HEADER HELICASE ACTIVATOR 27-JUN-08 SMS20027 TITLE BROME MOSAIC VIRUS PROTEIN 1A HELIX A BOUND TO SDS MICELLE COMPND MOL_ID: 1; COMPND 2 MOLECULE: REPLICATION PROTEIN 1A; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 392-409; COMPND 5 SYNONYM: ATP-DEPENDENT HELICASE, METHYLTRANSFERASE; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: BROME MOSAIC VIRUS; SOURCE 4 ORGANISM_COMMON: BMV; SOURCE 5 ORGANISM_TAXID: 12302; SOURCE 6 OTHER_DETAILS: SYNTHESIZED ON AN APPLIED BIOSYSTEMS 432A SYNTHESIZER SOURCE 7 USING STANDARD FMOC CHEMISTRY WITH HBTU/HOBT COUPLING KEYWDS AMPHIPATHIC HELIX, SDS MICELLE, HELICASE ACTIVATOR EXPDTA SOLUTION NMR NUMMDL 20 AUTHOR L.LIU,W.M.WESTLER,X.WANG,A.DIAZ,P.AHLQUIST JRNL AUTH L.LIU,W.M.WESTLER,J.A.DEN BOON,X.WANG,A.DIAZ,H.A.STEINBERG, JRNL AUTH 2 P.AHLQUIST JRNL TITL AN AMPHIPATHIC ALPHA-HELIX CONTROLS MULTIPLE ROLES OF BROME JRNL TITL 2 MOSAIC VIRUS PROTEIN 1A IN RNA REPLICATION COMPLEX ASSEMBLY JRNL TITL 3 AND FUNCTION JRNL REF PLOS PATHOG. V. 5 E1000 2009 JRNL REFN ISSN 1553-7366 JRNL PMID 19325881 JRNL DOI 10.1371/JOURNAL.PPAT.1000351 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PSVS REMARK 3 AUTHORS : BHATTACHARYA AND MONTELIONE REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 NULL COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 14-SEP-10. REMARK 100 THE BMRB ID CODE IS SMS20027. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : NULL REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 0.8MM [U-100% 13C; U-100% 15N] REMARK 210 PEPTIDE; 100MM SDS-D25; 95% H2O/ REMARK 210 5% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-15N HSQC; 2D 1H-13C HSQC; REMARK 210 3D CBCA(CO)NH; 3D C(CO)NH; 3D REMARK 210 HNCO; 3D HNCACB; 3D HBHA(CO)NH; REMARK 210 3D H(CCO)NH; 3D HCCH-TOCSY; 3D 1H REMARK 210 -13C NOESY; 3D 1H-15N NOESY; 3D REMARK 210 HN(CO)CA REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : DIRECTDRIVE REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : PISTACHIO, PECAN, SPARKY, CYANA, REMARK 210 VNMRJ, ATNOS/CANDID, PSVS, TALOS, REMARK 210 HIFI REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 80 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS 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 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 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 1 PHE A 3 164.06 62.42 REMARK 500 3 ALA A 2 -62.12 -128.48 REMARK 500 4 ALA A 2 -65.06 -103.42 REMARK 500 5 ALA A 2 -72.86 -52.07 REMARK 500 6 ALA A 2 -64.32 -121.99 REMARK 500 8 PHE A 3 120.00 -173.06 REMARK 500 9 ALA A 2 73.74 -176.73 REMARK 500 9 PHE A 3 -177.30 60.09 REMARK 500 10 ALA A 2 -69.38 -92.54 REMARK 500 10 PHE A 3 -177.71 -63.89 REMARK 500 12 ALA A 2 -70.58 -102.93 REMARK 500 16 PHE A 3 38.64 -179.19 REMARK 500 16 ALA A 4 -66.98 -90.65 REMARK 500 17 PHE A 3 177.98 61.71 REMARK 500 18 ALA A 2 -63.77 -97.98 REMARK 500 19 ALA A 2 -70.21 -150.50 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 20027 RELATED DB: BMRB DBREF A 1 18 UNP P03588 ORF1A_BMV 392 409 SEQRES 1 A 18 VAL ALA PHE ALA LEU THR LEU ASN LEU TYR GLN LYS TYR SEQRES 2 A 18 GLU LYS LEU THR ALA HELIX 1 1 ALA A 4 THR A 17 1 14 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 MODEL 1 ATOM 1 N VAL A 1 1.329 0.000 0.000 1.00 3.00 N ATOM 2 CA VAL A 1 2.094 -0.002 -1.242 1.00 12.15 C ATOM 3 C VAL A 1 2.479 1.415 -1.652 1.00 32.00 C ATOM 4 O VAL A 1 1.622 2.288 -1.784 1.00 51.23 O ATOM 5 CB VAL A 1 1.302 -0.659 -2.387 1.00 72.33 C ATOM 6 CG1 VAL A 1 -0.035 0.039 -2.582 1.00 13.30 C ATOM 7 CG2 VAL A 1 2.114 -0.643 -3.674 1.00 13.43 C ATOM 8 H1 VAL A 1 1.807 0.001 0.856 1.00 62.55 H ATOM 9 HA VAL A 1 2.994 -0.576 -1.078 1.00 61.44 H ATOM 10 HB VAL A 1 1.110 -1.688 -2.121 1.00 73.30 H ATOM 11 HG11 VAL A 1 0.128 1.011 -3.024 1.00 11.42 H ATOM 12 HG12 VAL A 1 -0.660 -0.554 -3.234 1.00 11.42 H ATOM 13 HG13 VAL A 1 -0.522 0.157 -1.625 1.00 52.00 H ATOM 14 HG21 VAL A 1 1.820 -1.475 -4.296 1.00 41.41 H ATOM 15 HG22 VAL A 1 1.933 0.283 -4.200 1.00 65.21 H ATOM 16 HG23 VAL A 1 3.165 -0.723 -3.438 1.00 30.34 H ATOM 17 N ALA A 2 3.774 1.636 -1.853 1.00 31.33 N ATOM 18 CA ALA A 2 4.273 2.946 -2.251 1.00 13.12 C ATOM 19 C ALA A 2 3.877 4.015 -1.238 1.00 2.21 C ATOM 20 O ALA A 2 3.112 4.928 -1.550 1.00 72.41 O ATOM 21 CB ALA A 2 3.755 3.310 -3.634 1.00 73.15 C ATOM 22 H ALA A 2 4.409 0.899 -1.731 1.00 54.33 H ATOM 23 HA ALA A 2 5.351 2.892 -2.300 1.00 11.13 H ATOM 24 HB1 ALA A 2 2.801 3.809 -3.541 1.00 72.40 H ATOM 25 HB2 ALA A 2 4.459 3.968 -4.121 1.00 23.21 H ATOM 26 HB3 ALA A 2 3.636 2.412 -4.221 1.00 75.35 H ATOM 27 N PHE A 3 4.403 3.896 -0.023 1.00 51.12 N ATOM 28 CA PHE A 3 4.103 4.852 1.037 1.00 60.23 C ATOM 29 C PHE A 3 2.615 4.838 1.376 1.00 4.33 C ATOM 30 O PHE A 3 1.799 4.322 0.614 1.00 14.41 O ATOM 31 CB PHE A 3 4.529 6.260 0.618 1.00 43.31 C ATOM 32 CG PHE A 3 5.513 6.894 1.560 1.00 72.10 C ATOM 33 CD1 PHE A 3 6.857 6.562 1.505 1.00 0.41 C ATOM 34 CD2 PHE A 3 5.093 7.821 2.500 1.00 2.20 C ATOM 35 CE1 PHE A 3 7.764 7.143 2.371 1.00 12.43 C ATOM 36 CE2 PHE A 3 5.995 8.406 3.369 1.00 65.23 C ATOM 37 CZ PHE A 3 7.333 8.067 3.303 1.00 13.14 C ATOM 38 H PHE A 3 5.007 3.147 0.165 1.00 34.10 H ATOM 39 HA PHE A 3 4.663 4.561 1.912 1.00 34.22 H ATOM 40 HB2 PHE A 3 4.988 6.215 -0.358 1.00 61.42 H ATOM 41 HB3 PHE A 3 3.656 6.894 0.572 1.00 65.22 H ATOM 42 HD1 PHE A 3 7.196 5.841 0.776 1.00 11.10 H ATOM 43 HD2 PHE A 3 4.047 8.087 2.552 1.00 54.23 H ATOM 44 HE1 PHE A 3 8.809 6.877 2.318 1.00 11.11 H ATOM 45 HE2 PHE A 3 5.655 9.128 4.096 1.00 32.31 H ATOM 46 HZ PHE A 3 8.039 8.522 3.981 1.00 2.15 H ATOM 47 N ALA A 4 2.272 5.409 2.526 1.00 20.03 N ATOM 48 CA ALA A 4 0.884 5.464 2.967 1.00 13.30 C ATOM 49 C ALA A 4 0.147 6.630 2.316 1.00 61.02 C ATOM 50 O ALA A 4 -1.075 6.601 2.169 1.00 75.34 O ATOM 51 CB ALA A 4 0.815 5.575 4.483 1.00 63.00 C ATOM 52 H ALA A 4 2.969 5.803 3.091 1.00 51.30 H ATOM 53 HA ALA A 4 0.404 4.541 2.676 1.00 21.20 H ATOM 54 HB1 ALA A 4 0.728 6.615 4.764 1.00 64.35 H ATOM 55 HB2 ALA A 4 -0.044 5.031 4.845 1.00 72.10 H ATOM 56 HB3 ALA A 4 1.713 5.159 4.915 1.00 43.32 H ATOM 57 N LEU A 5 0.897 7.655 1.928 1.00 5.31 N ATOM 58 CA LEU A 5 0.315 8.832 1.293 1.00 43.34 C ATOM 59 C LEU A 5 -0.524 8.438 0.081 1.00 4.22 C ATOM 60 O LEU A 5 -1.716 8.737 0.014 1.00 35.20 O ATOM 61 CB LEU A 5 1.417 9.805 0.870 1.00 42.44 C ATOM 62 CG LEU A 5 1.211 11.267 1.269 1.00 44.04 C ATOM 63 CD1 LEU A 5 2.393 12.114 0.821 1.00 34.11 C ATOM 64 CD2 LEU A 5 -0.085 11.803 0.680 1.00 52.24 C ATOM 65 H LEU A 5 1.866 7.621 2.072 1.00 52.11 H ATOM 66 HA LEU A 5 -0.324 9.317 2.016 1.00 42.04 H ATOM 67 HB2 LEU A 5 2.342 9.469 1.312 1.00 45.34 H ATOM 68 HB3 LEU A 5 1.499 9.764 -0.207 1.00 75.53 H ATOM 69 HG LEU A 5 1.143 11.333 2.346 1.00 50.42 H ATOM 70 HD11 LEU A 5 2.468 12.987 1.451 1.00 43.43 H ATOM 71 HD12 LEU A 5 2.248 12.421 -0.204 1.00 74.52 H ATOM 72 HD13 LEU A 5 3.301 11.534 0.898 1.00 72.01 H ATOM 73 HD21 LEU A 5 -0.874 11.724 1.413 1.00 63.41 H ATOM 74 HD22 LEU A 5 -0.348 11.227 -0.196 1.00 5.43 H ATOM 75 HD23 LEU A 5 0.047 12.839 0.402 1.00 13.24 H ATOM 76 N THR A 6 0.107 7.763 -0.875 1.00 3.41 N ATOM 77 CA THR A 6 -0.580 7.327 -2.084 1.00 14.15 C ATOM 78 C THR A 6 -1.788 6.460 -1.746 1.00 60.13 C ATOM 79 O THR A 6 -2.744 6.382 -2.519 1.00 33.22 O ATOM 80 CB THR A 6 0.361 6.537 -3.012 1.00 4.13 C ATOM 81 OG1 THR A 6 0.648 5.255 -2.443 1.00 31.34 O ATOM 82 CG2 THR A 6 1.659 7.297 -3.240 1.00 41.51 C ATOM 83 H THR A 6 1.058 7.555 -0.764 1.00 4.54 H ATOM 84 HA THR A 6 -0.917 8.207 -2.612 1.00 15.23 H ATOM 85 HB THR A 6 -0.130 6.398 -3.964 1.00 43.33 H ATOM 86 HG1 THR A 6 0.058 4.598 -2.821 1.00 21.24 H ATOM 87 HG21 THR A 6 2.168 6.889 -4.100 1.00 42.41 H ATOM 88 HG22 THR A 6 2.291 7.202 -2.369 1.00 73.33 H ATOM 89 HG23 THR A 6 1.439 8.341 -3.413 1.00 24.51 H ATOM 90 N LEU A 7 -1.739 5.810 -0.589 1.00 0.23 N ATOM 91 CA LEU A 7 -2.830 4.948 -0.148 1.00 54.23 C ATOM 92 C LEU A 7 -4.069 5.770 0.194 1.00 1.04 C ATOM 93 O LEU A 7 -5.161 5.502 -0.304 1.00 50.24 O ATOM 94 CB LEU A 7 -2.398 4.125 1.066 1.00 12.25 C ATOM 95 CG LEU A 7 -2.878 2.674 1.099 1.00 34.12 C ATOM 96 CD1 LEU A 7 -4.392 2.609 0.969 1.00 52.43 C ATOM 97 CD2 LEU A 7 -2.211 1.866 -0.005 1.00 12.34 C ATOM 98 H LEU A 7 -0.951 5.912 -0.016 1.00 21.22 H ATOM 99 HA LEU A 7 -3.071 4.278 -0.960 1.00 32.10 H ATOM 100 HB2 LEU A 7 -1.319 4.117 1.093 1.00 14.03 H ATOM 101 HB3 LEU A 7 -2.775 4.620 1.951 1.00 61.53 H ATOM 102 HG LEU A 7 -2.607 2.233 2.048 1.00 23.34 H ATOM 103 HD11 LEU A 7 -4.659 2.479 -0.069 1.00 63.51 H ATOM 104 HD12 LEU A 7 -4.825 3.527 1.339 1.00 43.24 H ATOM 105 HD13 LEU A 7 -4.768 1.777 1.545 1.00 21.24 H ATOM 106 HD21 LEU A 7 -1.203 2.224 -0.153 1.00 53.14 H ATOM 107 HD22 LEU A 7 -2.772 1.978 -0.921 1.00 32.22 H ATOM 108 HD23 LEU A 7 -2.186 0.824 0.277 1.00 31.42 H ATOM 109 N ASN A 8 -3.890 6.773 1.048 1.00 44.13 N ATOM 110 CA ASN A 8 -4.993 7.636 1.456 1.00 65.41 C ATOM 111 C ASN A 8 -5.532 8.428 0.269 1.00 62.33 C ATOM 112 O ASN A 8 -6.740 8.629 0.140 1.00 12.20 O ATOM 113 CB ASN A 8 -4.537 8.594 2.558 1.00 1.01 C ATOM 114 CG ASN A 8 -4.980 8.143 3.936 1.00 21.44 C ATOM 115 OD1 ASN A 8 -5.707 8.853 4.631 1.00 51.14 O ATOM 116 ND2 ASN A 8 -4.542 6.955 4.339 1.00 3.42 N ATOM 117 H ASN A 8 -2.995 6.937 1.412 1.00 43.31 H ATOM 118 HA ASN A 8 -5.780 7.006 1.842 1.00 52.14 H ATOM 119 HB2 ASN A 8 -3.458 8.655 2.550 1.00 13.32 H ATOM 120 HB3 ASN A 8 -4.950 9.573 2.370 1.00 54.34 H ATOM 121 HD21 ASN A 8 -3.965 6.444 3.733 1.00 13.31 H ATOM 122 HD22 ASN A 8 -4.813 6.639 5.226 1.00 74.32 H ATOM 123 N LEU A 9 -4.628 8.874 -0.597 1.00 14.22 N ATOM 124 CA LEU A 9 -5.013 9.644 -1.775 1.00 4.01 C ATOM 125 C LEU A 9 -5.777 8.775 -2.768 1.00 34.31 C ATOM 126 O LEU A 9 -6.806 9.186 -3.305 1.00 42.33 O ATOM 127 CB LEU A 9 -3.773 10.237 -2.448 1.00 32.34 C ATOM 128 CG LEU A 9 -4.012 10.969 -3.769 1.00 21.14 C ATOM 129 CD1 LEU A 9 -5.092 12.027 -3.605 1.00 2.11 C ATOM 130 CD2 LEU A 9 -2.720 11.596 -4.272 1.00 1.02 C ATOM 131 H LEU A 9 -3.681 8.682 -0.441 1.00 44.11 H ATOM 132 HA LEU A 9 -5.655 10.449 -1.450 1.00 32.42 H ATOM 133 HB2 LEU A 9 -3.326 10.936 -1.758 1.00 44.14 H ATOM 134 HB3 LEU A 9 -3.082 9.428 -2.637 1.00 22.34 H ATOM 135 HG LEU A 9 -4.351 10.259 -4.510 1.00 70.23 H ATOM 136 HD11 LEU A 9 -4.831 12.900 -4.183 1.00 43.23 H ATOM 137 HD12 LEU A 9 -5.176 12.297 -2.563 1.00 3.44 H ATOM 138 HD13 LEU A 9 -6.036 11.634 -3.951 1.00 73.15 H ATOM 139 HD21 LEU A 9 -2.231 12.113 -3.460 1.00 24.22 H ATOM 140 HD22 