0.426 1.00 20.44 H new ATOM 0 HB2 TYR A 126 -15.350 13.324 1.052 1.00 22.42 H new ATOM 0 HB3 TYR A 126 -14.289 13.134 -0.330 1.00 22.42 H new ATOM 0 HD1 TYR A 126 -15.360 12.246 -2.527 1.00 74.41 H new ATOM 0 HD2 TYR A 126 -17.617 13.994 0.682 1.00 55.54 H new ATOM 0 HE1 TYR A 126 -17.342 12.357 -3.998 1.00 75.22 H new ATOM 0 HE2 TYR A 126 -19.529 14.358 -0.864 1.00 43.03 H new ATOM 0 HH TYR A 126 -20.346 14.010 -2.961 1.00 62.24 H new ATOM 2085 N ILE A 127 -13.163 9.768 0.065 1.00 40.53 N ATOM 2086 CA ILE A 127 -11.806 9.245 0.172 1.00 40.51 C ATOM 2087 C ILE A 127 -10.876 10.072 -0.712 1.00 25.42 C ATOM 2088 O ILE A 127 -11.095 10.152 -1.928 1.00 2.01 O ATOM 2089 CB ILE A 127 -11.792 7.746 -0.194 1.00 33.45 C ATOM 2090 CG1 ILE A 127 -10.423 7.149 0.195 1.00 33.12 C ATOM 2091 CG2 ILE A 127 -12.180 7.412 -1.651 1.00 21.45 C ATOM 2092 CD1 ILE A 127 -10.429 5.620 0.249 1.00 44.12 C ATOM 0 H ILE A 127 -13.758 9.210 -0.548 1.00 40.53 H new ATOM 0 HA ILE A 127 -11.446 9.327 1.198 1.00 40.51 H new ATOM 0 HB ILE A 127 -12.589 7.278 0.384 1.00 33.45 H new ATOM 0 HG12 ILE A 127 -9.672 7.478 -0.523 1.00 33.12 H new ATOM 0 HG13 ILE A 127 -10.126 7.540 1.168 1.00 33.12 H new ATOM 0 HG21 ILE A 127 -12.138 6.333 -1.801 1.00 21.45 H new ATOM 0 HG22 ILE A 127 -13.192 7.766 -1.848 1.00 21.45 H new ATOM 0 HG23 ILE A 127 -11.485 7.901 -2.334 1.00 21.45 H new ATOM 0 HD11 ILE A 127 -9.438 5.262 0.528 1.00 44.12 H new ATOM 0 HD12 ILE A 127 -11.157 5.285 0.988 1.00 44.12 H new ATOM 0 HD13 ILE A 127 -10.696 5.222 -0.730 1.00 44.12 H new ATOM 2104 N TYR A 128 -9.882 10.738 -0.142 1.00 32.30 N ATOM 2105 CA TYR A 128 -8.972 11.555 -0.941 1.00 23.14 C ATOM 2106 C TYR A 128 -8.283 10.668 -1.976 1.00 31.44 C ATOM 2107 O TYR A 128 -7.898 9.549 -1.632 1.00 31.41 O ATOM 2108 CB TYR A 128 -7.944 12.252 -0.041 1.00 53.42 C ATOM 2109 CG TYR A 128 -8.237 13.720 0.161 1.00 12.41 C ATOM 2110 CD1 TYR A 128 -7.971 14.616 -0.887 1.00 34.22 C ATOM 2111 CD2 TYR A 128 -8.811 14.187 1.357 1.00 54.23 C ATOM 2112 CE1 TYR A 128 -8.248 15.980 -0.731 1.00 4.01 C ATOM 2113 CE2 TYR A 128 -9.133 15.545 1.514 1.00 54.22 C ATOM 2114 CZ TYR A 128 -8.840 16.445 0.461 1.00 51.31 C ATOM 2115 OH TYR A 128 -9.171 17.756 0.553 1.00 71.54 O ATOM 0 H TYR A 128 -9.684 10.731 0.859 1.00 32.30 H new ATOM 0 HA TYR A 128 -9.536 12.331 -1.457 1.00 23.14 H new ATOM 0 HB2 TYR A 128 -7.922 11.755 0.929 1.00 53.42 H new ATOM 0 HB3 TYR A 128 -6.952 12.142 -0.479 1.00 53.42 H new ATOM 0 HD1 TYR A 128 -7.552 14.253 -1.814 1.00 34.22 H new ATOM 0 HD2 TYR A 128 -9.006 13.495 2.163 1.00 54.23 H new ATOM 0 HE1 TYR A 128 -8.008 16.675 -1.523 1.00 4.01 H new ATOM 0 HE2 TYR A 128 -9.597 15.897 2.424 1.00 54.22 H new ATOM 0 HH TYR A 128 -9.571 17.932 1.430 1.00 71.54 H new ATOM 2125 N ILE A 129 -8.099 11.161 -3.204 1.00 42.43 N ATOM 2126 CA ILE A 129 -7.360 10.489 -4.273 1.00 2.12 C ATOM 2127 C ILE A 129 -6.396 11.463 -4.978 1.00 74.13 C ATOM 2128 O ILE A 129 -6.614 12.673 -4.939 1.00 55.32 O ATOM 2129 CB ILE A 129 -8.352 9.807 -5.250 1.00 22.13 C ATOM 2130 CG1 ILE A 129 -9.515 10.686 -5.757 1.00 1.00 C ATOM 2131 CG2 ILE A 129 -8.926 8.538 -4.617 1.00 43.31 C ATOM 2132 CD1 ILE A 129 -9.103 11.516 -6.968 1.00 40.01 C ATOM 0 H ILE A 129 -8.472 12.067 -3.489 1.00 42.43 H new ATOM 0 HA ILE A 129 -6.735 9.706 -3.844 1.00 2.12 H new ATOM 0 HB ILE A 129 -7.750 9.585 -6.131 1.00 22.13 H new ATOM 0 HG12 ILE A 129 -10.363 10.053 -6.020 1.00 1.00 H new ATOM 0 HG13 ILE A 129 -9.847 11.348 -4.957 1.00 1.00 H new ATOM 0 HG21 ILE A 129 -9.621 8.067 -5.312 1.00 43.31 H new ATOM 0 HG22 ILE A 129 -8.115 7.846 -4.390 1.00 43.31 H new ATOM 0 HG23 ILE A 129 -9.451 8.796 -3.697 1.00 43.31 H new ATOM 0 HD11 ILE A 129 -9.947 12.122 -7.298 1.00 40.01 H new ATOM 0 HD12 ILE A 129 -8.272 12.167 -6.697 1.00 40.01 H new ATOM 0 HD13 ILE A 129 -8.795 10.853 -7.776 1.00 40.01 H new ATOM 2144 N PRO A 130 -5.340 10.975 -5.655 1.00 13.40 N ATOM 2145 CA PRO A 130 -4.484 11.813 -6.488 1.00 5.02 C ATOM 2146 C PRO A 130 -5.209 12.192 -7.780 1.00 41.01 C ATOM 2147 O PRO A 130 -6.168 11.531 -8.184 1.00 15.35 O ATOM 2148 CB PRO A 130 -3.229 10.973 -6.759 1.00 1.23 C ATOM 2149 CG PRO A 130 -3.748 9.538 -6.708 1.00 40.14 C ATOM 2150 CD PRO A 130 -4.876 9.600 -5.678 1.00 53.04 C ATOM 0 HA PRO A 130 -4.223 12.754 -6.003 1.00 5.02 H new ATOM 0 HB2 PRO A 130 -2.790 11.208 -7.729 1.00 1.23 H new ATOM 0 HB3 PRO A 130 -2.458 11.149 -6.009 1.00 1.23 H new ATOM 0 HG2 PRO A 130 -4.112 9.208 -7.681 1.00 40.14 H new ATOM 0 HG3 PRO A 130 -2.967 8.840 -6.406 1.00 40.14 H new ATOM 0 HD2 PRO A 130 -5.686 8.922 -5.948 1.00 53.04 H new ATOM 0 HD3 PRO A 130 -4.520 9.295 -4.694 1.00 53.04 H new ATOM 2158 N LYS A 131 -4.730 13.237 -8.450 1.00 11.32 N ATOM 2159 CA LYS A 131 -5.087 13.576 -9.814 1.00 24.40 C ATOM 2160 C LYS A 131 -3.788 13.679 -10.612 1.00 2.00 C ATOM 2161 O LYS A 131 -2.877 12.889 -10.379 1.00 60.32 O ATOM 2162 CB LYS A 131 -5.977 14.829 -9.784 1.00 61.42 C ATOM 2163 CG LYS A 131 -6.868 15.022 -11.019 1.00 1.40 C ATOM 2164 CD LYS A 131 -7.998 13.984 -11.122 1.00 62.13 C ATOM 2165 CE LYS A 131 -7.572 12.703 -11.852 1.00 21.53 C ATOM 2166 NZ LYS A 131 -8.650 12.162 -12.699 1.00 33.23 N ATOM 0 H LYS A 131 -4.061 13.889 -8.040 1.00 11.32 H new ATOM 0 HA LYS A 131 -5.688 12.822 -10.323 1.00 24.40 H new ATOM 0 HB2 LYS A 131 -6.613 14.784 -8.900 1.00 61.42 H new ATOM 0 HB3 LYS A 131 -5.340 15.706 -9.674 1.00 61.42 H new ATOM 0 HG2 LYS A 131 -7.303 16.021 -10.992 1.00 1.40 H new ATOM 0 HG3 LYS A 131 -6.251 14.967 -11.916 1.00 1.40 H new ATOM 0 HD2 LYS A 131 -8.340 13.727 -10.119 1.00 62.13 H new ATOM 0 HD3 LYS A 131 -8.845 14.428 -11.644 1.00 62.13 H new ATOM 0 HE2 LYS A 131 -6.698 12.911 -12.468 1.00 21.53 H new ATOM 0 HE3 LYS A 131 -7.275 11.951 -11.121 1.00 21.53 H new ATOM 0 HZ1 LYS A 131 -8.319 11.298 -13.173 1.00 33.23 H new ATOM 0 HZ2 LYS A 131 -9.476 11.938 -12.108 1.00 33.23 H new ATOM 0 HZ3 LYS A 131 -8.917 12.868 -13.414 1.00 33.23 H new ATOM 2180 N ASN A 132 -3.722 14.584 -11.587 1.00 43.43 N ATOM 2181 CA ASN A 132 -2.599 14.763 -12.500 1.00 65.34 C ATOM 2182 C ASN A 132 -1.349 15.101 -11.693 1.00 14.31 C ATOM 2183 O ASN A 132 -0.511 14.262 -11.396 1.00 15.11 O ATOM 2184 CB ASN A 132 -2.882 15.870 -13.544 1.00 63.32 C ATOM 2185 CG ASN A 132 -3.667 17.094 -13.069 1.00 24.34 C ATOM 2186 OD1 ASN A 132 -4.861 17.002 -12.782 1.00 13.14 O ATOM 2187 ND2 ASN A 132 -3.022 18.235 -12.956 1.00 1.23 N ATOM 0 H ASN A 132 -4.483 15.239 -11.768 1.00 43.43 H new ATOM 0 HA ASN A 132 -2.446 13.834 -13.049 1.00 65.34 H new ATOM 0 HB2 ASN A 132 -1.926 16.214 -13.939 1.00 63.32 H new ATOM 0 HB3 ASN A 132 -3.427 15.420 -14.374 1.00 63.32 H new ATOM 0 