HEADER HORMONE 10-JUL-89 4INS 4INSA 1 COMPND INSULIN 4INS 4 SOURCE PIG (SUS $SCROFA) 4INS 5 AUTHOR G.G.DODSON,E.J.DODSON,D.C.HODGKIN,N.W.ISAACS,M.VIJAYAN 4INS 6 REVDAT 3 31-JUL-94 4INSB 3 HETATM 4INSB 1 REVDAT 2 15-JUL-93 4INSA 1 HEADER 4INSA 2 REVDAT 1 15-APR-90 4INS 0 4INS 7 SPRSDE 15-APR-90 4INS 1INS 4INS 8 REMARK 1 4INS 9 REMARK 1 REFERENCE 1 4INS 10 REMARK 1 AUTH E.N.BAKER,T.L.BLUNDELL,J.F.CUTFIELD,S.M.CUTFIELD, 4INS 11 REMARK 1 AUTH 2 E.J.DODSON,G.G.DODSON,D.M.CROWFOOT HODGKIN, 4INS 12 REMARK 1 AUTH 3 R.E.HUBBARD,N.W.ISAACS,C.D.REYNOLDS,K.SAKABE, 4INS 13 REMARK 1 AUTH 4 N.SAKABE,N.M.VIJAYAN 4INS 14 REMARK 1 TITL THE STRUCTURE OF 2ZN PIG INSULIN CRYSTALS AT 1.5 4INS 15 REMARK 1 TITL 2 ANGSTROMS RESOLUTION 4INS 16 REMARK 1 REF PHILOS.TRANS.R.SOC.LONDON, V. 319 369 1988 4INS 17 REMARK 1 REF 2 SER.B 4INS 18 REMARK 1 REFN ASTM PTRBAE UK ISSN 0080-4622 441 4INS 19 REMARK 1 REFERENCE 2 4INS 20 REMARK 1 AUTH J.BORDAS,G.G.DODSON,H.GREWE,M.H.J.KOCH,B.KREBS, 4INS 21 REMARK 1 AUTH 2 J.RANDALL 4INS 22 REMARK 1 TITL A COMPARATIVE ASSESSMENT OF THE ZINC-PROTEIN 4INS 23 REMARK 1 TITL 2 COORDINATION IN 2*ZN-INSULIN AS DETERMINED BY X-RAY 4INS 24 REMARK 1 TITL 3 ABSORPTION FINE STRUCTURE (/EXAFS$) AND X-RAY 4INS 25 REMARK 1 TITL 4 CRYSTALLOGRAPHY 4INS 26 REMARK 1 REF PROC.R.SOC.LONDON,SER.B V. 219 21 1983 4INS 27 REMARK 1 REFN ASTM PRLBA4 UK ISSN 0080-4649 338 4INS 28 REMARK 1 REFERENCE 3 4INS 29 REMARK 1 AUTH E.J.DODSON,G.G.DODSON,D.C.HODGKIN,C.D.REYNOLDS 4INS 30 REMARK 1 TITL STRUCTURAL RELATIONSHIPS IN THE TWO-ZINC INSULIN 4INS 31 REMARK 1 TITL 2 HEXAMER 4INS 32 REMARK 1 REF CAN.J.BIOCHEM. V. 57 469 1979 4INS 33 REMARK 1 REFN ASTM CJBIAE CN ISSN 0008-4018 415 4INS 34 REMARK 1 REFERENCE 4 4INS 35 REMARK 1 AUTH N.W.ISAACS,R.C.AGARWAL 4INS 36 REMARK 1 TITL EXPERIENCE WITH FAST FOURIER LEAST SQUARES IN THE 4INS 37 REMARK 1 TITL 2 REFINEMENT OF THE CRYSTAL STRUCTURE OF RHOMBOHEDRAL 4INS 38 REMARK 1 TITL 3 2-*ZINC INSULIN AT 1.5 ANGSTROMS RESOLUTION 4INS 39 REMARK 1 REF ACTA CRYSTALLOGR.,SECT.A V. 34 782 1978 4INS 40 REMARK 1 REFN ASTM ACACBN DK ISSN 0567-7394 108 4INS 41 REMARK 1 REFERENCE 5 4INS 42 REMARK 1 AUTH G.BENTLEY,G.DODSON,A.LEWITOVA 4INS 43 REMARK 1 TITL RHOMBOHEDRAL INSULIN CRYSTAL TRANSFORMATION 4INS 44 REMARK 1 REF J.MOL.BIOL. V. 126 871 1978 4INS 45 REMARK 1 REFN ASTM JMOBAK UK ISSN 0022-2836 070 4INS 46 REMARK 1 REFERENCE 6 4INS 47 REMARK 1 AUTH E.J.DODSON,N.W.ISAACS,J.S.ROLLETT 4INS 48 REMARK 1 TITL A METHOD FOR FITTING SATISFACTORY MODELS TO SETS OF 4INS 49 REMARK 1 TITL 2 ATOMIC POSITIONS IN PROTEIN STRUCTURE REFINEMENTS 4INS 50 REMARK 1 REF ACTA CRYSTALLOGR.,SECT.A V. 32 311 1976 4INS 51 REMARK 1 REFN ASTM ACACBN DK ISSN 0567-7394 108 4INS 52 REMARK 1 REFERENCE 7 4INS 53 REMARK 1 AUTH D.C.HODGKIN 4INS 54 REMARK 1 TITL VARIETIES OF INSULIN 4INS 55 REMARK 1 REF J.ENDOCRINOL. V. 63 1 1974 4INS 56 REMARK 1 REFN ASTM JOENAK UK ISSN 0022-0795 907 4INS 57 REMARK 1 REFERENCE 8 4INS 58 REMARK 1 AUTH D.C.HODGKIN 4INS 59 REMARK 1 TITL THE STRUCTURE OF INSULIN 4INS 60 REMARK 1 REF DAN.TIDSSKR.FARM. V. 46 1 1972 4INS 61 REMARK 1 REFN ASTM DTFAAN DK ISSN 0011-6513 168 4INS 62 REMARK 1 REFERENCE 9 4INS 63 REMARK 1 AUTH T.BLUNDELL,G.DODSON,D.HODGKIN,D.MERCOLA 4INS 64 REMARK 1 TITL INSULIN. THE STRUCTURE IN THE CRYSTAL AND ITS 4INS 65 REMARK 1 TITL 2 REFLECTION IN CHEMISTRY AND BIOLOGY 4INS 66 REMARK 1 REF ADV.PROTEIN CHEM. V. 26 279 1972 4INS 67 REMARK 1 REFN ASTM APCHA2 US ISSN 0065-3233 433 4INS 68 REMARK 1 REFERENCE 10 4INS 69 REMARK 1 AUTH T.L.BLUNDELL,J.F.CUTFIELD,E.J.DODSON,G.G.DODSON, 4INS 70 REMARK 1 AUTH 2 D.C.HODGKIN,D.A.MERCOLA 4INS 71 REMARK 1 TITL THE CRYSTAL STRUCTURE OF RHOMBOHEDRAL 2 ZINC 4INS 72 REMARK 1 TITL 2 INSULIN 4INS 73 REMARK 1 REF COLD SPRING HARBOR SYMP. V. 36 233 1972 4INS 74 REMARK 1 REF 2 QUANT.BIOL. 4INS 75 REMARK 1 REFN ASTM CSHSAZ US ISSN 0091-7451 421 4INS 76 REMARK 1 REFERENCE 11 4INS 77 REMARK 1 AUTH T.L.BLUNDELL,J.F.CUTFIELD,S.M.CUTFIELD,E.J.DODSON, 4INS 78 REMARK 1 AUTH 2 G.G.DODSON,D.C.HODGKIN,D.A.MERCOLA,M.VIJAYAN 4INS 79 REMARK 1 TITL ATOMIC POSITIONS IN RHOMBOHEDRAL 2-*ZINC INSULIN 4INS 80 REMARK 1 TITL 2 CRYSTALS 4INS 81 REMARK 1 REF NATURE V. 231 506 1971 4INS 82 REMARK 1 REFN ASTM NATUAS UK ISSN 0028-0836 006 4INS 83 REMARK 1 REFERENCE 12 4INS 84 REMARK 1 AUTH T.L.BLUNDELL,G.G.DODSON,E.DODSON,D.C.HODGKIN, 4INS 85 REMARK 1 AUTH 2 M.VIJAYAN 4INS 86 REMARK 1 TITL X-*RAY ANALYSIS AND THE STRUCTURE OF INSULIN 4INS 87 REMARK 1 REF RECENT PROG.HORM.RES. V. 27 1 1971 4INS 88 REMARK 1 REFN ASTM RPHRA6 US ISSN 0079-9963 908 4INS 89 REMARK 1 REFERENCE 13 4INS 90 REMARK 1 AUTH E.N.BAKER,G.DODSON 4INS 91 REMARK 1 TITL X-RAY DIFFRACTION DATA ON SOME CRYSTALLINE 4INS 92 REMARK 1 TITL 2 VARIETIES OF INSULIN 4INS 93 REMARK 1 REF J.MOL.BIOL. V. 54 605 1970 4INS 94 REMARK 1 REFN ASTM JMOBAK UK ISSN 0022-2836 070 4INS 95 REMARK 1 REFERENCE 14 4INS 96 REMARK 1 AUTH M.J.ADAMS,T.L.BLUNDELL,E.J.DODSON,G.G.DODSON, 4INS 97 REMARK 1 AUTH 2 M.VIJAYAN,E.N.BAKER,M.M.HARDING,D.C.HODGKIN, 4INS 98 REMARK 1 AUTH 3 B.RIMMER,S.SHEAT 4INS 99 REMARK 1 TITL STRUCTURE OF RHOMBOHEDRAL 2 ZINC INSULIN CRYSTALS 4INS 100 REMARK 1 REF NATURE V. 224 491 1969 4INS 101 REMARK 1 REFN ASTM NATUAS UK ISSN 0028-0836 006 4INS 102 REMARK 1 REFERENCE 15 4INS 103 REMARK 1 EDIT M.O.DAYHOFF 4INS 104 REMARK 1 REF ATLAS OF PROTEIN SEQUENCE V. 5 187 1972 4INS 105 REMARK 1 REF 2 AND STRUCTURE (DATA SECTION) 4INS 106 REMARK 1 PUBL NATIONAL BIOMEDICAL RESEARCH FOUNDATION, 4INS 107 REMARK 1 PUBL 2 SILVER SPRING,MD. 4INS 108 REMARK 1 REFN ISBN 0-912466-02-2 435 4INS 109 REMARK 2 4INS 110 REMARK 2 RESOLUTION. 1.5 ANGSTROMS. 4INS 111 REMARK 3 4INS 112 REMARK 3 REFINEMENT. BY THE RESTRAINED LEAST-SQUARES PROCEDURE OF J. 4INS 113 REMARK 3 KONNERT AND W. HENDRICKSON (PROGRAM *PROLSQ*). THE R 4INS 114 REMARK 3 VALUE IS 0.153. THE RMS DEVIATION FROM IDEALITY OF THE 4INS 115 REMARK 3 BOND LENGTHS IS 0.005 ANGSTROMS. THE RMS DEVIATION FROM 4INS 116 REMARK 3 IDEALITY OF THE BOND ANGLES IS 5.9 DEGREES. 4INS 117 REMARK 4 4INS 118 REMARK 4 SOLVENT MOLECULES ARE INCLUDED IN THE REFINEMENT 4INS 119 REMARK 4 CALCULATIONS. A COMPLETE SET OF SOLVENT COORDINATES IS 4INS 120 REMARK 4 INCLUDED IN THIS ENTRY. 4INS 121 REMARK 5 4INS 122 REMARK 5 THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT OF INSULIN CONSISTS OF 4INS 123 REMARK 5 TWO INSULIN MOLECULES EACH CONSISTING OF TWO CHAINS. THIS 4INS 124 REMARK 5 ENTRY PRESENTS COORDINATES FOR MOLECULES I (CHAIN 4INS 125 REMARK 5 INDICATORS *A* AND *B*) AND II (CHAIN INDICATORS *C* AND 4INS 126 REMARK 5 *D*). THE QUASI-TWO-FOLD AXIS THAT TRANSFORMS MOLECULE I 4INS 127 REMARK 5 INTO MOLECULE II IS GIVEN IN THE *MTRIX* RECORDS BELOW. 4INS 128 REMARK 5 APPLYING THE THREE-FOLD CRYSTALLOGRAPHIC AXIS YIELDS A 4INS 129 REMARK 5 HEXAMER AROUND THE AXIS. THERE ARE TWO ZINC IONS SITUATED 4INS 130 REMARK 5 ON THIS THREE-FOLD AXIS. COORDINATES FOR THE ZINC IONS AND 4INS 131 REMARK 5 SOME WATER MOLECULES ARE INCLUDED BELOW WITH A BLANK CHAIN 4INS 132 REMARK 5 INDICATOR. 4INS 133 REMARK 6 4INS 134 REMARK 6 SITES *D1* AND *D2* ARE THE DIMER-FORMING RESIDUES IN 4INS 135 REMARK 6 MOLECULES I AND II RESPECTIVELY. SITES *H1* AND *H2* ARE 4INS 136 REMARK 6 THE HEXAMER-FORMING RESIDUES IN MOLECULES I AND II 4INS 137 REMARK 6 RESPECTIVELY. SITES *SI1* AND *SI2* ARE THE 4INS 138 REMARK 6 SURFACE-INVARIANT RESIDUES IN MOLECULES I AND II, 4INS 139 REMARK 6 RESPECTIVELY, THAT ARE NOT INVOLVED IN DIMERIZATION. 4INS 140 REMARK 6 RESIDUE GLU A 4 IS INVARIANT AS A CARBOXYLIC ACID. 4INS 141 REMARK 6 RESIDUES HIS B 5 AND ARG B22 ARE INVARIANT IN INSULINS OF 4INS 142 REMARK 6 HIGH POTENCY ONLY. 4INS 143 REMARK 7 4INS 144 REMARK 7 THERE ARE TWO COORDINATION SITES IN THE HEXAMER. SITE 4INS 145 REMARK 7 *ZN1* COMPRISES RESIDUE HIS B 10 AND WATER HOH 4201 AND 4INS 146 REMARK 7 THEIR TWO CRYSTALLOGRAPHICALLY-RELATED EQUIVALENTS. SITE 4INS 147 REMARK 7 *ZN2* COMPRISES RESIDUE HIS D 10 AND WATER HOH 4513 AND 4INS 148 REMARK 7 THEIR TWO CRYSTALLOGRAPHICALLY-RELATED EQUIVALENTS. SITE 4INS 149 REMARK 7 *ZN1* IS OCTAHEDRALLY COORDINATED AROUND ZN1 AND SITE *ZN2* 4INS 150 REMARK 7 IS OCTAHEDRALLY COORDINATED AROUND ZN2. THE TWO SITES ARE 4INS 151 REMARK 7 VERY SIMILAR. 4INS 152 REMARK 7 BECAUSE THE COORDINATES OF THE SYMMETRY-RELATED ATOMS ARE 4INS 153 REMARK 7 NOT INCLUDED IN THIS ENTRY THE COMPLETE CONNECTIVITY OF 4INS 154 REMARK 7 ATOMS ZN1 AND ZN2 CANNOT BE SPECIFIED. PARTIAL 4INS 155 REMARK 7 CONNECTIVITY IS GIVEN BY 4INS 156 REMARK 7 CONECT 247 245 246 832 4INS 157 REMARK 7 CONECT 661 659 660 833 4INS 158 REMARK 7 CONECT 832 247 851 ... ... ... ... 4INS 159 REMARK 7 CONECT 833 661 895 ... ... ... ... 4INS 160 REMARK 7 CONECT 851 832 4INS 161 REMARK 7 CONECT 895 833 4INS 162 REMARK 7 . 4INS 163 REMARK 7 . 4INS 164 REMARK 7 . 4INS 165 REMARK 8 4INS 166 REMARK 8 SOME RESIDUES ARE APPARENTLY DISORDERED BUT DIFFICULT TO 4INS 167 REMARK 8 DESCRIBE IN TERMS OF ATOMIC POSITIONS. ALA B 30 IS ONE OF 4INS 168 REMARK 8 THESE RESIDUES. 4INS 169 REMARK 9 4INSA 3 REMARK 9 CORRECTION. CORRECT DEPOSITION DATE ON HEADER RECORD. 4INSA 4 REMARK 9 15-JUL-93. 4INSA 5 REMARK 10 4INSB 2 REMARK 10 CORRECTION. MOVE RESIDUE NUMBERS FOR HOH ATOMS TO THE 4INSB 3 REMARK 10 CORRECT COLUMNS. 31-JUL-94. 4INSB 4 SEQRES 1 A 21 GLY ILE VAL GLU GLN CYS CYS THR SER ILE CYS SER LEU 4INS 170 SEQRES 2 A 21 TYR GLN LEU GLU ASN TYR CYS ASN 4INS 171 SEQRES 1 B 30 PHE VAL ASN GLN HIS LEU CYS GLY SER HIS LEU VAL GLU 4INS 172 SEQRES 2 B 30 ALA LEU TYR LEU VAL CYS GLY GLU ARG GLY PHE PHE TYR 4INS 173 SEQRES 3 B 30 THR PRO LYS ALA 4INS 174 SEQRES 1 C 21 GLY ILE VAL GLU GLN CYS CYS THR SER ILE CYS SER LEU 4INS 175 SEQRES 2 C 21 TYR GLN LEU GLU ASN TYR CYS ASN 4INS 176 SEQRES 1 D 30 PHE VAL ASN GLN HIS LEU CYS GLY SER HIS LEU VAL GLU 4INS 177 SEQRES 2 D 30 ALA LEU TYR LEU VAL CYS GLY GLU ARG GLY PHE PHE TYR 4INS 178 SEQRES 3 D 30 THR PRO LYS ALA 4INS 179 FTNOTE 1 4INS 180 FTNOTE 1 THE QUASI-TWO-FOLD SYMMETRY BREAKS DOWN MOST SERIOUSLY AT 4INS 181 FTNOTE 1 RESIDUES 4INS 182 FTNOTE 1 GLY A 1 TO GLN A 5 AND GLY C 1 TO GLN C 5 4INS 183 FTNOTE 1 HIS B 5 AND HIS D 5 4INS 184 FTNOTE 1 PHE B 25 AND PHE D 25 4INS 185 FTNOTE 2 4INS 186 FTNOTE 2 THE FOLLOWING RESIDUES ARE DISORDERED - GLN B 4, VAL B 12, 4INS 187 FTNOTE 2 GLU B 21, ARG B 22, ARG D 22, LYS D 29. 4INS 188 FTNOTE 3 4INS 189 FTNOTE 3 SEE REMARK 8. 