LEU A 9 -2.945 12.297 -5.062 1.00 3.21 H ATOM 141 HD23 LEU A 9 -2.068 10.822 -4.652 1.00 15.31 H ATOM 142 N TYR A 10 -5.270 7.570 -3.005 1.00 43.41 N ATOM 143 CA TYR A 10 -5.905 6.643 -3.934 1.00 22.45 C ATOM 144 C TYR A 10 -7.255 6.175 -3.399 1.00 10.34 C ATOM 145 O TYR A 10 -8.263 6.222 -4.103 1.00 60.11 O ATOM 146 CB TYR A 10 -4.997 5.437 -4.183 1.00 34.42 C ATOM 147 CG TYR A 10 -5.484 4.532 -5.293 1.00 3.24 C ATOM 148 CD1 TYR A 10 -5.171 4.799 -6.620 1.00 25.21 C ATOM 149 CD2 TYR A 10 -6.257 3.412 -5.014 1.00 62.23 C ATOM 150 CE1 TYR A 10 -5.613 3.976 -7.637 1.00 71.34 C ATOM 151 CE2 TYR A 10 -6.702 2.582 -6.025 1.00 53.52 C ATOM 152 CZ TYR A 10 -6.378 2.869 -7.335 1.00 32.40 C ATOM 153 OH TYR A 10 -6.821 2.046 -8.345 1.00 33.31 O ATOM 154 H TYR A 10 -4.447 7.299 -2.546 1.00 74.04 H ATOM 155 HA TYR A 10 -6.061 7.162 -4.867 1.00 44.54 H ATOM 156 HB2 TYR A 10 -4.011 5.785 -4.448 1.00 54.31 H ATOM 157 HB3 TYR A 10 -4.935 4.849 -3.279 1.00 30.23 H ATOM 158 HD1 TYR A 10 -4.571 5.667 -6.854 1.00 20.33 H ATOM 159 HD2 TYR A 10 -6.509 3.191 -3.987 1.00 73.13 H ATOM 160 HE1 TYR A 10 -5.359 4.199 -8.663 1.00 53.22 H ATOM 161 HE2 TYR A 10 -7.302 1.716 -5.789 1.00 21.23 H ATOM 162 HH TYR A 10 -6.115 1.449 -8.604 1.00 74.30 H ATOM 163 N GLN A 11 -7.265 5.726 -2.148 1.00 32.02 N ATOM 164 CA GLN A 11 -8.491 5.250 -1.518 1.00 1.04 C ATOM 165 C GLN A 11 -9.548 6.349 -1.484 1.00 3.15 C ATOM 166 O GLN A 11 -10.693 6.137 -1.884 1.00 4.22 O ATOM 167 CB GLN A 11 -8.202 4.760 -0.098 1.00 31.33 C ATOM 168 CG GLN A 11 -7.709 3.323 -0.039 1.00 4.12 C ATOM 169 CD GLN A 11 -8.836 2.326 0.141 1.00 71.44 C ATOM 170 OE1 GLN A 11 -9.912 2.476 -0.440 1.00 3.03 O ATOM 171 NE2 GLN A 11 -8.596 1.299 0.947 1.00 25.43 N ATOM 172 H GLN A 11 -6.429 5.714 -1.637 1.00 74.25 H ATOM 173 HA GLN A 11 -8.866 4.425 -2.104 1.00 12.21 H ATOM 174 HB2 GLN A 11 -7.449 5.395 0.344 1.00 41.13 H ATOM 175 HB3 GLN A 11 -9.108 4.830 0.486 1.00 52.11 H ATOM 176 HG2 GLN A 11 -7.191 3.096 -0.959 1.00 21.42 H ATOM 177 HG3 GLN A 11 -7.025 3.225 0.791 1.00 21.05 H ATOM 178 HE21 GLN A 11 -7.716 1.244 1.377 1.00 43.22 H ATOM 179 HE22 GLN A 11 -9.307 0.639 1.082 1.00 43.40 H ATOM 180 N LYS A 12 -9.157 7.524 -1.003 1.00 3.44 N ATOM 181 CA LYS A 12 -10.069 8.658 -0.917 1.00 12.34 C ATOM 182 C LYS A 12 -10.610 9.028 -2.294 1.00 63.43 C ATOM 183 O LYS A 12 -11.822 9.100 -2.497 1.00 41.12 O ATOM 184 CB LYS A 12 -9.360 9.864 -0.295 1.00 71.13 C ATOM 185 CG LYS A 12 -10.285 11.036 -0.017 1.00 44.53 C ATOM 186 CD LYS A 12 -9.762 12.319 -0.643 1.00 31.04 C ATOM 187 CE LYS A 12 -9.909 12.301 -2.156 1.00 64.04 C ATOM 188 NZ LYS A 12 -9.910 13.675 -2.730 1.00 12.20 N ATOM 189 H LYS A 12 -8.231 7.632 -0.699 1.00 5.03 H ATOM 190 HA LYS A 12 -10.895 8.372 -0.284 1.00 35.02 H ATOM 191 HB2 LYS A 12 -8.908 9.559 0.637 1.00 14.43 H ATOM 192 HB3 LYS A 12 -8.584 10.197 -0.970 1.00 20.55 H ATOM 193 HG2 LYS A 12 -11.260 10.820 -0.428 1.00 24.11 H ATOM 194 HG3 LYS A 12 -10.365 11.174 1.052 1.00 44.43 H ATOM 195 HD2 LYS A 12 -10.320 13.155 -0.248 1.00 52.24 H ATOM 196 HD3 LYS A 12 -8.717 12.431 -0.392 1.00 44.40 H ATOM 197 HE2 LYS A 12 -9.085 11.745 -2.578 1.00 53.21 H ATOM 198 HE3 LYS A 12 -10.839 11.813 -2.409 1.00 3.50 H ATOM 199 HZ1 LYS A 12 -10.869 14.075 -2.697 1.00 54.33 H ATOM 200 HZ2 LYS A 12 -9.590 13.650 -3.719 1.00 70.53 H ATOM 201 HZ3 LYS A 12 -9.271 14.290 -2.187 1.00 30.22 H ATOM 202 N TYR A 13 -9.704 9.259 -3.238 1.00 25.43 N ATOM 203 CA TYR A 13 -10.090 9.621 -4.596 1.00 42.11 C ATOM 204 C TYR A 13 -11.038 8.583 -5.188 1.00 55.21 C ATOM 205 O TYR A 13 -11.973 8.923 -5.912 1.00 54.32 O ATOM 206 CB TYR A 13 -8.850 9.759 -5.482 1.00 12.04 C ATOM 207 CG TYR A 13 -9.119 10.457 -6.796 1.00 34.42 C ATOM 208 CD1 TYR A 13 -9.193 11.842 -6.867 1.00 42.23 C ATOM 209 CD2 TYR A 13 -9.299 9.730 -7.966 1.00 74.23 C ATOM 210 CE1 TYR A 13 -9.439 12.483 -8.066 1.00 13.43 C ATOM 211 CE2 TYR A 13 -9.545 10.363 -9.169 1.00 61.35 C ATOM 212 CZ TYR A 13 -9.614 11.740 -9.214 1.00 34.50 C ATOM 213 OH TYR A 13 -9.859 12.375 -10.410 1.00 62.30 O ATOM 214 H TYR A 13 -8.752 9.185 -3.015 1.00 40.22 H ATOM 215 HA TYR A 13 -10.597 10.574 -4.554 1.00 35.44 H ATOM 216 HB2 TYR A 13 -8.100 10.327 -4.953 1.00 70.22 H ATOM 217 HB3 TYR A 13 -8.462 8.775 -5.701 1.00 41.33 H ATOM 218 HD1 TYR A 13 -9.055 12.422 -5.966 1.00 64.10 H ATOM 219 HD2 TYR A 13 -9.244 8.651 -7.928 1.00 54.43 H ATOM 220 HE1 TYR A 13 -9.493 13.562 -8.101 1.00 33.51 H ATOM 221 HE2 TYR A 13 -9.682 9.781 -10.069 1.00 34.31 H ATOM 222 HH TYR A 13 -9.454 11.878 -11.125 1.00 22.43 H ATOM 223 N GLU A 14 -10.790 7.316 -4.873 1.00 62.11 N ATOM 224 CA GLU A 14 -11.621 6.228 -5.374 1.00 34.33 C ATOM 225 C GLU A 14 -12.965 6.192 -4.650 1.00 43.44 C ATOM 226 O GLU A 14 -13.977 5.781 -5.217 1.00 35.13 O ATOM 227 CB GLU A 14 -10.903 4.887 -5.204 1.00 10.41 C ATOM 228 CG GLU A 14 -9.736 4.697 -6.159 1.00 34.04 C ATOM 229 CD GLU A 14 -10.160 4.098 -7.485 1.00 73.44 C ATOM 230 OE1 GLU A 14 -11.381 4.025 -7.740 1.00 21.43 O ATOM 231 OE2 GLU A 14 -9.272 3.702 -8.269 1.00 33.41 O ATOM 232 H GLU A 14 -10.029 7.108 -4.291 1.00 73.11 H ATOM 233 HA GLU A 14 -11.797 6.401 -6.425 1.00 23.24 H ATOM 234 HB2 GLU A 14 -10.530 4.818 -4.193 1.00 5.32 H ATOM 235 HB3 GLU A 14 -11.612 4.090 -5.371 1.00 65.33 H ATOM 236 HG2 GLU A 14 -9.280 5.657 -6.345 1.00 5.33 H ATOM 237 HG3 GLU A 14 -9.014 4.039 -5.698 1.00 11.45 H ATOM 238 N LYS A 15 -12.965 6.626 -3.395 1.00 12.45 N ATOM 239 CA LYS A 15 -14.182 6.646 -2.592 1.00 12.22 C ATOM 240 C LYS A 15 -15.129 7.745 -3.065 1.00 65.23 C ATOM 241 O LYS A 15 -16.239 7.468 -3.522 1.00 3.14 O ATOM 242 CB LYS A 15 -13.840 6.855 -1.115 1.00 33.52 C ATOM 243 CG LYS A 15 -15.015 6.622 -0.180 1.00 25.11 C ATOM 244 CD LYS A 15 -15.120 5.163 0.230 1.00 31.34 C ATOM 245 CE LYS A 15 -16.145 4.419 -0.613 1.00 44.30 C ATOM 246 NZ LYS A 15 -17.417 4.198 0.128 1.00 55.43 N ATOM 247 H LYS A 15 -12.126 6.942 -2.998 1.00 2.42 H ATOM 248 HA LYS A 15 -14.672 5.691 -2.708 1.00 42.20 H ATOM 249 HB2 LYS A 15 -13.049 6.173 -0.841 1.00 64.33 H ATOM 250 HB3 LYS A 15 -13.493 7.869 -0.978 1.00 35.34 H ATOM 251 HG2 LYS A 15 -14.883 7.225 0.706 1.00 3.01 H ATOM 252 HG3 LYS A 15 -15.926 6.912 -0.683 1.00 12.02 H ATOM 253 HD2 LYS A 15 -14.157 4.691 0.104 1.00 2.41 H ATOM 254 HD3 LYS A 15 -15.415 5.110 1.269 1.00 52.21 H ATOM 255 HE2 LYS A 15 -16.350 4.999 -1.500 1.00 32.12 H ATOM 256 HE3 LYS A 15 -15.732 3.462 -0.896 1.00 41.32 H ATOM 257 HZ1 LYS A 15 -17.364 3.316 0.675 1.00 73.43 H ATOM 258 HZ2 LYS A 15 -18.212 4.133 -0.540 1.00 73.21 H ATOM 259 HZ3 LYS A 15 -17.593 4.988 0.781 1.00 43.54 H ATOM 260 N LEU A 16 -14.683 8.991 -2.955 1.00 45.34 N ATOM 261 CA LEU A 16 -15.489 10.132 -3.374 1.00 14.30 C ATOM 262 C LEU A 16 -15.872 10.018 -4.846 1.00 44.12 C ATOM 263 O LEU A 16 -17.018 10.265 -5.223 1.00 2.32 O ATOM 264 CB LEU A 16 -14.727 11.437 -3.133 1.00 35.42 C ATOM 265 CG LEU A 16 -14.008 11.555 -1.789 1.00 15.34 C ATOM 266 CD1 LEU A 16 -13.386 12.935 -1.636 1.00 34.41 C ATOM 267 CD2 LEU A 16 -14.969 11.272 -0.643 1.00 72.30 C ATOM 268 H LEU A 16 -13.790 9.149 -2.584 1.00 42.22 H ATOM 269 HA LEU A 16 -16.391 10.136 -2.780 1.00 1.34 H ATOM 270 HB2 LEU A 16 -13.988 11.537 -3.913 1.00 34.22 H ATOM 271 HB3 LEU A 16 -15.436 12.250 -3.204 1.00 5.24 H ATOM 272 HG LEU A 16 -13.213 10.824 -1.747 1.00 45.54 H ATOM 273 HD11 LEU A 16 -14.146 13.641 -1.339 1.00 13.24 H ATOM 274 HD12 LEU A 16 -12.957 13.242 -2.578 1.00 54.20 H ATOM 275 HD13 LEU A 16 -12.613 12.899 -0.883 1.00 65.00 H ATOM 276 HD21 LEU A 16 -15.814 11.941 -0.708 1.00 72.30 H ATOM 277 HD22 LEU A 16 -14.461 11.423 0.298 1.00 72.00 H ATOM 278 HD23 LEU A 16 -15.313 10.249 -0.706 1.00 43.22 H ATOM 279 N THR A 17 -14.904 9.640 -5.676 1.00 33.40 N ATOM 280 CA THR A 17 -15.139 9.491 -7.107 1.00 12.24 C ATOM 281 C THR A 17 -15.626 10.798 -7.722 1.00 44.04 C ATOM 282 O THR A 17 -16.300 10.797 -8.752 1.00 31.13 O ATOM 283 CB THR A 17 -16.172 8.385 -7.395 1.00 11.44 C ATOM 284 OG1 THR A 17 -16.263 7.496 -6.276 1.00 4.11 O ATOM 285 CG2 THR A 17 -15.793 7.602 -8.642 1.00 44.02 C ATOM 286 H THR A 17 -14.011 9.457 -5.316 1.00 35.13 H ATOM 287 HA THR A 17 -14.205 9.211 -7.571 1.00 5.52 H ATOM 288 HB THR A 17 -17.136 8.847 -7.557 1.00 4.24 H ATOM 289 HG1 THR A 17 -15.387 7.169 -6.055 1.00 71.15 H ATOM 290 HG21 THR A 17 -14.718 7.576 -8.737 1.00 44.34 H ATOM 291 HG22 THR A 17 -16.219 8.080 -9.511 1.00 53.44 H ATOM 292 HG23 THR A 17 -16.172 6.594 -8.563 1.00 65.13 H ATOM 293 N ALA A 18 -15.278 11.912 -7.086 1.00 73.12 N ATOM 294 CA ALA A 18 -15.678 13.226 -7.574 1.00 4.33 C ATOM 295 C ALA A 18 -17.183 13.292 -7.805 1.00 74.22 C ATOM 296 O ALA A 18 -17.783 14.366 -7.750 1.00 34.03 O ATOM 297 CB ALA A 18 -14.929 13.564 -8.855 1.00 35.41 C ATOM 298 H ALA A 18 -14.740 11.848 -6.270 1.00 45.13 H ATOM 299 HA ALA A 18 -15.407 13.957 -6.825 1.00 24.43 H ATOM 300 HB1 ALA A 18 -14.301 14.426 -8.687 1.00 43.10 H ATOM 301 HB2 ALA A 18 -14.318 12.723 -9.146 1.00 61.14 H ATOM 302 HB3 ALA A 18 -15.639 13.782 -9.639 1.00 11.33 H TER 303 ALA A 18 ENDMDL MODEL 2 ATOM 1 N VAL A 1 1.637 -0.258 -3.849 1.00 73.43 N ATOM 2 CA VAL A 1 2.065 1.005 -3.261 1.00 41.12 C ATOM 3 C VAL A 1 3.172 0.787 -2.236 1.00 21.31 C ATOM 4 O VAL A 1 3.236 -0.258 -1.590 1.00 30.55 O ATOM 5 CB VAL A 1 0.890 1.736 -2.584 1.00 64.02 C ATOM 6 CG1 VAL A 1 -0.074 2.278 -3.628 1.00 51.20 C ATOM 7 CG2 VAL A 1 0.174 0.808 -1.615 1.00 55.11 C ATOM 8 H1 VAL A 1 1.748 -1.086 -3.337 1.00 31.13 H ATOM 9 HA VAL A 1 2.442 1.632 -4.056 1.00 1.52 H ATOM 10 HB VAL A 1 1.287 2.570 -2.024 1.00 55.44 H ATOM 11 HG11 VAL A 1 -0.581 1.456 -4.111 1.00 63.32 H ATOM 12 HG12 VAL A 1 -0.800 2.919 -3.149 1.00 72.14 H ATOM 13 HG13 VAL A 1 0.475 2.845 -4.366 1.00 24.54 H ATOM 14 HG21 VAL A 1 -0.516 1.380 -1.012 1.00 71.42 H ATOM 15 HG22 VAL A 1 -0.369 0.058 -2.171 1.00 12.12 H ATOM 16 HG23 VAL A 1 0.898 0.327 -0.974 1.00 61.31 H ATOM 17 N ALA A 2 4.042 1.781 -2.092 1.00 64.21 N ATOM 18 CA ALA A 2 5.146 1.699 -1.143 1.00 71.34 C ATOM 19 C ALA A 2 4.960 2.688 0.002 1.00 41.43 C ATOM 20 O ALA A 2 5.398 2.442 1.126 1.00 42.03 O ATOM 21 CB ALA A 2 6.470 1.949 -1.851 1.00 14.34 C ATOM 22 H ALA A 2 3.939 2.589 -2.636 1.00 52.01 H ATOM 23 HA ALA A 2 5.165 0.696 -0.740 1.00 45.41 H ATOM 24 HB1 ALA A 2 6.976 1.008 -2.008 1.00 43.11 H ATOM 25 HB2 ALA A 2 6.285 2.423 -2.803 1.00 74.11 H ATOM 26 HB3 ALA A 2 7.086 2.593 -1.242 1.00 24.04 H ATOM 27 N PHE A 3 4.309 3.809 -0.291 1.00 14.13 N ATOM 28 CA PHE A 3 4.066 4.837 0.715 