HD21 ASN A 132 -3.511 19.067 -12.625 1.00 1.23 H new ATOM 0 HD22 ASN A 132 -2.033 18.288 -13.199 1.00 1.23 H new ATOM 2194 N ASN A 133 -1.234 16.383 -11.342 1.00 64.15 N ATOM 2195 CA ASN A 133 -0.150 16.959 -10.557 1.00 53.51 C ATOM 2196 C ASN A 133 -0.603 17.181 -9.103 1.00 4.30 C ATOM 2197 O ASN A 133 0.118 17.741 -8.275 1.00 5.52 O ATOM 2198 CB ASN A 133 0.295 18.298 -11.174 1.00 0.03 C ATOM 2199 CG ASN A 133 0.723 18.236 -12.637 1.00 13.52 C ATOM 2200 OD1 ASN A 133 -0.082 17.961 -13.527 1.00 43.45 O ATOM 2201 ND2 ASN A 133 1.961 18.595 -12.915 1.00 32.10 N ATOM 0 H ASN A 133 -1.930 17.078 -11.612 1.00 64.15 H new ATOM 0 HA ASN A 133 0.691 16.265 -10.563 1.00 53.51 H new ATOM 0 HB2 ASN A 133 -0.525 19.010 -11.083 1.00 0.03 H new ATOM 0 HB3 ASN A 133 1.125 18.691 -10.587 1.00 0.03 H new ATOM 0 HD21 ASN A 133 2.270 18.650 -13.885 1.00 32.10 H new ATOM 0 HD22 ASN A 133 2.609 18.818 -12.160 1.00 32.10 H new ATOM 2208 N THR A 134 -1.848 16.818 -8.814 1.00 13.31 N ATOM 2209 CA THR A 134 -2.684 17.419 -7.790 1.00 55.15 C ATOM 2210 C THR A 134 -3.453 16.349 -7.019 1.00 22.35 C ATOM 2211 O THR A 134 -3.195 15.156 -7.178 1.00 23.11 O ATOM 2212 CB THR A 134 -3.588 18.457 -8.486 1.00 62.12 C ATOM 2213 OG1 THR A 134 -4.105 17.930 -9.694 1.00 42.11 O ATOM 2214 CG2 THR A 134 -2.831 19.736 -8.850 1.00 0.31 C ATOM 0 H THR A 134 -2.320 16.063 -9.311 1.00 13.31 H new ATOM 0 HA THR A 134 -2.088 17.931 -7.035 1.00 55.15 H new ATOM 0 HB THR A 134 -4.382 18.689 -7.776 1.00 62.12 H new ATOM 0 HG1 THR A 134 -4.678 18.599 -10.124 1.00 42.11 H new ATOM 0 HG21 THR A 134 -3.511 20.435 -9.337 1.00 0.31 H new ATOM 0 HG22 THR A 134 -2.430 20.192 -7.945 1.00 0.31 H new ATOM 0 HG23 THR A 134 -2.012 19.494 -9.528 1.00 0.31 H new ATOM 2222 N ILE A 135 -4.371 16.754 -6.143 1.00 3.31 N ATOM 2223 CA ILE A 135 -5.159 15.871 -5.301 1.00 2.24 C ATOM 2224 C ILE A 135 -6.625 16.235 -5.555 1.00 60.51 C ATOM 2225 O ILE A 135 -6.924 17.406 -5.787 1.00 31.45 O ATOM 2226 CB ILE A 135 -4.684 16.066 -3.841 1.00 31.23 C ATOM 2227 CG1 ILE A 135 -5.045 14.863 -2.954 1.00 35.34 C ATOM 2228 CG2 ILE A 135 -5.220 17.371 -3.228 1.00 5.41 C ATOM 2229 CD1 ILE A 135 -3.970 13.770 -2.981 1.00 20.50 C ATOM 0 H ILE A 135 -4.590 17.740 -5.999 1.00 3.31 H new ATOM 0 HA ILE A 135 -5.041 14.809 -5.517 1.00 2.24 H new ATOM 0 HB ILE A 135 -3.597 16.139 -3.880 1.00 31.23 H new ATOM 0 HG12 ILE A 135 -5.188 15.202 -1.928 1.00 35.34 H new ATOM 0 HG13 ILE A 135 -5.994 14.443 -3.286 1.00 35.34 H new ATOM 0 HG21 ILE A 135 -4.861 17.466 -2.203 1.00 5.41 H new ATOM 0 HG22 ILE A 135 -4.869 18.220 -3.815 1.00 5.41 H new ATOM 0 HG23 ILE A 135 -6.310 17.354 -3.231 1.00 5.41 H new ATOM 0 HD11 ILE A 135 -4.275 12.944 -2.338 1.00 20.50 H new ATOM 0 HD12 ILE A 135 -3.844 13.408 -4.002 1.00 20.50 H new ATOM 0 HD13 ILE A 135 -3.026 14.180 -2.622 1.00 20.50 H new ATOM 2241 N ASN A 136 -7.548 15.276 -5.573 1.00 2.41 N ATOM 2242 CA ASN A 136 -8.973 15.503 -5.830 1.00 42.05 C ATOM 2243 C ASN A 136 -9.776 14.647 -4.841 1.00 44.44 C ATOM 2244 O ASN A 136 -9.213 13.857 -4.080 1.00 1.32 O ATOM 2245 CB ASN A 136 -9.356 15.148 -7.292 1.00 13.22 C ATOM 2246 CG ASN A 136 -9.092 16.172 -8.399 1.00 15.00 C ATOM 2247 OD1 ASN A 136 -9.758 16.119 -9.434 1.00 22.13 O ATOM 2248 ND2 ASN A 136 -8.108 17.046 -8.277 1.00 74.15 N ATOM 0 H ASN A 136 -7.323 14.295 -5.406 1.00 2.41 H new ATOM 0 HA ASN A 136 -9.200 16.560 -5.693 1.00 42.05 H new ATOM 0 HB2 ASN A 136 -8.827 14.233 -7.558 1.00 13.22 H new ATOM 0 HB3 ASN A 136 -10.421 14.916 -7.306 1.00 13.22 H new ATOM 0 HD21 ASN A 136 -7.895 17.684 -9.044 1.00 74.15 H new ATOM 0 HD22 ASN A 136 -7.562 17.082 -7.416 1.00 74.15 H new ATOM 2255 N LEU A 137 -11.104 14.765 -4.895 1.00 44.52 N ATOM 2256 CA LEU A 137 -12.048 13.908 -4.186 1.00 31.51 C ATOM 2257 C LEU A 137 -12.835 13.114 -5.225 1.00 73.22 C ATOM 2258 O LEU A 137 -13.128 13.620 -6.318 1.00 12.44 O ATOM 2259 CB LEU A 137 -13.000 14.721 -3.278 1.00 2.04 C ATOM 2260 CG LEU A 137 -12.303 15.568 -2.195 1.00 44.22 C ATOM 2261 CD1 LEU A 137 -13.334 16.393 -1.420 1.00 73.24 C ATOM 2262 CD2 LEU A 137 -11.511 14.704 -1.212 1.00 43.44 C ATOM 0 H LEU A 137 -11.564 15.484 -5.453 1.00 44.52 H new ATOM 0 HA LEU A 137 -11.498 13.235 -3.528 1.00 31.51 H new ATOM 0 HB2 LEU A 137 -13.599 15.382 -3.905 1.00 2.04 H new ATOM 0 HB3 LEU A 137 -13.690 14.032 -2.791 1.00 2.04 H new ATOM 0 HG LEU A 137 -11.605 16.229 -2.708 1.00 44.22 H new ATOM 0 HD11 LEU A 137 -12.827 16.986 -0.659 1.00 73.24 H new ATOM 0 HD12 LEU A 137 -13.860 17.057 -2.107 1.00 73.24 H new ATOM 0 HD13 LEU A 137 -14.050 15.724 -0.942 1.00 73.24 H new ATOM 0 HD21 LEU A 137 -11.037 15.343 -0.467 1.00 43.44 H new ATOM 0 HD22 LEU A 137 -12.185 14.006 -0.716 1.00 43.44 H new ATOM 0 HD23 LEU A 137 -10.746 14.147 -1.752 1.00 43.44 H new ATOM 2274 N ASP A 138 -13.185 11.879 -4.887 1.00 2.20 N ATOM 2275 CA ASP A 138 -14.097 11.003 -5.605 1.00 13.34 C ATOM 2276 C ASP A 138 -14.940 10.201 -4.611 1.00 11.10 C ATOM 2277 O ASP A 138 -14.518 9.996 -3.472 1.00 0.04 O ATOM 2278 CB ASP A 138 -13.325 10.059 -6.534 1.00 2.42 C ATOM 2279 CG ASP A 138 -14.238 9.449 -7.594 1.00 21.12 C ATOM 2280 OD1 ASP A 138 -15.280 10.065 -7.906 1.00 12.43 O ATOM 2281 OD2 ASP A 138 -13.881 8.409 -8.188 1.00 40.42 O ATOM 0 H ASP A 138 -12.813 11.435 -4.047 1.00 2.20 H new ATOM 0 HA ASP A 138 -14.758 11.616 -6.218 1.00 13.34 H new ATOM 0 HB2 ASP A 138 -12.516 10.605 -7.019 1.00 2.42 H new ATOM 0 HB3 ASP A 138 -12.865 9.264 -5.947 1.00 2.42 H new ATOM 2286 N GLU A 139 -16.131 9.775 -5.019 1.00 14.12 N ATOM 2287 CA GLU A 139 -17.171 9.302 -4.103 1.00 63.51 C ATOM 2288 C GLU A 139 -17.089 7.780 -3.958 1.00 41.24 C ATOM 2289 O GLU A 139 -16.786 7.110 -4.951 1.00 73.43 O ATOM 2290 CB GLU A 139 -18.526 9.779 -4.649 1.00 71.21 C ATOM 2291 CG GLU A 139 -19.519 10.094 -3.525 1.00 53.44 C ATOM 2292 CD GLU A 139 -20.495 8.964 -3.177 1.00 55.33 C ATOM 2293 OE1 GLU A 139 -20.236 7.790 -3.539 1.00 35.12 O ATOM 2294 OE2 GLU A 139 -21.608 9.280 -2.681 1.00 71.44 O ATOM 0 H GLU A 139 -16.407 9.747 -6.001 1.00 14.12 H new ATOM 0 HA GLU A 139 -17.038 9.710 -3.101 1.00 63.51 H new ATOM 0 HB2 GLU A 139 -18.377 10.668 -5.261 1.00 71.21 H new ATOM 0 HB3 GLU A 139 -18.946 9.011 -5.299 1.00 71.21 H new ATOM 0 HG2 GLU A 139 -18.957 10.355 -2.628 1.00 53.44 H new ATOM 0 HG3 GLU A 139 -20.095 10.975 -3.808 1.00 53.44 H new ATOM 2301 N VAL A 140 -17.318 7.230 -2.755 1.00 11.05 N ATOM 2302 CA VAL A 140 -16.928 5.845 -2.440 1.00 64.43 C ATOM 2303 C VAL A 140 -17.864 4.769 -3.021 1.00 43.44 C ATOM 2304 O VAL A 140 -17.547 3.585 -2.967 1.00 44.45 O ATOM 2305 CB VAL A 140 -16.729 5.751 -0.908 1.00 52.42 C ATOM 2306 CG1 VAL A 140 -16.712 