4INS 190 HET ZN 1 1 ZINC ION ON 3-FOLD CRYSTAL AXIS 4INS 191 HET ZN 2 1 ZINC ION ON 3-FOLD CRYSTAL AXIS 4INS 192 FORMUL 5 ZN 2(ZN1 ++) 4INS 193 FORMUL 6 HOH *350(H2 O1) 4INS 194 HELIX 1 A11 GLY A 1 ILE A 10 1 VAL 203 O H-BONDED TO HOH 4INS 195 HELIX 2 A12 SER A 12 GLU A 17 5 CNTCTS MOSTLY GT 3A,NOT IDEAL 4INS 196 HELIX 3 B11 SER B 9 GLY B 20 1 CYS 67 GLY 68, 3(10) CONTACTS 4INS 197 HELIX 4 A21 GLY C 1 ILE C 10 1 NOT IDEAL ALPH,SOME PI CNTCTS 4INS 198 HELIX 5 A22 SER C 12 GLU C 17 5 CNTCTS MOSTLY GT 3A,NOT IDEAL 4INS 199 HELIX 6 B21 SER D 9 GLY D 20 1 CYS 67,GLY 68, 3(10) CONTACTS 4INS 200 SHEET 1 B 2 PHE B 24 TYR B 26 0 4INS 201 SHEET 2 B 2 PHE D 24 TYR D 26 -1 N PHE B 24 O TYR D 26 4INS 202 TURN 1 1B1 CYS B 19 ARG B 22 4INS 203 TURN 2 1B2 GLY B 20 GLY B 23 4INS 204 TURN 3 2B1 CYS D 19 ARG D 22 4INS 205 TURN 4 2B2 GLY D 20 GLY D 23 4INS 206 SSBOND 1 CYS A 6 CYS A 11 4INS 207 SSBOND 2 CYS C 6 CYS C 11 4INS 208 SSBOND 3 CYS A 7 CYS B 7 4INS 209 SSBOND 4 CYS A 20 CYS B 19 4INS 210 SSBOND 5 CYS C 7 CYS D 7 4INS 211 SSBOND 6 CYS C 20 CYS D 19 4INS 212 SITE 1 D1 5 VAL B 12 TYR B 16 PHE B 24 PHE B 25 4INS 213 SITE 2 D1 5 TYR B 26 4INS 214 SITE 1 D2 5 VAL D 12 TYR D 16 PHE D 24 PHE D 25 4INS 215 SITE 2 D2 5 TYR D 26 4INS 216 SITE 1 H1 7 LEU A 13 TYR A 14 PHE B 1 GLU B 13 4INS 217 SITE 2 H1 7 ALA B 14 LEU B 17 VAL B 18 4INS 218 SITE 1 H2 7 LEU C 13 TYR C 14 PHE D 1 GLU D 13 4INS 219 SITE 2 H2 7 ALA D 14 LEU D 17 VAL D 18 4INS 220 SITE 1 SI1 7 GLY A 1 GLU A 4 GLN A 5 CYS A 7 4INS 221 SITE 2 SI1 7 TYR A 19 ASN A 21 CYS B 7 4INS 222 SITE 1 SI2 7 GLY C 1 GLU C 4 GLN C 5 CYS C 7 4INS 223 SITE 2 SI2 7 TYR C 19 ASN C 21 CYS D 7 4INS 224 CRYST1 82.500 82.500 34.000 90.00 90.00 120.00 R 3 18 4INS 225 ORIGX1 1.000000 0.000000 0.000000 0.00000 4INS 226 ORIGX2 0.000000 1.000000 0.000000 0.00000 4INS 227 ORIGX3 0.000000 0.000000 1.000000 0.00000 4INS 228 SCALE1 0.012121 0.006998 0.000000 0.00000 4INS 229 SCALE2 0.000000 0.013996 0.000000 0.00000 4INS 230 SCALE3 0.000000 0.000000 0.029412 0.00000 4INS 231 MTRIX1 1 -0.878620 -0.476960 0.023050 0.00000 1 4INS 232 MTRIX2 1 -0.477430 0.878370 -0.022860 0.00000 1 4INS 233 MTRIX3 1 -0.009350 -0.031090 -0.999470 0.00000 1 4INS 234 ATOM 1 N GLY A 1 -8.863 16.944 14.289 1.00 21.88 1 4INS 235 ATOM 2 CA GLY A 1 -9.929 17.026 13.244 1.00 22.85 1 4INS 236 ATOM 3 C GLY A 1 -10.051 15.625 12.618 1.00 43.92 1 4INS 237 ATOM 4 O GLY A 1 -9.782 14.728 13.407 1.00 25.22 1 4INS 238 ATOM 5 N ILE A 2 -10.333 15.531 11.332 1.00 26.28 1 4INS 239 ATOM 6 CA ILE A 2 -10.488 14.266 10.600 1.00 20.84 1 4INS 240 ATOM 7 C ILE A 2 -9.367 13.302 10.658 1.00 11.81 1 4INS 241 ATOM 8 O ILE A 2 -9.580 12.092 10.969 1.00 20.31 1 4INS 242 ATOM 9 CB ILE A 2 -10.883 14.493 9.095 1.00 40.00 1 4INS 243 ATOM 10 CG1 ILE A 2 -11.579 13.146 8.697 1.00 36.74 1 4INS 244 ATOM 11 CG2 ILE A 2 -9.741 14.794 8.140 1.00 23.02 1 4INS 245 ATOM 12 CD1 ILE A 2 -12.813 13.031 9.640 1.00 26.69 1 4INS 246 ATOM 13 N VAL A 3 -8.133 13.759 10.483 1.00 16.57 1 4INS 247 ATOM 14 CA VAL A 3 -6.966 12.901 10.576 1.00 15.75 1 4INS 248 ATOM 15 C VAL A 3 -6.892 12.161 11.922 1.00 22.09 1 4INS 249 ATOM 16 O VAL A 3 -6.547 10.990 12.037 1.00 24.52 1 4INS 250 ATOM 17 CB VAL A 3 -5.697 13.708 10.225 1.00 21.34 1 4INS 251 ATOM 18 CG1 VAL A 3 -4.382 12.960 10.448 1.00 32.48 1 4INS 252 ATOM 19 CG2 VAL A 3 -5.842 14.209 8.777 1.00 26.35 1 4INS 253 ATOM 20 N GLU A 4 -7.043 13.019 12.935 1.00 16.58 1 4INS 254 ATOM 21 CA GLU A 4 -6.889 12.474 14.295 1.00 15.32 1 4INS 255 ATOM 22 C GLU A 4 -8.004 11.558 14.610 1.00 16.88 1 4INS 256 ATOM 23 O GLU A 4 -7.888 10.474 15.128 1.00 23.30 1 4INS 257 ATOM 24 CB GLU A 4 -6.809 13.691 15.266 1.00 17.11 1 4INS 258 ATOM 25 CG GLU A 4 -5.615 14.565 14.951 1.00 21.45 1 4INS 259 ATOM 26 CD GLU A 4 -5.704 15.457 13.735 1.00 21.59 1 4INS 260 ATOM 27 OE1 GLU A 4 -6.757 15.959 13.377 1.00 23.43 1 4INS 261 ATOM 28 OE2 GLU A 4 -4.568 15.569 13.179 1.00 25.36 1 4INS 262 ATOM 29 N GLN A 5 -9.199 12.048 14.356 1.00 15.69 1 4INS 263 ATOM 30 CA GLN A 5 -10.407 11.299 14.630 1.00 12.38 1 4INS 264 ATOM 31 C GLN A 5 -10.431 9.940 13.980 1.00 19.86 1 4INS 265 ATOM 32 O GLN A 5 -10.815 8.931 14.542 1.00 16.83 1 4INS 266 ATOM 33 CB GLN A 5 -11.594 12.130 14.152 1.00 21.13 1 4INS 267 ATOM 34 CG GLN A 5 -12.860 11.374 14.561 1.00 22.06 1 4INS 268 ATOM 35 CD GLN A 5 -13.946 11.901 13.634 1.00 42.02 1 4INS 269 ATOM 36 OE1 GLN A 5 -13.908 13.027 13.169 1.00 55.10 1 4INS 270 ATOM 37 NE2 GLN A 5 -14.943 11.030 13.351 1.00 27.27 1 4INS 271 ATOM 38 N CYS A 6 -10.033 9.815 12.695 1.00 13.19 4INS 272 ATOM 39 CA CYS A 6 -10.050 8.518 12.065 1.00 12.63 4INS 273 ATOM 40 C CYS A 6 -9.105 7.520 12.667 1.00 9.95 4INS 274 ATOM 41 O CYS A 6 -9.395 6.288 12.666 1.00 14.22 4INS 275 ATOM 42 CB CYS A 6 -9.660 8.673 10.559 1.00 12.54 4INS 276 ATOM 43 SG CYS A 6 -10.925 9.459 9.579 1.00 13.00 4INS 277 ATOM 44 N CYS A 7 -8.018 7.992 13.171 1.00 10.84 4INS 278 ATOM 45 CA CYS A 7 -6.964 7.186 13.808 1.00 17.02 4INS 279 ATOM 46 C CYS A 7 -7.236 6.948 15.358 1.00 13.71 4INS 280 ATOM 47 O CYS A 7 -7.061 5.782 15.768 1.00 19.28 4INS 281 ATOM 48 CB CYS A 7 -5.578 7.826 13.656 1.00 20.24 4INS 282 ATOM 49 SG CYS A 7 -4.181 6.819 14.134 1.00 13.80 4INS 283 ATOM 50 N THR A 8 -7.655 7.937 16.058 1.00 12.57 4INS 284 ATOM 51 CA THR A 8 -7.862 7.732 17.520 1.00 19.99 4INS 285 ATOM 52 C THR A 8 -9.143 6.997 17.870 1.00 26.34 4INS 286 ATOM 53 O THR A 8 -9.189 6.157 18.795 1.00 25.43 4INS 287 ATOM 54 CB THR A 8 -7.728 9.055 18.386 1.00 20.77 4INS 288 ATOM 55 OG1 THR A 8 -8.889 9.918 18.117 1.00 26.76 4INS 289 ATOM 56 CG2 THR A 8 -6.334 9.700 18.196 1.00 26.50 4INS 290 ATOM 57 N SER A 9 -10.170 7.350 17.058 1.00 20.01 4INS 291 ATOM 58 CA SER A 9 -11.509 6.803 17.121 1.00 16.88 4INS 292 ATOM 59 C SER A 9 -11.796 5.981 15.856 1.00 12.70 4INS 293 ATOM 60 O SER A 9 -11.139 5.010 15.473 1.00 17.60 4INS 294 ATOM 61 CB SER A 9 -12.331 8.067 17.439 1.00 19.52 4INS 295 ATOM 62 OG SER A 9 -13.674 7.774 17.650 1.00 32.34 4INS 296 ATOM 63 N ILE A 10 -12.883 6.382 15.159 1.00 15.34 4INS 297 ATOM 64 CA ILE A 10 -13.350 5.723 13.932 1.00 20.23 4INS 298 ATOM 65 C ILE A 10 -13.969 6.902 13.106 1.00 17.50 4INS 299 ATOM 66 O ILE A 10 -14.355 7.922 13.623 1.00 16.60 4INS 300 ATOM 67 CB ILE A 10 -14.366 4.524 14.047 1.00 19.39 4INS 301 ATOM 68 CG1 ILE A 10 -15.702 4.874 14.742 1.00 22.05 4INS 302 ATOM 69 CG2 ILE A 10 -13.711 3.300 14.723 1.00 23.30 4INS 303 ATOM 70 CD1 ILE A 10 -16.702 3.722 15.005 1.00 42.11 4INS 304 ATOM 71 N CYS A 11 -14.080 6.685 11.767 1.00 12.14 4INS 305 ATOM 72 CA CYS A 11 -14.665 7.679 10.880 1.00 11.24 4INS 306 ATOM 73 C CYS A 11 -15.301 6.881 9.766 1.00 12.17 4INS 307 ATOM 74 O CYS A 11 -14.962 5.692 9.528 1.00 21.14 4INS 308 ATOM 75 CB CYS A 11 -13.695 8.702 10.417 1.00 13.03 4INS 309 ATOM 76 SG CYS A 11 -12.375 8.019 9.385 1.00 13.60 4INS 310 ATOM 77 N SER A 12 -16.233 7.557 9.095 1.00 11.37 4INS 311 ATOM 78 CA SER A 12 -16.999 6.978 8.005 1.00 9.91 4INS 312 ATOM 79 C SER A 12 -16.563 7.644 6.726 1.00 7.40 4INS 313 ATOM 80 O SER A 12 -15.967 8.753 6.711 1.00 9.67 4INS 314 ATOM 81 CB SER A 12 -18.516 7.183 8.084 1.00 16.64 4INS 315 ATOM 82 OG SER A 12 -18.869 8.543 7.881 1.00 17.14 4INS 316 ATOM 83 N LEU A 13 -16.852 6.914 5.612 1.00 11.35 4INS 317 ATOM 84 CA LEU A 13 -16.530 7.444 4.259 1.00 11.35 4INS 318 ATOM 85 C LEU A 13 -17.317 8.715 4.030 1.00 12.55 4INS 319 ATOM 86 O LEU A 13 -16.835 9.521 3.226 1.00 11.78 4INS 320 ATOM 87 CB LEU A 13 -16.774 6.348 3.232 1.00 11.66 4INS 321 ATOM 88 CG LEU A 13 -15.940 5.046 3.316 1.00 18.12 4INS 322 ATOM 89 CD1 LEU A 13 -16.050 4.197 2.018 1.00 18.76 4INS 323 ATOM 90 CD2 LEU A 13 -14.471 5.320 3.537 1.00 17.26 4INS 324 ATOM 91 N TYR A 14 -18.491 8.790 4.629 1.00 10.84 4INS 325 ATOM 92 CA TYR A 14 -19.282 10.035 4.368 1.00 10.75 4INS 326 ATOM 93 C TYR A 14 -18.639 11.228 4.963 1.00 12.81 4INS 327 ATOM 94 O TYR A 14 -18.706 12.298 4.341 1.00 15.11 4INS 328 ATOM 95 CB TYR A 14 -20.746 9.900 4.799 1.00 12.90 4INS 329 ATOM 96 CG TYR A 14 -21.463 8.764 4.079 1.00 18.23 4INS 330 ATOM 97 CD1 TYR A 14 -22.110 9.123 2.891 1.00 18.95 4INS 331 ATOM 98 CD2 TYR A 14 -21.461 7.440 4.475 1.00 15.42 4INS 332 ATOM 99 CE1 TYR A 14 -22.767 8.167 2.086 1.00 18.15 4INS 333 ATOM 100 CE2 TYR A 14 -22.118 6.436 3.676 1.00 14.31 4INS 334 ATOM 101 CZ TYR A 14 -22.738 6.856 2.556 1.00 15.47 4INS 335 ATOM 102 OH TYR A 14 -23.436 5.926 1.716 1.00 24.86 4INS 336 ATOM 103 N GLN A 15 -17.945 11.100 6.091 1.00 9.63 4INS 337 ATOM 104 CA GLN A 15 -17.178 12.138 6.774 1.00 9.40 4INS 338 ATOM 105 C GLN A 15 -16.012 12.543 5.900 1.00 10.52 4INS 339 ATOM 106 O GLN A 15 -15.611 13.717 5.722 1.00 14.25 4INS 340 ATOM 107 CB GLN A 15 -16.774 11.841 8.205 1.00 13.89 4INS 341 ATOM 108 CG GLN A 15 -17.894 11.668 9.206 1.00 17.53 4INS 342 ATOM 109 CD GLN A 15 -17.524 11.056 10.515 1.00 28.21 4INS 343 ATOM 110 OE1 GLN A 15 -16.865 10.027 10.598 1.00 20.14 4INS 344 ATOM 111 NE2 GLN A 15 -17.994 11.650 11.624 1.00 30.25 4INS 345 ATOM 112 N LEU A 16 -15.352 11.525 5.325 1.00 12.99 4INS 346 ATOM 113 CA LEU A 16 -14.185 11.826 4.470 1.00 11.19 4INS 347 ATOM 114 C LEU A 16 -14.605 12.634 3.249 1.00 15.54 4INS 348 ATOM 115 O LEU A 16 -13.767 13.398 2.745 1.00 16.01 4INS 349 ATOM 116 CB LEU A 16 -13.588 10.521 4.060 1.00 12.67 4INS 350 ATOM 117 CG LEU A 16 -12.954 9.717 5.182 1.00 13.07 4INS 351 ATOM 118 CD1 LEU A 16 -12.115 8.571 4.602 1.00 16.61 4INS 352 ATOM 119 CD2 LEU A 16 -12.041 10.559 6.028 1.00 16.50 4INS 353 ATOM 120 N GLU A 17 -15.779 12.420 2.759 1.00 17.50 4INS 354 ATOM 121 CA GLU A 17 -16.223 13.179 1.589 1.00 17.72 4INS 355 ATOM 122 C GLU A 17 -16.171 14.693 1.811 1.00 19.21 4INS 356 ATOM 123 O GLU A 17 -16.118 15.466 0.803 1.00 18.48 4INS 357 ATOM 124 CB GLU A 17 -17.645 12.862 1.215 1.00 17.38 4INS 358 ATOM 125 CG GLU A 17 -17.885 11.629 0.360 1.00 27.97 4INS 359 ATOM 126 CD GLU A 17 -19.225 11.667 -0.391 1.00 26.70 4INS 360 ATOM 127 OE1 GLU A 17 -20.201 11.466 0.276 1.00 29.93 4INS 361 ATOM 128 OE2 GLU A 17 -19.127 11.873 -1.643 1.00 34.66 4INS 362 ATOM 129 N ASN A 18 -16.094 15.074 3.104 1.00 15.10 4INS 363 ATOM 130 CA ASN A 18 -16.029 16.534 3.332 1.00 18.85 4INS 364 ATOM 131 C ASN A 18 -14.703 17.131 2.954 1.00 18.46 4INS 365 ATOM 132 O ASN A 18 -14.545 18.377 2.834 1.00 19.68 4INS 366 ATOM 133 CB ASN A 18 -16.489 16.934 4.738 1.00 20.66 4INS 367 ATOM 134 CG ASN A 18 -17.868 16.338 5.142 1.00 29.79 4INS 368 ATOM 135 OD1 ASN A 18 -18.813 16.053 4.382 1.00 34.48 4INS 369 ATOM 136 ND2 ASN A 18 -17.991 16.168 6.452 1.00 36.00 4INS 370 ATOM 137 N TYR A 19 -13.697 16.327 2.738 1.00 15.68 4INS 371 ATOM 138 CA TYR A 19 -12.358 16.724 2.380 1.00 14.19 4INS 372 ATOM 139 C TYR A 19 -12.154 16.695 0.899 1.00 13.20 4INS 373 ATOM 140 O TYR A 19 -11.010 17.038 0.480 1.00 16.12 4INS 374 ATOM 141 CB TYR A 19 -11.364 15.840 3.178 1.00 14.35 4INS 375 ATOM 142 CG TYR A 19 -11.586 16.223 4.634 1.00 21.24 4INS 376 ATOM 143 CD1 TYR A 19 -10.853 17.300 5.129 1.00 26.61 4INS 377 ATOM 144 CD2 TYR A 19 -12.562 15.703 5.445 1.00 19.21 4INS 378 ATOM 145 CE1 TYR A 19 -11.084 17.801 6.393 1.00 27.80 4INS 379 ATOM 146 CE2 TYR A 19 -12.833 16.207 6.714 1.00 23.98 4INS 380 ATOM 147 CZ TYR A 19 -12.081 17.267 7.187 1.00 34.08 4INS 381 ATOM 148 OH TYR A 19 -12.227 17.849 8.400 1.00 37.96 4INS 382 ATOM 149 N CYS A 20 -13.057 16.313 0.077 1.00 13.05 4INS 383 ATOM 150 CA CYS A 20 -12.838 16.309 -1.389 1.00 18.69 4INS 384 ATOM 151 C CYS A 20 -12.984 17.799 -1.802 1.00 19.09 4INS 385 ATOM 152 O CYS A 20 -13.588 18.579 -1.084 1.00 19.31 4INS 386 ATOM 153 CB CYS A 20 -13.850 15.490 -2.157 1.00 15.99 4INS 387 ATOM 154 SG CYS A 20 -13.923 13.761 -1.584 1.00 12.90 4INS 388 ATOM 155 N ASN A 21 -12.380 18.063 -2.909 1.00 17.63 4INS 389 ATOM 156 CA ASN A 21 -12.404 19.399 -3.608 1.00 25.23 4INS 390 ATOM 157 C ASN A 21 -13.642 19.696 -4.447 1.00 34.82 4INS 391 ATOM 158 O ASN A 21 -14.146 18.703 -4.956 1.00 31.24 4INS 392 ATOM 159 CB ASN A 21 -11.228 19.392 -4.521 1.00 19.06 4INS 393 ATOM 160 CG ASN A 21 -10.020 20.283 -4.456 1.00 40.71 4INS 394 ATOM 161 OD1 ASN A 21 -10.067 21.380 -5.083 1.00 68.22 4INS 395 ATOM 162 ND2 ASN A 21 -9.004 19.667 -3.808 1.00 39.69 4INS 396 ATOM 163 OXT ASN A 21 -13.881 20.890 -4.604 1.00 41.83 4INS 397 TER 164 ASN A 21 4INS 398 ATOM 165 N PHE B 1 -21.768 1.132 3.577 1.00 25.87 4INS 399 ATOM 166 CA PHE B 1 -20.374 1.368 4.053 1.00 24.30 4INS 400 ATOM 167 C PHE B 1 -20.341 1.145 5.585 1.00 39.74 4INS 401 ATOM 168 O PHE B 1 -21.423 1.141 6.173 1.00 38.10 4INS 402 ATOM 169 CB PHE B 1 -19.806 2.718 3.624 1.00 22.51 4INS 403 ATOM 170 CG PHE B 1 -19.924 2.916 2.131 1.00 16.52 4INS 404 ATOM 171 CD1 PHE B 1 -20.067 4.204 1.618 1.00 35.58 4INS 405 ATOM 172 CD2 PHE B 1 -19.709 1.873 1.262 1.00 20.86 4INS 406 ATOM 173 CE1 PHE B 1 -20.093 4.444 0.243 1.00 52.66 4INS 407 ATOM 174 CE2 PHE B 1 -19.824 2.067 -0.123 1.00 51.46 4INS 408 ATOM 175 CZ PHE B 1 -20.011 3.332 -0.631 1.00 42.63 4INS 409 ATOM 176 N VAL B 2 -19.104 0.899 6.027 1.00 21.12 4INS 410 ATOM 177 CA VAL B 2 -18.754 0.598 7.406 1.00 36.74 4INS 411 ATOM 178 C VAL B 2 -17.780 1.656 7.965 1.00 23.52 4INS 412 ATOM 179 O VAL B 2 -17.104 2.328 7.197 1.00 19.56 4INS 413 ATOM 180 CB VAL B 2 -18.048 -0.765 7.638 1.00 30.58 4INS 414 ATOM 181 CG1 VAL B 2 -18.993 -1.953 7.609 1.00 25.73 4INS 415 ATOM 182 CG2 VAL B 2 -16.776 -0.916 6.799 1.00 22.31 4INS 416 ATOM 183 N ASN B 3 -17.741 1.753 9.278 1.00 13.38 4INS 417 ATOM 184 CA ASN B 3 -16.872 2.691 9.950 1.00 13.94 4INS 418 ATOM 185 C ASN B 3 -15.457 2.100 9.881 1.00 15.03 4INS 419 ATOM 186 O ASN B 3 -15.312 0.857 9.926 1.00 24.85 4INS 420 ATOM 187 CB ASN B 3 -17.272 3.010 11.382 1.00 25.01 4INS 421 ATOM 188 CG ASN B 3 -18.513 3.844 11.511 1.00 49.04 4INS 422 ATOM 189 OD1 ASN B 3 -18.658 4.774 10.724 1.00 34.50 4INS 423 ATOM 190 ND2 ASN B 3 -19.333 3.415 12.473 1.00 35.00 4INS 424 ATOM 191 N GLN B 4 -14.509 3.031 9.767 1.00 12.52 2 4INS 425 ATOM 192 CA GLN B 4 -13.137 2.542 9.571 1.00 22.69 2 4INS 426 ATOM 193 C GLN B 4 -12.213 3.224 10.580 1.00 13.29 2 4INS 427 ATOM 194 O GLN B 4 -12.347 4.333 11.118 1.00 20.53 2 4INS 428 ATOM 195 CB GLN B 4 -12.666 2.760 8.116 1.00 39.18 2 4INS 429 ATOM 196 CG AGLN B 4 -13.007 1.731 7.035 0.60 11.45 2 4INS 430 ATOM 197 CG BGLN B 4 -12.978 1.763 6.996 0.40 37.30 2 4INS 431 ATOM 198 CD AGLN B 4 -12.270 0.520 6.830 0.60 12.42 2 4INS 432 ATOM 199 CD BGLN B 4 -14.070 2.781 6.746 0.40 32.97 2 4INS 433 ATOM 200 OE1AGLN B 4 -12.812 -0.612 6.494 0.60 17.67 2 4INS 434 ATOM 201 OE1BGLN B 4 -14.059 3.957 7.112 0.40 40.00 2 4INS 435 ATOM 202 NE2AGLN B 4 -10.898 0.624 6.949 0.60 28.94 2 4INS 436 ATOM 203 NE2BGLN B 4 -15.108 2.179 6.165 0.40 35.67 2 4INS 437 ATOM 204 N HIS B 5 -11.158 2.442 10.837 1.00 13.02 1 4INS 438 ATOM 205 CA HIS B 5 -10.083 3.000 11.779 1.00 17.05 1 4INS 439 ATOM 206 C HIS B 5 -8.855 3.149 10.899 1.00 10.95 1 4INS 440 ATOM 207 O HIS B 5 -8.284 2.166 10.380 1.00 17.14 1 4INS 441 ATOM 208 CB HIS B 5 -9.982 1.956 12.877 1.00 22.24 1 4INS 442 ATOM 209 CG HIS B 5 -8.934 2.400 13.860 1.00 25.74 1 4INS 443 ATOM 210 ND1 HIS B 5 -8.072 1.535 14.436 1.00 35.32 1 4INS 444 ATOM 211 CD2 HIS B 5 -8.637 3.596 14.329 1.00 28.02 1 4INS 445 ATOM 212 CE1 HIS B 5 -7.275 2.240 15.211 1.00 28.73 1 4INS 446 ATOM 213 NE2 HIS B 5 -7.571 3.509 15.150 1.00 30.21 1 4INS 447 ATOM 214 N LEU B 6 -8.529 4.400 10.604 1.00 11.30 4INS 448 ATOM 215 CA LEU B 6 -7.468 4.709 9.611 1.00 11.13 4INS 449 ATOM 216 C LEU B 6 -6.399 5.604 10.158 1.00 11.03 4INS 450 ATOM 217 O LEU B 6 -6.695 6.779 10.484 1.00 13.66 4INS 451 ATOM 218 CB LEU B 6 -8.231 5.398 8.411 1.00 14.13 4INS 452 ATOM 219 CG LEU B 6 -9.251 4.634 7.563 1.00 13.39 4INS 453 ATOM 220 CD1 LEU B 6 -10.017 5.598 6.671 1.00 14.70 4INS 454 ATOM 221 CD2 LEU B 6 -8.620 3.517 6.767 1.00 18.25 4INS 455 ATOM 222 N CYS B 7 -5.180 5.069 10.115 1.00 10.06 4INS 456 ATOM 223 CA CYS B 7 -4.058 5.835 10.569 1.00 10.70 4INS 457 ATOM 224 C CYS B 7 -3.033 5.982 9.484 1.00 13.26 4INS 458 ATOM 225 O CYS B 7 -2.955 5.198 8.573 1.00 19.10 4INS 459 ATOM 226 CB CYS B 7 -3.434 5.105 11.762 1.00 15.88 4INS 460 ATOM 227 SG CYS B 7 -4.523 5.099 13.246 1.00 16.40 4INS 461 ATOM 228 N GLY B 8 -2.181 6.993 9.540 1.00 12.37 4INS 462 ATOM 229 CA GLY B 8 -1.070 7.261 8.632 1.00 12.72 4INS 463 ATOM 230 C GLY B 8 -1.465 7.317 7.204 1.00 13.24 4INS 464 ATOM 231 O GLY B 8 -2.470 7.884 6.744 1.00 11.92 4INS 465 ATOM 232 N SER B 9 -0.609 6.582 6.429 1.00 11.74 4INS 466 ATOM 233 CA SER B 9 -0.863 6.544 4.980 1.00 15.89 4INS 467 ATOM 234 C SER B 9 -2.183 5.870 4.578 1.00 9.73 4INS 468 ATOM 235 O SER B 9 -2.649 6.111 3.528 1.00 10.43 4INS 469 ATOM 236 CB SER B 9 0.309 5.921 4.206 1.00 17.74 4INS 470 ATOM 237 OG SER B 9 0.534 4.626 4.735 1.00 17.37 4INS 471 ATOM 238 N HIS B 10 -2.721 5.100 5.451 1.00 10.19 4INS 472 ATOM 239 CA HIS B 10 -3.940 4.379 5.188 1.00 7.66 4INS 473 ATOM 240 C HIS B 10 -5.081 5.431 5.075 1.00 10.17 4INS 474 ATOM 241 O HIS B 10 -6.021 5.163 4.291 1.00 10.92 4INS 475 ATOM 242 CB HIS B 10 -4.234 3.316 6.228 1.00 9.55 4INS 476 ATOM 243 CG HIS B 10 -3.192 2.269 6.364 1.00 9.55 4INS 477 ATOM 244 ND1 HIS B 10 -3.043 1.310 5.423 1.00 15.86 4INS 478 ATOM 245 CD2 HIS B 10 -2.289 1.991 7.311 1.00 8.47 4INS 479 ATOM 246 CE1 HIS B 10 -2.078 0.573 5.774 1.00 10.65 4INS 480 ATOM 247 NE2 HIS B 10 -1.589 0.939 6.878 1.00 9.41 4INS 481 ATOM 248 N LEU B 11 -5.016 6.497 5.810 1.00 8.93 4INS 482 ATOM 249 CA LEU B 11 -6.071 7.518 5.617 1.00 9.64 4INS 483 ATOM 250 C LEU B 11 -5.967 8.182 4.279 1.00 7.89 4INS 484 ATOM 251 O LEU B 11 -6.969 8.462 3.666 1.00 9.74 4INS 485 ATOM 252 CB LEU B 11 -5.860 8.541 6.740 1.00 6.93 4INS 486 ATOM 253 CG LEU B 11 -6.949 9.607 6.783 1.00 14.50 4INS 487 ATOM 254 CD1 LEU B 11 -8.376 9.229 6.627 1.00 18.34 4INS 488 ATOM 255 CD2 LEU B 11 -6.742 10.309 8.115 1.00 20.70 4INS 489 ATOM 256 N VAL B 12 -4.751 8.449 3.799 1.00 10.12 2 4INS 490 ATOM 257 CA VAL B 12 -4.579 9.057 2.495 1.00 8.05 2 4INS 491 ATOM 258 C VAL B 12 -5.050 8.131 1.372 1.00 8.14 2 4INS 492 ATOM 259 O VAL B 12 -5.595 8.653 0.398 1.00 11.63 2 4INS 493 ATOM 260 CB VAL B 12 -3.153 9.538 2.230 1.00 11.54 2 4INS 494 ATOM 261 CG1 VAL B 12 -2.809 10.670 3.148 1.00 17.75 2 4INS 495 ATOM 262 CG2AVAL B 12 -2.822 9.786 0.799 0.50 4.68 2 4INS 496 ATOM 263 CG2BVAL B 12 -1.963 8.655 2.123 0.50 10.87 2 4INS 497 ATOM 264 N GLU B 13 -4.906 6.880 1.502 1.00 6.12 4INS 498 ATOM 265 CA GLU B 13 -5.432 5.946 0.542 1.00 8.88 4INS 499 ATOM 266 C GLU B 13 -6.966 6.014 0.472 1.00 12.22 4INS 500 ATOM 267 O GLU B 13 -7.578 6.035 -0.614 1.00 11.15 4INS 501 ATOM 268 CB GLU B 13 -4.996 4.506 0.854 1.00 12.65 4INS 502 ATOM 269 CG GLU B 13 -3.497 4.444 0.582 1.00 15.60 4INS 503 ATOM 270 CD GLU B 13 -3.246 3.857 -0.794 1.00 53.85 4INS 504 ATOM 271 OE1 GLU B 13 -4.238 3.643 -1.500 1.00 33.68 4INS 505 ATOM 272 OE2 GLU B 13 -2.114 3.611 -1.126 1.00 47.24 4INS 506 ATOM 273 N ALA B 14 -7.659 6.004 1.637 1.00 7.15 4INS 507 ATOM 274 CA ALA B 14 -9.061 6.164 1.719 1.00 7.29 4INS 508 ATOM 275 C ALA B 14 -9.563 7.482 1.051 1.00 6.80 4INS 509 ATOM 276 O ALA B 14 -10.595 7.468 0.346 1.00 11.10 4INS 510 ATOM 277 CB ALA B 14 -9.604 6.039 3.106 1.00 12.06 4INS 511 ATOM 278 N LEU B 15 -8.876 8.580 1.321 1.00 6.72 4INS 512 ATOM 279 CA LEU B 15 -9.224 9.854 0.717 1.00 13.51 4INS 513 ATOM 280 C LEU B 15 -9.111 9.815 -0.829 1.00 14.62 4INS 514 ATOM 281 O LEU B 15 -9.956 10.390 -1.496 1.00 12.32 4INS 515 ATOM 282 CB LEU B 15 -8.317 10.981 1.327 1.00 9.71 4INS 516 ATOM 283 CG LEU B 15 -8.755 11.581 2.649 1.00 8.92 4INS 517 ATOM 284 CD1 LEU B 15 -7.682 12.475 3.236 1.00 14.49 4INS 518 ATOM 285 CD2 LEU B 15 -10.096 12.235 2.460 1.00 12.03 4INS 519 ATOM 286 N TYR B 16 -8.050 9.147 -1.297 1.00 8.65 4INS 520 ATOM 287 CA TYR B 16 -7.838 8.961 -2.686 1.00 8.75 4INS 521 ATOM 288 C TYR B 16 -8.999 8.175 -3.284 1.00 11.14 4INS 522 ATOM 289 O TYR B 16 -9.508 8.504 -4.371 1.00 14.34 4INS 523 ATOM 290 CB TYR B 16 -6.494 8.247 -3.047 1.00 7.72 4INS 524 ATOM 291 CG TYR B 16 -6.271 8.027 -4.522 1.00 10.81 4INS 525 ATOM 292 CD1 TYR B 16 -6.450 6.784 -5.047 1.00 17.09 4INS 526 ATOM 293 CD2 TYR B 16 -6.009 9.104 -5.338 1.00 12.64 4INS 527 ATOM 294 CE1 TYR B 16 -6.354 6.581 -6.467 1.00 17.76 4INS 528 ATOM 295 CE2 TYR B 16 -5.898 8.958 -6.741 1.00 13.94 4INS 529 ATOM 296 CZ TYR B 16 -6.110 7.692 -7.259 1.00 17.34 4INS 530 ATOM 297 OH TYR B 16 -5.925 7.520 -8.594 1.00 25.34 4INS 531 ATOM 298 N LEU B 17 -9.428 7.109 -2.664 1.00 8.68 4INS 532 ATOM 299 CA LEU B 17 -10.566 6.290 -3.167 1.00 8.83 4INS 533 ATOM 300 C LEU B 17 -11.861 7.087 -3.142 1.00 10.95 4INS 534 ATOM 301 O LEU B 17 -12.650 7.046 -4.073 1.00 15.67 4INS 535 ATOM 302 CB LEU B 17 -10.665 5.052 -2.327 1.00 10.82 4INS 536 ATOM 303 CG LEU B 17 -9.594 4.104 -2.924 1.00 28.76 4INS 537 ATOM 304 CD1 LEU B 17 -9.136 3.067 -1.933 1.00 30.52 4INS 538 ATOM 305 CD2 LEU B 17 -10.280 3.540 -4.157 1.00 34.91 4INS 539 ATOM 306 N VAL B 18 -12.123 7.786 -2.036 1.00 8.85 4INS 540 ATOM 307 CA VAL B 18 -13.351 8.545 -1.933 1.00 8.77 4INS 541 ATOM 308 C VAL B 18 -13.433 9.713 -2.873 1.00 9.77 4INS 542 ATOM 309 O VAL B 18 -14.472 9.937 -3.457 1.00 16.86 4INS 543 ATOM 310 CB VAL B 18 -13.604 8.974 -0.463 1.00 14.39 4INS 544 ATOM 311 CG1 VAL B 18 -14.784 9.899 -0.282 1.00 11.72 4INS 545 ATOM 312 CG2 VAL B 18 -13.862 7.763 0.393 1.00 12.58 4INS 546 ATOM 313 N CYS B 19 -12.422 10.518 -2.958 1.00 9.03 4INS 547 ATOM 314 CA CYS B 19 -12.433 11.758 -3.756 1.00 8.88 4INS 548 ATOM 315 C CYS B 19 -11.994 11.555 -5.212 1.00 14.69 4INS 549 ATOM 316 O CYS B 19 -12.410 12.303 -6.126 1.00 16.46 4INS 550 ATOM 317 CB CYS B 19 -11.558 12.719 -3.005 1.00 11.19 4INS 551 ATOM 318 SG CYS B 19 -12.040 13.127 -1.344 1.00 10.10 4INS 552 ATOM 319 N GLY B 20 -11.149 10.609 -5.463 1.00 17.12 4INS 553 ATOM 320 CA GLY B 20 -10.685 10.359 -6.851 1.00 21.59 4INS 554 ATOM 321 C GLY B 20 -10.275 11.650 -7.524 1.00 21.38 4INS 555 ATOM 322 O GLY B 20 -9.494 12.483 -7.053 1.00 20.41 4INS 556 ATOM 323 N GLU B 21 -10.784 11.844 -8.710 1.00 29.76 2 4INS 557 ATOM 324 CA GLU B 21 -10.398 13.043 -9.501 1.00 24.44 2 4INS 558 ATOM 325 C GLU B 21 -10.898 14.356 -9.065 1.00 19.21 2 4INS 559 ATOM 326 O GLU B 21 -10.430 15.331 -9.665 1.00 19.00 2 4INS 560 ATOM 327 CB GLU B 21 -10.776 12.724 -10.968 1.00 28.66 2 4INS 561 ATOM 328 CG AGLU B 21 -12.310 12.519 -11.045 0.50 56.11 2 4INS 562 ATOM 329 CG BGLU B 21 -9.804 13.415 -11.966 0.50 75.35 2 4INS 563 ATOM 330 CD AGLU B 21 -12.707 11.349 -11.901 0.50 62.47 2 4INS 564 ATOM 331 CD BGLU B 21 -9.689 13.292 -13.466 0.50 52.68 2 4INS 565 ATOM 332 OE1AGLU B 21 -12.515 10.193 -11.564 0.50 48.34 2 4INS 566 ATOM 333 OE1BGLU B 21 -10.540 12.768 -14.159 0.50 50.28 2 4INS 567 ATOM 334 OE2AGLU B 21 -13.225 11.772 -12.958 0.50 49.92 2 4INS 568 ATOM 335 OE2BGLU B 21 -8.505 13.537 -13.781 0.50 27.33 2 4INS 569 ATOM 336 N ARG B 22 -11.703 14.491 -8.034 1.00 15.49 2 4INS 570 ATOM 337 CA ARG B 22 -12.089 15.732 -7.456 1.00 16.44 2 4INS 571 ATOM 338 C ARG B 22 -10.797 16.222 -6.745 1.00 17.70 2 4INS 572 ATOM 339 O ARG B 22 -10.636 17.458 -6.608 1.00 21.36 2 4INS 573 ATOM 340 CB ARG B 22 -13.234 15.678 -6.464 1.00 21.99 2 4INS 574 ATOM 341 CG ARG B 22 -14.645 15.427 -7.037 1.00 57.89 2 4INS 575 ATOM 342 CD ARG B 22 -15.675 15.167 -5.960 1.00 31.23 2 4INS 576 ATOM 343 NE AARG B 22 -15.739 16.404 -5.124 0.50 16.46 2 4INS 577 ATOM 344 NE BARG B 22 -15.629 13.808 -5.271 0.50 17.69 2 4INS 578 ATOM 345 CZ AARG B 22 -16.608 16.581 -4.143 0.50 39.57 2 4INS 579 ATOM 346 CZ BARG B 22 -16.379 13.225 -4.283 0.50 33.09 2 4INS 580 ATOM 347 NH1AARG B 22 -16.743 17.672 -3.416 0.50 20.14 2 4INS 581 ATOM 348 NH1BARG B 22 -16.987 14.046 -3.392 0.50 51.50 2 4INS 582 ATOM 349 NH2AARG B 22 -17.405 15.551 -3.871 0.50 35.40 2 4INS 583 ATOM 350 NH2BARG B 22 -16.705 11.943 -4.184 0.50 19.59 2 4INS 584 ATOM 351 N GLY B 23 -10.007 15.246 -6.287 1.00 19.18 4INS 585 ATOM 352 CA GLY B 23 -8.844 15.673 -5.491 1.00 11.89 4INS 586 ATOM 353 C GLY B 23 -9.339 15.932 -4.075 1.00 12.83 4INS 587 ATOM 354 O GLY B 23 -10.524 15.922 -3.626 1.00 14.47 4INS 588 ATOM 355 N PHE B 24 -8.343 16.165 -3.187 1.00 12.54 4INS 589 ATOM 356 CA PHE B 24 -8.584 16.432 -1.765 1.00 10.08 4INS 590 ATOM 357 C PHE B 24 -7.488 17.220 -1.123 1.00 10.77 4INS 591 ATOM 358 O PHE B 24 -6.411 17.409 -1.657 1.00 10.93 4INS 592 ATOM 359 CB PHE B 24 -8.754 15.111 -1.032 1.00 3.80 4INS 593 ATOM 360 CG PHE B 24 -7.638 14.114 -1.034 1.00 5.98 4INS 594 ATOM 361 CD1 PHE B 24 -7.488 13.202 -2.069 1.00 5.61 4INS 595 ATOM 362 CD2 PHE B 24 -6.667 14.205 -0.036 1.00 8.93 4INS 596 ATOM 363 CE1 PHE B 24 -6.375 12.338 -2.106 1.00 14.64 4INS 597 ATOM 364 CE2 PHE B 24 -5.573 13.387 0.027 1.00 11.74 4INS 598 ATOM 365 CZ PHE B 24 -5.457 12.470 -1.008 1.00 9.78 4INS 599 ATOM 366 N PHE B 25 -7.717 17.612 0.116 1.00 14.20 1 4INS 600 ATOM 367 CA PHE B 25 -6.813 18.302 1.052 1.00 12.03 1 4INS 601 ATOM 368 C PHE B 25 -6.569 17.356 2.221 1.00 12.69 1 4INS 602 ATOM 369 O PHE B 25 -7.485 16.788 2.757 1.00 15.22 1 4INS 603 ATOM 370 CB PHE B 25 -7.387 19.633 1.684 1.00 17.25 1 4INS 604 ATOM 371 CG PHE B 25 -7.105 20.689 0.637 1.00 30.38 1 4INS 605 ATOM 372 CD1 PHE B 25 -7.842 20.802 -0.543 1.00 61.20 1 4INS 606 ATOM 373 CD2 PHE B 25 -6.003 21.541 0.896 1.00 56.90 1 4INS 607 ATOM 374 CE1 PHE B 25 -7.445 21.790 -1.461 1.00 29.52 1 4INS 608 ATOM 375 CE2 PHE B 25 -5.648 22.564 -0.027 1.00 40.31 1 4INS 609 ATOM 376 CZ PHE B 25 -6.382 22.681 -1.235 1.00 30.38 1 4INS 610 ATOM 377 N TYR B 26 -5.345 17.202 2.583 1.00 11.25 4INS 611 ATOM 378 CA TYR B 26 -4.996 16.333 3.717 1.00 10.42 4INS 612 ATOM 379 C TYR B 26 -4.445 17.350 4.714 1.00 15.08 4INS 613 ATOM 380 O TYR B 26 -3.350 17.906 4.518 1.00 14.52 4INS 614 ATOM 381 CB TYR B 26 -3.949 15.288 3.319 1.00 9.51 4INS 615 ATOM 382 CG TYR B 26 -3.404 14.530 4.474 1.00 12.61 4INS 616 ATOM 383 CD1 TYR B 26 -4.243 13.688 5.178 1.00 20.50 4INS 617 ATOM 384 CD2 TYR B 26 -2.105 14.676 4.857 1.00 13.88 4INS 618 ATOM 385 CE1 TYR B 26 -3.652 12.967 6.246 1.00 16.38 4INS 619 ATOM 386 CE2 TYR B 26 -1.577 14.010 5.941 1.00 10.97 4INS 620 ATOM 387 CZ TYR B 26 -2.347 13.149 6.642 1.00 11.71 4INS 621 ATOM 388 OH TYR B 26 -1.853 12.447 7.734 1.00 16.39 4INS 622 ATOM 389 N THR B 27 -5.287 17.537 5.752 1.00 15.47 4INS 623 ATOM 390 CA THR B 27 -4.902 18.555 6.772 1.00 20.05 4INS 624 ATOM 391 C THR B 27 -4.834 18.053 8.250 1.00 15.09 4INS 625 ATOM 392 O THR B 27 -5.825 18.282 8.943 1.00 22.56 4INS 626 ATOM 393 CB THR B 27 -5.856 19.825 6.753 1.00 26.34 4INS 627 ATOM 394 OG1ATHR B 27 -7.228 19.328 6.558 0.50 39.91 4INS 628 ATOM 395 OG1BTHR B 27 -5.691 20.478 5.511 0.50 29.43 4INS 629 ATOM 396 CG2ATHR B 27 -5.505 20.781 5.606 0.50 34.53 4INS 630 ATOM 397 CG2BTHR B 27 -5.413 20.850 7.858 0.50 34.13 4INS 631 ATOM 398 N PRO B 28 -3.702 17.548 8.603 1.00 18.26 4INS 632 ATOM 399 CA PRO B 28 -3.494 17.055 9.954 1.00 21.56 4INS 633 ATOM 400 C PRO B 28 -3.306 18.220 10.892 1.00 22.68 4INS 634 ATOM 401 O PRO B 28 -3.072 19.330 10.484 1.00 21.93 4INS 635 ATOM 402 CB PRO B 28 -2.249 16.209 9.808 1.00 21.60 4INS 636 ATOM 403 CG PRO B 28 -1.544 16.617 8.595 1.00 21.39 4INS 637 ATOM 404 CD PRO B 28 -2.526 17.320 7.778 1.00 14.32 4INS 638 ATOM 405 N LYS B 29 -3.452 17.975 12.175 1.00 26.27 4INS 639 ATOM 406 CA LYS B 29 -3.227 18.941 13.307 1.00 23.17 4INS 640 ATOM 407 C LYS B 29 -1.707 18.995 13.459 1.00 52.81 4INS 641 ATOM 408 O LYS B 29 -1.026 17.919 13.406 1.00 39.37 4INS 642 ATOM 409 CB LYS B 29 -3.764 18.417 14.615 1.00 22.26 4INS 643 ATOM 410 CG LYS B 29 -3.990 19.385 15.801 1.00 48.01 4INS 644 ATOM 411 CD LYS B 29 -5.153 18.811 16.622 1.00 37.36 4INS 645 ATOM 412 CE LYS B 29 -5.067 18.493 18.087 1.00 53.09 4INS 646 ATOM 413 NZ LYS B 29 -4.208 19.418 18.841 1.00 61.16 4INS 647 ATOM 414 N ALA B 30 -1.166 20.052 13.779 1.00 53.30 3 4INS 648 ATOM 415 CA ALA B 30 0.148 20.539 13.902 1.00 45.30 3 4INS 649 ATOM 416 C ALA B 30 0.991 20.467 15.167 1.00 50.30 3 4INS 650 ATOM 417 O ALA B 30 0.427 20.710 16.268 1.00 62.63 3 4INS 651 ATOM 418 CB ALA B 30 0.033 22.113 13.690 1.00 53.30 3 4INS 652 ATOM 419 OXT ALA B 30 2.226 20.205 15.000 1.00 76.30 3 4INS 653 TER 420 ALA B 30 4INS 654 ATOM 421 N GLY C 1 -0.643 19.956 -14.073 1.00 26.16 1 4INS 655 ATOM 422 CA GLY C 1 -0.389 20.033 -12.615 1.00 30.96 1 4INS 656 ATOM 423 C GLY C 1 0.447 18.825 -12.180 1.00 33.76 1 4INS 657 ATOM 424 O GLY C 1 1.216 18.311 -13.006 1.00 21.35 1 4INS 658 ATOM 425 N ILE C 2 0.244 18.434 -10.942 1.00 23.96 1 4INS 659 ATOM 426 CA ILE C 2 1.003 17.290 -10.393 1.00 15.36 1 4INS 660 ATOM 427 C ILE C 2 0.946 16.025 -11.185 1.00 13.59 1 4INS 661 ATOM 428 O ILE C 2 1.971 15.359 -11.278 1.00 17.19 1 4INS 662 ATOM 429 CB ILE C 2 0.491 17.013 -8.931 1.00 16.47 1 4INS 663 ATOM 430 CG1 ILE C 2 1.539 16.143 -8.164 1.00 15.91 1 4INS 664 ATOM 431 CG2 ILE C 2 -0.969 16.533 -8.863 1.00 17.06 1 4INS 665 ATOM 432 CD1 ILE C 2 1.081 15.828 -6.720 1.00 19.56 1 4INS 666 ATOM 433 N VAL C 3 -0.179 15.655 -11.786 1.00 13.55 1 4INS 667 ATOM 434 CA VAL C 3 -0.278 14.455 -12.591 1.00 17.58 1 4INS 668 ATOM 435 C VAL C 3 0.590 14.454 -13.881 1.00 21.18 1 4INS 669 ATOM 436 O VAL C 3 1.245 13.451 -14.197 1.00 19.26 1 4INS 670 ATOM 437 CB VAL C 3 -1.709 14.136 -12.915 1.00 26.49 1 4INS 671 ATOM 438 CG1 VAL C 3 -1.808 12.868 -13.745 1.00 30.71 1 4INS 672 ATOM 439 CG2 VAL C 3 -2.567 13.989 -11.662 1.00 16.85 1 4INS 673 ATOM 440 N GLU C 4 0.621 15.590 -14.497 1.00 24.23 1 4INS 674 ATOM 441 CA GLU C 4 1.481 15.743 -15.686 1.00 23.06 1 4INS 675 ATOM 442 C GLU C 4 2.966 15.744 -15.343 1.00 19.78 1 4INS 676 ATOM 443 O GLU C 4 3.805 15.198 -16.061 1.00 29.30 1 4INS 677 ATOM 444 CB GLU C 4 1.063 17.059 -16.361 1.00 24.43 1 4INS 678 ATOM 445 CG GLU C 4 -0.349 16.900 -16.964 1.00 19.87 1 4INS 679 ATOM 446 CD GLU C 4 -1.541 17.024 -16.030 1.00 27.93 1 4INS 680 ATOM 447 OE1 GLU C 4 -2.429 16.169 -16.211 1.00 37.08 1 4INS 681 ATOM 448 OE2 GLU C 4 -1.527 17.967 -15.181 1.00 27.92 1 4INS 682 ATOM 449 N GLN C 5 3.289 16.386 -14.236 1.00 17.90 1 4INS 683 ATOM 450 CA GLN C 5 4.695 16.445 -13.800 1.00 17.90 1 4INS 684 ATOM 451 C GLN C 5 5.206 15.104 -13.307 1.00 23.62 1 4INS 685 ATOM 452 O GLN C 5 6.331 14.684 -13.578 1.00 26.25 1 4INS 686 ATOM 453 CB GLN C 5 4.820 17.553 -12.780 1.00 22.64 1 4INS 687 ATOM 454 CG GLN C 5 4.373 18.969 -13.199 1.00 32.56 1 4INS 688 ATOM 455 CD GLN C 5 5.405 19.755 -12.404 1.00 59.85 1 4INS 689 ATOM 456 OE1 GLN C 5 6.478 19.979 -12.947 1.00 50.22 1 4INS 690 ATOM 457 NE2 GLN C 5 4.976 19.940 -11.148 1.00 56.46 1 4INS 691 ATOM 458 N CYS C 6 4.386 14.408 -12.514 1.00 20.45 4INS 692 ATOM 459 CA CYS C 6 4.949 13.166 -11.921 1.00 20.95 4INS 693 ATOM 460 C CYS C 6 4.472 11.875 -12.436 1.00 18.67 4INS 694 ATOM 461 O CYS C 6 5.127 10.851 -12.293 1.00 17.98 4INS 695 ATOM 462 CB CYS C 6 4.732 13.264 -10.354 1.00 16.76 4INS 696 ATOM 463 SG CYS C 6 5.416 14.719 -9.509 1.00 20.00 4INS 697 ATOM 464 N CYS C 7 3.347 11.802 -13.063 1.00 15.93 4INS 698 ATOM 465 CA CYS C 7 2.858 10.515 -13.612 1.00 10.31 4INS 699 ATOM 466 C CYS C 7 3.090 10.422 -15.112 1.00 27.34 4INS 700 ATOM 467 O CYS C 7 3.601 9.455 -15.603 1.00 24.77 4INS 701 ATOM 468 CB CYS C 7 1.348 10.332 -13.329 1.00 17.60 4INS 702 ATOM 469 SG CYS C 7 0.602 8.899 -13.976 1.00 19.30 4INS 703 ATOM 470 N THR C 8 2.691 11.395 -15.898 1.00 22.31 4INS 704 ATOM 471 CA THR C 8 2.912 11.356 -17.382 1.00 20.22 4INS 705 ATOM 472 C THR C 8 4.408 11.508 -17.641 1.00 29.24 4INS 706 ATOM 473 O THR C 8 5.051 10.716 -18.357 1.00 25.27 4INS 707 ATOM 474 CB THR C 8 1.993 12.487 -17.997 1.00 28.76 4INS 708 ATOM 475 OG1 THR C 8 0.590 12.071 -17.868 1.00 41.93 4INS 709 ATOM 476 CG2 THR C 8 2.536 12.795 -19.370 1.00 39.10 4INS 710 ATOM 477 N SER C 9 4.957 12.549 -16.969 1.00 23.04 4INS 711 ATOM 478 CA SER C 9 6.438 12.783 -17.031 1.00 23.81 4INS 712 ATOM 479 C SER C 9 7.038 12.104 -15.796 1.00 22.97 4INS 713 ATOM 480 O SER C 9 6.505 11.080 -15.351 1.00 28.36 4INS 714 ATOM 481 CB SER C 9 6.838 14.249 -17.258 1.00 22.96 4INS 715 ATOM 482 OG SER C 9 8.266 14.523 -17.319 1.00 30.96 4INS 716 ATOM 483 N ILE C 10 8.157 12.532 -15.274 1.00 18.48 4INS 717 ATOM 484 CA ILE C 10 8.820 12.068 -14.116 1.00 14.18 4INS 718 ATOM 485 C ILE C 10 9.162 13.268 -13.217 1.00 22.06 4INS 719 ATOM 486 O ILE C 10 9.398 14.336 -13.807 1.00 21.37 4INS 720 ATOM 487 CB ILE C 10 10.082 11.219 -14.296 1.00 14.27 4INS 721 ATOM 488 CG1 ILE C 10 11.168 12.058 -14.941 1.00 17.05 4INS 722 ATOM 489 CG2 ILE C 10 9.771 9.901 -15.075 1.00 23.12 4INS 723 ATOM 490 CD1 ILE C 10 12.447 11.250 -15.181 1.00 28.86 4INS 724 ATOM 491 N CYS C 11 9.158 13.001 -11.897 1.00 17.73 4INS 725 ATOM 492 CA CYS C 11 9.488 14.178 -11.063 1.00 13.63 4INS 726 ATOM 493 C CYS C 11 10.301 13.733 -9.869 1.00 24.12 4INS 727 