1.00 44.23 C ATOM 29 C PHE A 3 2.668 4.698 1.309 1.00 21.33 C ATOM 30 O PHE A 3 1.816 3.999 0.761 1.00 12.53 O ATOM 31 CB PHE A 3 4.236 6.229 0.102 1.00 0.25 C ATOM 32 CG PHE A 3 5.544 6.414 -0.612 1.00 50.34 C ATOM 33 CD1 PHE A 3 6.743 6.141 0.027 1.00 54.03 C ATOM 34 CD2 PHE A 3 5.575 6.861 -1.924 1.00 12.04 C ATOM 35 CE1 PHE A 3 7.947 6.311 -0.629 1.00 4.34 C ATOM 36 CE2 PHE A 3 6.777 7.033 -2.584 1.00 73.23 C ATOM 37 CZ PHE A 3 7.965 6.757 -1.936 1.00 75.51 C ATOM 38 H PHE A 3 3.983 3.948 -1.205 1.00 44.21 H ATOM 39 HA PHE A 3 4.794 4.708 1.501 1.00 13.23 H ATOM 40 HB2 PHE A 3 3.443 6.401 -0.609 1.00 75.21 H ATOM 41 HB3 PHE A 3 4.177 6.969 0.887 1.00 62.24 H ATOM 42 HD1 PHE A 3 6.731 5.792 1.049 1.00 70.33 H ATOM 43 HD2 PHE A 3 4.646 7.077 -2.432 1.00 15.21 H ATOM 44 HE1 PHE A 3 8.875 6.094 -0.120 1.00 12.43 H ATOM 45 HE2 PHE A 3 6.786 7.381 -3.606 1.00 42.14 H ATOM 46 HZ PHE A 3 8.905 6.891 -2.450 1.00 74.30 H ATOM 47 N ALA A 4 2.441 5.367 2.435 1.00 52.23 N ATOM 48 CA ALA A 4 1.147 5.320 3.104 1.00 74.34 C ATOM 49 C ALA A 4 0.230 6.432 2.606 1.00 42.31 C ATOM 50 O ALA A 4 -0.966 6.221 2.402 1.00 31.04 O ATOM 51 CB ALA A 4 1.328 5.417 4.611 1.00 12.41 C ATOM 52 H ALA A 4 3.160 5.907 2.823 1.00 22.24 H ATOM 53 HA ALA A 4 0.691 4.365 2.882 1.00 51.44 H ATOM 54 HB1 ALA A 4 1.843 6.336 4.852 1.00 14.21 H ATOM 55 HB2 ALA A 4 0.361 5.410 5.091 1.00 34.40 H ATOM 56 HB3 ALA A 4 1.909 4.577 4.959 1.00 65.34 H ATOM 57 N LEU A 5 0.798 7.618 2.412 1.00 30.42 N ATOM 58 CA LEU A 5 0.031 8.765 1.938 1.00 24.25 C ATOM 59 C LEU A 5 -0.677 8.442 0.627 1.00 40.33 C ATOM 60 O LEU A 5 -1.856 8.753 0.452 1.00 42.03 O ATOM 61 CB LEU A 5 0.949 9.974 1.752 1.00 41.32 C ATOM 62 CG LEU A 5 0.827 11.078 2.803 1.00 53.33 C ATOM 63 CD1 LEU A 5 -0.539 11.742 2.723 1.00 12.01 C ATOM 64 CD2 LEU A 5 1.069 10.517 4.196 1.00 14.04 C ATOM 65 H LEU A 5 1.755 7.725 2.591 1.00 30.15 H ATOM 66 HA LEU A 5 -0.711 8.999 2.687 1.00 73.33 H ATOM 67 HB2 LEU A 5 1.968 9.620 1.761 1.00 5.45 H ATOM 68 HB3 LEU A 5 0.730 10.409 0.787 1.00 72.12 H ATOM 69 HG LEU A 5 1.576 11.834 2.611 1.00 61.12 H ATOM 70 HD11 LEU A 5 -1.242 11.194 3.332 1.00 61.31 H ATOM 71 HD12 LEU A 5 -0.878 11.746 1.698 1.00 40.53 H ATOM 72 HD13 LEU A 5 -0.467 12.758 3.082 1.00 1.32 H ATOM 73 HD21 LEU A 5 1.533 9.545 4.117 1.00 14.35 H ATOM 74 HD22 LEU A 5 0.126 10.425 4.715 1.00 10.35 H ATOM 75 HD23 LEU A 5 1.718 11.184 4.745 1.00 22.30 H ATOM 76 N THR A 6 0.049 7.815 -0.293 1.00 61.34 N ATOM 77 CA THR A 6 -0.509 7.449 -1.589 1.00 34.32 C ATOM 78 C THR A 6 -1.731 6.552 -1.427 1.00 72.42 C ATOM 79 O THR A 6 -2.628 6.548 -2.272 1.00 10.44 O ATOM 80 CB THR A 6 0.531 6.727 -2.465 1.00 62.35 C ATOM 81 OG1 THR A 6 1.272 5.790 -1.675 1.00 73.35 O ATOM 82 CG2 THR A 6 1.485 7.724 -3.105 1.00 43.02 C ATOM 83 H THR A 6 0.983 7.594 -0.095 1.00 31.01 H ATOM 84 HA THR A 6 -0.806 8.357 -2.093 1.00 2.10 H ATOM 85 HB THR A 6 0.012 6.194 -3.249 1.00 52.13 H ATOM 86 HG1 THR A 6 0.888 4.915 -1.773 1.00 62.34 H ATOM 87 HG21 THR A 6 1.349 7.715 -4.176 1.00 44.31 H ATOM 88 HG22 THR A 6 2.503 7.451 -2.870 1.00 22.34 H ATOM 89 HG23 THR A 6 1.280 8.713 -2.724 1.00 44.41 H ATOM 90 N LEU A 7 -1.761 5.792 -0.338 1.00 33.30 N ATOM 91 CA LEU A 7 -2.875 4.890 -0.065 1.00 21.31 C ATOM 92 C LEU A 7 -4.157 5.672 0.201 1.00 40.35 C ATOM 93 O LEU A 7 -5.206 5.376 -0.370 1.00 42.22 O ATOM 94 CB LEU A 7 -2.551 3.997 1.134 1.00 33.22 C ATOM 95 CG LEU A 7 -3.401 2.734 1.279 1.00 31.12 C ATOM 96 CD1 LEU A 7 -2.847 1.615 0.411 1.00 40.00 C ATOM 97 CD2 LEU A 7 -3.466 2.299 2.736 1.00 24.20 C ATOM 98 H LEU A 7 -1.018 5.838 0.298 1.00 21.43 H ATOM 99 HA LEU A 7 -3.020 4.269 -0.937 1.00 0.33 H ATOM 100 HB2 LEU A 7 -1.519 3.693 1.051 1.00 33.21 H ATOM 101 HB3 LEU A 7 -2.680 4.588 2.030 1.00 63.01 H ATOM 102 HG LEU A 7 -4.408 2.945 0.948 1.00 54.35 H ATOM 103 HD11 LEU A 7 -3.591 0.841 0.303 1.00 33.23 H ATOM 104 HD12 LEU A 7 -1.963 1.203 0.875 1.00 13.15 H ATOM 105 HD13 LEU A 7 -2.592 2.008 -0.562 1.00 65.24 H ATOM 106 HD21 LEU A 7 -4.331 1.671 2.886 1.00 14.43 H ATOM 107 HD22 LEU A 7 -3.538 3.171 3.369 1.00 53.12 H ATOM 108 HD23 LEU A 7 -2.571 1.746 2.986 1.00 15.25 H ATOM 109 N ASN A 8 -4.064 6.674 1.069 1.00 23.22 N ATOM 110 CA ASN A 8 -5.216 7.501 1.409 1.00 31.41 C ATOM 111 C ASN A 8 -5.715 8.267 0.188 1.00 43.21 C ATOM 112 O ASN A 8 -6.920 8.371 -0.044 1.00 61.14 O ATOM 113 CB ASN A 8 -4.855 8.480 2.528 1.00 52.03 C ATOM 114 CG ASN A 8 -5.462 8.085 3.860 1.00 14.21 C ATOM 115 OD1 ASN A 8 -5.319 6.947 4.308 1.00 44.34 O ATOM 116 ND2 ASN A 8 -6.146 9.026 4.501 1.00 42.42 N ATOM 117 H ASN A 8 -3.200 6.861 1.492 1.00 2.42 H ATOM 118 HA ASN A 8 -6.002 6.847 1.755 1.00 34.20 H ATOM 119 HB2 ASN A 8 -3.781 8.510 2.639 1.00 41.33 H ATOM 120 HB3 ASN A 8 -5.214 9.464 2.267 1.00 41.25 H ATOM 121 HD21 ASN A 8 -6.219 9.911 4.084 1.00 72.50 H ATOM 122 HD22 ASN A 8 -6.548 8.798 5.365 1.00 54.54 H ATOM 123 N LEU A 9 -4.780 8.802 -0.590 1.00 11.32 N ATOM 124 CA LEU A 9 -5.124 9.559 -1.789 1.00 4.44 C ATOM 125 C LEU A 9 -5.843 8.676 -2.803 1.00 15.33 C ATOM 126 O LEU A 9 -6.885 9.053 -3.340 1.00 40.25 O ATOM 127 CB LEU A 9 -3.863 10.155 -2.418 1.00 11.20 C ATOM 128 CG LEU A 9 -3.862 11.672 -2.611 1.00 51.13 C ATOM 129 CD1 LEU A 9 -5.021 12.098 -3.500 1.00 23.24 C ATOM 130 CD2 LEU A 9 -3.930 12.381 -1.267 1.00 11.15 C ATOM 131 H LEU A 9 -3.837 8.686 -0.353 1.00 44.14 H ATOM 132 HA LEU A 9 -5.784 10.362 -1.496 1.00 2.15 H ATOM 133 HB2 LEU A 9 -3.026 9.902 -1.785 1.00 54.22 H ATOM 134 HB3 LEU A 9 -3.730 9.697 -3.388 1.00 34.12 H ATOM 135 HG LEU A 9 -2.943 11.966 -3.099 1.00 62.21 H ATOM 136 HD11 LEU A 9 -5.653 12.787 -2.961 1.00 30.12 H ATOM 137 HD12 LEU A 9 -5.595 11.228 -3.783 1.00 51.32 H ATOM 138 HD13 LEU A 9 -4.636 12.579 -4.387 1.00 2.43 H ATOM 139 HD21 LEU A 9 -4.939 12.723 -1.091 1.00 10.42 H ATOM 140 HD22 LEU A 9 -3.258 13.227 -1.272 1.00 33.34 H ATOM 141 HD23 LEU A 9 -3.640 11.696 -0.483 1.00 60.32 H ATOM 142 N TYR A 10 -5.283 7.499 -3.058 1.00 2.44 N ATOM 143 CA TYR A 10 -5.871 6.562 -4.007 1.00 40.33 C ATOM 144 C TYR A 10 -7.250 6.107 -3.541 1.00 14.54 C ATOM 145 O TYR A 10 -8.234 6.226 -4.271 1.00 31.24 O ATOM 146 CB TYR A 10 -4.957 5.350 -4.192 1.00 32.44 C ATOM 147 CG TYR A 10 -5.094 4.689 -5.545 1.00 23.44 C ATOM 148 CD1 TYR A 10 -6.128 3.798 -5.803 1.00 33.41 C ATOM 149 CD2 TYR A 10 -4.188 4.954 -6.564 1.00 51.02 C ATOM 150 CE1 TYR A 10 -6.257 3.191 -7.037 1.00 62.33 C ATOM 151 CE2 TYR A 10 -4.310 4.353 -7.802 1.00 23.10 C ATOM 152 CZ TYR A 10 -5.345 3.472 -8.034 1.00 34.14 C ATOM 153 OH TYR A 10 -5.469 2.870 -9.265 1.00 11.01 O ATOM 154 H TYR A 10 -4.453 7.255 -2.598 1.00 3.34 H ATOM 155 HA TYR A 10 -5.973 7.071 -4.955 1.00 35.32 H ATOM 156 HB2 TYR A 10 -3.930 5.660 -4.077 1.00 53.44 H ATOM 157 HB3 TYR A 10 -5.191 4.613 -3.437 1.00 74.00 H ATOM 158 HD1 TYR A 10 -6.841 3.579 -5.020 1.00 43.35 H ATOM 159 HD2 TYR A 10 -3.378 5.644 -6.379 1.00 43.32 H ATOM 160 HE1 TYR A 10 -7.068 2.501 -7.219 1.00 62.13 H ATOM 161 HE2 TYR A 10 -3.596 4.573 -8.582 1.00 62.41 H ATOM 162 HH TYR A 10 -5.208 1.949 -9.198 1.00 64.41 H ATOM 163 N GLN A 11 -7.313 5.588 -2.319 1.00 21.41 N ATOM 164 CA GLN A 11 -8.571 5.115 -1.754 1.00 32.21 C ATOM 165 C GLN A 11 -9.628 6.214 -1.782 1.00 3.43 C ATOM 166 O GLN A 11 -10.773 5.980 -2.167 1.00 52.13 O ATOM 167 CB GLN A 11 -8.360 4.630 -0.318 1.00 41.35 C ATOM 168 CG GLN A 11 -9.561 3.899 0.260 1.00 42.31 C ATOM 169 CD GLN A 11 -10.059 2.789 -0.644 1.00 23.31 C ATOM 170 OE1 GLN A 11 -10.948 2.996 -1.470 1.00 42.51 O ATOM 171 NE2 GLN A 11 -9.487 1.600 -0.492 1.00 4.03 N ATOM 172 H GLN A 11 -6.494 5.520 -1.786 1.00 12.13 H ATOM 173 HA GLN A 11 -8.915 4.288 -2.356 1.00 63.43 H ATOM 174 HB2 GLN A 11 -7.513 3.960 -0.298 1.00 54.41 H ATOM 175 HB3 GLN A 11 -8.149 5.483 0.309 1.00 0.53 H ATOM 176 HG2 GLN A 11 -9.281 3.470 1.211 1.00 54.23 H ATOM 177 HG3 GLN A 11 -10.361 4.609 0.408 1.00 41.51 H ATOM 178 HE21 GLN A 11 -8.785 1.508 0.188 1.00 74.15 H ATOM 179 HE22 GLN A 11 -9.790 0.864 -1.062 1.00 44.10 H ATOM 180 N LYS A 12 -9.236 7.415 -1.370 1.00 45.30 N ATOM 181 CA LYS A 12 -10.148 8.553 -1.348 1.00 64.31 C ATOM 182 C LYS A 12 -10.687 8.844 -2.745 1.00 14.24 C ATOM 183 O LYS A 12 -11.900 8.904 -2.952 1.00 4.51 O ATOM 184 CB LYS A 12 -9.438 9.791 -0.795 1.00 73.12 C ATOM 185 CG LYS A 12 -10.349 10.997 -0.644 1.00 50.05 C ATOM 186 CD LYS A 12 -9.739 12.238 -1.273 1.00 50.54 C ATOM 187 CE LYS A 12 -9.823 12.193 -2.791 1.00 54.14 C ATOM 188 NZ LYS A 12 -10.036 13.546 -3.376 1.00 2.22 N ATOM 189 H LYS A 12 -8.309 7.540 -1.074 1.00 61.03 H ATOM 190 HA LYS A 12 -10.974 8.303 -0.701 1.00 33.44 H ATOM 191 HB2 LYS A 12 -9.027 9.553 0.175 1.00 74.42 H ATOM 192 HB3 LYS A 12 -8.631 10.057 -1.463 1.00 33.21 H ATOM 193 HG2 LYS A 12 -11.292 10.788 -1.128 1.00 64.11 H ATOM 194 HG3 LYS A 12 -10.515 11.182 0.407 1.00 32.14 H ATOM 195 HD2 LYS A 12 -10.272 13.109 -0.921 1.00 5.23 H ATOM 196 HD3 LYS A 12 -8.701 12.306 -0.981 1.00 4.30 H ATOM 197 HE2 LYS A 12 -8.903 11.784 -3.178 1.00 4.00 H ATOM 198 HE3 LYS A 12 -10.647 11.555 -3.074 1.00 34.31 H ATOM 199 HZ1 LYS A 12 -9.494 14.255 -2.842 1.00 43.33 H ATOM 200 HZ2 LYS A 12 -11.045 13.797 -3.339 1.00 23.41 H ATOM 201 HZ3 LYS A 12 -9.723 13.560 -4.367 1.00 52.24 H ATOM 202 N TYR A 13 -9.781 9.023 -3.699 1.00 22.21 N ATOM 203 CA TYR A 13 -10.166 9.309 -5.076 1.00 35.24 C ATOM 204 C TYR A 13 -11.088 8.222 -5.620 1.00 63.54 C ATOM 205 O TYR A 13 -12.018 8.503 -6.375 1.00 70.41 O ATOM 206 CB TYR A 13 -8.925 9.431 -5.960 1.00 43.13 C ATOM 207 CG TYR A 13 -8.848 10.736 -6.720 1.00 14.33 C ATOM 208 CD1 TYR A 13 -9.741 11.019 -7.746 1.00 51.01 C ATOM 209 CD2 TYR A 13 -7.884 11.687 -6.410 1.00 1.41 C ATOM 210 CE1 TYR A 13 -9.674 12.210 -8.443 1.00 34.10 C ATOM 211 CE2 TYR A 13 -7.811 12.882 -7.101 1.00 23.35 C ATOM 212 CZ TYR A 13 -8.708 13.138 -8.116 1.00 42.04 C ATOM 213 OH TYR A 13 -8.639 14.326 -8.807 1.00 40.13 O ATOM 214 H TYR A 13 -8.829 8.963 -3.472 1.00 74.41 H ATOM 215 HA TYR A 13 -10.696 10.250 -5.083 1.00 42.41 H ATOM 216 HB2 TYR A 13 -8.043 9.355 -5.343 1.00 44.24 H ATOM 217 HB3 TYR A 13 -8.924 8.627 -6.681 1.00 72.24 H ATOM 218 HD1 TYR A 13 -10.497 10.290 -7.999 1.00 73.10 H ATOM 219 HD2 TYR A 13 -7.183 11.484 -5.614 1.00 24.23 H ATOM 220 HE1 TYR A 13 -10.377 12.411 -9.238 1.00 50.02 H ATOM 221 HE2 TYR A 13 -7.054 13.609 -6.845 1.00 62.24 H ATOM 222 HH TYR A 13 -8.234 14.175 -9.665 1.00 21.45 H ATOM 223 N GLU A 14 -10.821 6.979 -5.231 1.00 22.12 N ATOM 224 CA GLU A 14 -11.625 5.849 -5.680 1.00 33.31 C ATOM 225 C GLU A 14 -12.979 5.831 -4.976 1.00 53.03 C ATOM 226 O GLU A 14 -13.974 5.361 -5.530 1.00 23.14 O ATOM 227 CB GLU A 14 -10.887 4.534 -5.422 1.00 22.33 C ATOM 228 CG GLU A 14 -11.060 3.510 -6.531 1.00 42.45 C ATOM 229 CD GLU A 14 -11.760 2.251 -6.060 1.00 21.24 C ATOM 230 OE1 GLU A 14 -12.751 2.368 -5.310 1.00 34.13 O ATOM 231 OE2 GLU A 14 -11.316 1.148 -6.441 1.00 62.42 O ATOM 232 H GLU A 14 -10.065 6.818 -4.628 1.00 11.41 H ATOM 233 HA GLU A 14 -11.787 5.958 -6.742 1.00 25.43 H ATOM 234 HB2 GLU A 14 -9.833 4.742 -5.313 1.00 3.12 H ATOM 235 HB3 GLU A 14 -11.256 4.103 -4.503 1.00 22.42 H ATOM 236 HG2 GLU A 14 -11.644 3.953 -7.324 1.00 53.01 H ATOM 237 HG3 GLU A 14 -10.085 3.242 -6.912 1.00 10.15 H ATOM 238 N LYS A 15 -13.010 6.346 -3.752 1.00 1.11 N ATOM 239 CA LYS A 15 -14.240 6.391 -2.971 1.00 12.32 C ATOM 240 C LYS A 15 -15.188 7.458 -3.510 1.00 0.14 C ATOM 241 O LYS A 15 -16.284 7.149 -3.980 1.00 2.32 O ATOM 242 CB LYS A 15 -13.925 6.670 -1.500 1.00 4.55 C ATOM 243 CG LYS A 15 -14.638 5.737 -0.537 1.00 2.03 C ATOM 244 CD LYS A 15 -14.898 6.409 0.801 1.00 21.53 C ATOM 245 CE LYS A 15 -13.979 5.866 1.885 1.00 34.43 C ATOM 246 NZ LYS A 15 -14.553 6.058 3.246 1.00 2.50 N ATOM 247 H LYS A 15 -12.184 6.706 -3.364 1.00 71.12 H ATOM 248 HA LYS A 15 -14.720 5.427 -3.051 1.00 5.43 H ATOM 249 HB2 LYS A 15 -12.860 6.568 -1.346 1.00 74.43 H ATOM 250 HB3 LYS A 15 -14.217 7.685 -1.267 1.00 64.44 H ATOM 251 HG2 LYS A 15 -15.583 5.442 -0.969 1.00 25.13 H ATOM 252 HG3 LYS A 15 -14.024 4.862 -0.377 1.00 21.01 H ATOM 253 HD2 LYS A 15 -14.729 7.470 0.701 1.00 44.34 H ATOM 254 HD3 LYS A 15 -15.925 6.232 1.089 1.00 24.45 H ATOM 255 HE2 LYS A 15 -13.827 4.811 1.715 1.00 43.04 H ATOM 256 HE3 LYS A 15 -13.032 6.380 1.827 1.00 42.53 H ATOM 257 HZ1 LYS A 15 -13.896 5.696 3.966 1.00 64.13 H ATOM 258 HZ2 LYS A 15 -15.456 5.549 3.328 1.00 1.13 H ATOM 259 HZ3 LYS A 15 -14.721 7.069 3.423 1.00 42.30 H ATOM 260 N LEU A 16 -14.759 8.713 -3.440 1.00 13.53 N ATOM 261 CA LEU A 16 -15.569 9.827 -3.922 1.00 75.43 C ATOM 262 C LEU A 16 -15.916 9.648 -5.397 1.00 15.41 C ATOM 263 O LEU A 16 -17.061 9.847 -5.805 1.00 72.15 O ATOM 264 CB LEU A 16 -14.828 11.149 -3.717 1.00 74.11 C ATOM 265 CG LEU A 16 -14.142 11.331 -2.363 1.00 33.22 C ATOM 266 CD1 LEU A 16 -13.542 12.724 -2.251 1.00 71.42 C ATOM 267 CD2 LEU A 16 -15.125 11.079 -1.229 1.00 14.32 C ATOM 268 H LEU A 16 -13.877 8.897 -3.055 1.00 15.32 H ATOM 269 HA LEU A 16 -16.484 9.843 -3.349 1.00 14.20 H ATOM 270 HB2 LEU A 16 -14.073 11.227 -4.483 1.00 63.35 H ATOM 271 HB3 LEU A 16 -15.544 11.950 -3.837 1.00 0.10 H ATOM 272 HG LEU A 16 -13.338 10.613 -2.275 1.00 0.34 H ATOM 273 HD11 LEU A 16 -14.163 13.333 -1.613 1.00 55.30 H ATOM 274 HD12 LEU A 16 -13.486 13.171 -3.233 1.00 24.14 H ATOM 275 HD13 LEU A 16 -12.550 12.655 -1.830 1.00 2.12 H ATOM 276 HD21 LEU A 16 -16.131 11.264 -1.576 1.00 42.15 H ATOM 277 HD22 LEU A 16 -14.901 11.741 -0.405 1.00 53.24 H ATOM 278 HD23 LEU A 16 -15.040 10.054 -0.899 1.00 72.35 H ATOM 279 N THR A 17 -14.921 9.270 -6.192 1.00 43.35 N ATOM 280 CA THR A 17 -15.120 9.064 -7.621 1.00 52.03 C ATOM 281 C THR A 17 -15.594 10.344 -8.301 1.00 33.43 C ATOM 282 O THR A 17 -16.250 10.299 -9.341 1.00 62.12 O ATOM 283 CB THR A 17 -16.143 7.944 -7.890 1.00 14.33 C ATOM 284 OG1 THR A 17 -16.283 7.119 -6.728 1.00 4.01 O ATOM 285 CG2 THR A 17 -15.715 7.092 -9.075 1.00 2.31 C ATOM 286 H THR A 17 -14.031 9.128 -5.808 1.00 23.02 H ATOM 287 HA THR A 17 -14.174 8.769 -8.051 1.00 61.11 H ATOM 288 HB THR A 17 -17.098 8.397 -8.117 1.00 71.11 H ATOM 289 HG1 THR A 17 -17.036 6.534 -6.839 1.00 61.01 H ATOM 290 HG21 THR A 17 -15.282 6.170 -8.717 1.00 14.20 H ATOM 291 HG22 THR A 17 -14.983 7.630 -9.659 1.00 4.11 H ATOM 292 HG23 THR A 17 -16.575 6.872 -9.690 1.00 1.14 H ATOM 293 N ALA A 18 -15.258 11.483 -7.706 1.00 1.51 N ATOM 294 CA ALA A 18 -15.647 12.776 -8.256 1.00 12.02 C ATOM 295 C ALA A 18 -17.146 12.827 -8.531 1.00 33.42 C ATOM 296 O ALA A 18 -17.827 13.776 -8.141 1.00 2.31 O ATOM 297 CB ALA A 18 -14.865 13.065 -9.528 1.00 52.25 C ATOM 298 H ALA A 18 -14.734 11.454 -6.878 1.00 53.33 H ATOM 299 HA ALA A 18 -15.399 13.536 -7.529 1.00 42.42 H ATOM 300 HB1 ALA A 18 -14.040 12.372 -9.608 1.00 51.23 H ATOM 301 HB2 ALA A 18 -15.515 12.952 -10.383 1.00 42.35 H ATOM 302 HB3 ALA A 18 -14.485 14.075 -9.495 1.00 52.34 H TER 303 ALA A 18 ENDMDL MODEL 3 ATOM 1 N VAL A 1 0.980 0.561 -4.764 1.00 73.35 N ATOM 2 CA VAL A 1 1.361 0.778 -3.374 1.00 45.23 C ATOM 3 C VAL A 1 2.808 1.250 -3.269 1.00 35.53 C ATOM 4 O VAL A 1 3.735 0.525 -3.628 1.00 30.35 O ATOM 5 CB VAL A 1 1.188 -0.503 -2.538 1.00 24.35 C ATOM 6 CG1 VAL A 1 1.454 -0.221 -1.067 1.00 4.12 C ATOM 7 CG2 VAL A 1 -0.204 -1.083 -2.734 1.00 70.42 C ATOM 8 H1 VAL A 1 1.372 1.126 -5.462 1.00 10.41 H ATOM 9 HA VAL A 1 0.714 1.540 -2.965 1.00 52.24 H ATOM 10 HB VAL A 1 1.910 -1.231 -2.878 1.00 21.33 H ATOM 11 HG11 VAL A 1 0.693 0.443 -0.685 1.00 34.24 H ATOM 12 HG12 VAL A 1 1.437 -1.148 -0.513 1.00 31.11 H ATOM 13 HG13 VAL A 1 2.423 0.245 -0.959 1.00 60.24 H ATOM 14 HG21 VAL A 1 -0.864 -0.317 -3.113 1.00 23.12 H ATOM 15 HG22 VAL A 1 -0.157 -1.899 -3.440 1.00 22.42 H ATOM 16 HG23 VAL A 1 -0.580 -1.447 -1.789 1.00 11.23 H ATOM 17 N ALA A 2 2.992 2.469 -2.773 1.00 60.15 N ATOM 18 CA ALA A 2 4.325 3.037 -2.618 1.00 65.40 C ATOM 19 C ALA A 2 4.536 3.565 -1.203 1.00 73.01 C ATOM 20 O ALA A 2 5.407 3.089 -0.475 1.00 10.01 O ATOM 21 CB ALA A 2 4.549 4.145 -3.636 1.00 62.11 C ATOM 22 H ALA A 2 2.213 2.999 -2.505 1.00 33.40 H ATOM 23 HA ALA A 2 5.046 2.254 -2.810 1.00 52.20 H ATOM 24 HB1 ALA A 2 4.183 5.079 -3.236 1.00 54.21 H ATOM 25 HB2 ALA A 2 5.605 4.232 -3.847 1.00 14.44 H ATOM 26 HB3 ALA A 2 4.018 3.910 -4.546 1.00 63.33 H ATOM 27 N PHE A 3 3.733 4.552 -0.820 1.00 33.03 N ATOM 28 CA PHE A 3 3.832 5.146 0.508 1.00 2.42 C ATOM 29 C PHE A 3 2.502 5.046 1.250 1.00 45.11 C ATOM 30 O PHE A 3 1.506 4.579 0.699 1.00 21.23 O ATOM 31 CB PHE A 3 4.261 6.611 0.403 1.00 4.45 C ATOM 32 CG PHE A 3 5.621 6.795 -0.208 1.00 51.40 C ATOM 33 CD1 PHE A 3 6.765 6.487 0.510 1.00 44.25 C ATOM 34 CD2 PHE A 3 5.754 7.277 -1.500 1.00 43.23 C ATOM 35 CE1 PHE A 3 8.018 6.655 -0.050 1.00 50.03 C ATOM 36 CE2 PHE A 3 7.004 7.447 -2.065 1.00 61.35 C ATOM 37 CZ PHE A 3 8.137 7.136 -1.339 1.00 43.43 C ATOM 38 H PHE A 3 3.057 4.889 -1.445 1.00 43.14 H ATOM 39 HA PHE A 3 4.581 4.599 1.060 1.00 12.40 H ATOM 40 HB2 PHE A 3 3.549 7.145 -0.207 1.00 13.21 H ATOM 41 HB3 PHE A 3 4.279 7.045 1.392 1.00 41.11 H ATOM 42 HD1 PHE A 3 6.673 6.111 1.519 1.00 71.43 H ATOM 43 HD2 PHE A 3 4.869 7.521 -2.069 1.00 42.42 H ATOM 44 HE1 PHE A 3 8.902 6.411 0.521 1.00 53.45 H ATOM 45 HE2 PHE A 3 7.095 7.824 -3.073 1.00 72.53 H ATOM 46 HZ PHE A 3 9.115 7.268 -1.779 1.00 32.32 H ATOM 47 N ALA A 4 2.496 5.488 2.503 1.00 2.03 N ATOM 48 CA ALA A 4 1.290 5.450 3.321 1.00 60.22 C ATOM 49 C ALA A 4 0.302 6.529 2.892 1.00 74.23 C ATOM 50 O ALA A 4 -0.904 6.286 2.815 1.00 44.22 O ATOM 51 CB ALA A 4 1.644 5.611 4.792 1.00 61.52 C ATOM 52 H ALA A 4 3.322 5.850 2.887 1.00 62.43 H ATOM 53 HA ALA A 4 0.829 4.481 3.190 1.00 1.25 H ATOM 54 HB1 ALA A 4 1.158 6.492 5.184 1.00 41.32 H ATOM 55 HB2 ALA A 4 1.310 4.742 5.339 1.00 24.41 H ATOM 56 HB3 ALA A 4 2.714 5.713 4.895 1.00 31.21 H ATOM 57 N LEU A 5 0.818 7.721 2.614 1.00 61.33 N ATOM 58 CA LEU A 5 -0.020 8.838 2.193 1.00 43.34 C ATOM 59 C LEU A 5 -0.722 8.526 0.875 1.00 43.32 C ATOM 60 O LEU A 5 -1.935 8.697 0.749 1.00 61.22 O ATOM 61 CB LEU A 5 0.823 10.107 2.047 1.00 70.51 C ATOM 62 CG LEU A 5 0.599 11.186 3.106 1.00 3.41 C ATOM 63 CD1 LEU A 5 1.822 12.084 3.220 1.00 54.25 C ATOM 64 CD2 LEU A 5 -0.639 12.007 2.778 1.00 51.34 C ATOM 65 H LEU A 5 1.785 7.854 2.693 1.00 24.51 H ATOM 66 HA LEU A 5 -0.767 8.998 2.956 1.00 60.04 H ATOM 67 HB2 LEU A 5 1.862 9.819 2.083 1.00 64.31 H ATOM 68 HB3 LEU A 5 0.604 10.539 1.081 1.00 61.22 H ATOM 69 HG LEU A 5 0.443 10.713 4.066 1.00 42.40 H ATOM 70 HD11 LEU A 5 1.978 12.351 4.254 1.00 75.13 H ATOM 71 HD12 LEU A 5 1.666 12.980 2.636 1.00 33.42 H ATOM 72 HD13 LEU A 5 2.689 11.559 2.847 1.00 4.35 H ATOM 73 HD21 LEU A 5 -1.335 11.955 3.602 1.00 43.12 H ATOM 74 HD22 LEU A 5 -1.106 11.613 1.887 1.00 44.43 H ATOM 75 HD23 LEU A 5 -0.355 13.036 2.610 1.00 42.21 H ATOM 76 N THR A 6 0.049 8.066 -0.106 1.00 31.11 N ATOM 77 CA THR A 6 -0.498 7.729 -1.414 1.00 34.32 C ATOM 78 C THR A 6 -1.660 6.750 -1.288 1.00 32.10 C ATOM 79 O THR A 6 -2.588 6.764 -2.098 1.00 62.23 O ATOM 80 CB THR A 6 0.576 7.117 -2.332 1.00 25.31 C ATOM 81 OG1 THR A 6 1.707 6.706 -1.556 1.00 24.33 O ATOM 82 CG2 THR A 6 1.018 8.117 -3.390 1.00 34.30 C ATOM 83 H THR A 6 1.009 7.952 0.056 1.00 73.54 H ATOM 84 HA THR A 6 -0.856 8.640 -1.871 1.00 1.12 H ATOM 85 HB THR A 6 0.156 6.253 -2.827 1.00 20.01 H ATOM 86 HG1 THR A 6 2.480 6.647 -2.123 1.00 23.54 H ATOM 87 HG21 THR A 6 0.646 7.806 -4.355 1.00 4.10 H ATOM 88 HG22 THR A 6 2.096 8.160 -3.417 1.00 3.43 H ATOM 89 HG23 THR A 6 0.623 9.093 -3.149 1.00 62.34 H ATOM 90 N LEU A 7 -1.605 5.901 -0.267 1.00 43.35 N ATOM 91 CA LEU A 7 -2.654 4.915 -0.035 1.00 21.23 C ATOM 92 C LEU A 7 -3.981 5.596 0.285 1.00 43.14 C ATOM 93 O LEU A 7 -5.002 5.310 -0.338 1.00 52.04 O ATOM 94 CB LEU A 7 -2.258 3.981 1.111 1.00 54.15 C ATOM 95 CG LEU A 7 -3.036 2.668 1.205 1.00 63.33 C ATOM 96 CD1 LEU A 7 -2.552 1.685 0.150 1.00 74.51 C ATOM 97 CD2 LEU A 7 -2.902 2.068 2.597 1.00 73.42 C ATOM 98 H LEU A 7 -0.841 5.938 0.345 1.00 43.14 H ATOM 99 HA LEU A 7 -2.769 4.335 -0.938 1.00 72.51 H ATOM 100 HB2 LEU A 7 -1.213 3.739 0.994 1.00 73.24 H ATOM 101 HB3 LEU A 7 -2.400 4.518 2.038 1.00 71.02 H ATOM 102 HG LEU A 7 -4.084 2.863 1.023 1.00 44.12 H ATOM 103 HD11 LEU A 7 -1.505 1.476 0.306 1.00 61.25 H ATOM 104 HD12 LEU A 7 -2.692 2.112 -0.832 1.00 15.22 H ATOM 105 HD13 LEU A 7 -3.118 0.768 0.227 1.00 73.54 H ATOM 106 HD21 LEU A 7 -1.863 1.852 2.798 1.00 55.51 H ATOM 107 HD22 LEU A 7 -3.477 1.155 2.651 1.00 23.42 H ATOM 108 HD23 LEU A 7 -3.274 2.770 3.329 1.00 44.43 H ATOM 109 N ASN A 8 -3.956 6.500 1.258 1.00 15.43 N ATOM 110 CA ASN A 8 -5.157 7.224 1.659 1.00 14.22 C ATOM 111 C ASN A 8 -5.712 8.043 0.498 1.00 53.03 C ATOM 112 O ASN A 8 -6.912 8.014 0.220 1.00 31.24 O ATOM 113 CB ASN A 8 -4.853 8.142 2.845 1.00 20.32 C ATOM 114 CG ASN A 8 -5.252 7.524 4.171 1.00 14.24 C ATOM 115 OD1 ASN A 8 -4.442 6.880 4.838 1.00 52.01 O ATOM 116 ND2 ASN A 8 -6.507 7.718 4.560 1.00 12.43 N ATOM 117 H ASN A 8 -3.111 6.685 1.718 1.00 12.35 H ATOM 118 HA ASN A 8 -5.898 