4.336 -0.311 1.00 11.42 C ATOM 2307 CG2 VAL A 140 -15.407 6.434 -0.529 1.00 71.43 C ATOM 0 H VAL A 140 -17.771 7.722 -1.985 1.00 11.05 H new ATOM 0 HA VAL A 140 -15.989 5.617 -2.943 1.00 64.43 H new ATOM 0 HB VAL A 140 -17.607 6.242 -0.489 1.00 52.42 H new ATOM 0 HG11 VAL A 140 -16.566 4.398 0.767 1.00 11.42 H new ATOM 0 HG12 VAL A 140 -17.660 3.841 -0.521 1.00 11.42 H new ATOM 0 HG13 VAL A 140 -15.898 3.764 -0.755 1.00 11.42 H new ATOM 0 HG21 VAL A 140 -15.261 6.371 0.549 1.00 71.43 H new ATOM 0 HG22 VAL A 140 -14.581 5.935 -1.037 1.00 71.43 H new ATOM 0 HG23 VAL A 140 -15.439 7.481 -0.830 1.00 71.43 H new ATOM 2317 N ILE A 141 -18.977 5.151 -3.642 1.00 34.52 N ATOM 2318 CA ILE A 141 -19.978 4.298 -4.296 1.00 11.50 C ATOM 2319 C ILE A 141 -20.144 2.868 -3.714 1.00 22.11 C ATOM 2320 O ILE A 141 -21.024 2.647 -2.879 1.00 2.03 O ATOM 2321 CB ILE A 141 -19.756 4.314 -5.827 1.00 32.35 C ATOM 2322 CG1 ILE A 141 -18.300 3.990 -6.236 1.00 40.51 C ATOM 2323 CG2 ILE A 141 -20.145 5.681 -6.419 1.00 15.42 C ATOM 2324 CD1 ILE A 141 -18.230 3.216 -7.543 1.00 41.25 C ATOM 0 H ILE A 141 -19.226 6.138 -3.709 1.00 34.52 H new ATOM 0 HA ILE A 141 -20.946 4.743 -4.067 1.00 11.50 H new ATOM 0 HB ILE A 141 -20.397 3.529 -6.227 1.00 32.35 H new ATOM 0 HG12 ILE A 141 -17.737 4.918 -6.335 1.00 40.51 H new ATOM 0 HG13 ILE A 141 -17.823 3.410 -5.446 1.00 40.51 H new ATOM 0 HG21 ILE A 141 -19.981 5.671 -7.497 1.00 15.42 H new ATOM 0 HG22 ILE A 141 -21.197 5.880 -6.214 1.00 15.42 H new ATOM 0 HG23 ILE A 141 -19.533 6.461 -5.966 1.00 15.42 H new ATOM 0 HD11 ILE A 141 -17.188 3.011 -7.789 1.00 41.25 H new ATOM 0 HD12 ILE A 141 -18.770 2.275 -7.438 1.00 41.25 H new ATOM 0 HD13 ILE A 141 -18.682 3.806 -8.340 1.00 41.25 H new ATOM 2336 N LYS A 142 -19.372 1.881 -4.190 1.00 52.53 N ATOM 2337 CA LYS A 142 -19.445 0.465 -3.842 1.00 32.23 C ATOM 2338 C LYS A 142 -18.614 0.203 -2.591 1.00 75.55 C ATOM 2339 O LYS A 142 -17.413 0.489 -2.586 1.00 75.12 O ATOM 2340 CB LYS A 142 -19.002 -0.385 -5.056 1.00 21.11 C ATOM 2341 CG LYS A 142 -18.508 -1.803 -4.705 1.00 44.12 C ATOM 2342 CD LYS A 142 -17.921 -2.564 -5.906 1.00 1.11 C ATOM 2343 CE LYS A 142 -18.978 -3.346 -6.695 1.00 41.14 C ATOM 2344 NZ LYS A 142 -18.609 -4.770 -6.860 1.00 73.34 N ATOM 0 H LYS A 142 -18.636 2.068 -4.871 1.00 52.53 H new ATOM 0 HA LYS A 142 -20.469 0.176 -3.607 1.00 32.23 H new ATOM 0 HB2 LYS A 142 -19.839 -0.468 -5.749 1.00 21.11 H new ATOM 0 HB3 LYS A 142 -18.205 0.143 -5.580 1.00 21.11 H new ATOM 0 HG2 LYS A 142 -17.750 -1.732 -3.925 1.00 44.12 H new ATOM 0 HG3 LYS A 142 -19.338 -2.376 -4.292 1.00 44.12 H new ATOM 0 HD2 LYS A 142 -17.429 -1.856 -6.572 1.00 1.11 H new ATOM 0 HD3 LYS A 142 -17.155 -3.254 -5.552 1.00 1.11 H new ATOM 0 HE2 LYS A 142 -19.937 -3.278 -6.182 1.00 41.14 H new ATOM 0 HE3 LYS A 142 -19.108 -2.890 -7.676 1.00 41.14 H new ATOM 0 HZ1 LYS A 142 -18.485 -4.982 -7.871 1.00 73.34 H new ATOM 0 HZ2 LYS A 142 -17.719 -4.959 -6.355 1.00 73.34 H new ATOM 0 HZ3 LYS A 142 -19.363 -5.371 -6.470 1.00 73.34 H new ATOM 2358 N VAL A 143 -19.216 -0.451 -1.594 1.00 22.20 N ATOM 2359 CA VAL A 143 -18.595 -0.787 -0.319 1.00 43.02 C ATOM 2360 C VAL A 143 -18.775 -2.270 0.007 1.00 22.41 C ATOM 2361 O VAL A 143 -19.819 -2.704 0.490 1.00 34.50 O ATOM 2362 CB VAL A 143 -19.042 0.156 0.822 1.00 73.35 C ATOM 2363 CG1 VAL A 143 -17.823 0.905 1.357 1.00 2.20 C ATOM 2364 CG2 VAL A 143 -20.090 1.212 0.443 1.00 43.54 C ATOM 0 H VAL A 143 -20.183 -0.770 -1.659 1.00 22.20 H new ATOM 0 HA VAL A 143 -17.522 -0.620 -0.417 1.00 43.02 H new ATOM 0 HB VAL A 143 -19.510 -0.501 1.555 1.00 73.35 H new ATOM 0 HG11 VAL A 143 -18.130 1.572 2.162 1.00 2.20 H new ATOM 0 HG12 VAL A 143 -17.094 0.189 1.737 1.00 2.20 H new ATOM 0 HG13 VAL A 143 -17.373 1.489 0.554 1.00 2.20 H new ATOM 0 HG21 VAL A 143 -20.330 1.817 1.317 1.00 43.54 H new ATOM 0 HG22 VAL A 143 -19.692 1.853 -0.344 1.00 43.54 H new ATOM 0 HG23 VAL A 143 -20.993 0.717 0.086 1.00 43.54 H new ATOM 2374 N GLU A 144 -17.735 -3.055 -0.267 1.00 23.45 N ATOM 2375 CA GLU A 144 -17.632 -4.499 -0.114 1.00 21.45 C ATOM 2376 C GLU A 144 -16.163 -4.904 0.121 1.00 11.22 C ATOM 2377 O GLU A 144 -15.286 -4.058 0.330 1.00 1.20 O ATOM 2378 CB GLU A 144 -18.205 -5.162 -1.374 1.00 44.03 C ATOM 2379 CG GLU A 144 -17.469 -4.717 -2.646 1.00 0.14 C ATOM 2380 CD GLU A 144 -17.994 -5.454 -3.879 1.00 14.40 C ATOM 2381 OE1 GLU A 144 -19.220 -5.423 -4.139 1.00 73.14 O ATOM 2382 OE2 GLU A 144 -17.175 -5.933 -4.703 1.00 63.33 O ATOM 0 H GLU A 144 -16.869 -2.659 -0.633 1.00 23.45 H new ATOM 0 HA GLU A 144 -18.202 -4.832 0.753 1.00 21.45 H new ATOM 0 HB2 GLU A 144 -18.136 -6.245 -1.276 1.00 44.03 H new ATOM 0 HB3 GLU A 144 -19.263 -4.916 -1.463 1.00 44.03 H new ATOM 0 HG2 GLU A 144 -17.592 -3.643 -2.782 1.00 0.14 H new ATOM 0 HG3 GLU A 144 -16.401 -4.904 -2.535 1.00 0.14 H new ATOM 2389 N THR A 145 -15.878 -6.200 0.064 1.00 11.30 N ATOM 2390 CA THR A 145 -14.602 -6.810 0.398 1.00 34.13 C ATOM 2391 C THR A 145 -14.200 -7.822 -0.687 1.00 21.52 C ATOM 2392 O THR A 145 -14.916 -8.012 -1.679 1.00 74.25 O ATOM 2393 CB THR A 145 -14.730 -7.442 1.805 1.00 0.04 C ATOM 2394 OG1 THR A 145 -16.019 -7.989 2.007 1.00 0.21 O ATOM 2395 CG2 THR A 145 -14.533 -6.417 2.923 1.00 62.34 C ATOM 0 H THR A 145 -16.570 -6.888 -0.233 1.00 11.30 H new ATOM 0 HA THR A 145 -13.802 -6.070 0.428 1.00 34.13 H new ATOM 0 HB THR A 145 -13.955 -8.208 1.844 1.00 0.04 H new ATOM 0 HG1 THR A 145 -16.071 -8.383 2.903 1.00 0.21 H new ATOM 0 HG21 THR A 145 -14.632 -6.910 3.890 1.00 62.34 H new ATOM 0 HG22 THR A 145 -13.540 -5.976 2.841 1.00 62.34 H new ATOM 0 HG23 THR A 145 -15.286 -5.634 2.836 1.00 62.34 H new ATOM 2403 N VAL A 146 -13.041 -8.449 -0.507 1.00 20.43 N ATOM 2404 CA VAL A 146 -12.620 -9.700 -1.119 1.00 33.50 C ATOM 2405 C VAL A 146 -12.268 -10.645 0.026 1.00 34.14 C ATOM 2406 O VAL A 146 -11.994 -10.180 1.135 1.00 3.25 O ATOM 2407 CB VAL A 146 -11.401 -9.493 -2.045 1.00 31.34 C ATOM 2408 CG1 VAL A 146 -11.652 -8.387 -3.067 1.00 45.25 C ATOM 2409 CG2 VAL A 146 -10.111 -9.097 -1.312 1.00 53.45 C ATOM 0 H VAL A 146 -12.325 -8.069 0.112 1.00 20.43 H new ATOM 0 HA VAL A 146 -13.416 -10.108 -1.742 1.00 33.50 H new ATOM 0 HB VAL A 146 -11.270 -10.469 -2.513 1.00 31.34 H new ATOM 0 HG11 VAL A 146 -10.773 -8.270 -3.700 1.00 45.25 H new ATOM 0 HG12 VAL A 146 -12.511 -8.650 -3.684 1.00 45.25 H new ATOM 0 HG13 VAL A 146 -11.852 -7.450 -2.547 1.00 45.25 H new ATOM 0 HG21 VAL A 146 -9.305 -8.972 -2.035 1.00 53.45 H new ATOM 0 HG22 VAL A 146 -10.269 -8.160 -0.779 1.00 53.45 H new ATOM 0 HG23 VAL A 146 -9.842 -9.878 -0.601 1.00 53.45 H new ATOM 2419 N ASP A 147 -12.170 -11.943 -0.241 1.00 51.43 N ATOM 