ATOM 494 O CYS C 11 10.238 12.518 -9.595 1.00 27.63 4INS 728 ATOM 495 CB CYS C 11 8.284 14.934 -10.501 1.00 24.47 4INS 729 ATOM 496 SG CYS C 11 7.324 13.971 -9.301 1.00 22.60 4INS 730 ATOM 497 N SER C 12 10.941 14.682 -9.241 1.00 20.64 4INS 731 ATOM 498 CA SER C 12 11.739 14.434 -8.095 1.00 19.89 4INS 732 ATOM 499 C SER C 12 10.978 14.612 -6.784 1.00 26.49 4INS 733 ATOM 500 O SER C 12 9.925 15.241 -6.843 1.00 17.94 4INS 734 ATOM 501 CB SER C 12 12.896 15.478 -7.911 1.00 22.13 4INS 735 ATOM 502 OG SER C 12 12.280 16.737 -7.889 1.00 25.55 4INS 736 ATOM 503 N LEU C 13 11.522 14.165 -5.654 1.00 20.92 4INS 737 ATOM 504 CA LEU C 13 10.827 14.392 -4.422 1.00 18.59 4INS 738 ATOM 505 C LEU C 13 10.811 15.860 -4.099 1.00 17.62 4INS 739 ATOM 506 O LEU C 13 9.865 16.311 -3.427 1.00 17.56 4INS 740 ATOM 507 CB LEU C 13 11.451 13.616 -3.261 1.00 24.54 4INS 741 ATOM 508 CG LEU C 13 11.620 12.137 -3.475 1.00 37.60 4INS 742 ATOM 509 CD1 LEU C 13 12.386 11.586 -2.273 1.00 42.94 4INS 743 ATOM 510 CD2 LEU C 13 10.209 11.562 -3.628 1.00 33.13 4INS 744 ATOM 511 N TYR C 14 11.756 16.642 -4.538 1.00 19.39 4INS 745 ATOM 512 CA TYR C 14 11.756 18.053 -4.253 1.00 15.81 4INS 746 ATOM 513 C TYR C 14 10.632 18.665 -4.977 1.00 16.49 4INS 747 ATOM 514 O TYR C 14 10.098 19.673 -4.517 1.00 24.31 4INS 748 ATOM 515 CB TYR C 14 13.061 18.792 -4.698 1.00 23.42 4INS 749 ATOM 516 CG TYR C 14 14.244 18.334 -3.884 1.00 22.68 4INS 750 ATOM 517 CD1 TYR C 14 14.406 18.926 -2.643 1.00 37.43 4INS 751 ATOM 518 CD2 TYR C 14 15.065 17.294 -4.321 1.00 44.52 4INS 752 ATOM 519 CE1 TYR C 14 15.469 18.455 -1.806 1.00 35.18 4INS 753 ATOM 520 CE2 TYR C 14 16.138 16.837 -3.558 1.00 39.13 4INS 754 ATOM 521 CZ TYR C 14 16.305 17.440 -2.304 1.00 43.24 4INS 755 ATOM 522 OH TYR C 14 17.325 17.067 -1.472 1.00 40.09 4INS 756 ATOM 523 N GLN C 15 10.286 18.189 -6.156 1.00 16.44 4INS 757 ATOM 524 CA GLN C 15 9.175 18.706 -6.908 1.00 13.87 4INS 758 ATOM 525 C GLN C 15 7.940 18.402 -6.108 1.00 16.45 4INS 759 ATOM 526 O GLN C 15 7.042 19.228 -6.047 1.00 17.74 4INS 760 ATOM 527 CB GLN C 15 9.021 18.202 -8.378 1.00 19.83 4INS 761 ATOM 528 CG GLN C 15 10.045 18.695 -9.368 1.00 27.50 4INS 762 ATOM 529 CD GLN C 15 10.002 18.165 -10.771 1.00 46.46 4INS 763 ATOM 530 OE1 GLN C 15 10.459 17.057 -11.040 1.00 43.32 4INS 764 ATOM 531 NE2 GLN C 15 9.456 18.889 -11.761 1.00 35.38 4INS 765 ATOM 532 N LEU C 16 7.841 17.245 -5.491 1.00 18.47 4INS 766 ATOM 533 CA LEU C 16 6.580 16.984 -4.783 1.00 17.18 4INS 767 ATOM 534 C LEU C 16 6.311 17.904 -3.587 1.00 21.36 4INS 768 ATOM 535 O LEU C 16 5.195 18.069 -3.079 1.00 17.34 4INS 769 ATOM 536 CB LEU C 16 6.542 15.527 -4.227 1.00 17.15 4INS 770 ATOM 537 CG LEU C 16 6.500 14.520 -5.341 1.00 17.53 4INS 771 ATOM 538 CD1 LEU C 16 6.477 13.227 -4.593 1.00 22.82 4INS 772 ATOM 539 CD2 LEU C 16 5.117 14.493 -5.991 1.00 18.33 4INS 773 ATOM 540 N GLU C 17 7.389 18.427 -3.040 1.00 16.47 4INS 774 ATOM 541 CA GLU C 17 7.353 19.319 -1.959 1.00 10.93 4INS 775 ATOM 542 C GLU C 17 6.614 20.601 -2.282 1.00 11.20 4INS 776 ATOM 543 O GLU C 17 6.183 21.310 -1.386 1.00 13.69 4INS 777 ATOM 544 CB GLU C 17 8.751 19.800 -1.584 1.00 16.99 4INS 778 ATOM 545 CG GLU C 17 9.178 18.980 -0.408 1.00 22.69 4INS 779 ATOM 546 CD GLU C 17 10.397 19.524 0.269 1.00 26.38 4INS 780 ATOM 547 OE1 GLU C 17 11.270 20.013 -0.342 1.00 26.42 4INS 781 ATOM 548 OE2 GLU C 17 10.358 19.291 1.470 1.00 30.68 4INS 782 ATOM 549 N ASN C 18 6.466 20.844 -3.575 1.00 13.42 4INS 783 ATOM 550 CA ASN C 18 5.707 22.010 -4.006 1.00 12.91 4INS 784 ATOM 551 C ASN C 18 4.238 21.879 -3.683 1.00 14.96 4INS 785 ATOM 552 O ASN C 18 3.506 22.887 -3.698 1.00 17.72 4INS 786 ATOM 553 CB ASN C 18 5.894 22.279 -5.506 1.00 16.62 4INS 787 ATOM 554 CG ASN C 18 7.286 22.755 -5.884 1.00 20.64 4INS 788 ATOM 555 OD1 ASN C 18 7.761 22.375 -6.927 1.00 28.41 4INS 789 ATOM 556 ND2 ASN C 18 7.836 23.540 -4.999 1.00 26.53 4INS 790 ATOM 557 N TYR C 19 3.683 20.717 -3.420 1.00 10.42 4INS 791 ATOM 558 CA TYR C 19 2.315 20.489 -3.110 1.00 11.44 4INS 792 ATOM 559 C TYR C 19 2.035 20.284 -1.641 1.00 19.22 4INS 793 ATOM 560 O TYR C 19 0.884 20.008 -1.330 1.00 14.52 4INS 794 ATOM 561 CB TYR C 19 1.745 19.342 -3.938 1.00 13.89 4INS 795 ATOM 562 CG TYR C 19 1.995 19.579 -5.394 1.00 13.15 4INS 796 ATOM 563 CD1 TYR C 19 1.176 20.360 -6.185 1.00 15.85 4INS 797 ATOM 564 CD2 TYR C 19 3.101 19.022 -6.004 1.00 20.18 4INS 798 ATOM 565 CE1 TYR C 19 1.482 20.590 -7.526 1.00 15.80 4INS 799 ATOM 566 CE2 TYR C 19 3.427 19.257 -7.342 1.00 20.94 4INS 800 ATOM 567 CZ TYR C 19 2.600 20.077 -8.111 1.00 16.07 4INS 801 ATOM 568 OH TYR C 19 2.930 20.198 -9.438 1.00 28.20 4INS 802 ATOM 569 N CYS C 20 2.997 20.523 -0.779 1.00 15.85 4INS 803 ATOM 570 CA CYS C 20 2.816 20.515 0.660 1.00 12.75 4INS 804 ATOM 571 C CYS C 20 2.167 21.848 1.080 1.00 18.29 4INS 805 ATOM 572 O CYS C 20 2.424 22.842 0.449 1.00 26.63 4INS 806 ATOM 573 CB CYS C 20 4.116 20.329 1.465 1.00 12.02 4INS 807 ATOM 574 SG CYS C 20 5.109 18.925 1.079 1.00 13.70 4INS 808 ATOM 575 N ASN C 21 1.396 21.899 2.168 1.00 17.14 4INS 809 ATOM 576 CA ASN C 21 0.814 23.152 2.677 1.00 22.18 4INS 810 ATOM 577 C ASN C 21 1.879 23.650 3.681 1.00 31.46 4INS 811 ATOM 578 O ASN C 21 2.937 22.991 3.836 1.00 44.77 4INS 812 ATOM 579 CB ASN C 21 -0.433 22.757 3.387 1.00 21.67 4INS 813 ATOM 580 CG ASN C 21 -1.636 22.166 2.742 1.00 29.17 4INS 814 ATOM 581 OD1 ASN C 21 -2.062 22.468 1.647 1.00 33.63 4INS 815 ATOM 582 ND2 ASN C 21 -2.242 21.277 3.591 1.00 33.21 4INS 816 ATOM 583 OXT ASN C 21 1.575 24.585 4.398 1.00 52.38 4INS 817 TER 584 ASN C 21 4INS 818 ATOM 585 N PHE D 1 18.330 11.816 -3.893 1.00 61.50 4INS 819 ATOM 586 CA PHE D 1 17.047 11.272 -4.371 1.00 28.75 4INS 820 ATOM 587 C PHE D 1 17.165 10.885 -5.854 1.00 45.77 4INS 821 ATOM 588 O PHE D 1 18.169 11.137 -6.550 1.00 49.85 4INS 822 ATOM 589 CB PHE D 1 15.801 12.158 -4.041 1.00 30.01 4INS 823 ATOM 590 CG PHE D 1 16.035 12.424 -2.571 1.00 31.74 4INS 824 ATOM 591 CD1 PHE D 1 15.980 11.294 -1.745 1.00 39.79 4INS 825 ATOM 592 CD2 PHE D 1 16.425 13.629 -2.070 1.00 31.26 4INS 826 ATOM 593 CE1 PHE D 1 16.219 11.375 -0.405 1.00 31.66 4INS 827 ATOM 594 CE2 PHE D 1 16.706 13.719 -0.715 1.00 53.74 4INS 828 ATOM 595 CZ PHE D 1 16.609 12.612 0.115 1.00 37.15 4INS 829 ATOM 596 N VAL D 2 16.117 10.168 -6.274 1.00 33.71 4INS 830 ATOM 597 CA VAL D 2 16.006 9.666 -7.682 1.00 24.16 4INS 831 ATOM 598 C VAL D 2 14.648 10.218 -8.239 1.00 33.79 4INS 832 ATOM 599 O VAL D 2 13.733 10.588 -7.495 1.00 22.26 4INS 833 ATOM 600 CB VAL D 2 16.128 8.144 -7.911 1.00 27.80 4INS 834 ATOM 601 CG1 VAL D 2 17.529 7.562 -7.875 1.00 85.81 4INS 835 ATOM 602 CG2 VAL D 2 15.239 7.326 -6.976 1.00 36.43 4INS 836 ATOM 603 N ASN D 3 14.564 10.315 -9.558 1.00 19.91 4INS 837 ATOM 604 CA ASN D 3 13.383 10.694 -10.332 1.00 33.51 4INS 838 ATOM 605 C ASN D 3 12.449 9.525 -10.618 1.00 27.19 4INS 839 ATOM 606 O ASN D 3 12.946 8.479 -11.058 1.00 35.28 4INS 840 ATOM 607 CB ASN D 3 13.966 11.427 -11.571 1.00 28.03 4INS 841 ATOM 608 CG ASN D 3 14.214 12.869 -11.102 1.00 36.72 4INS 842 ATOM 609 OD1 ASN D 3 14.425 13.813 -11.829 1.00 71.83 4INS 843 ATOM 610 ND2 ASN D 3 14.114 13.118 -9.791 1.00 69.95 4INS 844 ATOM 611 N GLN D 4 11.128 9.652 -10.488 1.00 38.71 4INS 845 ATOM 612 CA GLN D 4 10.224 8.523 -10.782 1.00 30.37 4INS 846 ATOM 613 C GLN D 4 8.833 8.864 -11.345 1.00 13.92 4INS 847 ATOM 614 O GLN D 4 8.361 10.028 -11.197 1.00 25.56 4INS 848 ATOM 615 CB GLN D 4 9.983 7.921 -9.378 1.00 38.84 4INS 849 ATOM 616 CG GLN D 4 10.350 6.429 -9.194 1.00 40.71 4INS 850 ATOM 617 CD GLN D 4 10.515 6.248 -7.678 1.00 31.29 4INS 851 ATOM 618 OE1 GLN D 4 10.490 5.138 -7.268 1.00 47.62 4INS 852 ATOM 619 NE2 GLN D 4 10.697 7.383 -6.997 1.00 30.17 4INS 853 ATOM 620 N HIS D 5 8.291 7.803 -12.000 1.00 13.87 1 4INS 854 ATOM 621 CA HIS D 5 6.903 7.919 -12.482 1.00 16.22 1 4INS 855 ATOM 622 C HIS D 5 6.029 7.528 -11.252 1.00 16.61 1 4INS 856 ATOM 623 O HIS D 5 6.115 6.355 -10.822 1.00 21.77 1 4INS 857 ATOM 624 CB HIS D 5 6.427 7.086 -13.663 1.00 24.93 1 4INS 858 ATOM 625 CG HIS D 5 6.855 7.450 -15.054 1.00 32.91 1 4INS 859 ATOM 626 ND1 HIS D 5 6.285 8.338 -15.876 1.00 31.86 1 4INS 860 ATOM 627 CD2 HIS D 5 7.867 6.966 -15.822 1.00 31.55 1 4INS 861 ATOM 628 CE1 HIS D 5 6.866 8.458 -17.068 1.00 28.50 1 4INS 862 ATOM 629 NE2 HIS D 5 7.838 7.587 -17.015 1.00 18.29 1 4INS 863 ATOM 630 N LEU D 6 5.259 8.452 -10.792 1.00 11.23 4INS 864 ATOM 631 CA LEU D 6 4.302 8.232 -9.639 1.00 22.97 4INS 865 ATOM 632 C LEU D 6 2.854 8.566 -10.048 1.00 11.62 4INS 866 ATOM 633 O LEU D 6 2.505 9.705 -10.335 1.00 14.32 4INS 867 ATOM 634 CB LEU D 6 4.815 9.069 -8.489 1.00 16.96 4INS 868 ATOM 635 CG LEU D 6 6.253 8.828 -7.985 1.00 18.92 4INS 869 ATOM 636 CD1 LEU D 6 6.828 10.000 -7.271 1.00 17.11 4INS 870 ATOM 637 CD2 LEU D 6 6.091 7.594 -7.091 1.00 18.40 4INS 871 ATOM 638 N CYS D 7 2.119 7.495 -10.108 1.00 13.70 4INS 872 ATOM 639 CA CYS D 7 0.745 7.570 -10.582 1.00 18.64 4INS 873 ATOM 640 C CYS D 7 -0.288 7.058 -9.564 1.00 17.90 4INS 874 ATOM 641 O CYS D 7 0.016 6.138 -8.853 1.00 18.63 4INS 875 ATOM 642 CB CYS D 7 0.607 6.723 -11.869 1.00 31.44 4INS 876 ATOM 643 SG CYS D 7 1.635 7.350 -13.232 1.00 20.00 4INS 877 ATOM 644 N GLY D 8 -1.440 7.618 -9.644 1.00 19.94 4INS 878 ATOM 645 CA GLY D 8 -2.580 7.155 -8.776 1.00 18.12 4INS 879 ATOM 646 C GLY D 8 -2.305 7.237 -7.329 1.00 8.63 4INS 880 ATOM 647 O GLY D 8 -1.914 8.246 -6.763 1.00 13.74 4INS 881 ATOM 648 N SER D 9 -2.656 6.101 -6.694 1.00 11.65 4INS 882 ATOM 649 CA SER D 9 -2.483 5.997 -5.227 1.00 12.39 4INS 883 ATOM 650 C SER D 9 -1.032 6.120 -4.867 1.00 8.86 4INS 884 ATOM 651 O SER D 9 -0.760 6.584 -3.762 1.00 9.84 4INS 885 ATOM 652 CB SER D 9 -3.264 4.870 -4.568 1.00 14.54 4INS 886 ATOM 653 OG SER D 9 -2.756 3.670 -5.015 1.00 21.40 4INS 887 ATOM 654 N HIS D 10 -0.166 5.698 -5.800 1.00 8.91 4INS 888 ATOM 655 CA HIS D 10 1.270 5.805 -5.452 1.00 9.09 4INS 889 ATOM 656 C HIS D 10 1.755 7.227 -5.317 1.00 7.69 4INS 890 ATOM 657 O HIS D 10 2.658 7.481 -4.533 1.00 11.42 4INS 891 ATOM 658 CB HIS D 10 2.092 5.048 -6.482 1.00 8.95 4INS 892 ATOM 659 CG HIS D 10 1.707 3.599 -6.615 1.00 8.78 4INS 893 ATOM 660 ND1 HIS D 10 1.951 2.701 -5.608 1.00 13.99 4INS 894 ATOM 661 CD2 HIS D 10 1.059 2.922 -7.561 1.00 11.16 4INS 895 ATOM 662 CE1 HIS D 10 1.536 1.530 -6.025 1.00 8.79 4INS 896 ATOM 663 NE2 HIS D 10 0.948 1.628 -7.159 1.00 11.60 4INS 897 ATOM 664 N LEU D 11 1.142 8.109 -6.070 1.00 9.45 4INS 898 ATOM 665 CA LEU D 11 1.434 9.541 -6.053 1.00 9.98 4INS 899 ATOM 666 C LEU D 11 1.027 10.155 -4.729 1.00 5.91 4INS 900 ATOM 667 O LEU D 11 1.818 10.853 -4.084 1.00 8.83 4INS 901 ATOM 668 CB LEU D 11 0.815 10.196 -7.249 1.00 10.51 4INS 902 ATOM 669 CG LEU D 11 1.105 11.705 -7.294 1.00 13.37 4INS 903 ATOM 670 CD1 LEU D 11 