6.498 1.958 1.00 23.45 H ATOM 119 HB2 ASN A 8 -3.793 8.347 2.871 1.00 64.03 H ATOM 120 HB3 ASN A 8 -5.392 9.069 2.723 1.00 12.04 H ATOM 121 HD21 ASN A 8 -7.097 8.242 3.978 1.00 21.11 H ATOM 122 HD22 ASN A 8 -6.792 7.331 5.414 1.00 21.21 H ATOM 123 N LEU A 9 -4.832 8.772 -0.179 1.00 3.45 N ATOM 124 CA LEU A 9 -5.233 9.599 -1.311 1.00 45.44 C ATOM 125 C LEU A 9 -5.872 8.751 -2.406 1.00 13.03 C ATOM 126 O LEU A 9 -6.917 9.108 -2.951 1.00 44.14 O ATOM 127 CB LEU A 9 -4.024 10.350 -1.873 1.00 63.22 C ATOM 128 CG LEU A 9 -4.329 11.645 -2.627 1.00 24.02 C ATOM 129 CD1 LEU A 9 -3.142 12.594 -2.559 1.00 31.10 C ATOM 130 CD2 LEU A 9 -4.693 11.347 -4.074 1.00 34.13 C ATOM 131 H LEU A 9 -3.890 8.755 0.089 1.00 24.13 H ATOM 132 HA LEU A 9 -5.959 10.316 -0.958 1.00 5.33 H ATOM 133 HB2 LEU A 9 -3.373 10.593 -1.048 1.00 1.34 H ATOM 134 HB3 LEU A 9 -3.509 9.685 -2.552 1.00 25.55 H ATOM 135 HG LEU A 9 -5.173 12.134 -2.162 1.00 15.21 H ATOM 136 HD11 LEU A 9 -3.498 13.609 -2.467 1.00 22.24 H ATOM 137 HD12 LEU A 9 -2.554 12.499 -3.460 1.00 5.15 H ATOM 138 HD13 LEU A 9 -2.532 12.346 -1.703 1.00 3.22 H ATOM 139 HD21 LEU A 9 -4.964 12.265 -4.573 1.00 41.12 H ATOM 140 HD22 LEU A 9 -5.529 10.663 -4.100 1.00 64.42 H ATOM 141 HD23 LEU A 9 -3.846 10.900 -4.574 1.00 32.02 H ATOM 142 N TYR A 10 -5.240 7.626 -2.720 1.00 33.31 N ATOM 143 CA TYR A 10 -5.748 6.726 -3.749 1.00 45.01 C ATOM 144 C TYR A 10 -7.126 6.191 -3.374 1.00 21.44 C ATOM 145 O TYR A 10 -8.081 6.313 -4.140 1.00 44.14 O ATOM 146 CB TYR A 10 -4.777 5.563 -3.963 1.00 12.02 C ATOM 147 CG TYR A 10 -4.979 4.839 -5.275 1.00 0.40 C ATOM 148 CD1 TYR A 10 -4.355 5.279 -6.436 1.00 54.42 C ATOM 149 CD2 TYR A 10 -5.794 3.717 -5.354 1.00 25.30 C ATOM 150 CE1 TYR A 10 -4.537 4.622 -7.638 1.00 32.04 C ATOM 151 CE2 TYR A 10 -5.980 3.052 -6.551 1.00 1.24 C ATOM 152 CZ TYR A 10 -5.350 3.509 -7.690 1.00 21.34 C ATOM 153 OH TYR A 10 -5.534 2.850 -8.884 1.00 11.42 O ATOM 154 H TYR A 10 -4.412 7.395 -2.250 1.00 30.11 H ATOM 155 HA TYR A 10 -5.830 7.287 -4.669 1.00 21.24 H ATOM 156 HB2 TYR A 10 -3.766 5.939 -3.944 1.00 61.21 H ATOM 157 HB3 TYR A 10 -4.905 4.846 -3.165 1.00 65.21 H ATOM 158 HD1 TYR A 10 -3.719 6.152 -6.392 1.00 74.34 H ATOM 159 HD2 TYR A 10 -6.286 3.362 -4.460 1.00 1.11 H ATOM 160 HE1 TYR A 10 -4.044 4.979 -8.530 1.00 20.22 H ATOM 161 HE2 TYR A 10 -6.617 2.181 -6.592 1.00 24.24 H ATOM 162 HH TYR A 10 -6.084 2.076 -8.741 1.00 5.13 H ATOM 163 N GLN A 11 -7.220 5.597 -2.188 1.00 12.51 N ATOM 164 CA GLN A 11 -8.481 5.043 -1.710 1.00 12.02 C ATOM 165 C GLN A 11 -9.583 6.098 -1.732 1.00 62.52 C ATOM 166 O GLN A 11 -10.681 5.853 -2.232 1.00 50.22 O ATOM 167 CB GLN A 11 -8.315 4.492 -0.293 1.00 34.44 C ATOM 168 CG GLN A 11 -8.830 3.071 -0.129 1.00 32.34 C ATOM 169 CD GLN A 11 -9.468 2.834 1.226 1.00 23.23 C ATOM 170 OE1 GLN A 11 -9.303 3.630 2.151 1.00 51.54 O ATOM 171 NE2 GLN A 11 -10.201 1.734 1.351 1.00 32.14 N ATOM 172 H GLN A 11 -6.424 5.531 -1.622 1.00 64.21 H ATOM 173 HA GLN A 11 -8.760 4.236 -2.370 1.00 24.31 H ATOM 174 HB2 GLN A 11 -7.267 4.504 -0.035 1.00 10.15 H ATOM 175 HB3 GLN A 11 -8.855 5.128 0.394 1.00 65.13 H ATOM 176 HG2 GLN A 11 -9.567 2.878 -0.894 1.00 61.42 H ATOM 177 HG3 GLN A 11 -8.003 2.386 -0.246 1.00 1.42 H ATOM 178 HE21 GLN A 11 -10.287 1.144 0.573 1.00 52.44 H ATOM 179 HE22 GLN A 11 -10.624 1.556 2.216 1.00 31.52 H ATOM 180 N LYS A 12 -9.282 7.271 -1.187 1.00 14.41 N ATOM 181 CA LYS A 12 -10.246 8.365 -1.144 1.00 70.25 C ATOM 182 C LYS A 12 -10.692 8.752 -2.551 1.00 4.21 C ATOM 183 O LYS A 12 -11.886 8.784 -2.847 1.00 53.22 O ATOM 184 CB LYS A 12 -9.640 9.579 -0.437 1.00 43.15 C ATOM 185 CG LYS A 12 -10.646 10.679 -0.146 1.00 34.51 C ATOM 186 CD LYS A 12 -10.062 12.055 -0.414 1.00 3.24 C ATOM 187 CE LYS A 12 -9.972 12.343 -1.905 1.00 34.44 C ATOM 188 NZ LYS A 12 -8.623 12.838 -2.294 1.00 53.41 N ATOM 189 H LYS A 12 -8.390 7.406 -0.804 1.00 64.01 H ATOM 190 HA LYS A 12 -11.107 8.027 -0.587 1.00 43.13 H ATOM 191 HB2 LYS A 12 -9.208 9.257 0.499 1.00 52.22 H ATOM 192 HB3 LYS A 12 -8.859 9.991 -1.061 1.00 31.10 H ATOM 193 HG2 LYS A 12 -11.512 10.538 -0.776 1.00 41.32 H ATOM 194 HG3 LYS A 12 -10.941 10.618 0.892 1.00 10.12 H ATOM 195 HD2 LYS A 12 -10.692 12.801 0.048 1.00 71.32 H ATOM 196 HD3 LYS A 12 -9.070 12.105 0.014 1.00 71.01 H ATOM 197 HE2 LYS A 12 -10.182 11.433 -2.446 1.00 54.24 H ATOM 198 HE3 LYS A 12 -10.709 13.091 -2.158 1.00 62.22 H ATOM 199 HZ1 LYS A 12 -8.710 13.579 -3.019 1.00 11.23 H ATOM 200 HZ2 LYS A 12 -8.053 12.058 -2.678 1.00 32.31 H ATOM 201 HZ3 LYS A 12 -8.135 13.234 -1.466 1.00 12.14 H ATOM 202 N TYR A 13 -9.725 9.044 -3.413 1.00 44.34 N ATOM 203 CA TYR A 13 -10.018 9.430 -4.788 1.00 42.45 C ATOM 204 C TYR A 13 -10.875 8.375 -5.480 1.00 32.43 C ATOM 205 O TYR A 13 -11.775 8.700 -6.253 1.00 13.21 O ATOM 206 CB TYR A 13 -8.719 9.640 -5.569 1.00 53.14 C ATOM 207 CG TYR A 13 -8.911 10.374 -6.878 1.00 32.44 C ATOM 208 CD1 TYR A 13 -9.550 11.606 -6.918 1.00 54.44 C ATOM 209 CD2 TYR A 13 -8.452 9.834 -8.073 1.00 31.21 C ATOM 210 CE1 TYR A 13 -9.729 12.280 -8.111 1.00 65.55 C ATOM 211 CE2 TYR A 13 -8.624 10.501 -9.271 1.00 35.45 C ATOM 212 CZ TYR A 13 -9.264 11.723 -9.285 1.00 23.33 C ATOM 213 OH TYR A 13 -9.438 12.391 -10.475 1.00 61.20 O ATOM 214 H TYR A 13 -8.791 9.001 -3.118 1.00 72.02 H ATOM 215 HA TYR A 13 -10.565 10.361 -4.762 1.00 42.42 H ATOM 216 HB2 TYR A 13 -8.033 10.214 -4.966 1.00 21.30 H ATOM 217 HB3 TYR A 13 -8.280 8.678 -5.789 1.00 73.04 H ATOM 218 HD1 TYR A 13 -9.913 12.040 -5.997 1.00 61.14 H ATOM 219 HD2 TYR A 13 -7.952 8.876 -8.059 1.00 1.34 H ATOM 220 HE1 TYR A 13 -10.229 13.237 -8.123 1.00 25.22 H ATOM 221 HE2 TYR A 13 -8.261 10.065 -10.190 1.00 21.15 H ATOM 222 HH TYR A 13 -9.332 11.776 -11.205 1.00 51.21 H ATOM 223 N GLU A 14 -10.588 7.108 -5.194 1.00 12.53 N ATOM 224 CA GLU A 14 -11.333 6.004 -5.788 1.00 4.33 C ATOM 225 C GLU A 14 -12.720 5.885 -5.163 1.00 23.20 C ATOM 226 O GLU A 14 -13.666 5.432 -5.807 1.00 35.45 O ATOM 227 CB GLU A 14 -10.567 4.691 -5.612 1.00 13.01 C ATOM 228 CG GLU A 14 -10.872 3.661 -6.686 1.00 63.43 C ATOM 229 CD GLU A 14 -9.918 2.482 -6.651 1.00 41.34 C ATOM 230 OE1 GLU A 14 -9.993 1.685 -5.693 1.00 54.23 O ATOM 231 OE2 GLU A 14 -9.096 2.358 -7.583 1.00 61.54 O ATOM 232 H GLU A 14 -9.859 6.913 -4.569 1.00 63.54 H ATOM 233 HA GLU A 14 -11.442 6.208 -6.842 1.00 74.42 H ATOM 234 HB2 GLU A 14 -9.508 4.900 -5.632 1.00 2.20 H ATOM 235 HB3 GLU A 14 -10.823 4.266 -4.653 1.00 24.25 H ATOM 236 HG2 GLU A 14 -11.877 3.294 -6.541 1.00 50.44 H ATOM 237 HG3 GLU A 14 -10.799 4.136 -7.654 1.00 22.54 H ATOM 238 N LYS A 15 -12.832 6.294 -3.904 1.00 12.21 N ATOM 239 CA LYS A 15 -14.102 6.235 -3.190 1.00 72.21 C ATOM 240 C LYS A 15 -15.055 7.319 -3.684 1.00 31.31 C ATOM 241 O LYS A 15 -16.116 7.023 -4.235 1.00 33.21 O ATOM 242 CB LYS A 15 -13.873 6.390 -1.685 1.00 64.20 C ATOM 243 CG LYS A 15 -15.019 5.866 -0.838 1.00 12.03 C ATOM 244 CD LYS A 15 -15.267 6.750 0.373 1.00 54.53 C ATOM 245 CE LYS A 15 -16.726 6.711 0.802 1.00 52.53 C ATOM 246 NZ LYS A 15 -16.888 7.032 2.247 1.00 50.11 N ATOM 247 H LYS A 15 -12.041 6.646 -3.443 1.00 51.14 H ATOM 248 HA LYS A 15 -14.545 5.269 -3.381 1.00 0.04 H ATOM 249 HB2 LYS A 15 -12.976 5.852 -1.413 1.00 13.34 H ATOM 250 HB3 LYS A 15 -13.736 7.438 -1.460 1.00 21.20 H ATOM 251 HG2 LYS A 15 -15.916 5.838 -1.439 1.00 63.41 H ATOM 252 HG3 LYS A 15 -14.778 4.868 -0.500 1.00 13.13 H ATOM 253 HD2 LYS A 15 -14.654 6.406 1.192 1.00 61.23 H ATOM 254 HD3 LYS A 15 -15.001 7.768 0.125 1.00 52.35 H ATOM 255 HE2 LYS A 15 -17.279 7.431 0.218 1.00 1.50 H ATOM 256 HE3 LYS A 15 -17.116 5.722 0.615 1.00 31.33 H ATOM 257 HZ1 LYS A 15 -16.454 7.953 2.460 1.00 73.14 H ATOM 258 HZ2 LYS A 15 -16.429 6.302 2.828 1.00 20.21 H ATOM 259 HZ3 LYS A 15 -17.897 7.071 2.493 1.00 15.04 H ATOM 260 N LEU A 16 -14.670 8.574 -3.485 1.00 2.35 N ATOM 261 CA LEU A 16 -15.490 9.703 -3.911 1.00 45.12 C ATOM 262 C LEU A 16 -15.755 9.646 -5.412 1.00 53.51 C ATOM 263 O LEU A 16 -16.879 9.868 -5.864 1.00 34.10 O ATOM 264 CB LEU A 16 -14.803 11.022 -3.553 1.00 25.03 C ATOM 265 CG LEU A 16 -14.191 11.102 -2.154 1.00 22.54 C ATOM 266 CD1 LEU A 16 -13.634 12.492 -1.893 1.00 3.41 C ATOM 267 CD2 LEU A 16 -15.223 10.732 -1.098 1.00 52.14 C ATOM 268 H LEU A 16 -13.814 8.748 -3.040 1.00 72.51 H ATOM 269 HA LEU A 16 -16.432 9.644 -3.388 1.00 75.03 H ATOM 270 HB2 LEU A 16 -14.012 11.188 -4.269 1.00 15.43 H ATOM 271 HB3 LEU A 16 -15.537 11.810 -3.639 1.00 44.54 H ATOM 272 HG LEU A 16 -13.374 10.397 -2.084 1.00 65.13 H ATOM 273 HD11 LEU A 16 -13.012 12.471 -1.011 1.00 2.51 H ATOM 274 HD12 LEU A 16 -14.449 13.184 -1.742 1.00 51.33 H ATOM 275 HD13 LEU A 16 -13.045 12.809 -2.742 1.00 14.33 H ATOM 276 HD21 LEU A 16 -14.774 10.792 -0.119 1.00 24.15 H ATOM 277 HD22 LEU A 16 -15.572 9.725 -1.274 1.00 52.20 H ATOM 278 HD23 LEU A 16 -16.057 11.417 -1.155 1.00 60.04 H ATOM 279 N THR A 17 -14.714 9.346 -6.182 1.00 5.24 N ATOM 280 CA THR A 17 -14.834 9.259 -7.631 1.00 51.14 C ATOM 281 C THR A 17 -15.305 10.582 -8.224 1.00 73.04 C ATOM 282 O THR A 17 -15.902 10.613 -9.300 1.00 41.22 O ATOM 283 CB THR A 17 -15.813 8.145 -8.048 1.00 11.23 C ATOM 284 OG1 THR A 17 -15.781 7.081 -7.090 1.00 2.31 O ATOM 285 CG2 THR A 17 -15.463 7.604 -9.426 1.00 11.41 C ATOM 286 H THR A 17 -13.843 9.180 -5.763 1.00 14.34 H ATOM 287 HA THR A 17 -13.860 9.022 -8.033 1.00 43.14 H ATOM 288 HB THR A 17 -16.811 8.558 -8.082 1.00 51.31 H ATOM 289 HG1 THR A 17 -14.987 6.556 -7.221 1.00 54.31 H ATOM 290 HG21 THR A 17 -14.412 7.361 -9.460 1.00 41.22 H ATOM 291 HG22 THR A 17 -15.684 8.352 -10.173 1.00 3.51 H ATOM 292 HG23 THR A 17 -16.045 6.716 -9.622 1.00 50.34 H ATOM 293 N ALA A 18 -15.033 11.673 -7.516 1.00 50.01 N ATOM 294 CA ALA A 18 -15.427 12.999 -7.974 1.00 50.44 C ATOM 295 C ALA A 18 -16.912 13.043 -8.318 1.00 32.14 C ATOM 296 O ALA A 18 -17.287 13.299 -9.463 1.00 33.25 O ATOM 297 CB ALA A 18 -14.593 13.411 -9.178 1.00 41.15 C ATOM 298 H ALA A 18 -14.554 11.584 -6.666 1.00 35.32 H ATOM 299 HA ALA A 18 -15.232 13.700 -7.175 1.00 42.35 H ATOM 300 HB1 ALA A 18 -13.656 13.830 -8.840 1.00 71.30 H ATOM 301 HB2 ALA A 18 -14.399 12.546 -9.795 1.00 14.01 H ATOM 302 HB3 ALA A 18 -15.131 14.150 -9.753 1.00 0.21 H TER 303 ALA A 18 ENDMDL MODEL 4 ATOM 1 N VAL A 1 1.372 -1.191 -3.464 1.00 75.15 N ATOM 2 CA VAL A 1 1.451 0.003 -2.631 1.00 74.41 C ATOM 3 C VAL A 1 2.898 0.437 -2.429 1.00 30.31 C ATOM 4 O VAL A 1 3.760 -0.376 -2.098 1.00 21.54 O ATOM 5 CB VAL A 1 0.799 -0.230 -1.255 1.00 12.50 C ATOM 