2420 CA ASP A 147 -11.490 -12.902 0.597 1.00 42.55 C ATOM 2421 C ASP A 147 -10.105 -13.086 -0.017 1.00 31.15 C ATOM 2422 O ASP A 147 -9.993 -13.152 -1.244 1.00 60.43 O ATOM 2423 CB ASP A 147 -12.302 -14.196 0.571 1.00 44.14 C ATOM 2424 CG ASP A 147 -13.184 -14.302 1.816 1.00 13.53 C ATOM 2425 OD1 ASP A 147 -12.720 -14.756 2.889 1.00 11.11 O ATOM 2426 OD2 ASP A 147 -14.364 -13.895 1.722 1.00 75.41 O ATOM 0 H ASP A 147 -12.578 -12.362 -1.077 1.00 51.43 H new ATOM 0 HA ASP A 147 -11.391 -12.587 1.636 1.00 42.55 H new ATOM 0 HB2 ASP A 147 -12.923 -14.225 -0.325 1.00 44.14 H new ATOM 0 HB3 ASP A 147 -11.630 -15.053 0.521 1.00 44.14 H new ATOM 2431 N TYR A 148 -9.044 -13.131 0.791 1.00 1.04 N ATOM 2432 CA TYR A 148 -7.669 -13.185 0.298 1.00 20.35 C ATOM 2433 C TYR A 148 -6.803 -13.994 1.253 1.00 51.03 C ATOM 2434 O TYR A 148 -7.043 -13.953 2.461 1.00 51.12 O ATOM 2435 CB TYR A 148 -7.124 -11.757 0.155 1.00 0.14 C ATOM 2436 CG TYR A 148 -6.227 -11.570 -1.045 1.00 72.32 C ATOM 2437 CD1 TYR A 148 -6.785 -11.436 -2.329 1.00 44.43 C ATOM 2438 CD2 TYR A 148 -4.834 -11.545 -0.878 1.00 74.42 C ATOM 2439 CE1 TYR A 148 -5.951 -11.252 -3.446 1.00 22.50 C ATOM 2440 CE2 TYR A 148 -3.990 -11.386 -1.994 1.00 43.51 C ATOM 2441 CZ TYR A 148 -4.548 -11.211 -3.285 1.00 11.00 C ATOM 2442 OH TYR A 148 -3.732 -11.001 -4.354 1.00 21.41 O ATOM 0 H TYR A 148 -9.116 -13.131 1.808 1.00 1.04 H new ATOM 0 HA TYR A 148 -7.650 -13.672 -0.677 1.00 20.35 H new ATOM 0 HB2 TYR A 148 -7.961 -11.063 0.084 1.00 0.14 H new ATOM 0 HB3 TYR A 148 -6.570 -11.497 1.057 1.00 0.14 H new ATOM 0 HD1 TYR A 148 -7.857 -11.475 -2.457 1.00 44.43 H new ATOM 0 HD2 TYR A 148 -4.408 -11.648 0.109 1.00 74.42 H new ATOM 0 HE1 TYR A 148 -6.384 -11.142 -4.429 1.00 22.50 H new ATOM 0 HE2 TYR A 148 -2.918 -11.397 -1.866 1.00 43.51 H new ATOM 0 HH TYR A 148 -3.941 -10.134 -4.760 1.00 21.41 H new ATOM 2452 N ASN A 149 -5.845 -14.781 0.747 1.00 62.42 N ATOM 2453 CA ASN A 149 -5.302 -15.927 1.495 1.00 43.53 C ATOM 2454 C ASN A 149 -3.818 -16.172 1.203 1.00 32.54 C ATOM 2455 O ASN A 149 -3.337 -17.303 1.306 1.00 22.50 O ATOM 2456 CB ASN A 149 -6.080 -17.215 1.150 1.00 14.02 C ATOM 2457 CG ASN A 149 -7.596 -17.134 1.041 1.00 25.14 C ATOM 2458 OD1 ASN A 149 -8.260 -16.488 1.977 1.00 3.05 O flip ATOM 2459 ND2 ASN A 149 -8.171 -17.645 0.086 1.00 74.23 N flip ATOM 0 H ASN A 149 -5.429 -14.647 -0.175 1.00 62.42 H new ATOM 0 HA ASN A 149 -5.412 -15.680 2.551 1.00 43.53 H new ATOM 0 HB2 ASN A 149 -5.698 -17.590 0.201 1.00 14.02 H new ATOM 0 HB3 ASN A 149 -5.840 -17.961 1.907 1.00 14.02 H new ATOM 0 HD21 ASN A 149 -7.635 -18.140 -0.627 1.00 74.23 H new ATOM 0 HD22 ASN A 149 -9.185 -17.575 0.004 1.00 74.23 H new ATOM 2466 N GLY A 150 -3.106 -15.141 0.777 1.00 2.40 N ATOM 2467 CA GLY A 150 -1.893 -15.289 -0.018 1.00 63.15 C ATOM 2468 C GLY A 150 -0.675 -14.902 0.800 1.00 42.11 C ATOM 2469 O GLY A 150 -0.320 -15.581 1.765 1.00 11.24 O ATOM 0 H GLY A 150 -3.353 -14.171 0.973 1.00 2.40 H new ATOM 0 HA2 GLY A 150 -1.797 -16.320 -0.359 1.00 63.15 H new ATOM 0 HA3 GLY A 150 -1.955 -14.663 -0.908 1.00 63.15 H new ATOM 2473 N HIS A 151 -0.047 -13.791 0.420 1.00 33.14 N ATOM 2474 CA HIS A 151 0.815 -12.985 1.270 1.00 75.22 C ATOM 2475 C HIS A 151 0.406 -11.523 1.049 1.00 75.13 C ATOM 2476 O HIS A 151 -0.362 -11.219 0.126 1.00 42.53 O ATOM 2477 CB HIS A 151 2.301 -13.238 0.970 1.00 45.03 C ATOM 2478 CG HIS A 151 2.832 -14.566 1.468 1.00 35.25 C ATOM 2479 ND1 HIS A 151 2.898 -15.734 0.746 1.00 12.20 N ATOM 2480 CD2 HIS A 151 3.372 -14.823 2.700 1.00 63.11 C ATOM 2481 CE1 HIS A 151 3.479 -16.668 1.516 1.00 45.15 C ATOM 2482 NE2 HIS A 151 3.786 -16.169 2.730 1.00 1.11 N ATOM 0 H HIS A 151 -0.130 -13.417 -0.525 1.00 33.14 H new ATOM 0 HA HIS A 151 0.693 -13.251 2.320 1.00 75.22 H new ATOM 0 HB2 HIS A 151 2.454 -13.182 -0.108 1.00 45.03 H new ATOM 0 HB3 HIS A 151 2.889 -12.437 1.417 1.00 45.03 H new ATOM 0 HD2 HIS A 151 3.465 -14.115 3.510 1.00 63.11 H new ATOM 0 HE1 HIS A 151 3.674 -17.683 1.204 1.00 45.15 H new ATOM 0 HE2 HIS A 151 4.226 -16.662 3.507 1.00 1.11 H new ATOM 2490 N ILE A 152 0.841 -10.643 1.943 1.00 73.41 N ATOM 2491 CA ILE A 152 0.681 -9.191 1.902 1.00 72.32 C ATOM 2492 C ILE A 152 2.054 -8.530 2.067 1.00 5.04 C ATOM 2493 O ILE A 152 2.994 -9.177 2.541 1.00 60.11 O ATOM 2494 CB ILE A 152 -0.318 -8.721 2.985 1.00 41.33 C ATOM 2495 CG1 ILE A 152 0.042 -9.316 4.369 1.00 42.24 C ATOM 2496 CG2 ILE A 152 -1.750 -9.074 2.553 1.00 3.22 C ATOM 2497 CD1 ILE A 152 -0.799 -8.794 5.533 1.00 24.53 C ATOM 0 H ILE A 152 1.350 -10.944 2.774 1.00 73.41 H new ATOM 0 HA ILE A 152 0.267 -8.893 0.939 1.00 72.32 H new ATOM 0 HB ILE A 152 -0.255 -7.638 3.089 1.00 41.33 H new ATOM 0 HG12 ILE A 152 -0.064 -10.400 4.321 1.00 42.24 H new ATOM 0 HG13 ILE A 152 1.092 -9.107 4.576 1.00 42.24 H new ATOM 0 HG21 ILE A 152 -2.453 -8.742 3.317 1.00 3.22 H new ATOM 0 HG22 ILE A 152 -1.978 -8.578 1.610 1.00 3.22 H new ATOM 0 HG23 ILE A 152 -1.836 -10.153 2.425 1.00 3.22 H new ATOM 0 HD11 ILE A 152 -0.473 -9.268 6.459 1.00 24.53 H new ATOM 0 HD12 ILE A 152 -0.676 -7.714 5.615 1.00 24.53 H new ATOM 0 HD13 ILE A 152 -1.849 -9.027 5.356 1.00 24.53 H new ATOM 2509 N TYR A 153 2.172 -7.262 1.664 1.00 11.00 N ATOM 2510 CA TYR A 153 3.443 -6.550 1.526 1.00 52.31 C ATOM 2511 C TYR A 153 3.267 -5.093 1.955 1.00 55.34 C ATOM 2512 O TYR A 153 2.167 -4.554 1.842 1.00 35.54 O ATOM 2513 CB TYR A 153 3.912 -6.626 0.064 1.00 60.12 C ATOM 2514 CG TYR A 153 3.998 -8.039 -0.491 1.00 41.45 C ATOM 2515 CD1 TYR A 153 2.848 -8.678 -0.994 1.00 34.51 C ATOM 2516 CD2 TYR A 153 5.215 -8.739 -0.437 1.00 12.40 C ATOM 2517 CE1 TYR A 153 2.908 -10.027 -1.384 1.00 54.02 C ATOM 2518 CE2 TYR A 153 5.298 -10.067 -0.891 1.00 33.43 C ATOM 2519 CZ TYR A 153 4.135 -10.726 -1.347 1.00 52.55 C ATOM 2520 OH TYR A 153 4.186 -12.030 -1.735 1.00 73.41 O ATOM 0 H TYR A 153 1.365 -6.689 1.419 1.00 11.00 H new ATOM 0 HA TYR A 153 4.195 -7.012 2.165 1.00 52.31 H new ATOM 0 HB2 TYR A 153 3.229 -6.045 -0.556 1.00 60.12 H new ATOM 0 HB3 TYR A 153 4.892 -6.156 -0.016 1.00 60.12 H new ATOM 0 HD1 TYR A 153 1.920 -8.132 -1.080 1.00 34.51 H new ATOM 0 HD2 TYR A 153 6.095 -8.252 -0.043 1.00 12.40 H new ATOM 0 HE1 TYR A 153 2.012 -10.532 -1.714 1.00 54.02 H new ATOM 0 HE2 TYR A 153 6.248 -10.581 -0.891 1.00 33.43 H new ATOM 0 HH TYR A 153 5.104 -12.361 -1.650 1.00 73.41 H new ATOM 2530 N ASP A 154 4.322 -4.444 2.451 1.00 1.21 N ATOM 2531 CA ASP A 154 4.293 -3.036 2.869 1.00 1.31 C ATOM 2532 C ASP A 154 5.688 -2.450 2.636 1.00 42.32 C ATOM 2533 O ASP A 154 6.583 -3.143 2.143 1.00 1.24 O ATOM 2534 CB ASP A 154 3.825 -2.885 4.336 1.00 63.34 C ATOM 2535 CG ASP A 154 3.197 -1.519 