2.526 12.118 -7.270 1.00 11.72 4INS 904 ATOM 671 CD2 LEU D 11 0.404 12.225 -8.564 1.00 16.22 4INS 905 ATOM 672 N VAL D 12 -0.188 9.816 -4.302 1.00 6.52 4INS 906 ATOM 673 CA VAL D 12 -0.534 10.395 -2.938 1.00 6.95 4INS 907 ATOM 674 C VAL D 12 0.207 9.758 -1.787 1.00 5.55 4INS 908 ATOM 675 O VAL D 12 0.467 10.475 -0.761 1.00 8.60 4INS 909 ATOM 676 CB VAL D 12 -2.065 10.355 -2.790 1.00 14.07 4INS 910 ATOM 677 CG1 VAL D 12 -2.687 11.271 -3.899 1.00 16.64 4INS 911 ATOM 678 CG2 VAL D 12 -2.636 9.010 -2.737 1.00 14.03 4INS 912 ATOM 679 N GLU D 13 0.681 8.537 -1.890 1.00 8.61 4INS 913 ATOM 680 CA GLU D 13 1.509 7.903 -0.866 1.00 7.25 4INS 914 ATOM 681 C GLU D 13 2.815 8.631 -0.804 1.00 7.02 4INS 915 ATOM 682 O GLU D 13 3.403 8.915 0.274 1.00 11.89 4INS 916 ATOM 683 CB GLU D 13 1.770 6.435 -1.051 1.00 11.84 4INS 917 ATOM 684 CG GLU D 13 0.458 5.634 -0.816 1.00 27.71 4INS 918 ATOM 685 CD GLU D 13 0.536 4.937 0.492 1.00 62.15 4INS 919 ATOM 686 OE1 GLU D 13 1.499 5.094 1.172 1.00 28.12 4INS 920 ATOM 687 OE2 GLU D 13 -0.429 4.258 0.726 1.00 32.97 4INS 921 ATOM 688 N ALA D 14 3.390 9.046 -1.888 1.00 9.58 4INS 922 ATOM 689 CA ALA D 14 4.643 9.836 -1.985 1.00 10.00 4INS 923 ATOM 690 C ALA D 14 4.495 11.218 -1.377 1.00 10.02 4INS 924 ATOM 691 O ALA D 14 5.373 11.718 -0.675 1.00 12.34 4INS 925 ATOM 692 CB ALA D 14 5.151 9.884 -3.366 1.00 9.23 4INS 926 ATOM 693 N LEU D 15 3.340 11.836 -1.609 1.00 8.93 4INS 927 ATOM 694 CA LEU D 15 3.014 13.121 -1.053 1.00 9.97 4INS 928 ATOM 695 C LEU D 15 2.968 13.020 0.450 1.00 16.23 4INS 929 ATOM 696 O LEU D 15 3.462 13.914 1.142 1.00 11.63 4INS 930 ATOM 697 CB LEU D 15 1.719 13.654 -1.641 1.00 9.29 4INS 931 ATOM 698 CG LEU D 15 1.771 14.340 -2.979 1.00 10.49 4INS 932 ATOM 699 CD1 LEU D 15 0.398 14.483 -3.556 1.00 12.99 4INS 933 ATOM 700 CD2 LEU D 15 2.487 15.663 -2.804 1.00 15.87 4INS 934 ATOM 701 N TYR D 16 2.313 11.974 0.938 1.00 11.90 4INS 935 ATOM 702 CA TYR D 16 2.254 11.791 2.374 1.00 8.84 4INS 936 ATOM 703 C TYR D 16 3.662 11.710 3.013 1.00 11.08 4INS 937 ATOM 704 O TYR D 16 3.925 12.338 4.014 1.00 10.74 4INS 938 ATOM 705 CB TYR D 16 1.409 10.545 2.657 1.00 8.68 4INS 939 ATOM 706 CG TYR D 16 1.408 10.201 4.150 1.00 9.93 4INS 940 ATOM 707 CD1 TYR D 16 0.611 10.879 5.091 1.00 13.27 4INS 941 ATOM 708 CD2 TYR D 16 2.232 9.163 4.535 1.00 10.34 4INS 942 ATOM 709 CE1 TYR D 16 0.657 10.554 6.429 1.00 11.61 4INS 943 ATOM 710 CE2 TYR D 16 2.284 8.846 5.894 1.00 17.86 4INS 944 ATOM 711 CZ TYR D 16 1.518 9.554 6.843 1.00 13.23 4INS 945 ATOM 712 OH TYR D 16 1.664 9.081 8.177 1.00 17.80 4INS 946 ATOM 713 N LEU D 17 4.478 10.910 2.349 1.00 9.51 4INS 947 ATOM 714 CA LEU D 17 5.832 10.719 2.819 1.00 8.94 4INS 948 ATOM 715 C LEU D 17 6.672 11.993 2.879 1.00 12.51 4INS 949 ATOM 716 O LEU D 17 7.395 12.298 3.853 1.00 13.68 4INS 950 ATOM 717 CB LEU D 17 6.573 9.683 1.932 1.00 12.01 4INS 951 ATOM 718 CG LEU D 17 7.784 9.141 2.606 1.00 26.75 4INS 952 ATOM 719 CD1 LEU D 17 7.274 8.084 3.613 1.00 27.77 4INS 953 ATOM 720 CD2 LEU D 17 8.533 8.579 1.435 1.00 36.25 4INS 954 ATOM 721 N VAL D 18 6.585 12.773 1.784 1.00 10.21 4INS 955 ATOM 722 CA VAL D 18 7.348 14.029 1.661 1.00 8.25 4INS 956 ATOM 723 C VAL D 18 6.789 15.099 2.514 1.00 8.01 4INS 957 ATOM 724 O VAL D 18 7.560 15.914 3.063 1.00 14.17 4INS 958 ATOM 725 CB VAL D 18 7.357 14.409 0.176 1.00 8.24 4INS 959 ATOM 726 CG1 VAL D 18 7.683 15.903 0.006 1.00 18.17 4INS 960 ATOM 727 CG2 VAL D 18 8.321 13.582 -0.638 1.00 16.22 4INS 961 ATOM 728 N CYS D 19 5.469 15.224 2.565 1.00 8.80 4INS 962 ATOM 729 CA CYS D 19 4.790 16.327 3.282 1.00 10.89 4INS 963 ATOM 730 C CYS D 19 4.550 16.076 4.760 1.00 20.41 4INS 964 ATOM 731 O CYS D 19 4.771 17.057 5.513 1.00 17.13 4INS 965 ATOM 732 CB CYS D 19 3.540 16.778 2.546 1.00 11.71 4INS 966 ATOM 733 SG CYS D 19 3.846 17.363 0.909 1.00 11.30 4INS 967 ATOM 734 N GLY D 20 4.108 14.860 5.076 1.00 15.31 4INS 968 ATOM 735 CA GLY D 20 3.841 14.553 6.475 1.00 18.10 4INS 969 ATOM 736 C GLY D 20 2.815 15.479 7.177 1.00 19.19 4INS 970 ATOM 737 O GLY D 20 1.669 15.721 6.770 1.00 18.72 4INS 971 ATOM 738 N GLU D 21 3.387 15.976 8.278 1.00 20.01 4INS 972 ATOM 739 CA GLU D 21 2.659 16.847 9.244 1.00 23.69 4INS 973 ATOM 740 C GLU D 21 2.237 18.138 8.636 1.00 19.09 4INS 974 ATOM 741 O GLU D 21 1.246 18.727 9.109 1.00 24.03 4INS 975 ATOM 742 CB GLU D 21 3.575 17.120 10.476 1.00 22.76 4INS 976 ATOM 743 CG GLU D 21 5.075 17.192 10.046 1.00 53.97 4INS 977 ATOM 744 CD GLU D 21 6.099 17.832 10.938 1.00 78.86 4INS 978 ATOM 745 OE1 GLU D 21 5.775 18.563 11.863 1.00 73.07 4INS 979 ATOM 746 OE2 GLU D 21 7.300 17.568 10.645 1.00 72.74 4INS 980 ATOM 747 N ARG D 22 2.952 18.555 7.566 1.00 15.75 2 4INS 981 ATOM 748 CA ARG D 22 2.552 19.835 6.996 1.00 21.02 2 4INS 982 ATOM 749 C ARG D 22 1.231 19.779 6.228 1.00 30.79 2 4INS 983 ATOM 750 O ARG D 22 0.558 20.740 5.955 1.00 22.02 2 4INS 984 ATOM 751 CB ARG D 22 3.613 20.247 5.973 1.00 29.63 2 4INS 985 ATOM 752 CG ARG D 22 5.024 20.325 6.450 1.00 16.81 2 4INS 986 ATOM 753 CD ARG D 22 5.952 20.706 5.309 1.00 32.57 2 4INS 987 ATOM 754 NE AARG D 22 5.584 21.912 4.554 0.50 23.88 2 4INS 988 ATOM 755 NE BARG D 22 6.663 19.518 4.827 0.50 24.77 2 4INS 989 ATOM 756 CZ AARG D 22 6.163 22.431 3.476 0.50 34.85 2 4INS 990 ATOM 757 CZ BARG D 22 7.482 19.684 3.777 0.50 11.98 2 4INS 991 ATOM 758 NH1AARG D 22 5.819 23.547 2.845 0.50 18.26 2 4INS 992 ATOM 759 NH1BARG D 22 7.547 20.848 3.124 0.50 20.33 2 4INS 993 ATOM 760 NH2AARG D 22 7.190 21.770 2.930 0.50 20.80 2 4INS 994 ATOM 761 NH2BARG D 22 8.196 18.646 3.318 0.50 20.38 2 4INS 995 ATOM 762 N GLY D 23 0.914 18.555 5.836 1.00 17.93 4INS 996 ATOM 763 CA GLY D 23 -0.237 18.302 4.993 1.00 12.82 4INS 997 ATOM 764 C GLY D 23 0.087 18.615 3.514 1.00 11.10 4INS 998 ATOM 765 O GLY D 23 1.137 19.102 3.198 1.00 12.49 4INS 999 ATOM 766 N PHE D 24 -0.903 18.290 2.672 1.00 11.76 4INS1000 ATOM 767 CA PHE D 24 -0.774 18.497 1.209 1.00 10.21 4INS1001 ATOM 768 C PHE D 24 -2.127 18.688 0.607 1.00 9.65 4INS1002 ATOM 769 O PHE D 24 -3.142 18.470 1.204 1.00 12.03 4INS1003 ATOM 770 CB PHE D 24 0.000 17.400 0.578 1.00 9.41 4INS1004 ATOM 771 CG PHE D 24 -0.602 16.046 0.597 1.00 9.89 4INS1005 ATOM 772 CD1 PHE D 24 -0.280 15.182 1.648 1.00 12.55 4INS1006 ATOM 773 CD2 PHE D 24 -1.497 15.657 -0.387 1.00 12.14 4INS1007 ATOM 774 CE1 PHE D 24 -0.863 13.901 1.714 1.00 19.03 4INS1008 ATOM 775 CE2 PHE D 24 -2.049 14.388 -0.368 1.00 12.53 4INS1009 ATOM 776 CZ PHE D 24 -1.737 13.486 0.692 1.00 14.23 4INS1010 ATOM 777 N PHE D 25 -2.070 19.069 -0.693 1.00 8.89 1 4INS1011 ATOM 778 CA PHE D 25 -3.285 19.185 -1.469 1.00 10.03 1 4INS1012 ATOM 779 C PHE D 25 -3.021 18.326 -2.724 1.00 9.84 1 4INS1013 ATOM 780 O PHE D 25 -1.918 18.362 -3.216 1.00 12.46 1 4INS1014 ATOM 781 CB PHE D 25 -3.686 20.613 -1.925 1.00 10.32 1 4INS1015 ATOM 782 CG PHE D 25 -2.567 21.455 -2.479 1.00 14.41 1 4INS1016 ATOM 783 CD1 PHE D 25 -2.435 21.546 -3.850 1.00 20.47 1 4INS1017 ATOM 784 CD2 PHE D 25 -1.647 22.070 -1.651 1.00 14.83 1 4INS1018 ATOM 785 CE1 PHE D 25 -1.470 22.321 -4.476 1.00 13.89 1 4INS1019 ATOM 786 CE2 PHE D 25 -0.608 22.775 -2.271 1.00 20.12 1 4INS1020 ATOM 787 CZ PHE D 25 -0.558 22.880 -3.660 1.00 13.72 1 4INS1021 ATOM 788 N TYR D 26 -3.962 17.546 -3.192 1.00 10.77 4INS1022 ATOM 789 CA TYR D 26 -3.915 16.723 -4.366 1.00 8.24 4INS1023 ATOM 790 C TYR D 26 -5.013 17.222 -5.272 1.00 11.68 4INS1024 ATOM 791 O TYR D 26 -6.209 17.040 -5.011 1.00 12.49 4INS1025 ATOM 792 CB TYR D 26 -4.090 15.233 -4.010 1.00 12.91 4INS1026 ATOM 793 CG TYR D 26 -4.159 14.291 -5.196 1.00 13.37 4INS1027 ATOM 794 CD1 TYR D 26 -5.379 13.599 -5.455 1.00 12.94 4INS1028 ATOM 795 CD2 TYR D 26 -3.138 14.227 -6.110 1.00 12.82 4INS1029 ATOM 796 CE1 TYR D 26 -5.491 12.770 -6.582 1.00 18.45 4INS1030 ATOM 797 CE2 TYR D 26 -3.289 13.401 -7.216 1.00 14.97 4INS1031 ATOM 798 CZ TYR D 26 -4.390 12.679 -7.390 1.00 16.87 4INS1032 ATOM 799 OH TYR D 26 -4.411 11.849 -8.508 1.00 19.99 4INS1033 ATOM 800 N THR D 27 -4.639 17.933 -6.342 1.00 10.07 4INS1034 ATOM 801 CA THR D 27 -5.563 18.555 -7.264 1.00 15.24 4INS1035 ATOM 802 C THR D 27 -5.254 18.120 -8.704 1.00 16.10 4INS1036 ATOM 803 O THR D 27 -4.545 18.821 -9.404 1.00 18.07 4INS1037 ATOM 804 CB THR D 27 -5.536 20.114 -7.048 1.00 16.40 4INS1038 ATOM 805 OG1 THR D 27 -4.178 20.585 -6.974 1.00 19.93 4INS1039 ATOM 806 CG2 THR D 27 -6.181 20.408 -5.709 1.00 16.74 4INS1040 ATOM 807 N PRO D 28 -5.766 17.035 -9.149 1.00 11.98 4INS1041 ATOM 808 CA PRO D 28 -5.571 16.537 -10.477 1.00 13.55 4INS1042 ATOM 809 C PRO D 28 -6.105 17.452 -11.585 1.00 21.64 4INS1043 ATOM 810 O PRO D 28 -5.471 17.453 -12.635 1.00 24.41 4INS1044 ATOM 811 CB PRO D 28 -6.192 15.163 -10.479 1.00 21.77 4INS1045 ATOM 812 CG PRO D 28 -6.813 14.874 -9.135 1.00 18.60 4INS1046 ATOM 813 CD PRO D 28 -6.687 16.109 -8.343 1.00 11.54 4INS1047 ATOM 814 N LYS D 29 -7.103 18.249 -11.346 1.00 18.85 2 4INS1048 ATOM 815 CA LYS D 29 -7.647 19.148 -12.397 1.00 21.86 2 4INS1049 ATOM 816 C LYS D 29 -6.782 20.313 -12.719 1.00 25.32 2 4INS1050 ATOM 817 O LYS D 29 -6.944 20.988 -13.739 1.00 28.67 2 4INS1051 ATOM 818 CB LYS D 29 -9.020 19.689 -11.971 1.00 37.73 2 4INS1052 ATOM 819 CG ALYS D 29 -10.118 18.678 -12.365 0.50 26.24 2 4INS1053 ATOM 820 CG BLYS D 29 -9.869 20.535 -12.933 0.50 51.60 2 4INS1054 ATOM 821 CD ALYS D 29 -11.261 18.659 -11.369 0.50 25.69 2 4INS1055 ATOM 822 CD BLYS D 29 -11.094 21.211 -12.318 0.50 26.73 2 4INS1056 ATOM 823 CE ALYS D 29 -12.315 17.615 -11.670 0.50 22.42 2 4INS1057 ATOM 824 CE BLYS D 29 -12.076 21.723 -13.345 0.50 41.26 2 4INS1058 ATOM 825 NZ ALYS D 29 -13.648 18.108 -11.182 0.50 39.07 2 4INS1059 ATOM 826 NZ BLYS D 29 -13.280 22.348 -12.731 0.50 38.89 2 4INS1060 ATOM 827 N ALA D 30 -5.874 20.552 -11.809 1.00 17.54 4INS1061 ATOM 828 CA ALA D 30 -5.022 21.709 -11.876 1.00 15.58 4INS1062 ATOM 829 C ALA D 30 -3.942 21.534 -12.910 1.00 35.26 4INS1063 ATOM 830 O ALA D 30 -3.347 20.451 -13.025 1.00 37.09 4INS1064 ATOM 831 CB ALA D 30 -4.392 21.978 -10.527 1.00 32.86 4INS1065 ATOM 832 OXT ALA D 30 -3.822 22.597 -13.538 1.00 43.22 4INS1066 TER 833 ALA D 30 4INS1067 HETATM 834 ZN ZN 1 -0.002 -0.004 7.891 0.33 10.40 4INS1068 HETATM 835 ZN ZN 2 0.000 0.000 -8.039 0.33 11.00 4INS1069 HETATM 836 O HOH 18 1.208 0.917 -0.239 1.00 44.11 4INSB 5 HETATM 837 O HOH 19 26.674 0.029 0.118 1.00 64.26 4INSB 6 HETATM 838 O HOH 11 13.443 19.181 0.629 1.00 37.18 4INSB 7 HETATM 839 O HOH 12 8.897 22.662 0.833 0.50 72.59 4INSB 8 HETATM 840 O HOH 13 5.430 4.632 0.353 0.50 68.27 4INSB 9 HETATM 841 O HOH 14 -9.600 22.800 0.340 1.00 86.30 4INSB 10 HETATM 842 O HOH 21 -11.312 20.399 0.771 1.00 76.27 4INSB 11 HETATM 843 O HOH 22 10.779 23.846 1.400 0.50 44.66 4INSB 12 HETATM 844 O HOH 15 14.910 22.149 0.107 1.00 64.34 4INSB 13 HETATM 845 O HOH 41 3.208 6.718 