6 CG1 VAL A 1 0.907 1.021 -0.395 1.00 73.42 C ATOM 7 CG2 VAL A 1 -0.654 -0.651 -1.418 1.00 42.32 C ATOM 8 H1 VAL A 1 1.783 -2.023 -3.149 1.00 10.43 H ATOM 9 HA VAL A 1 0.914 0.795 -3.131 1.00 55.33 H ATOM 10 HB VAL A 1 1.330 -1.028 -0.758 1.00 34.21 H ATOM 11 HG11 VAL A 1 0.907 1.895 -1.030 1.00 23.40 H ATOM 12 HG12 VAL A 1 0.066 1.066 0.282 1.00 40.24 H ATOM 13 HG13 VAL A 1 1.825 0.989 0.173 1.00 60.45 H ATOM 14 HG21 VAL A 1 -1.265 -0.120 -0.704 1.00 54.21 H ATOM 15 HG22 VAL A 1 -0.985 -0.419 -2.419 1.00 43.45 H ATOM 16 HG23 VAL A 1 -0.742 -1.714 -1.247 1.00 53.14 H ATOM 17 N ALA A 2 3.157 1.725 -2.630 1.00 63.43 N ATOM 18 CA ALA A 2 4.500 2.268 -2.468 1.00 30.03 C ATOM 19 C ALA A 2 4.627 3.034 -1.155 1.00 61.40 C ATOM 20 O ALA A 2 5.378 2.637 -0.264 1.00 31.04 O ATOM 21 CB ALA A 2 4.851 3.169 -3.643 1.00 34.05 C ATOM 22 H ALA A 2 2.428 2.324 -2.893 1.00 72.51 H ATOM 23 HA ALA A 2 5.196 1.441 -2.459 1.00 51.34 H ATOM 24 HB1 ALA A 2 5.922 3.182 -3.777 1.00 45.34 H ATOM 25 HB2 ALA A 2 4.379 2.792 -4.538 1.00 2.31 H ATOM 26 HB3 ALA A 2 4.500 4.171 -3.445 1.00 30.24 H ATOM 27 N PHE A 3 3.889 4.133 -1.043 1.00 2.11 N ATOM 28 CA PHE A 3 3.921 4.956 0.161 1.00 72.32 C ATOM 29 C PHE A 3 2.669 4.733 1.005 1.00 42.02 C ATOM 30 O PHE A 3 1.709 4.106 0.557 1.00 3.53 O ATOM 31 CB PHE A 3 4.043 6.435 -0.210 1.00 2.11 C ATOM 32 CG PHE A 3 5.461 6.887 -0.411 1.00 2.52 C ATOM 33 CD1 PHE A 3 6.226 6.374 -1.445 1.00 63.34 C ATOM 34 CD2 PHE A 3 6.029 7.826 0.435 1.00 4.14 C ATOM 35 CE1 PHE A 3 7.531 6.788 -1.633 1.00 45.14 C ATOM 36 CE2 PHE A 3 7.334 8.245 0.252 1.00 33.41 C ATOM 37 CZ PHE A 3 8.086 7.724 -0.783 1.00 1.13 C ATOM 38 H PHE A 3 3.310 4.398 -1.788 1.00 72.01 H ATOM 39 HA PHE A 3 4.786 4.665 0.737 1.00 15.01 H ATOM 40 HB2 PHE A 3 3.505 6.614 -1.128 1.00 41.45 H ATOM 41 HB3 PHE A 3 3.611 7.033 0.578 1.00 21.03 H ATOM 42 HD1 PHE A 3 5.793 5.641 -2.112 1.00 21.23 H ATOM 43 HD2 PHE A 3 5.443 8.233 1.246 1.00 52.32 H ATOM 44 HE1 PHE A 3 8.117 6.379 -2.444 1.00 33.05 H ATOM 45 HE2 PHE A 3 7.765 8.976 0.919 1.00 42.32 H ATOM 46 HZ PHE A 3 9.105 8.050 -0.928 1.00 63.31 H ATOM 47 N ALA A 4 2.688 5.251 2.229 1.00 64.43 N ATOM 48 CA ALA A 4 1.556 5.110 3.135 1.00 13.23 C ATOM 49 C ALA A 4 0.483 6.153 2.840 1.00 45.41 C ATOM 50 O ALA A 4 -0.702 5.928 3.087 1.00 21.44 O ATOM 51 CB ALA A 4 2.019 5.222 4.580 1.00 23.52 C ATOM 52 H ALA A 4 3.483 5.740 2.528 1.00 33.44 H ATOM 53 HA ALA A 4 1.134 4.125 2.993 1.00 4.31 H ATOM 54 HB1 ALA A 4 1.302 4.735 5.226 1.00 64.13 H ATOM 55 HB2 ALA A 4 2.982 4.745 4.687 1.00 62.11 H ATOM 56 HB3 ALA A 4 2.100 6.263 4.853 1.00 43.14 H ATOM 57 N LEU A 5 0.906 7.296 2.310 1.00 24.12 N ATOM 58 CA LEU A 5 -0.018 8.375 1.981 1.00 12.34 C ATOM 59 C LEU A 5 -0.772 8.072 0.690 1.00 3.41 C ATOM 60 O LEU A 5 -1.964 8.356 0.573 1.00 74.32 O ATOM 61 CB LEU A 5 0.738 9.698 1.846 1.00 64.24 C ATOM 62 CG LEU A 5 -0.071 10.965 2.121 1.00 52.52 C ATOM 63 CD1 LEU A 5 0.187 11.468 3.533 1.00 61.32 C ATOM 64 CD2 LEU A 5 0.263 12.044 1.100 1.00 74.51 C ATOM 65 H LEU A 5 1.863 7.417 2.136 1.00 54.53 H ATOM 66 HA LEU A 5 -0.731 8.459 2.789 1.00 64.44 H ATOM 67 HB2 LEU A 5 1.566 9.678 2.538 1.00 61.44 H ATOM 68 HB3 LEU A 5 1.117 9.759 0.835 1.00 24.33 H ATOM 69 HG LEU A 5 -1.125 10.738 2.036 1.00 61.23 H ATOM 70 HD11 LEU A 5 0.488 10.642 4.159 1.00 34.33 H ATOM 71 HD12 LEU A 5 -0.715 11.910 3.928 1.00 34.22 H ATOM 72 HD13 LEU A 5 0.972 12.210 3.513 1.00 60.41 H ATOM 73 HD21 LEU A 5 -0.220 11.813 0.162 1.00 14.12 H ATOM 74 HD22 LEU A 5 1.332 12.082 0.955 1.00 41.14 H ATOM 75 HD23 LEU A 5 -0.086 13.001 1.460 1.00 33.41 H ATOM 76 N THR A 6 -0.068 7.493 -0.278 1.00 32.45 N ATOM 77 CA THR A 6 -0.670 7.150 -1.560 1.00 31.12 C ATOM 78 C THR A 6 -1.940 6.329 -1.369 1.00 71.32 C ATOM 79 O THR A 6 -2.901 6.467 -2.127 1.00 50.22 O ATOM 80 CB THR A 6 0.310 6.360 -2.447 1.00 62.23 C ATOM 81 OG1 THR A 6 1.142 5.524 -1.635 1.00 33.32 O ATOM 82 CG2 THR A 6 1.178 7.302 -3.268 1.00 14.53 C ATOM 83 H THR A 6 0.879 7.292 -0.124 1.00 34.30 H ATOM 84 HA THR A 6 -0.921 8.070 -2.067 1.00 44.22 H ATOM 85 HB THR A 6 -0.260 5.739 -3.123 1.00 53.14 H ATOM 86 HG1 THR A 6 1.050 4.610 -1.917 1.00 45.41 H ATOM 87 HG21 THR A 6 0.984 8.321 -2.968 1.00 41.41 H ATOM 88 HG22 THR A 6 0.945 7.186 -4.316 1.00 30.52 H ATOM 89 HG23 THR A 6 2.219 7.070 -3.102 1.00 31.35 H ATOM 90 N LEU A 7 -1.939 5.474 -0.352 1.00 70.23 N ATOM 91 CA LEU A 7 -3.093 4.630 -0.061 1.00 63.22 C ATOM 92 C LEU A 7 -4.315 5.477 0.280 1.00 24.45 C ATOM 93 O LEU A 7 -5.412 5.229 -0.217 1.00 50.43 O ATOM 94 CB LEU A 7 -2.776 3.681 1.096 1.00 71.20 C ATOM 95 CG LEU A 7 -3.798 2.573 1.354 1.00 21.13 C ATOM 96 CD1 LEU A 7 -3.506 1.363 0.480 1.00 1.13 C ATOM 97 CD2 LEU A 7 -3.801 2.182 2.825 1.00 2.51 C ATOM 98 H LEU A 7 -1.144 5.408 0.217 1.00 74.13 H ATOM 99 HA LEU A 7 -3.309 4.048 -0.945 1.00 23.23 H ATOM 100 HB2 LEU A 7 -1.826 3.212 0.889 1.00 52.41 H ATOM 101 HB3 LEU A 7 -2.695 4.274 1.996 1.00 64.40 H ATOM 102 HG LEU A 7 -4.785 2.936 1.102 1.00 43.03 H ATOM 103 HD11 LEU A 7 -3.605 1.638 -0.559 1.00 24.41 H ATOM 104 HD12 LEU A 7 -4.206 0.574 0.712 1.00 1.14 H ATOM 105 HD13 LEU A 7 -2.500 1.018 0.668 1.00 23.24 H ATOM 106 HD21 LEU A 7 -3.136 2.834 3.372 1.00 51.41 H ATOM 107 HD22 LEU A 7 -3.467 1.160 2.926 1.00 12.33 H ATOM 108 HD23 LEU A 7 -4.802 2.275 3.220 1.00 74.21 H ATOM 109 N ASN A 8 -4.115 6.478 1.132 1.00 71.34 N ATOM 110 CA ASN A 8 -5.200 7.363 1.539 1.00 75.35 C ATOM 111 C ASN A 8 -5.710 8.178 0.354 1.00 14.33 C ATOM 112 O ASN A 8 -6.917 8.361 0.186 1.00 42.24 O ATOM 113 CB ASN A 8 -4.732 8.300 2.653 1.00 24.24 C ATOM 114 CG ASN A 8 -5.075 7.773 4.034 1.00 44.44 C ATOM 115 OD1 ASN A 8 -5.519 6.635 4.183 1.00 0.12 O ATOM 116 ND2 ASN A 8 -4.869 8.602 5.051 1.00 53.34 N ATOM 117 H ASN A 8 -3.217 6.625 1.495 1.00 21.11 H ATOM 118 HA ASN A 8 -6.006 6.749 1.912 1.00 73.23 H ATOM 119 HB2 ASN A 8 -3.659 8.416 2.590 1.00 13.31 H ATOM 120 HB3 ASN A 8 -5.202 9.263 2.528 1.00 53.30 H ATOM 121 HD21 ASN A 8 -4.513 9.495 4.856 1.00 30.45 H ATOM 122 HD22 ASN A 8 -5.082 8.287 5.954 1.00 41.41 H ATOM 123 N LEU A 9 -4.784 8.666 -0.464 1.00 32.22 N ATOM 124 CA LEU A 9 -5.139 9.462 -1.634 1.00 30.33 C ATOM 125 C LEU A 9 -5.922 8.628 -2.643 1.00 31.34 C ATOM 126 O LEU A 9 -6.951 9.064 -3.159 1.00 12.34 O ATOM 127 CB LEU A 9 -3.879 10.028 -2.291 1.00 71.42 C ATOM 128 CG LEU A 9 -4.091 10.802 -3.593 1.00 32.23 C ATOM 129 CD1 LEU A 9 -4.768 12.135 -3.316 1.00 43.52 C ATOM 130 CD2 LEU A 9 -2.766 11.013 -4.310 1.00 23.42 C ATOM 131 H LEU A 9 -3.839 8.487 -0.278 1.00 32.23 H ATOM 132 HA LEU A 9 -5.761 10.280 -1.302 1.00 25.14 H ATOM 133 HB2 LEU A 9 -3.408 10.693 -1.584 1.00 64.32 H ATOM 134 HB3 LEU A 9 -3.217 9.200 -2.501 1.00 64.15 H ATOM 135 HG LEU A 9 -4.737 10.229 -4.244 1.00 13.03 H ATOM 136 HD11 LEU A 9 -5.760 12.130 -3.741 1.00 10.51 H ATOM 137 HD12 LEU A 9 -4.189 12.931 -3.762 1.00 14.55 H ATOM 138 HD13 LEU A 9 -4.833 12.292 -2.249 1.00 64.33 H ATOM 139 HD21 LEU A 9 -2.335 11.953 -4.001 1.00 3.13 H ATOM 140 HD22 LEU A 9 -2.932 11.026 -5.377 1.00 34.12 H ATOM 141 HD23 LEU A 9 -2.090 10.207 -4.061 1.00 61.13 H ATOM 142 N TYR A 10 -5.429 7.425 -2.917 1.00 53.24 N ATOM 143 CA TYR A 10 -6.083 6.530 -3.865 1.00 24.34 C ATOM 144 C TYR A 10 -7.465 6.122 -3.364 1.00 62.41 C ATOM 145 O TYR A 10 -8.456 6.236 -4.085 1.00 1.55 O ATOM 146 CB TYR A 10 -5.224 5.285 -4.097 1.00 53.12 C ATOM 147 CG TYR A 10 -4.374 5.361 -5.345 1.00 61.41 C ATOM 148 CD1 TYR A 10 -3.310 6.250 -5.432 1.00 22.31 C ATOM 149 CD2 TYR A 10 -4.634 4.542 -6.437 1.00 71.22 C ATOM 150 CE1 TYR A 10 -2.531 6.322 -6.570 1.00 41.54 C ATOM 151 CE2 TYR A 10 -3.859 4.607 -7.579 1.00 74.32 C ATOM 152 CZ TYR A 10 -2.809 5.499 -7.641 1.00 74.12 C ATOM 153 OH TYR A 10 -2.035 5.567 -8.777 1.00 1.35 O ATOM 154 H TYR A 10 -4.606 7.133 -2.474 1.00 44.02 H ATOM 155 HA TYR A 10 -6.193 7.059 -4.800 1.00 24.12 H ATOM 156 HB2 TYR A 10 -4.564 5.149 -3.255 1.00 31.24 H ATOM 157 HB3 TYR A 10 -5.869 4.423 -4.186 1.00 51.15 H ATOM 158 HD1 TYR A 10 -3.094 6.893 -4.591 1.00 51.11 H ATOM 159 HD2 TYR A 10 -5.457 3.844 -6.386 1.00 33.13 H ATOM 160 HE1 TYR A 10 -1.708 7.021 -6.619 1.00 33.31 H ATOM 161 HE2 TYR A 10 -4.077 3.962 -8.418 1.00 53.22 H ATOM 162 HH TYR A 10 -2.374 6.256 -9.354 1.00 24.32 H ATOM 163 N GLN A 11 -7.521 5.645 -2.124 1.00 53.55 N ATOM 164 CA GLN A 11 -8.781 5.220 -1.527 1.00 13.23 C ATOM 165 C GLN A 11 -9.797 6.358 -1.530 1.00 61.00 C ATOM 166 O GLN A 11 -10.936 6.187 -1.966 1.00 3.02 O ATOM 167 CB GLN A 11 -8.552 4.730 -0.096 1.00 64.00 C ATOM 168 CG GLN A 11 -9.743 3.992 0.493 1.00 70.11 C ATOM 169 CD GLN A 11 -10.110 2.752 -0.298 1.00 74.21 C ATOM 170 OE1 GLN A 11 -11.267 2.563 -0.677 1.00 23.03 O ATOM 171 NE2 GLN A 11 -9.126 1.898 -0.552 1.00 45.23 N ATOM 172 H GLN A 11 -6.697 5.578 -1.600 1.00 43.32 H ATOM 173 HA GLN A 11 -9.170 4.405 -2.118 1.00 54.54 H ATOM 174 HB2 GLN A 11 -7.702 4.063 -0.089 1.00 15.15 H ATOM 175 HB3 GLN A 11 -8.337 5.581 0.533 1.00 5.02 H ATOM 176 HG2 GLN A 11 -9.504 3.697 1.504 1.00 61.01 H ATOM 177 HG3 GLN A 11 -10.593 4.659 0.505 1.00 64.50 H ATOM 178 HE21 GLN A 11 -8.229 2.114 -0.218 1.00 71.41 H ATOM 179 HE22 GLN A 11 -9.335 1.088 -1.061 1.00 2.12 H ATOM 180 N LYS A 12 -9.378 7.520 -1.041 1.00 4.01 N ATOM 181 CA LYS A 12 -10.249 8.688 -0.988 1.00 33.42 C ATOM 182 C LYS A 12 -10.763 9.047 -2.378 1.00 74.43 C ATOM 183 O LYS A 12 -11.970 9.167 -2.593 1.00 21.13 O ATOM 184 CB LYS A 12 -9.503 9.880 -0.385 1.00 30.11 C ATOM 185 CG LYS A 12 -10.336 11.148 -0.317 1.00 53.03 C ATOM 186 CD LYS A 12 -9.642 12.309 -1.009 1.00 5.24 C ATOM 187 CE LYS A 12 -9.813 12.242 -2.518 1.00 43.24 C ATOM 188 NZ LYS A 12 -9.964 13.596 -3.120 1.00 71.01 N ATOM 189 H LYS A 12 -8.458 7.595 -0.708 1.00 71.51 H ATOM 190 HA LYS A 12 -11.091 8.445 -0.357 1.00 72.44 H ATOM 191 HB2 LYS A 12 -9.191 9.625 0.617 1.00 34.23 H ATOM 192 HB3 LYS A 12 -8.627 10.081 -0.985 1.00 10.44 H ATOM 193 HG2 LYS A 12 -11.285 10.971 -0.801 1.00 72.23 H ATOM 194 HG3 LYS A 12 -10.501 11.405 0.720 1.00 72.44 H ATOM 195 HD2 LYS A 12 -10.065 13.236 -0.651 1.00 31.24 H ATOM 196 HD3 LYS A 12 -8.587 12.278 -0.773 1.00 11.43 H ATOM 197 HE2 LYS A 12 -8.945 11.763 -2.945 1.00 41.11 H ATOM 198 HE3 LYS A 12 -10.693 11.658 -2.742 1.00 21.40 H ATOM 199 HZ1 LYS A 12 -9.254 13.737 -3.867 1.00 34.20 H ATOM 200 HZ2 LYS A 12 -9.835 14.327 -2.391 1.00 60.14 H ATOM 201 HZ3 LYS A 12 -10.913 13.699 -3.534 1.00 5.12 H ATOM 202 N TYR A 13 -9.841 9.215 -3.320 1.00 34.24 N ATOM 203 CA TYR A 13 -10.202 