4.672 1.00 52.23 C ATOM 2536 OD1 ASP A 154 3.516 -0.482 4.045 1.00 51.33 O ATOM 2537 OD2 ASP A 154 2.297 -1.480 5.535 1.00 54.23 O ATOM 0 H ASP A 154 5.233 -4.885 2.576 1.00 1.21 H new ATOM 0 HA ASP A 154 3.565 -2.482 2.276 1.00 1.31 H new ATOM 0 HB2 ASP A 154 3.098 -3.668 4.554 1.00 63.34 H new ATOM 0 HB3 ASP A 154 4.678 -3.050 4.994 1.00 63.34 H new ATOM 2542 N LEU A 155 5.901 -1.183 2.970 1.00 41.55 N ATOM 2543 CA LEU A 155 7.060 -0.400 2.600 1.00 0.34 C ATOM 2544 C LEU A 155 7.685 0.251 3.816 1.00 2.41 C ATOM 2545 O LEU A 155 7.217 0.178 4.951 1.00 20.12 O ATOM 2546 CB LEU A 155 6.658 0.688 1.587 1.00 61.11 C ATOM 2547 CG LEU A 155 6.260 0.152 0.212 1.00 72.12 C ATOM 2548 CD1 LEU A 155 5.865 1.353 -0.650 1.00 63.32 C ATOM 2549 CD2 LEU A 155 7.386 -0.643 -0.459 1.00 35.45 C ATOM 0 H LEU A 155 5.235 -0.654 3.533 1.00 41.55 H new ATOM 0 HA LEU A 155 7.791 -1.070 2.148 1.00 0.34 H new ATOM 0 HB2 LEU A 155 5.825 1.259 1.996 1.00 61.11 H new ATOM 0 HB3 LEU A 155 7.491 1.381 1.467 1.00 61.11 H new ATOM 0 HG LEU A 155 5.429 -0.544 0.326 1.00 72.12 H new ATOM 0 HD11 LEU A 155 5.574 1.009 -1.642 1.00 63.32 H new ATOM 0 HD12 LEU A 155 5.027 1.874 -0.186 1.00 63.32 H new ATOM 0 HD13 LEU A 155 6.712 2.033 -0.736 1.00 63.32 H new ATOM 0 HD21 LEU A 155 7.049 -1.000 -1.432 1.00 35.45 H new ATOM 0 HD22 LEU A 155 8.257 -0.001 -0.590 1.00 35.45 H new ATOM 0 HD23 LEU A 155 7.654 -1.494 0.167 1.00 35.45 H new ATOM 2561 N THR A 156 8.795 0.899 3.524 1.00 13.14 N ATOM 2562 CA THR A 156 9.426 1.941 4.301 1.00 22.43 C ATOM 2563 C THR A 156 9.642 3.075 3.309 1.00 24.14 C ATOM 2564 O THR A 156 10.631 3.087 2.568 1.00 54.43 O ATOM 2565 CB THR A 156 10.711 1.410 4.929 1.00 1.00 C ATOM 2566 OG1 THR A 156 10.350 0.209 5.571 1.00 1.23 O ATOM 2567 CG2 THR A 156 11.379 2.358 5.924 1.00 52.33 C ATOM 0 H THR A 156 9.317 0.693 2.672 1.00 13.14 H new ATOM 0 HA THR A 156 8.832 2.293 5.145 1.00 22.43 H new ATOM 0 HB THR A 156 11.457 1.279 4.145 1.00 1.00 H new ATOM 0 HG1 THR A 156 11.025 -0.018 6.244 1.00 1.23 H new ATOM 0 HG21 THR A 156 12.284 1.894 6.317 1.00 52.33 H new ATOM 0 HG22 THR A 156 11.638 3.290 5.421 1.00 52.33 H new ATOM 0 HG23 THR A 156 10.693 2.567 6.744 1.00 52.33 H new ATOM 2575 N VAL A 157 8.660 3.967 3.250 1.00 51.13 N ATOM 2576 CA VAL A 157 8.762 5.261 2.604 1.00 20.45 C ATOM 2577 C VAL A 157 8.751 6.200 3.797 1.00 14.25 C ATOM 2578 O VAL A 157 7.712 6.721 4.207 1.00 63.21 O ATOM 2579 CB VAL A 157 7.635 5.458 1.568 1.00 12.50 C ATOM 2580 CG1 VAL A 157 7.474 6.933 1.164 1.00 5.12 C ATOM 2581 CG2 VAL A 157 7.877 4.557 0.347 1.00 2.10 C ATOM 0 H VAL A 157 7.743 3.800 3.665 1.00 51.13 H new ATOM 0 HA VAL A 157 9.648 5.422 1.990 1.00 20.45 H new ATOM 0 HB VAL A 157 6.694 5.163 2.032 1.00 12.50 H new ATOM 0 HG11 VAL A 157 6.670 7.025 0.434 1.00 5.12 H new ATOM 0 HG12 VAL A 157 7.233 7.527 2.045 1.00 5.12 H new ATOM 0 HG13 VAL A 157 8.405 7.294 0.726 1.00 5.12 H new ATOM 0 HG21 VAL A 157 7.076 4.704 -0.378 1.00 2.10 H new ATOM 0 HG22 VAL A 157 8.832 4.814 -0.111 1.00 2.10 H new ATOM 0 HG23 VAL A 157 7.894 3.514 0.662 1.00 2.10 H new ATOM 2591 N GLU A 158 9.913 6.328 4.431 1.00 3.32 N ATOM 2592 CA GLU A 158 10.024 7.159 5.632 1.00 22.41 C ATOM 2593 C GLU A 158 10.050 8.648 5.276 1.00 23.51 C ATOM 2594 O GLU A 158 9.797 9.524 6.098 1.00 61.23 O ATOM 2595 CB GLU A 158 11.142 6.725 6.568 1.00 62.12 C ATOM 2596 CG GLU A 158 12.487 6.558 5.916 1.00 44.42 C ATOM 2597 CD GLU A 158 13.617 6.283 6.919 1.00 64.22 C ATOM 2598 OE1 GLU A 158 13.442 6.417 8.155 1.00 71.53 O ATOM 2599 OE2 GLU A 158 14.686 5.808 6.477 1.00 13.02 O ATOM 0 H GLU A 158 10.780 5.876 4.141 1.00 3.32 H new ATOM 0 HA GLU A 158 9.119 6.999 6.217 1.00 22.41 H new ATOM 0 HB2 GLU A 158 11.231 7.460 7.368 1.00 62.12 H new ATOM 0 HB3 GLU A 158 10.860 5.780 7.033 1.00 62.12 H new ATOM 0 HG2 GLU A 158 12.437 5.737 5.201 1.00 44.42 H new ATOM 0 HG3 GLU A 158 12.724 7.459 5.350 1.00 44.42 H new ATOM 2606 N ASP A 159 10.290 8.928 4.003 1.00 12.55 N ATOM 2607 CA ASP A 159 10.894 10.159 3.497 1.00 61.53 C ATOM 2608 C ASP A 159 9.907 11.302 3.610 1.00 62.44 C ATOM 2609 O ASP A 159 10.257 12.398 4.054 1.00 64.21 O ATOM 2610 CB ASP A 159 11.300 9.995 2.028 1.00 54.43 C ATOM 2611 CG ASP A 159 12.273 8.837 1.817 1.00 0.04 C ATOM 2612 OD1 ASP A 159 11.766 7.687 1.909 1.00 34.32 O ATOM 2613 OD2 ASP A 159 13.464 9.084 1.546 1.00 34.11 O ATOM 0 H ASP A 159 10.059 8.273 3.256 1.00 12.55 H new ATOM 0 HA ASP A 159 11.781 10.375 4.093 1.00 61.53 H new ATOM 0 HB2 ASP A 159 10.408 9.831 1.424 1.00 54.43 H new ATOM 0 HB3 ASP A 159 11.758 10.919 1.675 1.00 54.43 H new ATOM 2618 N ASN A 160 8.655 11.038 3.222 1.00 23.44 N ATOM 2619 CA ASN A 160 7.529 11.917 3.510 1.00 11.04 C ATOM 2620 C ASN A 160 6.399 11.179 4.231 1.00 55.01 C ATOM 2621 O ASN A 160 5.348 11.773 4.464 1.00 2.21 O ATOM 2622 CB ASN A 160 7.047 12.632 2.239 1.00 41.22 C ATOM 2623 CG ASN A 160 6.344 13.936 2.588 1.00 4.35 C ATOM 2624 OD1 ASN A 160 5.036 13.949 2.769 1.00 65.14 O flip ATOM 2625 ND2 ASN A 160 6.990 14.964 2.755 1.00 13.30 N flip ATOM 0 H ASN A 160 8.398 10.202 2.697 1.00 23.44 H new ATOM 0 HA ASN A 160 7.876 12.687 4.198 1.00 11.04 H new ATOM 0 HB2 ASN A 160 7.896 12.834 1.586 1.00 41.22 H new ATOM 0 HB3 ASN A 160 6.367 11.983 1.687 1.00 41.22 H new ATOM 0 HD21 ASN A 160 8.001 14.959 2.617 1.00 13.30 H new ATOM 0 HD22 ASN A 160 6.517 15.824 3.032 1.00 13.30 H new ATOM 2632 N HIS A 161 6.587 9.903 4.600 1.00 44.13 N ATOM 2633 CA HIS A 161 5.540 9.065 5.189 1.00 52.12 C ATOM 2634 C HIS A 161 4.253 9.059 4.330 1.00 3.40 C ATOM 2635 O HIS A 161 3.142 9.051 4.856 1.00 22.11 O ATOM 2636 CB HIS A 161 5.266 9.509 6.641 1.00 62.42 C ATOM 2637 CG HIS A 161 6.255 9.015 7.655 1.00 21.32 C ATOM 2638 ND1 HIS A 161 7.114 7.963 7.502 1.00 3.03 N flip ATOM 2639 CD2 HIS A 161 6.276 9.383 8.977 1.00 53.23 C flip ATOM 2640 CE1 HIS A 161 7.621 7.644 8.757 1.00 72.21 C flip ATOM 2641 NE2 HIS A 161 7.121 8.554 9.607 1.00 2.10 N flip ATOM 0 H HIS A 161 7.480 9.422 4.495 1.00 44.13 H new ATOM 0 HA HIS A 161 5.895 8.034 5.208 1.00 52.12 H new ATOM 0 HB2 HIS A 161 5.249 10.598 6.674 1.00 62.42 H new ATOM 0 HB3 HIS A 161 4.272 9.165 6.928 1.00 62.42 H new ATOM 0 HD2 HIS A 161 5.716 10.190 9.426 1.00 53.23 H new ATOM 0 HE1 HIS A 161 8.285 6.827 8.999 1.00 72.21 H new ATOM 0 HE2 HIS A 161 7.353 8.608 10.599 1.00 2.10 H new ATOM 2649 N THR A 162 4.371 9.083 3.004 1.00 43.04 N ATOM 2650 CA THR A 162 3.251 9.062 2.071 1.00 22.25 C ATOM 2651 C THR A 162 3.705 8.309 0.820 1.00 53.31 C ATOM 2652 O THR A 162 4.859 8.471 0.428 1.00 74.23 O ATOM 2653 CB THR A 162 2.794 10.509 1.769 1.00 3.40 C ATOM 2654 OG1 THR A 162 3.858 11.440 1.625 1.00 3.24 O ATOM 