2.188 1.00 44.14 4INSB 14 HETATM 846 O HOH 42 15.228 18.988 2.773 1.00 47.95 4INSB 15 HETATM 847 O HOH 51 1.948 1.415 2.000 1.00 83.31 4INSB 16 HETATM 848 O HOH 52 -12.203 23.328 2.558 0.50 53.25 4INSB 17 HETATM 849 O HOH 61 3.289 3.437 2.898 1.00 29.40 4INSB 18 HETATM 850 O HOH 62 -0.463 3.085 2.990 1.00 35.04 4INSB 19 HETATM 851 O HOH 63 10.311 22.834 3.121 0.50 53.93 4INSB 20 HETATM 852 O HOH 64 10.183 24.198 3.002 0.50 47.80 4INSB 21 HETATM 853 O HOH 65 23.650 0.900 3.000 1.00 86.30 4INSB 22 HETATM 854 O HOH 71 8.256 18.783 3.330 0.50 14.13 4INSB 23 HETATM 855 O HOH 72 0.000 0.000 2.721 0.33 78.41 4INSB 24 HETATM 856 O HOH 73 -5.500 23.300 3.200 1.00 76.30 4INSB 25 HETATM 857 O HOH 74 -10.414 20.888 3.177 1.00 46.17 4INSB 26 HETATM 858 O HOH 75 5.786 4.688 3.296 1.00 79.24 4INSB 27 HETATM 859 O HOH 76 12.041 23.097 3.478 0.50 31.09 4INSB 28 HETATM 860 O HOH 101 -9.400 22.600 4.900 0.50 52.19 4INSB 29 HETATM 861 O HOH 91 9.781 13.999 4.347 1.00 38.00 4INSB 30 HETATM 862 O HOH 92 14.487 19.051 4.963 0.50 47.26 4INSB 31 HETATM 863 O HOH 94 24.800 2.000 4.680 1.00 50.76 4INSB 32 HETATM 864 O HOH 95 1.700 14.430 4.490 1.00 60.70 4INSB 33 HETATM 865 O HOH 111 -7.624 16.101 5.527 1.00 25.99 4INSB 34 HETATM 866 O HOH 113 4.071 5.888 5.145 1.00 60.78 4INSB 35 HETATM 867 O HOH 112 12.744 23.426 5.604 0.50 40.09 4INSB 36 HETATM 868 O HOH 115 10.354 21.084 4.829 0.50 33.95 4INSB 37 HETATM 869 O HOH 116 12.369 21.475 5.162 0.50 61.18 4INSB 38 HETATM 870 O HOH 122 -9.100 20.600 6.100 0.50 60.00 4INSB 39 HETATM 871 O HOH 123 -8.768 19.973 5.675 0.50 51.16 4INSB 40 HETATM 872 O HOH 131 13.100 13.724 6.029 1.00 21.23 4INSB 41 HETATM 873 O HOH 132 -7.991 22.590 6.582 0.50 57.20 4INSB 42 HETATM 874 O HOH 133 -12.272 21.574 6.100 1.00 55.48 4INSB 43 HETATM 875 O HOH 141 -2.652 21.385 6.534 1.00 64.51 4INSB 44 HETATM 876 O HOH 142 25.212 3.031 6.890 1.00 49.58 4INSB 45 HETATM 877 O HOH 143 10.600 10.100 6.800 0.50 50.00 4INSB 46 HETATM 878 O HOH 146 11.191 23.508 6.621 0.50 37.26 4INSB 47 HETATM 879 O HOH 151 14.528 16.192 7.070 1.00 51.29 4INSB 48 HETATM 880 O HOH 152 1.492 23.231 6.892 0.50 27.00 4INSB 49 HETATM 881 O HOH 155 14.502 18.882 6.980 0.50 59.76 4INSB 50 HETATM 882 O HOH 156 -9.484 23.456 7.067 0.50 41.28 4INSB 51 HETATM 883 O HOH 161 1.228 4.480 7.603 1.00 34.42 4INSB 52 HETATM 884 O HOH 162 0.172 22.959 7.609 0.50 29.31 4INSB 53 HETATM 885 O HOH 164 10.079 20.626 8.067 0.52 33.28 4INSB 54 HETATM 886 O HOH 144 8.276 22.353 6.634 0.50 71.16 4INSB 55 HETATM 887 O HOH 145 11.200 20.200 6.480 0.50 43.34 4INSB 56 HETATM 888 O HOH 147 9.467 21.709 6.550 0.50 60.52 4INSB 57 HETATM 889 O HOH 165 12.911 19.857 7.882 0.50 41.83 4INSB 58 HETATM 890 O HOH 166 5.794 10.580 7.551 0.50 18.82 4INSB 59 HETATM 891 O HOH 171 -3.193 10.008 8.356 1.00 20.33 4INSB 60 HETATM 892 O HOH 172 3.540 5.186 7.514 1.00 50.94 4INSB 61 HETATM 893 O HOH 173 -2.600 23.100 8.100 0.50 37.93 4INSB 62 HETATM 894 O HOH 174 24.906 0.400 8.400 1.00 59.59 4INSB 63 HETATM 895 O HOH 175 22.962 4.308 7.971 1.00 75.46 4INSB 64 HETATM 896 O HOH 181 3.162 12.350 8.534 1.00 60.02 4INSB 65 HETATM 897 O HOH 182 6.986 23.533 8.608 0.50 42.86 4INSB 66 HETATM 898 O HOH 183 7.747 22.514 8.736 0.50 51.31 4INSB 67 HETATM 899 O HOH 184 11.350 23.300 9.170 1.00 50.61 4INSB 68 HETATM 900 O HOH 185 13.640 22.500 8.400 1.00 61.09 4INSB 69 HETATM 901 O HOH 186 5.402 7.037 8.018 1.00 76.30 4INSB 70 HETATM 902 O HOH 191 -9.443 20.240 8.418 0.50 46.63 4INSB 71 HETATM 903 O HOH 193 21.200 5.800 9.000 1.00 46.66 4INSB 72 HETATM 904 O HOH 194 -0.559 20.337 9.227 0.50 31.04 4INSB 73 HETATM 905 O HOH 201 -0.074 1.535 9.452 1.00 25.97 4INSB 74 HETATM 906 O HOH 202 18.617 13.600 9.207 1.00 29.22 4INSB 75 HETATM 907 O HOH 203 0.475 13.399 9.000 1.00 61.33 4INSB 76 HETATM 908 O HOH 204 2.956 7.356 9.255 1.00 37.48 4INSB 77 HETATM 909 O HOH 205 11.907 19.705 9.066 0.50 35.59 4INSB 78 HETATM 910 O HOH 206 16.094 16.073 9.932 1.00 48.31 4INSB 79 HETATM 911 O HOH 207 -8.473 18.398 9.204 0.50 34.10 4INSB 80 HETATM 912 O HOH 208 13.482 17.840 9.054 1.00 66.41 4INSB 81 HETATM 913 O HOH 209 4.832 22.586 10.697 0.50 41.13 4INSB 82 HETATM 914 O HOH 211 4.499 3.274 9.801 1.00 21.36 4INSB 83 HETATM 915 O HOH 212 9.900 19.400 10.176 1.00 57.45 4INSB 84 HETATM 916 O HOH 213 -9.814 18.858 10.172 0.50 36.40 4INSB 85 HETATM 917 O HOH 214 8.300 21.900 9.770 0.50 62.82 4INSB 86 HETATM 918 O HOH 215 5.531 14.046 9.251 1.00 53.12 4INSB 87 HETATM 919 O HOH 216 0.500 21.500 9.739 0.50 40.73 4INSB 88 HETATM 920 O HOH 217 24.500 1.839 10.261 0.50 44.08 4INSB 89 HETATM 921 O HOH 218 14.403 20.407 9.881 0.25 62.98 4INSB 90 HETATM 922 O HOH 219 -9.503 22.800 10.020 0.50 40.98 4INSB 91 HETATM 923 O HOH 221 -5.367 9.301 10.390 1.00 29.29 4INSB 92 HETATM 924 O HOH 222 5.099 10.014 10.625 1.00 39.93 4INSB 93 HETATM 925 O HOH 223 3.402 22.242 10.235 0.50 38.69 4INSB 94 HETATM 926 O HOH 224 0.786 10.457 10.424 0.50 27.11 4INSB 95 HETATM 927 O HOH 225 7.099 20.641 10.117 0.50 45.52 4INSB 96 HETATM 928 O HOH 226 1.327 5.583 11.052 0.50 56.24 4INSB 97 HETATM 929 O HOH 227 -11.769 21.611 10.650 0.50 56.71 4INSB 98 HETATM 930 O HOH 228 -9.990 20.281 10.186 0.50 56.19 4INSB 99 HETATM 931 O HOH 231 -7.077 17.022 11.114 1.00 24.63 4INSB100 HETATM 932 O HOH 232 10.114 17.143 11.048 1.00 38.47 4INSB101 HETATM 933 O HOH 233 13.122 21.921 10.724 0.50 29.51 4INSB102 HETATM 934 O HOH 234 -8.631 22.492 11.840 0.50 43.99 4INSB103 HETATM 935 O HOH 235 24.000 4.400 11.200 1.00 63.61 4INSB104 HETATM 936 O HOH 241 0.397 4.490 11.763 0.50 23.04 4INSB105 HETATM 937 O HOH 242 20.200 6.301 11.100 1.00 62.49 4INSB106 HETATM 938 O HOH 243 -6.059 22.694 11.492 1.00 61.96 4INSB107 HETATM 939 O HOH 244 2.400 0.700 11.139 1.00 63.37 4INSB108 HETATM 940 O HOH 245 1.431 8.001 10.900 1.00 61.63 4INSB109 HETATM 941 O HOH 246 0.589 13.731 11.296 0.50 60.20 4INSB110 HETATM 942 O HOH 247 -0.216 11.635 11.240 0.50 52.12 4INSB111 HETATM 943 O HOH 249 3.575 13.150 11.256 0.50 53.19 4INSB112 HETATM 944 O HOH 251 -0.023 -0.033 11.206 0.33 21.05 4INSB113 HETATM 945 O HOH 252 3.725 4.937 12.004 1.00 60.07 4INSB114 HETATM 946 O HOH 253 9.246 23.287 11.503 1.00 45.58 4INSB115 HETATM 947 O HOH 254 -5.435 20.514 11.630 1.00 51.70 4INSB116 HETATM 948 O HOH 255 13.713 17.818 11.963 1.00 66.30 4INSB117 HETATM 949 O HOH 256 16.125 12.139 12.240 1.00 50.03 4INSB118 HETATM 950 O HOH 257 12.904 20.420 11.491 0.50 30.82 4INSB119 HETATM 951 O HOH 258 22.345 2.177 11.300 1.00 53.69 4INSB120 HETATM 952 O HOH 261 -1.821 8.684 12.044 1.00 36.04 4INSB121 HETATM 953 O HOH 262 2.938 2.622 12.785 1.00 45.76 4INSB122 HETATM 954 O HOH 263 3.200 8.800 12.200 1.00 58.95 4INSB123 HETATM 955 O HOH 271 6.250 11.753 12.889 1.00 50.22 4INSB124 HETATM 956 O HOH 272 12.623 23.254 12.208 0.50 36.01 4INSB125 HETATM 957 O HOH 273 6.083 21.437 12.952 0.50 45.78 4INSB126 HETATM 958 O HOH 274 15.629 16.552 13.704 1.00 54.02 4INSB127 HETATM 959 O HOH 275 4.207 21.400 12.867 0.50 42.63 4INSB128 HETATM 960 O HOH 276 1.400 10.000 13.205 1.00 62.38 4INSB129 HETATM 961 O HOH 281 -1.805 14.585 13.563 1.00 36.72 4INSB130 HETATM 962 O HOH 282 10.681 15.953 13.460 1.00 37.62 4INSB131 HETATM 963 O HOH 283 3.526 17.510 13.393 0.50 58.59 4INSB132 HETATM 964 O HOH 284 4.989 14.660 13.137 1.00 52.11 4INSB133 HETATM 965 O HOH 285 -3.059 10.929 12.998 0.50 54.91 4INSB134 HETATM 966 O HOH 286 -8.655 24.051 2.000 1.00 56.40 4INSB135 HETATM 967 O HOH 287 17.589 14.886 12.994 0.50 46.92 4INSB136 HETATM 968 O HOH 288 -2.700 22.200 12.300 1.00 69.61 4INSB137 HETATM 969 O HOH 289 -7.400 20.900 13.300 1.00 82.49 4INSB138 HETATM 970 O HOH 291 7.840 13.593 13.240 1.00 36.77 4INSB139 HETATM 971 O HOH 277 8.436 16.103 13.124 0.50 66.40 4INSB140 HETATM 972 O HOH 292 20.767 2.758 14.127 0.50 49.50 4INSB141 HETATM 973 O HOH 278 19.461 3.175 13.236 0.50 43.30 4INSB142 HETATM 974 O HOH 293 10.600 21.200 12.800 1.00 65.41 4INSB143 HETATM 975 O HOH 294 17.091 12.037 14.424 1.00 66.30 4INSB144 HETATM 976 O HOH 295 26.230 1.151 12.982 0.50 42.97 4INSB145 HETATM 977 O HOH 296 1.000 16.700 13.200 1.00 45.00 4INSB146 HETATM 978 O HOH 297 -1.841 2.626 14.104 1.00 47.47 4INSB147 HETATM 979 O HOH 298 8.200 19.886 13.338 1.00 59.62 4INSB148 HETATM 980 O HOH 299 3.947 18.704 13.926 0.50 87.22 4INSB149 HETATM 981 O HOH 301 3.000 8.250 14.500 1.00 39.38 4INSB150 HETATM 982 O HOH 306 23.669 1.157 13.223 1.00 49.56 4INSB151 HETATM 983 O HOH 307 6.706 17.656 14.200 1.00 62.44 4INSB152 HETATM 984 O HOH 308 -10.436 21.800 14.703 1.00 82.89 4INSB153 HETATM 985 O HOH 302 21.660 8.100 14.400 1.00 78.85 4INSB154 HETATM 986 O HOH 303 16.002 14.165 14.204 0.50 36.21 4INSB155 HETATM 987 O HOH 311 18.624 9.971 14.472 1.00 68.09 4INSB156 HETATM 988 O HOH 312 12.345 18.363 14.320 1.00 61.52 4INSB157 HETATM 989 O HOH 314 15.375 13.331 15.234 0.50 38.87 4INSB158 HETATM 990 O HOH 315 8.900 16.074 15.111 0.50 56.02 4INSB159 HETATM 991 O HOH 316 -8.811 19.800 14.800 1.00 84.33 4INSB160 HETATM 992 O HOH 319 9.800 20.500 15.000 0.50 37.74 4INSB161 HETATM 993 O HOH 321 -0.629 5.214 14.504 1.00 52.63 4INSB162 HETATM 994 O HOH 305 0.063 7.371 13.477 0.50 44.43 4INSB163 HETATM 995 O HOH 322 4.331 21.351 15.200 1.00 48.37 4INSB164 HETATM 996 O HOH 324 20.471 6.314 15.326 0.50 42.47 4INSB165 HETATM 997 O HOH 325 15.956 10.347 15.577 1.00 73.09 4INSB166 HETATM 998 O HOH 326 4.166 16.122 15.117 1.00 64.59 4INSB167 HETATM 999 O HOH 331 -3.496 10.462 15.323 1.00 41.57 4INSB168 HETATM 1000 O HOH 333 22.179 1.588 16.322 1.00 60.14 4INSB169 HETATM 1001 O HOH 334 7.227 21.575 16.034 1.00 79.51 4INSB170 HETATM 1002 O HOH 335 24.987 3.024 15.000 0.50 77.50 4INSB171 HETATM 1003 O HOH 341 0.000 0.000 15.940 0.33 48.19 4INSB172 HETATM 1004 O HOH 342 2.058 1.124 15.886 0.50 57.48 4INSB173 HETATM 1005 O HOH 343 -1.885 13.663 16.148 1.00 61.43 4INSB174 HETATM 1006 O HOH 344 -3.119 22.865 15.776 1.00 59.24 4INSB175 HETATM 1007 O HOH 345 19.200 4.000 16.256 1.00 52.18 4INSB176 HETATM 1008 O HOH 346 14.044 21.773 15.730 0.50 35.08 4INSB177 HETATM 1009 O HOH 347 1.900 3.400 16.729 1.00 42.63 4INSB178 HETATM 1010 O HOH 349 14.400 17.800 15.886 0.50 52.96 4INSB179 HETATM 1011 O HOH 336 13.700 15.600 15.000 1.00 65.01 4INSB180 HETATM 1012 O HOH 351 2.100 6.200 15.800 1.00 73.63 4INSB181 HETATM 1013 O HOH 352 13.105 18.675 16.692 0.50 57.75 4INSB182 HETATM 1014 O HOH 355 5.384 1.947 16.328 1.00 52.83 4INSB183 HETATM 1015 O HOH 356 19.387 1.649 16.538 1.00 38.74 4INSB184 HETATM 1016 O HOH 357 6.570 18.429 16.505 1.00 50.65 4INSB185 HETATM 1017 O HOH 358 -11.760 21.100 16.700 0.50 40.14 4INSB186 HETATM 1018 O HOH 359 18.269 7.536 16.565 1.00 60.44 4INSB187 HETATM 1019 O HOH 350 16.961 12.601 17.169 1.00 81.43 4INSB188 HETATM 1020 O HOH 354 19.266 10.576 17.790 