9.561 -4.689 1.00 62.34 C ATOM 204 C TYR A 13 -11.166 8.534 -5.275 1.00 60.40 C ATOM 205 O TYR A 13 -12.089 8.882 -6.010 1.00 52.10 O ATOM 206 CB TYR A 13 -8.948 9.655 -5.561 1.00 31.34 C ATOM 207 CG TYR A 13 -9.172 10.380 -6.868 1.00 75.13 C ATOM 208 CD1 TYR A 13 -9.886 9.785 -7.902 1.00 24.43 C ATOM 209 CD2 TYR A 13 -8.671 11.659 -7.071 1.00 3.51 C ATOM 210 CE1 TYR A 13 -10.093 10.443 -9.099 1.00 24.05 C ATOM 211 CE2 TYR A 13 -8.874 12.326 -8.264 1.00 30.22 C ATOM 212 CZ TYR A 13 -9.585 11.713 -9.274 1.00 53.55 C ATOM 213 OH TYR A 13 -9.789 12.373 -10.465 1.00 3.43 O ATOM 214 H TYR A 13 -8.896 9.105 -3.088 1.00 4.42 H ATOM 215 HA TYR A 13 -10.688 10.525 -4.671 1.00 35.11 H ATOM 216 HB2 TYR A 13 -8.179 10.182 -5.017 1.00 52.05 H ATOM 217 HB3 TYR A 13 -8.601 8.658 -5.789 1.00 74.52 H ATOM 218 HD1 TYR A 13 -10.282 8.789 -7.761 1.00 2.31 H ATOM 219 HD2 TYR A 13 -8.114 12.136 -6.277 1.00 44.12 H ATOM 220 HE1 TYR A 13 -10.650 9.964 -9.890 1.00 43.03 H ATOM 221 HE2 TYR A 13 -8.476 13.320 -8.402 1.00 15.50 H ATOM 222 HH TYR A 13 -9.907 11.732 -11.170 1.00 0.43 H ATOM 223 N GLU A 14 -10.944 7.266 -4.942 1.00 64.23 N ATOM 224 CA GLU A 14 -11.792 6.187 -5.435 1.00 52.32 C ATOM 225 C GLU A 14 -13.145 6.194 -4.729 1.00 72.14 C ATOM 226 O GLU A 14 -14.151 5.752 -5.286 1.00 0.34 O ATOM 227 CB GLU A 14 -11.106 4.835 -5.233 1.00 4.04 C ATOM 228 CG GLU A 14 -10.009 4.551 -6.245 1.00 50.44 C ATOM 229 CD GLU A 14 -10.114 3.163 -6.845 1.00 61.33 C ATOM 230 OE1 GLU A 14 -11.249 2.721 -7.123 1.00 2.14 O ATOM 231 OE2 GLU A 14 -9.062 2.518 -7.037 1.00 72.32 O ATOM 232 H GLU A 14 -10.191 7.051 -4.352 1.00 72.14 H ATOM 233 HA GLU A 14 -11.950 6.346 -6.491 1.00 70.32 H ATOM 234 HB2 GLU A 14 -10.670 4.810 -4.244 1.00 53.25 H ATOM 235 HB3 GLU A 14 -11.847 4.054 -5.309 1.00 34.33 H ATOM 236 HG2 GLU A 14 -10.076 5.277 -7.042 1.00 72.23 H ATOM 237 HG3 GLU A 14 -9.051 4.645 -5.755 1.00 70.53 H ATOM 238 N LYS A 15 -13.162 6.697 -3.500 1.00 10.50 N ATOM 239 CA LYS A 15 -14.390 6.763 -2.716 1.00 41.23 C ATOM 240 C LYS A 15 -15.302 7.874 -3.227 1.00 12.04 C ATOM 241 O LYS A 15 -16.405 7.613 -3.710 1.00 64.13 O ATOM 242 CB LYS A 15 -14.065 6.994 -1.239 1.00 5.41 C ATOM 243 CG LYS A 15 -14.041 5.719 -0.415 1.00 21.15 C ATOM 244 CD LYS A 15 -15.420 5.378 0.126 1.00 43.44 C ATOM 245 CE LYS A 15 -15.640 3.875 0.184 1.00 24.51 C ATOM 246 NZ LYS A 15 -14.783 3.228 1.217 1.00 52.51 N ATOM 247 H LYS A 15 -12.328 7.034 -3.110 1.00 44.31 H ATOM 248 HA LYS A 15 -14.901 5.818 -2.820 1.00 43.01 H ATOM 249 HB2 LYS A 15 -13.095 7.464 -1.165 1.00 63.14 H ATOM 250 HB3 LYS A 15 -14.808 7.656 -0.818 1.00 50.13 H ATOM 251 HG2 LYS A 15 -13.699 4.905 -1.037 1.00 2.15 H ATOM 252 HG3 LYS A 15 -13.361 5.850 0.416 1.00 53.34 H ATOM 253 HD2 LYS A 15 -15.517 5.784 1.122 1.00 70.12 H ATOM 254 HD3 LYS A 15 -16.168 5.818 -0.519 1.00 1.33 H ATOM 255 HE2 LYS A 15 -16.676 3.684 0.418 1.00 41.32 H ATOM 256 HE3 LYS A 15 -15.405 3.452 -0.782 1.00 11.02 H ATOM 257 HZ1 LYS A 15 -14.119 2.566 0.768 1.00 53.14 H ATOM 258 HZ2 LYS A 15 -15.374 2.705 1.894 1.00 31.20 H ATOM 259 HZ3 LYS A 15 -14.241 3.950 1.733 1.00 24.33 H ATOM 260 N LEU A 16 -14.836 9.113 -3.117 1.00 50.13 N ATOM 261 CA LEU A 16 -15.610 10.264 -3.569 1.00 43.34 C ATOM 262 C LEU A 16 -15.954 10.141 -5.050 1.00 40.43 C ATOM 263 O LEU A 16 -17.065 10.468 -5.470 1.00 44.14 O ATOM 264 CB LEU A 16 -14.830 11.557 -3.321 1.00 33.11 C ATOM 265 CG LEU A 16 -14.146 11.677 -1.959 1.00 34.14 C ATOM 266 CD1 LEU A 16 -13.507 13.048 -1.801 1.00 62.33 C ATOM 267 CD2 LEU A 16 -15.142 11.419 -0.837 1.00 54.23 C ATOM 268 H LEU A 16 -13.951 9.259 -2.724 1.00 21.54 H ATOM 269 HA LEU A 16 -16.527 10.291 -3.000 1.00 42.30 H ATOM 270 HB2 LEU A 16 -14.068 11.635 -4.081 1.00 74.21 H ATOM 271 HB3 LEU A 16 -15.521 12.383 -3.420 1.00 23.53 H ATOM 272 HG LEU A 16 -13.364 10.934 -1.889 1.00 44.11 H ATOM 273 HD11 LEU A 16 -12.750 13.181 -2.559 1.00 60.23 H ATOM 274 HD12 LEU A 16 -13.055 13.124 -0.824 1.00 24.35 H ATOM 275 HD13 LEU A 16 -14.263 13.812 -1.908 1.00 62.12 H ATOM 276 HD21 LEU A 16 -15.557 10.428 -0.945 1.00 53.22 H ATOM 277 HD22 LEU A 16 -15.936 12.150 -0.887 1.00 33.22 H ATOM 278 HD23 LEU A 16 -14.640 11.498 0.116 1.00 44.22 H ATOM 279 N THR A 17 -14.995 9.666 -5.838 1.00 64.23 N ATOM 280 CA THR A 17 -15.196 9.498 -7.272 1.00 0.31 C ATOM 281 C THR A 17 -15.602 10.813 -7.927 1.00 40.35 C ATOM 282 O THR A 17 -16.251 10.822 -8.973 1.00 15.13 O ATOM 283 CB THR A 17 -16.272 8.437 -7.568 1.00 30.42 C ATOM 284 OG1 THR A 17 -16.183 7.370 -6.616 1.00 41.32 O ATOM 285 CG2 THR A 17 -16.112 7.882 -8.975 1.00 72.32 C ATOM 286 H THR A 17 -14.131 9.423 -5.444 1.00 43.05 H ATOM 287 HA THR A 17 -14.263 9.165 -7.703 1.00 51.11 H ATOM 288 HB THR A 17 -17.245 8.900 -7.488 1.00 0.12 H ATOM 289 HG1 THR A 17 -16.491 7.679 -5.760 1.00 64.43 H ATOM 290 HG21 THR A 17 -16.816 8.366 -9.635 1.00 0.52 H ATOM 291 HG22 THR A 17 -16.301 6.818 -8.967 1.00 11.44 H ATOM 292 HG23 THR A 17 -15.107 8.066 -9.323 1.00 3.32 H ATOM 293 N ALA A 18 -15.214 11.923 -7.307 1.00 74.21 N ATOM 294 CA ALA A 18 -15.536 13.244 -7.832 1.00 60.14 C ATOM 295 C ALA A 18 -17.029 13.375 -8.113 1.00 32.42 C ATOM 296 O ALA A 18 -17.432 13.816 -9.190 1.00 1.33 O ATOM 297 CB ALA A 18 -14.734 13.519 -9.096 1.00 3.24 C ATOM 298 H ALA A 18 -14.699 11.851 -6.477 1.00 43.01 H ATOM 299 HA ALA A 18 -15.254 13.976 -7.090 1.00 0.25 H ATOM 300 HB1 ALA A 18 -15.263 13.123 -9.950 1.00 42.33 H ATOM 301 HB2 ALA A 18 -14.604 14.585 -9.214 1.00 25.50 H ATOM 302 HB3 ALA A 18 -13.767 13.044 -9.018 1.00 52.24 H TER 303 ALA A 18 ENDMDL MODEL 5 ATOM 1 N VAL A 1 4.632 -1.302 -1.573 1.00 21.32 N ATOM 2 CA VAL A 1 4.221 -0.024 -2.141 1.00 71.11 C ATOM 3 C VAL A 1 5.211 1.079 -1.786 1.00 1.31 C ATOM 4 O VAL A 1 5.759 1.104 -0.684 1.00 41.53 O ATOM 5 CB VAL A 1 2.818 0.383 -1.651 1.00 64.33 C ATOM 6 CG1 VAL A 1 2.808 0.549 -0.139 1.00 41.34 C ATOM 7 CG2 VAL A 1 2.364 1.661 -2.340 1.00 20.22 C ATOM 8 H1 VAL A 1 5.554 -1.609 -1.703 1.00 54.13 H ATOM 9 HA VAL A 1 4.187 -0.132 -3.216 1.00 12.24 H ATOM 10 HB VAL A 1 2.127 -0.406 -1.909 1.00 55.40 H ATOM 11 HG11 VAL A 1 3.424 1.393 0.134 1.00 43.55 H ATOM 12 HG12 VAL A 1 1.796 0.717 0.198 1.00 73.22 H ATOM 13 HG13 VAL A 1 3.199 -0.345 0.324 1.00 51.04 H ATOM 14 HG21 VAL A 1 1.288 1.737 -2.284 1.00 44.34 H ATOM 15 HG22 VAL A 1 2.812 2.512 -1.849 1.00 71.10 H ATOM 16 HG23 VAL A 1 2.670 1.641 -3.376 1.00 23.31 H ATOM 17 N ALA A 2 5.436 1.991 -2.727 1.00 34.33 N ATOM 18 CA ALA A 2 6.358 3.099 -2.512 1.00 61.33 C ATOM 19 C ALA A 2 6.030 3.844 -1.223 1.00 42.53 C ATOM 20 O ALA A 2 6.751 3.736 -0.231 1.00 35.42 O ATOM 21 CB ALA A 2 6.324 4.051 -3.699 1.00 31.14 C ATOM 22 H ALA A 2 4.969 1.917 -3.585 1.00 35.22 H ATOM 23 HA ALA A 2 7.356 2.692 -2.437 1.00 44.11 H ATOM 24 HB1 ALA A 2 5.476 3.814 -4.325 1.00 11.12 H ATOM 25 HB2 ALA A 2 6.237 5.066 -3.342 1.00 54.43 H ATOM 26 HB3 ALA A 2 7.234 3.946 -4.270 1.00 0.30 H ATOM 27 N PHE A 3 4.939 4.603 -1.245 1.00 61.11 N ATOM 28 CA PHE A 3 4.517 5.368 -0.078 1.00 52.51 C ATOM 29 C PHE A 3 3.199 4.834 0.475 1.00 11.22 C ATOM 30 O PHE A 3 2.389 4.269 -0.259 1.00 52.40 O ATOM 31 CB PHE A 3 4.369 6.848 -0.439 1.00 1.14 C ATOM 32 CG PHE A 3 5.510 7.699 0.041 1.00 20.14 C ATOM 33 CD1 PHE A 3 6.638 7.876 -0.744 1.00 31.41 C ATOM 34 CD2 PHE A 3 5.455 8.322 1.277 1.00 14.35 C ATOM 35 CE1 PHE A 3 7.689 8.657 -0.304 1.00 44.21 C ATOM 36 CE2 PHE A 3 6.503 9.106 1.722 1.00 30.44 C ATOM 37 CZ PHE A 3 7.621 9.274 0.930 1.00 64.01 C ATOM 38 H PHE A 3 4.405 4.649 -2.066 1.00 45.13 H ATOM 39 HA PHE A 3 5.279 5.265 0.679 1.00 42.55 H ATOM 40 HB2 PHE A 3 4.312 6.946 -1.512 1.00 70.22 H ATOM 41 HB3 PHE A 3 3.461 7.229 0.002 1.00 15.54 H ATOM 42 HD1 PHE A 3 6.692 7.395 -1.710 1.00 22.14 H ATOM 43 HD2 PHE A 3 4.579 8.191 1.898 1.00 3.34 H ATOM 44 HE1 PHE A 3 8.563 8.788 -0.926 1.00 33.43 H ATOM 45 HE2 PHE A 3 6.446 9.586 2.688 1.00 42.22 H ATOM 46 HZ PHE A 3 8.442 9.885 1.276 1.00 72.12 H ATOM 47 N ALA A 4 2.992 5.017 1.775 1.00 25.33 N ATOM 48 CA ALA A 4 1.773 4.555 2.427 1.00 24.04 C ATOM 49 C ALA A 4 0.620 5.522 2.183 1.00 0.12 C ATOM 50 O ALA A 4 -0.537 5.112 2.083 1.00 32.13 O ATOM 51 CB ALA A 4 2.008 4.377 3.920 1.00 24.11 C ATOM 52 H ALA A 4 3.676 5.474 2.308 1.00 12.10 H ATOM 53 HA ALA A 4 1.516 3.592 2.011 1.00 65.50 H ATOM 54 HB1 ALA A 4 1.136 3.926 4.370 1.00 55.13 H ATOM 55 HB2 ALA A 4 2.865 3.738 4.076 1.00 52.12 H ATOM 56 HB3 ALA A 4 2.190 5.340 4.373 1.00 50.10 H ATOM 57 N LEU A 5 0.942 6.807 2.089 1.00 51.44 N ATOM 58 CA LEU A 5 -0.068 7.834 1.856 1.00 12.05 C ATOM 59 C LEU A 5 -0.822 7.573 0.556 1.00 24.42 C ATOM 60 O LEU A 5 -2.005 7.892 0.436 1.00 41.21 O ATOM 61 CB LEU A 5 0.583 9.217 1.813 1.00 40.54 C ATOM 62 CG LEU A 5 -0.304 10.391 2.231 1.00 31.51 C ATOM 63 CD1 LEU A 5 -0.325 10.530 3.745 1.00 11.23 C ATOM 64 CD2 LEU A 5 0.175 11.680 1.581 1.00 5.23 C ATOM 65 H LEU A 5 1.881 7.073 2.177 1.00 54.54 H ATOM 66 HA LEU A 5 -0.769 7.801 2.677 1.00 21.24 H ATOM 67 HB2 LEU A 5 1.440 9.201 2.469 1.00 74.53 H ATOM 68 HB3 LEU A 5 0.912 9.395 0.798 1.00 11.25 H ATOM 69 HG LEU A 5 -1.316 10.204 1.900 1.00 54.23 H ATOM 70 HD11 LEU A 5 -1.210 10.054 4.138 1.00 33.05 H ATOM 71 HD12 LEU A 5 -0.332 11.577 4.010 1.00 4.21 H ATOM 72 HD13 LEU A 5 0.553 10.059 4.162 1.00 3.53 H ATOM 73 HD21 LEU A 5 -0.637 12.391 1.549 1.00 71.55 H ATOM 74 HD22 LEU A 5 0.513 11.472 0.577 1.00 44.53 H ATOM 75 HD23 LEU A 5 0.992 12.092 2.158 1.00 74.25 H ATOM 76 N THR A 6 -0.129 6.987 -0.416 1.00 2.22 N ATOM 77 CA THR A 6 -0.732 6.681 -1.707 1.00 1.41 C ATOM 78 C THR A 6 -2.030 5.900 -1.536 1.00 64.03 C ATOM 79 O THR A 6 -2.992 6.105 -2.278 1.00 23.33 O ATOM 80 CB THR A 6 0.229 5.871 -2.598 1.00 14.31 C ATOM 81 OG1 THR A 6 0.398 4.553 -2.064 1.00 52.41 O ATOM 82 CG2 THR A 6 1.581 6.560 -2.701 1.00 62.42 C ATOM 83 H THR A 6 0.811 6.757 -0.260 1.00 33.34 H ATOM 84 HA THR A 6 -0.948 7.616 -2.204 1.00 13.14 H ATOM 85 HB THR A 6 -0.198 5.798 -3.588 1.00 13.40 H ATOM 86 HG1 THR A 6 0.820 4.608 -1.203 1.00 41.44 H ATOM 87 HG21 THR A 6 2.162 6.345 -1.817 1.00 0.42 H ATOM 88 HG22 THR A 6 1.437 7.626 -2.787 1.00 13.52 H ATOM 89 HG23 THR A 6 2.105 6.196 -3.573 1.00 35.22 H ATOM 90 N LEU A 7 -2.051 5.004 -0.555 1.00 43.43 N ATOM 91 CA LEU A 7 -3.232 4.192 -0.286 1.00 70.25 C ATOM 92 C LEU A 7 -4.426 5.070 0.076 1.00 23.52 C ATOM 93 O LEU A 7 -5.542 4.837 -0.385 1.00 12.01 O ATOM 94 CB LEU A 7 -2.948 3.203 0.846 1.00 15.51 C ATOM 95 CG LEU A 7 -4.105 2.284 1.240 1.00 12.31 C ATOM 96 CD1 LEU A 