2655 CG2 THR A 162 1.924 11.062 2.890 1.00 72.33 C ATOM 0 H THR A 162 5.277 9.119 2.537 1.00 43.04 H new ATOM 0 HA THR A 162 2.386 8.548 2.491 1.00 22.25 H new ATOM 0 HB THR A 162 2.256 10.415 0.825 1.00 3.40 H new ATOM 0 HG1 THR A 162 3.944 11.695 0.683 1.00 3.24 H new ATOM 0 HG21 THR A 162 1.620 12.080 2.646 1.00 72.33 H new ATOM 0 HG22 THR A 162 1.039 10.437 3.006 1.00 72.33 H new ATOM 0 HG23 THR A 162 2.490 11.066 3.822 1.00 72.33 H new ATOM 2663 N TYR A 163 2.844 7.505 0.185 1.00 62.33 N ATOM 2664 CA TYR A 163 3.146 6.814 -1.070 1.00 71.43 C ATOM 2665 C TYR A 163 1.910 6.775 -1.963 1.00 22.42 C ATOM 2666 O TYR A 163 0.808 7.081 -1.502 1.00 14.31 O ATOM 2667 CB TYR A 163 3.714 5.396 -0.820 1.00 23.10 C ATOM 2668 CG TYR A 163 2.896 4.410 0.007 1.00 3.43 C ATOM 2669 CD1 TYR A 163 1.603 4.003 -0.378 1.00 40.01 C ATOM 2670 CD2 TYR A 163 3.479 3.825 1.145 1.00 23.41 C ATOM 2671 CE1 TYR A 163 0.885 3.076 0.396 1.00 42.32 C ATOM 2672 CE2 TYR A 163 2.757 2.936 1.955 1.00 1.20 C ATOM 2673 CZ TYR A 163 1.443 2.578 1.592 1.00 73.11 C ATOM 2674 OH TYR A 163 0.736 1.716 2.373 1.00 42.52 O ATOM 0 H TYR A 163 1.905 7.315 0.535 1.00 62.33 H new ATOM 0 HA TYR A 163 3.923 7.376 -1.588 1.00 71.43 H new ATOM 0 HB2 TYR A 163 3.897 4.938 -1.792 1.00 23.10 H new ATOM 0 HB3 TYR A 163 4.683 5.510 -0.334 1.00 23.10 H new ATOM 0 HD1 TYR A 163 1.160 4.407 -1.276 1.00 40.01 H new ATOM 0 HD2 TYR A 163 4.501 4.064 1.400 1.00 23.41 H new ATOM 0 HE1 TYR A 163 -0.092 2.745 0.076 1.00 42.32 H new ATOM 0 HE2 TYR A 163 3.204 2.529 2.850 1.00 1.20 H new ATOM 0 HH TYR A 163 1.270 1.472 3.158 1.00 42.52 H new ATOM 2684 N ILE A 164 2.085 6.356 -3.221 1.00 60.21 N ATOM 2685 CA ILE A 164 0.994 5.874 -4.058 1.00 1.21 C ATOM 2686 C ILE A 164 1.021 4.349 -3.992 1.00 42.04 C ATOM 2687 O ILE A 164 2.089 3.738 -4.065 1.00 71.22 O ATOM 2688 CB ILE A 164 1.106 6.365 -5.520 1.00 12.33 C ATOM 2689 CG1 ILE A 164 1.240 7.898 -5.639 1.00 72.15 C ATOM 2690 CG2 ILE A 164 -0.105 5.889 -6.352 1.00 14.01 C ATOM 2691 CD1 ILE A 164 -0.013 8.691 -5.256 1.00 3.11 C ATOM 0 H ILE A 164 2.994 6.344 -3.684 1.00 60.21 H new ATOM 0 HA ILE A 164 0.048 6.269 -3.688 1.00 1.21 H new ATOM 0 HB ILE A 164 2.023 5.927 -5.913 1.00 12.33 H new ATOM 0 HG12 ILE A 164 2.066 8.225 -5.007 1.00 72.15 H new ATOM 0 HG13 ILE A 164 1.508 8.145 -6.666 1.00 72.15 H new ATOM 0 HG21 ILE A 164 -0.005 6.246 -7.377 1.00 14.01 H new ATOM 0 HG22 ILE A 164 -0.143 4.800 -6.349 1.00 14.01 H new ATOM 0 HG23 ILE A 164 -1.023 6.285 -5.918 1.00 14.01 H new ATOM 0 HD11 ILE A 164 0.181 9.757 -5.373 1.00 3.11 H new ATOM 0 HD12 ILE A 164 -0.840 8.400 -5.904 1.00 3.11 H new ATOM 0 HD13 ILE A 164 -0.273 8.481 -4.219 1.00 3.11 H new ATOM 2703 N ALA A 165 -0.153 3.733 -3.881 1.00 4.54 N ATOM 2704 CA ALA A 165 -0.372 2.323 -4.178 1.00 11.05 C ATOM 2705 C ALA A 165 -1.865 2.104 -4.428 1.00 32.25 C ATOM 2706 O ALA A 165 -2.678 2.935 -4.013 1.00 65.25 O ATOM 2707 CB ALA A 165 0.092 1.468 -2.998 1.00 52.32 C ATOM 0 H ALA A 165 -0.999 4.214 -3.574 1.00 4.54 H new ATOM 0 HA ALA A 165 0.197 2.034 -5.062 1.00 11.05 H new ATOM 0 HB1 ALA A 165 -0.074 0.415 -3.224 1.00 52.32 H new ATOM 0 HB2 ALA A 165 1.154 1.638 -2.821 1.00 52.32 H new ATOM 0 HB3 ALA A 165 -0.473 1.741 -2.107 1.00 52.32 H new ATOM 2713 N GLY A 166 -2.248 1.005 -5.074 1.00 72.23 N ATOM 2714 CA GLY A 166 -3.653 0.655 -5.274 1.00 51.14 C ATOM 2715 C GLY A 166 -3.925 0.209 -6.702 1.00 64.31 C ATOM 2716 O GLY A 166 -2.984 0.013 -7.468 1.00 20.42 O ATOM 0 H GLY A 166 -1.594 0.332 -5.474 1.00 72.23 H new ATOM 0 HA2 GLY A 166 -3.931 -0.142 -4.585 1.00 51.14 H new ATOM 0 HA3 GLY A 166 -4.279 1.515 -5.036 1.00 51.14 H new ATOM 2720 N LYS A 167 -5.187 0.082 -7.120 1.00 41.22 N ATOM 2721 CA LYS A 167 -5.508 -0.285 -8.504 1.00 64.51 C ATOM 2722 C LYS A 167 -5.944 0.951 -9.295 1.00 4.03 C ATOM 2723 O LYS A 167 -6.155 2.038 -8.745 1.00 1.02 O ATOM 2724 CB LYS A 167 -6.505 -1.461 -8.555 1.00 75.12 C ATOM 2725 CG LYS A 167 -6.158 -2.584 -7.557 1.00 33.52 C ATOM 2726 CD LYS A 167 -6.373 -4.017 -8.066 1.00 1.42 C ATOM 2727 CE LYS A 167 -6.300 -4.934 -6.843 1.00 33.24 C ATOM 2728 NZ LYS A 167 -6.420 -6.370 -7.148 1.00 4.02 N ATOM 0 H LYS A 167 -6.001 0.227 -6.523 1.00 41.22 H new ATOM 0 HA LYS A 167 -4.611 -0.657 -8.999 1.00 64.51 H new ATOM 0 HB2 LYS A 167 -7.508 -1.090 -8.343 1.00 75.12 H new ATOM 0 HB3 LYS A 167 -6.524 -1.872 -9.565 1.00 75.12 H new ATOM 0 HG2 LYS A 167 -5.114 -2.475 -7.264 1.00 33.52 H new ATOM 0 HG3 LYS A 167 -6.758 -2.444 -6.658 1.00 33.52 H new ATOM 0 HD2 LYS A 167 -7.339 -4.110 -8.563 1.00 1.42 H new ATOM 0 HD3 LYS A 167 -5.611 -4.286 -8.798 1.00 1.42 H new ATOM 0 HE2 LYS A 167 -5.353 -4.762 -6.332 1.00 33.24 H new ATOM 0 HE3 LYS A 167 -7.092 -4.656 -6.148 1.00 33.24 H new ATOM 0 HZ1 LYS A 167 -6.649 -6.892 -6.278 1.00 4.02 H new ATOM 0 HZ2 LYS A 167 -7.176 -6.514 -7.847 1.00 4.02 H new ATOM 0 HZ3 LYS A 167 -5.520 -6.719 -7.534 1.00 4.02 H new ATOM 2742 N ASN A 168 -6.053 0.789 -10.613 1.00 11.01 N ATOM 2743 CA ASN A 168 -6.312 1.804 -11.623 1.00 0.52 C ATOM 2744 C ASN A 168 -5.156 2.785 -11.803 1.00 32.24 C ATOM 2745 O ASN A 168 -4.366 2.628 -12.734 1.00 3.20 O ATOM 2746 CB ASN A 168 -7.699 2.454 -11.437 1.00 35.41 C ATOM 2747 CG ASN A 168 -8.466 2.564 -12.749 1.00 14.00 C ATOM 2748 OD1 ASN A 168 -7.919 2.895 -13.794 1.00 23.11 O ATOM 2749 ND2 ASN A 168 -9.756 2.289 -12.751 1.00 53.04 N ATOM 0 H ASN A 168 -5.953 -0.135 -11.033 1.00 11.01 H new ATOM 0 HA ASN A 168 -6.362 1.297 -12.587 1.00 0.52 H new ATOM 0 HB2 ASN A 168 -8.281 1.867 -10.727 1.00 35.41 H new ATOM 0 HB3 ASN A 168 -7.577 3.447 -11.005 1.00 35.41 H new ATOM 0 HD21 ASN A 168 -10.290 2.353 -13.618 1.00 53.04 H new ATOM 0 HD22 ASN A 168 -10.220 2.013 -11.886 1.00 53.04 H new ATOM 2756 N GLU A 169 -5.092 3.832 -10.992 1.00 2.35 N ATOM 2757 CA GLU A 169 -3.946 4.731 -10.895 1.00 62.51 C ATOM 2758 C GLU A 169 -3.389 4.806 -9.464 1.00 4.31 C ATOM 2759 O GLU A 169 -2.226 5.149 -9.255 1.00 14.01 O ATOM 2760 CB GLU A 169 -4.232 6.061 -11.592 1.00 60.51 C ATOM 2761 CG GLU A 169 -4.421 7.178 -10.590 1.00 72.13 C ATOM 2762 CD GLU A 169 -5.003 8.478 -11.177 1.00 34.25 C ATOM 2763 OE1 GLU A 169 -5.730 8.458 -12.187 1.00 1.33 O ATOM 2764 OE2 GLU A 169 -4.899 9.534 -10.506 1.00 43.31 O ATOM 0 H GLU A 169 -5.855 4.088 -10.366 1.00 2.35 H new ATOM 0 HA GLU A 169 -3.109 4.315 -11.456 1.00 62.51 H new ATOM 0 HB2 GLU A 169 -3.409 6.307 -12.263 1.00 60.51 H new ATOM 0 HB3 GLU A 169 -5.127 5.966 -12.207 1.00 60.51 H new ATOM 0 HG2 GLU A 169 -5.080 6.827 -9.796 1.00 72.13 H new ATOM 0 HG3 GLU A 169 -3.458 7.402 -10.130 1.00 72.13 H new ATOM 2771 N GLY A 170 -4.230 4.493 -8.483 1.00 0.12 N ATOM 2772 CA GLY A 