1.00 63.02 4INSB189 HETATM 1021 O HOH 361 -2.564 5.638 17.137 1.00 48.33 4INSB190 HETATM 1022 O HOH 362 -3.814 12.169 17.184 1.00 40.38 4INSB191 HETATM 1023 O HOH 363 21.336 8.539 16.849 1.00 46.39 4INSB192 HETATM 1024 O HOH 364 11.361 23.312 16.935 1.00 56.56 4INSB193 HETATM 1025 O HOH 365 11.482 20.115 16.180 0.50 36.42 4INSB194 HETATM 1026 O HOH 366 10.431 19.608 16.704 0.50 61.59 4INSB195 HETATM 1027 O HOH 367 -0.459 10.100 16.800 1.00 96.03 4INSB196 HETATM 1028 O HOH 368 -5.600 22.740 16.755 0.50 60.98 4INSB197 HETATM 1029 O HOH 369 22.701 4.882 16.533 0.50 59.04 4INSB198 HETATM 1030 O HOH 360 -0.559 7.125 16.712 1.00 55.39 4INSB199 HETATM 1031 O HOH 370 22.349 3.895 16.628 0.50 44.55 4INSB200 HETATM 1032 O HOH 379 24.254 2.529 17.221 0.50 64.98 4INSB201 HETATM 1033 O HOH 371 -8.270 20.622 17.537 0.50 29.13 4INSB202 HETATM 1034 O HOH 376 -7.614 21.771 17.400 0.50 39.65 4INSB203 HETATM 1035 O HOH 372 17.313 15.074 17.581 1.00 53.72 4INSB204 HETATM 1036 O HOH 374 -1.700 21.227 17.206 1.00 50.32 4INSB205 HETATM 1037 O HOH 375 16.509 9.562 17.812 1.00 54.16 4INSB206 HETATM 1038 O HOH 377 -7.800 16.300 17.668 1.00 75.77 4INSB207 HETATM 1039 O HOH 381 4.677 20.377 17.882 1.00 49.25 4INSB208 HETATM 1040 O HOH 382 17.535 3.747 17.792 1.00 51.88 4INSB209 HETATM 1041 O HOH 383 -2.265 8.874 17.970 1.00 48.81 4INSB210 HETATM 1042 O HOH 386 -8.894 18.338 17.943 1.00 51.71 4INSB211 HETATM 1043 O HOH 387 0.500 3.000 18.600 0.50 35.00 4INSB212 HETATM 1044 O HOH 388 6.000 4.100 17.800 1.00 50.00 4INSB213 HETATM 1045 O HOH 390 2.700 3.900 19.000 0.50 40.00 4INSB214 HETATM 1046 O HOH 391 2.992 5.257 18.400 0.50 40.00 4INSB215 HETATM 1047 O HOH 389 22.320 6.616 18.376 1.00 76.30 4INSB216 HETATM 1048 O HOH 378 14.300 15.147 17.400 0.50 41.41 4INSB217 HETATM 1049 O HOH 392 12.379 14.000 18.485 1.00 69.21 4INSB218 HETATM 1050 O HOH 394 26.585 1.034 18.302 1.00 72.39 4INSB219 HETATM 1051 O HOH 395 15.048 0.586 18.649 0.50 27.91 4INSB220 HETATM 1052 O HOH 396 24.664 3.165 18.640 0.50 55.98 4INSB221 HETATM 1053 O HOH 397 16.000 6.400 18.500 1.00 75.03 4INSB222 HETATM 1054 O HOH 401 -4.837 15.671 19.009 1.00 33.67 4INSB223 HETATM 1055 O HOH 402 -1.199 22.838 19.138 1.00 36.10 4INSB224 HETATM 1056 O HOH 403 1.686 21.194 18.890 1.00 36.62 4INSB225 HETATM 1057 O HOH 404 7.587 19.898 18.900 1.00 74.10 4INSB226 HETATM 1058 O HOH 405 23.636 0.400 18.433 0.50 38.58 4INSB227 HETATM 1059 O HOH 407 7.200 0.000 19.364 1.00 80.00 4INSB228 HETATM 1060 O HOH 408 12.325 20.187 18.584 1.00 76.30 4INSB229 HETATM 1061 O HOH 409 8.868 21.918 18.717 1.00 88.44 4INSB230 HETATM 1062 O HOH 411 -5.300 12.855 19.148 1.00 51.00 4INSB231 HETATM 1063 O HOH 412 4.000 0.889 19.161 1.00 56.19 4INSB232 HETATM 1064 O HOH 413 11.500 16.200 18.500 1.00 54.59 4INSB233 HETATM 1065 O HOH 414 15.033 14.600 19.135 0.50 40.58 4INSB234 HETATM 1066 O HOH 415 16.700 11.300 19.500 0.50 53.18 4INSB235 HETATM 1067 O HOH 421 4.304 23.913 8.300 1.00 56.36 4INSB236 HETATM 1068 O HOH 422 17.595 8.307 19.856 1.00 43.95 4INSB237 HETATM 1069 O HOH 423 8.460 17.052 19.897 1.00 58.87 4INSB238 HETATM 1070 O HOH 424 11.600 18.400 20.000 1.00 60.00 4INSB239 HETATM 1071 O HOH 425 -9.409 23.116 19.633 1.00 66.30 4INSB240 HETATM 1072 O HOH 428 7.200 3.000 19.668 1.00 79.22 4INSB241 HETATM 1073 O HOH 429 21.000 4.000 19.956 1.00 59.41 4INSB242 HETATM 1074 O HOH 420 -0.800 4.800 19.700 1.00 50.00 4INSB243 HETATM 1075 O HOH 431 13.592 4.017 20.054 1.00 43.20 4INSB244 HETATM 1076 O HOH 432 -0.400 2.600 20.000 0.50 40.00 4INSB245 HETATM 1077 O HOH 433 19.480 6.217 19.797 1.00 62.99 4INSB246 HETATM 1078 O HOH 435 20.876 1.574 20.116 0.50 41.62 4INSB247 HETATM 1079 O HOH 437 18.870 3.203 20.295 1.00 65.25 4INSB248 HETATM 1080 O HOH 438 22.043 8.448 20.602 0.50 38.02 4INSB249 HETATM 1081 O HOH 439 15.420 7.740 20.813 1.00 61.77 4INSB250 HETATM 1082 O HOH 441 14.400 19.900 20.800 1.00 46.45 4INSB251 HETATM 1083 O HOH 442 8.900 4.300 20.900 1.00 66.62 4INSB252 HETATM 1084 O HOH 443 12.900 7.700 20.600 1.00 50.81 4INSB253 HETATM 1085 O HOH 444 23.373 3.907 20.784 0.50 37.81 4INSB254 HETATM 1086 O HOH 445 22.600 5.200 21.000 0.50 50.00 4INSB255 HETATM 1087 O HOH 446 11.000 20.300 21.100 0.50 50.00 4INSB256 HETATM 1088 O HOH 447 3.848 22.050 20.436 1.00 73.68 4INSB257 HETATM 1089 O HOH 448 15.900 13.400 20.500 0.50 37.02 4INSB258 HETATM 1090 O HOH 449 15.000 15.900 20.409 0.50 51.72 4INSB259 HETATM 1091 O HOH 451 -5.648 12.110 21.371 1.00 36.62 4INSB260 HETATM 1092 O HOH 453 -3.499 9.530 21.143 1.00 58.40 4INSB261 HETATM 1093 O HOH 452 11.455 5.672 21.400 0.50 45.30 4INSB262 HETATM 1094 O HOH 455 19.300 11.200 21.251 1.00 93.71 4INSB263 HETATM 1095 O HOH 456 12.867 15.311 21.383 1.00104.59 4INSB264 HETATM 1096 O HOH 450 16.200 18.500 20.516 0.50 57.42 4INSB265 HETATM 1097 O HOH 459 17.900 14.200 21.400 0.50 54.11 4INSB266 HETATM 1098 O HOH 461 -2.438 17.554 21.488 1.00 27.54 4INSB267 HETATM 1099 O HOH 462 2.426 2.789 21.667 0.50 37.21 4INSB268 HETATM 1100 O HOH 473 5.591 3.514 22.644 1.00 66.58 4INSB269 HETATM 1101 O HOH 474 21.490 9.784 21.789 0.50 37.24 4INSB270 HETATM 1102 O HOH 475 22.459 7.099 21.906 0.50 54.11 4INSB271 HETATM 1103 O HOH 476 23.362 5.246 22.116 0.50 53.14 4INSB272 HETATM 1104 O HOH 477 10.026 5.995 22.154 0.50 36.85 4INSB273 HETATM 1105 O HOH 481 16.230 16.756 22.900 1.00 51.60 4INSB274 HETATM 1106 O HOH 482 7.950 1.500 22.400 1.00 74.32 4INSB275 HETATM 1107 O HOH 484 0.000 0.000 22.203 0.33 26.53 4INSB276 HETATM 1108 O HOH 485 6.000 0.331 22.809 1.00 81.99 4INSB277 HETATM 1109 O HOH 486 2.400 1.900 22.950 0.50 53.75 4INSB278 HETATM 1110 O HOH 487 16.826 9.360 22.915 1.00 64.50 4INSB279 HETATM 1111 O HOH 488 10.028 0.600 22.667 1.00 50.88 4INSB280 HETATM 1112 O HOH 491 1.801 22.097 22.791 1.00 33.66 4INSB281 HETATM 1113 O HOH 492 -2.158 10.172 22.900 1.00 34.73 4INSB282 HETATM 1114 O HOH 493 8.566 22.210 23.275 1.00 52.52 4INSB283 HETATM 1115 O HOH 494 19.041 7.317 22.965 1.00 45.49 4INSB284 HETATM 1116 O HOH 496 13.154 17.896 23.121 0.50 58.99 4INSB285 HETATM 1117 O HOH 497 25.120 2.792 23.670 1.00 49.60 4INSB286 HETATM 1118 O HOH 498 0.848 2.630 23.300 0.50 51.96 4INSB287 HETATM 1119 O HOH 501 12.799 4.914 23.300 1.00 45.19 4INSB288 HETATM 1120 O HOH 502 14.100 1.511 23.000 1.00 54.91 4INSB289 HETATM 1121 O HOH 503 18.000 5.200 23.400 0.50 40.00 4INSB290 HETATM 1122 O HOH 504 20.460 5.246 23.195 0.50 42.74 4INSB291 HETATM 1123 O HOH 505 18.500 13.238 23.926 0.50 60.34 4INSB292 HETATM 1124 O HOH 506 9.469 4.007 23.263 0.50 65.39 4INSB293 HETATM 1125 O HOH 511 3.330 4.805 23.757 1.00 24.03 4INSB294 HETATM 1126 O HOH 512 -6.414 11.027 24.091 1.00 36.40 4INSB295 HETATM 1127 O HOH 514 -1.798 3.543 24.064 1.00 80.64 4INSB296 HETATM 1128 O HOH 513 1.468 0.225 24.184 1.00 35.46 4INSB297 HETATM 1129 O HOH 515 -12.014 22.141 24.296 1.00 66.63 4INSB298 HETATM 1130 O HOH 516 13.052 19.509 23.128 0.50 62.84 4INSB299 HETATM 1131 O HOH 517 -9.519 22.726 24.412 1.00 71.89 4INSB300 HETATM 1132 O HOH 521 9.900 22.890 25.259 1.00 65.26 4INSB301 HETATM 1133 O HOH 522 16.495 17.126 26.000 1.00 40.00 4INSB302 HETATM 1134 O HOH 524 21.700 5.400 24.514 0.50 50.22 4INSB303 HETATM 1135 O HOH 525 6.642 20.679 24.898 1.00 58.56 4INSB304 HETATM 1136 O HOH 526 20.692 8.311 24.457 0.50 48.03 4INSB305 HETATM 1137 O HOH 531 -1.763 20.077 25.007 1.00 21.36 4INSB306 HETATM 1138 O HOH 532 -8.670 18.367 25.265 1.00 27.41 4INSB307 HETATM 1139 O HOH 533 7.700 4.223 25.055 1.00 33.74 4INSB308 HETATM 1140 O HOH 535 19.581 11.070 25.093 1.00 65.09 4INSB309 HETATM 1141 O HOH 536 -2.718 10.300 25.150 1.00 73.39 4INSB310 HETATM 1142 O HOH 537 22.450 8.700 25.159 0.50 48.15 4INSB311 HETATM 1143 O HOH 541 -1.293 22.963 25.513 1.00 29.91 4INSB312 HETATM 1144 O HOH 542 12.210 21.699 25.848 0.50 44.27 4INSB313 HETATM 1145 O HOH 527 11.500 21.600 24.157 0.50 70.69 4INSB314 HETATM 1146 O HOH 544 25.803 0.095 26.600 1.00 56.59 4INSB315 HETATM 1147 O HOH 545 23.392 1.295 25.732 1.00 48.54 4INSB316 HETATM 1148 O HOH 546 12.194 3.114 25.000 1.00 76.30 4INSB317 HETATM 1149 O HOH 551 4.708 1.340 26.039 1.00 30.59 4INSB318 HETATM 1150 O HOH 552 14.388 19.737 25.636 1.00 64.76 4INSB319 HETATM 1151 O HOH 561 5.419 3.667 26.434 1.00 31.12 4INSB320 HETATM 1152 O HOH 562 23.512 4.500 26.629 1.00 66.30 4INSB321 HETATM 1153 O HOH 563 -10.096 20.400 26.037 1.00 73.01 4INSB322 HETATM 1154 O HOH 571 -9.600 23.170 26.887 1.00 62.82 4INSB323 HETATM 1155 O HOH 572 16.389 14.064 27.171 1.00 74.53 4INSB324 HETATM 1156 O HOH 574 18.700 14.000 26.532 1.00 79.38 4INSB325 HETATM 1157 O HOH 582 10.926 10.684 26.940 1.00 44.80 4INSB326 HETATM 1158 O HOH 583 12.500 21.800 27.254 0.50 47.63 4INSB327 HETATM 1159 O HOH 581 15.038 21.545 5.268 1.00 55.92 4INSB328 HETATM 1160 O HOH 591 -1.739 18.453 27.705 1.00 12.21 4INSB329 HETATM 1161 O HOH 592 27.000 1.000 28.300 1.00 70.92 4INSB330 HETATM 1162 O HOH 593 20.879 8.934 27.397 0.50 49.09 4INSB331 HETATM 1163 O HOH 601 5.301 3.962 28.700 0.60 31.54 4INSB332 HETATM 1164 O HOH 602 13.794 13.317 28.059 1.00 74.41 4INSB333 HETATM 1165 O HOH 603 6.578 4.370 28.779 0.40 28.91 4INSB334 HETATM 1166 O HOH 611 19.254 14.024 28.832 1.00 55.11 4INSB335 HETATM 1167 O HOH 612 14.279 1.568 28.963 1.00 65.08 4INSB336 HETATM 1168 O HOH 622 14.080 9.849 29.479 1.00 27.58 4INSB337 HETATM 1169 O HOH 621 23.137 6.636 29.293 0.50 55.90 4INSB338 HETATM 1170 O HOH 641 18.586 7.949 30.401 0.50 17.96 4INSB339 HETATM 1171 O HOH 631 10.475 22.332 30.034 1.00 41.35 4INSB340 HETATM 1172 O HOH 632 14.200 22.300 30.301 1.00 67.11 4INSB341 HETATM 1173 O HOH 642 4.564 5.544 30.131 1.00 37.24 4INSB342 HETATM 1174 O HOH 651 0.000 0.000 30.941 0.33 24.09 4INSB343 HETATM 1175 O HOH 652 3.559 3.107 30.844 1.00 34.61 4INSB344 HETATM 1176 O HOH 653 -1.317 2.461 30.833 1.00 27.74 4INSB345 HETATM 1177 O HOH 671 6.900 3.468 31.640 1.00 38.60 4INSB346 HETATM 1178 O HOH 672 1.484 2.379 31.639 1.00 81.34 4INSB347 HETATM 1179 O HOH 673 -11.700 22.918 32.100 1.00 83.01 4INSB348 HETATM 1180 O HOH 674 12.200 21.561 31.604 1.00 55.36 4INSB349 HETATM 1181 O HOH 691 25.195 1.527 33.000 1.00 77.73 4INSB350 HETATM 1182 O HOH 701 11.090 22.753 33.200 1.00 96.30 4INSB351 HETATM 1183 O HOH 702 3.296 3.651 33.200 1.00 86.30 4INSB352 HETATM 1184 O HOH 711 24.237 4.743 33.829 1.00 38.87 4INSB353 HETATM 1185 O HOH 721 6.358 23.611 -0.018 1.00 94.84 4INSB354 CONECT 43 42 76 4INS1420 CONECT 49 48 227 4INS1421 CONECT 76 43 75 4INS1422 CONECT 154 153 318 4INS1423 CONECT 227 49 226 4INS1424 CONECT 318 154 317 4INS1425 CONECT 463 462 496 4INS1426 CONECT 469 468 643 4INS1427 CONECT 496 463 495 4INS1428 CONECT 574 573 733 4INS1429 CONECT 643 469 642 4INS1430 CONECT 733 574 732 4INS1431 MASTER 167 11 2 6 2 4 12 9 1181 4 12 10 4INSB355 END 4INS1433