170 -3.865 4.257 -7.102 1.00 4.03 C ATOM 2773 C GLY A 170 -4.267 5.425 -6.212 1.00 24.42 C ATOM 2774 O GLY A 170 -4.820 6.437 -6.651 1.00 12.21 O ATOM 0 H GLY A 170 -5.232 4.394 -8.644 1.00 0.12 H new ATOM 0 HA2 GLY A 170 -4.347 3.346 -6.748 1.00 4.03 H new ATOM 0 HA3 GLY A 170 -2.789 4.097 -7.031 1.00 4.03 H new ATOM 2778 N PHE A 171 -4.014 5.245 -4.927 1.00 40.31 N ATOM 2779 CA PHE A 171 -4.364 6.149 -3.846 1.00 63.54 C ATOM 2780 C PHE A 171 -3.073 6.619 -3.186 1.00 33.43 C ATOM 2781 O PHE A 171 -2.127 5.850 -3.022 1.00 0.30 O ATOM 2782 CB PHE A 171 -5.277 5.432 -2.846 1.00 54.22 C ATOM 2783 CG PHE A 171 -6.674 5.141 -3.356 1.00 2.25 C ATOM 2784 CD1 PHE A 171 -6.877 4.089 -4.258 1.00 42.11 C ATOM 2785 CD2 PHE A 171 -7.786 5.852 -2.868 1.00 2.12 C ATOM 2786 CE1 PHE A 171 -8.176 3.724 -4.641 1.00 3.22 C ATOM 2787 CE2 PHE A 171 -9.086 5.499 -3.272 1.00 15.10 C ATOM 2788 CZ PHE A 171 -9.289 4.421 -4.147 1.00 43.52 C ATOM 0 H PHE A 171 -3.529 4.413 -4.591 1.00 40.31 H new ATOM 0 HA PHE A 171 -4.909 7.014 -4.223 1.00 63.54 H new ATOM 0 HB2 PHE A 171 -4.808 4.492 -2.557 1.00 54.22 H new ATOM 0 HB3 PHE A 171 -5.354 6.040 -1.945 1.00 54.22 H new ATOM 0 HD1 PHE A 171 -6.029 3.556 -4.661 1.00 42.11 H new ATOM 0 HD2 PHE A 171 -7.641 6.672 -2.180 1.00 2.12 H new ATOM 0 HE1 PHE A 171 -8.321 2.899 -5.322 1.00 3.22 H new ATOM 0 HE2 PHE A 171 -9.933 6.061 -2.907 1.00 15.10 H new ATOM 0 HZ PHE A 171 -10.288 4.132 -4.436 1.00 43.52 H new ATOM 2798 N ALA A 172 -3.064 7.898 -2.846 1.00 0.40 N ATOM 2799 CA ALA A 172 -2.107 8.634 -2.050 1.00 34.35 C ATOM 2800 C ALA A 172 -2.468 8.417 -0.577 1.00 22.13 C ATOM 2801 O ALA A 172 -3.411 9.037 -0.081 1.00 53.12 O ATOM 2802 CB ALA A 172 -2.227 10.110 -2.461 1.00 3.20 C ATOM 0 H ALA A 172 -3.816 8.511 -3.160 1.00 0.40 H new ATOM 0 HA ALA A 172 -1.078 8.307 -2.201 1.00 34.35 H new ATOM 0 HB1 ALA A 172 -1.521 10.707 -1.884 1.00 3.20 H new ATOM 0 HB2 ALA A 172 -2.005 10.211 -3.523 1.00 3.20 H new ATOM 0 HB3 ALA A 172 -3.241 10.460 -2.268 1.00 3.20 H new ATOM 2808 N VAL A 173 -1.782 7.506 0.114 1.00 5.24 N ATOM 2809 CA VAL A 173 -2.109 7.135 1.495 1.00 63.44 C ATOM 2810 C VAL A 173 -0.878 7.284 2.390 1.00 42.34 C ATOM 2811 O VAL A 173 0.177 7.728 1.916 1.00 63.41 O ATOM 2812 CB VAL A 173 -2.757 5.738 1.549 1.00 71.33 C ATOM 2813 CG1 VAL A 173 -4.007 5.670 0.668 1.00 2.52 C ATOM 2814 CG2 VAL A 173 -1.808 4.626 1.113 1.00 3.34 C ATOM 0 H VAL A 173 -0.981 7.002 -0.268 1.00 5.24 H new ATOM 0 HA VAL A 173 -2.858 7.821 1.891 1.00 63.44 H new ATOM 0 HB VAL A 173 -3.021 5.582 2.595 1.00 71.33 H new ATOM 0 HG11 VAL A 173 -4.441 4.672 0.728 1.00 2.52 H new ATOM 0 HG12 VAL A 173 -4.736 6.403 1.013 1.00 2.52 H new ATOM 0 HG13 VAL A 173 -3.736 5.886 -0.365 1.00 2.52 H new ATOM 0 HG21 VAL A 173 -2.321 3.666 1.172 1.00 3.34 H new ATOM 0 HG22 VAL A 173 -1.487 4.803 0.087 1.00 3.34 H new ATOM 0 HG23 VAL A 173 -0.937 4.613 1.768 1.00 3.34 H new ATOM 2824 N SER A 174 -1.026 6.998 3.691 1.00 35.42 N ATOM 2825 CA SER A 174 0.090 7.083 4.610 1.00 43.41 C ATOM 2826 C SER A 174 1.128 6.039 4.201 1.00 54.34 C ATOM 2827 O SER A 174 0.785 4.954 3.727 1.00 32.34 O ATOM 2828 CB SER A 174 -0.400 6.844 6.044 1.00 60.31 C ATOM 2829 OG SER A 174 0.513 7.401 6.962 1.00 11.04 O ATOM 0 H SER A 174 -1.906 6.709 4.117 1.00 35.42 H new ATOM 0 HA SER A 174 0.543 8.074 4.574 1.00 43.41 H new ATOM 0 HB2 SER A 174 -1.385 7.291 6.180 1.00 60.31 H new ATOM 0 HB3 SER A 174 -0.507 5.775 6.228 1.00 60.31 H new ATOM 0 HG SER A 174 0.194 7.247 7.876 1.00 11.04 H new ATOM 2835 N ALA A 175 2.391 6.338 4.445 1.00 0.50 N ATOM 2836 CA ALA A 175 3.457 5.373 4.559 1.00 1.43 C ATOM 2837 C ALA A 175 4.053 5.532 5.942 1.00 60.44 C ATOM 2838 O ALA A 175 3.862 6.568 6.586 1.00 54.11 O ATOM 2839 CB ALA A 175 4.535 5.666 3.525 1.00 21.44 C ATOM 0 H ALA A 175 2.709 7.299 4.573 1.00 0.50 H new ATOM 0 HA ALA A 175 3.078 4.364 4.397 1.00 1.43 H new ATOM 0 HB1 ALA A 175 5.337 4.933 3.617 1.00 21.44 H new ATOM 0 HB2 ALA A 175 4.105 5.609 2.525 1.00 21.44 H new ATOM 0 HB3 ALA A 175 4.936 6.666 3.691 1.00 21.44 H new ATOM 2845 N SER A 176 4.864 4.572 6.362 1.00 4.02 N ATOM 2846 CA SER A 176 5.614 4.751 7.579 1.00 3.04 C ATOM 2847 C SER A 176 6.948 4.005 7.520 1.00 54.24 C ATOM 2848 O SER A 176 7.563 3.884 6.452 1.00 24.53 O ATOM 2849 CB SER A 176 4.703 4.346 8.754 1.00 73.45 C ATOM 2850 OG SER A 176 4.387 2.969 8.714 1.00 52.32 O ATOM 0 H SER A 176 5.013 3.683 5.885 1.00 4.02 H new ATOM 0 HA SER A 176 5.899 5.793 7.723 1.00 3.04 H new ATOM 0 HB2 SER A 176 5.198 4.579 9.697 1.00 73.45 H new ATOM 0 HB3 SER A 176 3.785 4.932 8.722 1.00 73.45 H new ATOM 0 HG SER A 176 3.810 2.744 9.473 1.00 52.32 H new ATOM 2856 N SER A 177 7.413 3.567 8.685 1.00 62.52 N ATOM 2857 CA SER A 177 8.654 2.871 8.912 1.00 63.12 C ATOM 2858 C SER A 177 8.435 1.942 10.103 1.00 31.52 C ATOM 2859 O SER A 177 7.716 0.952 9.983 1.00 74.32 O ATOM 2860 CB SER A 177 9.756 3.926 9.103 1.00 54.52 C ATOM 2861 OG SER A 177 9.386 4.928 10.047 1.00 33.41 O ATOM 0 H SER A 177 6.889 3.703 9.549 1.00 62.52 H new ATOM 0 HA SER A 177 8.975 2.246 8.079 1.00 63.12 H new ATOM 0 HB2 SER A 177 10.671 3.436 9.436 1.00 54.52 H new ATOM 0 HB3 SER A 177 9.976 4.396 8.145 1.00 54.52 H new ATOM 0 HG SER A 177 9.743 5.795 9.761 1.00 33.41 H new ATOM 2867 N GLY A 178 8.997 2.293 11.258 1.00 14.34 N ATOM 2868 CA GLY A 178 8.654 1.719 12.535 1.00 4.01 C ATOM 2869 C GLY A 178 7.506 2.528 13.125 1.00 53.42 C ATOM 2870 O GLY A 178 7.709 3.667 13.554 1.00 2.14 O ATOM 0 H GLY A 178 9.723 3.006 11.321 1.00 14.34 H new ATOM 0 HA2 GLY A 178 8.363 0.675 12.417 1.00 4.01 H new ATOM 0 HA3 GLY A 178 9.515 1.736 13.204 1.00 4.01 H new ATOM 2874 N THR A 179 6.337 1.909 13.218 1.00 60.11 N ATOM 2875 CA THR A 179 5.250 2.302 14.098 1.00 61.42 C ATOM 2876 C THR A 179 4.620 3.642 13.676 1.00 0.02 C ATOM 2877 O THR A 179 4.861 4.159 12.574 1.00 32.54 O ATOM 2878 CB THR A 179 5.660 2.111 15.592 1.00 22.13 C ATOM 2879 OG1 THR A 179 6.070 3.290 16.262 1.00 64.12 O ATOM 2880 CG2 THR A 179 6.798 1.097 15.840 1.00 64.54 C ATOM 0 H THR A 179 6.113 1.086 12.659 1.00 60.11 H new ATOM 0 HA THR A 179 4.400 1.628 13.989 1.00 61.42 H new ATOM 0 HB THR A 179 4.715 1.742 15.992 1.00 22.13 H new ATOM 0 HG1 THR A 179 6.676 3.800 15.685 1.00 64.12 H new ATOM 0 HG21 THR A 179 7.007 1.038 16.908 1.00 64.54 H new ATOM 0 HG22 THR A 179 6.497 0.115 15.474 1.00 64.54 H new ATOM 0 HG23 THR A 179 7.695 1.421 15.313 1.00 64.54 H new ATOM 2888 N LEU A 180 3.722 4.184 14.503 1.00 14.42 N ATOM 2889 CA LEU A 180 3.124 5.500 14.312 1.00 13.01 C ATOM 2890 C LEU A 180 4.200 6.579 14.497 1.00 43.32 C ATOM 2891 O LEU A 180 4.338 7.157 15.573 1.00 65.13 O ATOM 2892 CB LEU A 180 1.910 5.664 15.247 1.00 13.13 C ATOM 2893 CG LEU A 180 1.146 6.991 15.078 1.00 40.33 C ATOM 2894 CD1 LEU A 180 0.563 7.173 13.667 1.00 23.53 C ATOM 2895 CD2 LEU A 180 0.005 7.083 16.095 1.00 21.23 C ATOM 0 H LEU A 180 3.386 3.707 15.340 1.00 14.42 H new ATOM 0 HA LEU A 180 2.742 5.610 13.297 1.00 13.01 H new ATOM 0 HB2 LEU A 180 1.220 4.838 15.074 1.00 13.13 H new ATOM 0 HB3 LEU A 180 2.250 5.584 16.280 1.00 13.13 H new ATOM 0 HG LEU A 180 1.875 7.784 15.245 1.00 40.33 H new ATOM 0 HD11 LEU A 180 0.037 8.126 13.611 1.00 23.53 H new ATOM 0 HD12 LEU A 180 1.371 7.161 12.935 1.00 23.53 H new ATOM 0 HD13 LEU A 180 -0.132 6.361 13.453 1.00 23.53 H new ATOM 0 HD21 LEU A 180 -0.525 8.026 15.963 1.00 21.23 H new ATOM 0 HD22 LEU A 180 -0.686 6.254 15.943 1.00 21.23 H new ATOM 0 HD23 LEU A 180 0.413 7.035 17.105 1.00 21.23 H new ATOM 2907 N HIS A 181 4.986 6.821 13.448 1.00 12.01 N ATOM 2908 CA HIS A 181 5.979 7.881 13.296 1.00 4.50 C ATOM 2909 C HIS A 181 6.990 8.031 14.457 1.00 20.13 C ATOM 2910 O HIS A 181 7.141 9.124 15.012 1.00 24.44 O ATOM 2911 CB HIS A 181 5.276 9.194 12.877 1.00 1.05 C ATOM 2912 CG HIS A 181 4.229 9.752 13.822 1.00 33.11 C ATOM 2913 ND1 HIS A 181 2.869 9.736 13.610 1.00 53.05 N ATOM 2914 CD2 HIS A 181 4.443 10.419 15.001 1.00 40.02 C ATOM 2915 CE1 HIS A 181 2.275 10.317 14.663 1.00 61.32 C ATOM 2916 NE2 HIS A 181 3.194 10.769 15.533 1.00 20.21 N ATOM 0 H HIS A 181 4.940 6.232 12.616 1.00 12.01 H new ATOM 0 HA HIS A 181 6.644 7.577 12.488 1.00 4.50 H new ATOM 0 HB2 HIS A 181 6.042 9.956 12.733 1.00 1.05 H new ATOM 0 HB3 HIS A 181 4.804 9.030 11.908 1.00 1.05 H new ATOM 0 HD2 HIS A 181 5.405 10.636 15.442 1.00 40.02 H new ATOM 0 HE1 HIS A 181 1.207 10.409 14.793 1.00 61.32 H new ATOM 0 HE2 HIS A 181 3.018 11.267 16.406 1.00 20.21 H new ATOM 2924 N HIS A 182 7.731 6.966 14.811 1.00 35.31 N ATOM 2925 CA HIS A 182 8.739 7.072 15.874 1.00 13.30 C ATOM 2926 C HIS A 182 10.079 7.696 15.436 1.00 24.43 C ATOM 2927 O HIS A 182 10.596 8.549 16.156 1.00 22.32 O ATOM 2928 CB HIS A 182 8.991 5.725 16.566 1.00 55.13 C ATOM 2929 CG HIS A 182 9.667 5.879 17.912 1.00 43.45 C ATOM 2930 ND1 HIS A 182 9.682 7.011 18.706 1.00 23.52 N ATOM 2931 CD2 HIS A 182 10.384 4.912 18.562 1.00 53.24 C ATOM 2932 CE1 HIS A 182 10.408 6.727 19.800 1.00 15.25 C ATOM 2933 NE2 HIS A 182 10.853 5.458 19.764 1.00 44.22 N ATOM 0 H HIS A 182 7.652 6.042 14.386 1.00 35.31 H new ATOM 0 HA HIS A 182 8.296 7.768 16.586 1.00 13.30 H new ATOM 0 HB2 HIS A 182 8.042 5.205 16.698 1.00 55.13 H new ATOM 0 HB3 HIS A 182 9.610 5.100 15.922 1.00 55.13 H new ATOM 0 HD2 HIS A 182 10.558 3.906 18.211 1.00 53.24 H new ATOM 0 HE1 HIS A 182 10.608 7.424 20.601 1.00 15.25 H new ATOM 0 HE2 HIS A 182 11.419 4.987 20.470 1.00 44.22 H new ATOM 2941 N HIS A 183 10.661 7.230 14.322 1.00 33.40 N ATOM 2942 CA HIS A 183 12.051 7.398 13.870 1.00 12.04 C ATOM 2943 C HIS A 183 13.071 7.494 15.003 1.00 71.33 C ATOM 2944 O HIS A 183 13.378 8.591 15.470 1.00 13.51 O ATOM 2945 CB HIS A 183 12.221 8.576 12.902 1.00 23.44 C ATOM 2946 CG HIS A 183 11.561 8.402 11.565 1.00 74.53 C ATOM 2947 ND1 HIS A 183 11.221 9.417 10.703 1.00 74.33 N ATOM 2948 CD2 HIS A 183 11.207 7.221 10.977 1.00 44.14 C ATOM 2949 CE1 HIS A 183 10.595 8.857 9.652 1.00 60.22 C ATOM 2950 NE2 HIS A 183 10.557 7.521 9.785 1.00 72.44 N ATOM 0 H HIS A 183 10.124 6.677 13.654 1.00 33.40 H new ATOM 0 HA HIS A 183 12.265 6.475 13.331 1.00 12.04 H new ATOM 0 HB2 HIS A 183 11.821 9.474 13.373 1.00 23.44 H new ATOM 0 HB3 HIS A 183 13.286 8.746 12.745 1.00 23.44 H new ATOM 0 HD1 HIS A 183 11.409 10.411 10.836 1.00 74.33 H new ATOM 0 HD2 HIS A 183 11.398 6.232 11.368 1.00 44.14 H new ATOM 0 HE1 HIS A 183 10.181 9.405 8.818 1.00 60.22 H new ATOM 2958 N HIS A 184 13.647 6.354 15.387 1.00 52.53 N ATOM 2959 CA HIS A 184 14.724 6.288 16.362 1.00 11.02 C ATOM 2960 C HIS A 184 16.064 6.037 15.648 1.00 54.25 C ATOM 2961 O HIS A 184 16.463 4.882 15.451 1.00 25.44 O ATOM 2962 CB HIS A 184 14.380 5.226 17.420 1.00 21.31 C ATOM 2963 CG HIS A 184 15.162 5.415 18.692 1.00 52.13 C ATOM 2964 ND1 HIS A 184 16.516 5.221 18.857 1.00 64.11 N ATOM 2965 CD2 HIS A 184 14.660 5.911 19.864 1.00 12.34 C ATOM 2966 CE1 HIS A 184 16.823 5.574 20.115 1.00 15.42 C ATOM 2967 NE2 HIS A 184 15.731 6.022 20.760 1.00 71.43 N ATOM 0 H HIS A 184 13.372 5.442 15.022 1.00 52.53 H new ATOM 0 HA HIS A 184 14.834 7.237 16.886 1.00 11.02 H new ATOM 0 HB2 HIS A 184 13.314 5.269 17.642 1.00 21.31 H new ATOM 0 HB3 HIS A 184 14.582 4.234 17.016 1.00 21.31 H new ATOM 0 HD2 HIS A 184 13.630 6.169 20.062 1.00 12.34 H new ATOM 0 HE1 HIS A 184 17.810 5.508 20.549 1.00 15.42 H new ATOM 0 HE2 HIS A 184 15.691 6.374 21.716 1.00 71.43 H new ATOM 2975 N HIS A 185 16.775 7.101 15.264 1.00 51.44 N ATOM 2976 CA HIS A 185 18.152 7.044 14.768 1.00 14.25 C ATOM 2977 C HIS A 185 19.025 8.038 15.531 1.00 14.15 C ATOM 2978 O HIS A 185 19.077 7.957 16.761 1.00 44.45 O ATOM 2979 CB HIS A 185 18.229 7.118 13.233 1.00 62.12 C ATOM 2980 CG HIS A 185 17.546 8.289 12.569 1.00 61.25 C ATOM 2981 ND1 HIS A 185 17.525 9.616 12.956 1.00 12.00 N ATOM 2982 CD2 HIS A 185 16.836 8.191 11.407 1.00 41.04 C ATOM 2983 CE1 HIS A 185 16.766 10.278 12.071 1.00 62.42 C ATOM 2984 NE2 HIS A 185 16.340 9.459 11.097 1.00 41.01 N ATOM 0 H HIS A 185 16.399 8.049 15.290 1.00 51.44 H new ATOM 0 HA HIS A 185 18.576 6.062 14.980 1.00 14.25 H new ATOM 0 HB2 HIS A 185 19.281 7.132 12.947 1.00 62.12 H new ATOM 0 HB3 HIS A 185 17.801 6.201 12.828 1.00 62.12 H new ATOM 0 HD1 HIS A 185 17.999 10.017 13.765 1.00 12.00 H new ATOM 0 HD2 HIS A 185 16.685 7.291 10.829 1.00 41.04 H new ATOM 0 HE1 HIS A 185 16.529 11.330 12.134 1.00 62.42 H new ATOM 2992 N HIS A 186 19.769 8.903 14.844 1.00 42.22 N ATOM 2993 CA HIS A 186 20.646 9.902 15.430 1.00 74.54 C ATOM 2994 C HIS A 186 20.404 11.255 14.776 1.00 3.54 C ATOM 2995 O HIS A 186 19.500 11.348 13.916 1.00 13.52 O ATOM 2996 CB HIS A 186 22.104 9.430 15.344 1.00 32.23 C ATOM 2997 CG HIS A 186 22.654 9.200 13.962 1.00 35.40 C ATOM 2998 ND1 HIS A 186 23.433 10.080 13.249 1.00 65.44 N ATOM 2999 CD2 HIS A 186 22.639 8.009 13.286 1.00 2.53 C ATOM 3000 CE1 HIS A 186 23.879 9.431 12.160 1.00 0.30 C ATOM 3001 NE2 HIS A 186 23.445 8.158 12.153 1.00 74.12 N ATOM 0 H HIS A 186 19.774 8.924 13.824 1.00 42.22 H new ATOM 0 HA HIS A 186 20.423 10.029 16.489 1.00 74.54 H new ATOM 0 HB2 HIS A 186 22.732 10.168 15.843 1.00 32.23 H new ATOM 0 HB3 HIS A 186 22.196 8.501 15.907 1.00 32.23 H new ATOM 0 HD2 HIS A 186 22.103 7.117 13.575 1.00 2.53 H new ATOM 0 HE1 HIS A 186 24.501 9.872 11.395 1.00 0.30 H new ATOM 0 HE2 HIS A 186 23.661 7.443 11.459 1.00 74.12 H new TER 3009 HIS A 186 END