7 -3.762 0.834 0.935 1.00 14.43 C ATOM 97 CD2 LEU A 7 -4.444 2.456 2.714 1.00 74.43 C ATOM 98 H LEU A 7 -1.254 4.886 0.002 1.00 42.10 H ATOM 99 HA LEU A 7 -3.466 3.640 -1.185 1.00 1.13 H ATOM 100 HB2 LEU A 7 -2.121 2.581 0.542 1.00 2.33 H ATOM 101 HB3 LEU A 7 -2.666 3.775 1.719 1.00 20.52 H ATOM 102 HG LEU A 7 -4.980 2.549 0.662 1.00 62.43 H ATOM 103 HD11 LEU A 7 -3.030 0.481 1.645 1.00 33.32 H ATOM 104 HD12 LEU A 7 -3.359 0.762 -0.064 1.00 53.30 H ATOM 105 HD13 LEU A 7 -4.656 0.231 1.007 1.00 65.20 H ATOM 106 HD21 LEU A 7 -5.118 3.291 2.833 1.00 5.42 H ATOM 107 HD22 LEU A 7 -3.538 2.640 3.272 1.00 74.30 H ATOM 108 HD23 LEU A 7 -4.917 1.556 3.081 1.00 1.11 H ATOM 109 N ASN A 8 -4.181 6.080 0.904 1.00 43.33 N ATOM 110 CA ASN A 8 -5.235 6.994 1.327 1.00 53.41 C ATOM 111 C ASN A 8 -5.755 7.809 0.146 1.00 10.34 C ATOM 112 O ASN A 8 -6.960 7.858 -0.106 1.00 64.24 O ATOM 113 CB ASN A 8 -4.718 7.932 2.420 1.00 71.11 C ATOM 114 CG ASN A 8 -4.511 7.219 3.742 1.00 0.34 C ATOM 115 OD1 ASN A 8 -5.180 6.229 4.038 1.00 12.23 O ATOM 116 ND2 ASN A 8 -3.580 7.722 4.546 1.00 72.55 N ATOM 117 H ASN A 8 -3.269 6.215 1.238 1.00 34.31 H ATOM 118 HA ASN A 8 -6.046 6.403 1.726 1.00 3.20 H ATOM 119 HB2 ASN A 8 -3.773 8.352 2.108 1.00 61.13 H ATOM 120 HB3 ASN A 8 -5.430 8.729 2.569 1.00 52.51 H ATOM 121 HD21 ASN A 8 -3.086 8.513 4.244 1.00 31.42 H ATOM 122 HD22 ASN A 8 -3.425 7.280 5.407 1.00 51.05 H ATOM 123 N LEU A 9 -4.839 8.448 -0.573 1.00 71.45 N ATOM 124 CA LEU A 9 -5.204 9.260 -1.729 1.00 1.54 C ATOM 125 C LEU A 9 -6.012 8.447 -2.734 1.00 34.52 C ATOM 126 O LEU A 9 -7.019 8.918 -3.263 1.00 71.12 O ATOM 127 CB LEU A 9 -3.949 9.820 -2.400 1.00 65.12 C ATOM 128 CG LEU A 9 -4.183 10.779 -3.568 1.00 3.45 C ATOM 129 CD1 LEU A 9 -4.888 12.039 -3.090 1.00 11.23 C ATOM 130 CD2 LEU A 9 -2.865 11.128 -4.244 1.00 60.22 C ATOM 131 H LEU A 9 -3.895 8.371 -0.323 1.00 51.14 H ATOM 132 HA LEU A 9 -5.811 10.082 -1.377 1.00 63.44 H ATOM 133 HB2 LEU A 9 -3.378 10.346 -1.650 1.00 35.43 H ATOM 134 HB3 LEU A 9 -3.371 8.984 -2.768 1.00 70.25 H ATOM 135 HG LEU A 9 -4.818 10.299 -4.299 1.00 33.45 H ATOM 136 HD11 LEU A 9 -5.917 11.810 -2.858 1.00 21.42 H ATOM 137 HD12 LEU A 9 -4.853 12.788 -3.867 1.00 4.21 H ATOM 138 HD13 LEU A 9 -4.394 12.415 -2.206 1.00 30.25 H ATOM 139 HD21 LEU A 9 -2.581 10.328 -4.912 1.00 1.21 H ATOM 140 HD22 LEU A 9 -2.100 11.260 -3.494 1.00 25.12 H ATOM 141 HD23 LEU A 9 -2.980 12.044 -4.806 1.00 20.50 H ATOM 142 N TYR A 10 -5.566 7.222 -2.990 1.00 75.15 N ATOM 143 CA TYR A 10 -6.248 6.342 -3.932 1.00 73.02 C ATOM 144 C TYR A 10 -7.649 5.996 -3.438 1.00 34.34 C ATOM 145 O TYR A 10 -8.630 6.146 -4.165 1.00 53.43 O ATOM 146 CB TYR A 10 -5.439 5.061 -4.144 1.00 1.44 C ATOM 147 CG TYR A 10 -5.840 4.289 -5.380 1.00 44.01 C ATOM 148 CD1 TYR A 10 -5.729 4.856 -6.644 1.00 25.42 C ATOM 149 CD2 TYR A 10 -6.329 2.992 -5.285 1.00 24.24 C ATOM 150 CE1 TYR A 10 -6.094 4.154 -7.776 1.00 32.20 C ATOM 151 CE2 TYR A 10 -6.695 2.282 -6.412 1.00 33.14 C ATOM 152 CZ TYR A 10 -6.577 2.867 -7.655 1.00 2.32 C ATOM 153 OH TYR A 10 -6.941 2.164 -8.780 1.00 42.44 O ATOM 154 H TYR A 10 -4.759 6.902 -2.537 1.00 44.23 H ATOM 155 HA TYR A 10 -6.330 6.864 -4.874 1.00 51.03 H ATOM 156 HB2 TYR A 10 -4.394 5.315 -4.236 1.00 32.01 H ATOM 157 HB3 TYR A 10 -5.573 4.414 -3.290 1.00 32.25 H ATOM 158 HD1 TYR A 10 -5.350 5.863 -6.735 1.00 43.41 H ATOM 159 HD2 TYR A 10 -6.420 2.536 -4.309 1.00 73.13 H ATOM 160 HE1 TYR A 10 -6.001 4.612 -8.750 1.00 30.24 H ATOM 161 HE2 TYR A 10 -7.073 1.275 -6.317 1.00 75.43 H ATOM 162 HH TYR A 10 -6.391 2.437 -9.519 1.00 73.31 H ATOM 163 N GLN A 11 -7.733 5.531 -2.195 1.00 52.51 N ATOM 164 CA GLN A 11 -9.014 5.163 -1.602 1.00 44.54 C ATOM 165 C GLN A 11 -9.985 6.339 -1.632 1.00 71.21 C ATOM 166 O GLN A 11 -11.138 6.195 -2.040 1.00 1.41 O ATOM 167 CB GLN A 11 -8.815 4.687 -0.162 1.00 61.05 C ATOM 168 CG GLN A 11 -10.019 3.956 0.408 1.00 34.31 C ATOM 169 CD GLN A 11 -10.242 2.603 -0.240 1.00 3.32 C ATOM 170 OE1 GLN A 11 -9.553 2.238 -1.193 1.00 22.34 O ATOM 171 NE2 GLN A 11 -11.208 1.852 0.275 1.00 22.31 N ATOM 172 H GLN A 11 -6.915 5.434 -1.665 1.00 75.21 H ATOM 173 HA GLN A 11 -9.428 4.355 -2.185 1.00 54.13 H ATOM 174 HB2 GLN A 11 -7.967 4.019 -0.131 1.00 1.44 H ATOM 175 HB3 GLN A 11 -8.612 5.544 0.463 1.00 72.11 H ATOM 176 HG2 GLN A 11 -9.867 3.809 1.467 1.00 12.21 H ATOM 177 HG3 GLN A 11 -10.899 4.562 0.253 1.00 52.55 H ATOM 178 HE21 GLN A 11 -11.717 2.209 1.033 1.00 21.54 H ATOM 179 HE22 GLN A 11 -11.374 0.973 -0.125 1.00 3.44 H ATOM 180 N LYS A 12 -9.512 7.502 -1.197 1.00 33.21 N ATOM 181 CA LYS A 12 -10.338 8.703 -1.174 1.00 1.41 C ATOM 182 C LYS A 12 -10.825 9.056 -2.576 1.00 21.22 C ATOM 183 O LYS A 12 -12.024 9.221 -2.804 1.00 4.14 O ATOM 184 CB LYS A 12 -9.551 9.877 -0.586 1.00 64.20 C ATOM 185 CG LYS A 12 -10.370 11.147 -0.441 1.00 13.24 C ATOM 186 CD LYS A 12 -9.585 12.371 -0.883 1.00 34.13 C ATOM 187 CE LYS A 12 -9.432 12.418 -2.395 1.00 53.33 C ATOM 188 NZ LYS A 12 -9.718 13.775 -2.939 1.00 63.24 N ATOM 189 H LYS A 12 -8.584 7.553 -0.884 1.00 53.41 H ATOM 190 HA LYS A 12 -11.194 8.506 -0.547 1.00 73.33 H ATOM 191 HB2 LYS A 12 -9.184 9.596 0.390 1.00 32.33 H ATOM 192 HB3 LYS A 12 -8.709 10.088 -1.230 1.00 2.33 H ATOM 193 HG2 LYS A 12 -11.258 11.064 -1.049 1.00 75.41 H ATOM 194 HG3 LYS A 12 -10.652 11.266 0.596 1.00 3.41 H ATOM 195 HD2 LYS A 12 -10.106 13.259 -0.557 1.00 51.11 H ATOM 196 HD3 LYS A 12 -8.604 12.341 -0.431 1.00 21.21 H ATOM 197 HE2 LYS A 12 -8.420 12.143 -2.650 1.00 54.24 H ATOM 198 HE3 LYS A 12 -10.119 11.711 -2.836 1.00 35.03 H ATOM 199 HZ1 LYS A 12 -9.732 14.473 -2.169 1.00 51.32 H ATOM 200 HZ2 LYS A 12 -10.642 13.781 -3.416 1.00 72.22 H ATOM 201 HZ3 LYS A 12 -8.985 14.046 -3.626 1.00 20.05 H ATOM 202 N TYR A 13 -9.889 9.168 -3.511 1.00 62.14 N ATOM 203 CA TYR A 13 -10.223 9.502 -4.891 1.00 31.51 C ATOM 204 C TYR A 13 -11.233 8.510 -5.462 1.00 3.42 C ATOM 205 O TYR A 13 -12.128 8.887 -6.217 1.00 35.51 O ATOM 206 CB TYR A 13 -8.961 9.515 -5.755 1.00 3.34 C ATOM 207 CG TYR A 13 -9.056 10.434 -6.952 1.00 33.40 C ATOM 208 CD1 TYR A 13 -9.098 11.813 -6.793 1.00 1.11 C ATOM 209 CD2 TYR A 13 -9.104 9.921 -8.243 1.00 2.32 C ATOM 210 CE1 TYR A 13 -9.186 12.656 -7.884 1.00 60.31 C ATOM 211 CE2 TYR A 13 -9.190 10.756 -9.340 1.00 14.41 C ATOM 212 CZ TYR A 13 -9.232 12.123 -9.155 1.00 63.34 C ATOM 213 OH TYR A 13 -9.318 12.959 -10.245 1.00 60.40 O ATOM 214 H TYR A 13 -8.950 9.025 -3.269 1.00 33.42 H ATOM 215 HA TYR A 13 -10.662 10.489 -4.897 1.00 21.55 H ATOM 216 HB2 TYR A 13 -8.125 9.840 -5.154 1.00 53.41 H ATOM 217 HB3 TYR A 13 -8.770 8.516 -6.117 1.00 70.31 H ATOM 218 HD1 TYR A 13 -9.061 12.227 -5.796 1.00 14.34 H ATOM 219 HD2 TYR A 13 -9.071 8.851 -8.384 1.00 74.42 H ATOM 220 HE1 TYR A 13 -9.218 13.726 -7.740 1.00 22.52 H ATOM 221 HE2 TYR A 13 -9.227 10.340 -10.336 1.00 25.53 H ATOM 222 HH TYR A 13 -9.445 13.862 -9.946 1.00 35.03 H ATOM 223 N GLU A 14 -11.080 7.242 -5.094 1.00 0.01 N ATOM 224 CA GLU A 14 -11.978 6.196 -5.569 1.00 40.12 C ATOM 225 C GLU A 14 -13.333 6.284 -4.873 1.00 2.24 C ATOM 226 O GLU A 14 -14.364 5.934 -5.447 1.00 64.34 O ATOM 227 CB GLU A 14 -11.360 4.816 -5.334 1.00 2.44 C ATOM 228 CG GLU A 14 -11.692 3.807 -6.420 1.00 3.22 C ATOM 229 CD GLU A 14 -10.809 3.956 -7.644 1.00 21.23 C ATOM 230 OE1 GLU A 14 -9.653 3.486 -7.603 1.00 21.42 O ATOM 231 OE2 GLU A 14 -11.275 4.543 -8.643 1.00 20.51 O ATOM 232 H GLU A 14 -10.346 7.004 -4.489 1.00 53.34 H ATOM 233 HA GLU A 14 -12.122 6.339 -6.629 1.00 50.34 H ATOM 234 HB2 GLU A 14 -10.286 4.920 -5.283 1.00 1.23 H ATOM 235 HB3 GLU A 14 -11.720 4.431 -4.391 1.00 62.42 H ATOM 236 HG2 GLU A 14 -11.563 2.812 -6.021 1.00 4.32 H ATOM 237 HG3 GLU A 14 -12.721 3.943 -6.718 1.00 1.43 H ATOM 238 N LYS A 15 -13.323 6.754 -3.630 1.00 0.41 N ATOM 239 CA LYS A 15 -14.549 6.890 -2.853 1.00 13.11 C ATOM 240 C LYS A 15 -15.402 8.040 -3.379 1.00 74.12 C ATOM 241 O LYS A 15 -16.516 7.830 -3.862 1.00 20.21 O ATOM 242 CB LYS A 15 -14.219 7.120 -1.376 1.00 51.35 C ATOM 243 CG LYS A 15 -15.435 7.073 -0.467 1.00 4.41 C ATOM 244 CD LYS A 15 -15.745 5.653 -0.024 1.00 2.54 C ATOM 245 CE LYS A 15 -15.718 5.524 1.492 1.00 54.33 C ATOM 246 NZ LYS A 15 -14.382 5.096 1.989 1.00 45.23 N ATOM 247 H LYS A 15 -12.469 7.018 -3.225 1.00 73.34 H ATOM 248 HA LYS A 15 -15.107 5.971 -2.949 1.00 64.23 H ATOM 249 HB2 LYS A 15 -13.523 6.360 -1.053 1.00 15.22 H ATOM 250 HB3 LYS A 15 -13.754 8.090 -1.271 1.00 50.00 H ATOM 251 HG2 LYS A 15 -15.243 7.678 0.407 1.00 23.11 H ATOM 252 HG3 LYS A 15 -16.287 7.469 -1.000 1.00 74.23 H ATOM 253 HD2 LYS A 15 -16.727 5.381 -0.380 1.00 31.34 H ATOM 254 HD3 LYS A 15 -15.008 4.985 -0.446 1.00 72.32 H ATOM 255 HE2 LYS A 15 -15.965 6.481 1.926 1.00 42.12 H ATOM 256 HE3 LYS A 15 -16.455 4.793 1.790 1.00 12.23 H ATOM 257 HZ1 LYS A 15 -14.444 4.149 2.414 1.00 54.33 H ATOM 258 HZ2 LYS A 15 -14.037 5.765 2.707 1.00 62.00 H ATOM 259 HZ3 LYS A 15 -13.701 5.068 1.203 1.00 23.33 H ATOM 260 N LEU A 16 -14.873 9.255 -3.285 1.00 31.45 N ATOM 261 CA LEU A 16 -15.586 10.438 -3.753 1.00 3.32 C ATOM 262 C LEU A 16 -15.933 10.315 -5.233 1.00 22.10 C ATOM 263 O LEU A 16 -17.046 10.638 -5.650 1.00 64.35 O ATOM 264 CB LEU A 16 -14.741 11.692 -3.518 1.00 55.11 C ATOM 265 CG LEU A 16 -14.054 11.793 -2.156 1.00 41.10 C ATOM 266 CD1 LEU A 16 -13.331 13.124 -2.020 1.00 53.32 C ATOM 267 CD2 LEU A 16 -15.066 11.616 -1.033 1.00 42.44 C ATOM 268 H LEU A 16 -13.982 9.359 -2.891 1.00 13.23 H ATOM 269 HA LEU A 16 -16.501 10.519 -3.186 1.00 54.42 H ATOM 270 HB2 LEU A 16 -13.976 11.722 -4.278 1.00 3.02 H ATOM 271 HB3 LEU A 16 -15.389 12.551 -3.628 1.00 24.23 H ATOM 272 HG LEU A 16 -13.318 11.005 -2.072 1.00 35.32 H ATOM 273 HD11 LEU A 16 -12.285 12.991 -2.252 1.00 14.43 H ATOM 274 HD12 LEU A 16 -13.433 13.487 -1.008 1.00 42.32 H ATOM 275 HD13 LEU A 16 -13.764 13.840 -2.704 1.00 10.01 H ATOM 276 HD21 LEU A 16 -15.165 10.567 -0.800 1.00 21.11 H ATOM 277 HD22 LEU A 16 -16.022 12.008 -1.347 1.00 34.22 H ATOM 278 HD23 LEU A 16 -14.728 12.151 -0.157 1.00 71.21 H ATOM 279 N THR A 17 -14.973 9.843 -6.023 1.00 54.23 N ATOM 280 CA THR A 17 -15.177 9.676 -7.457 1.00 34.34 C ATOM 281 C THR A 17 -15.551 10.998 -8.117 1.00 33.20 C ATOM 282 O THR A 17 -16.203 11.019 -9.161 1.00 23.42 O ATOM 283 CB THR A 17 -16.278 8.639 -7.750 1.00 53.00 C ATOM 284 OG1 THR A 17 -16.262 7.611 -6.753 1.00 45.21 O ATOM 285 CG2 THR A 17 -16.086 8.021 -9.127 1.00 32.45 C ATOM 286 H THR A 17 -14.108 9.603 -5.632 1.00 1.45 H ATOM 287 HA THR A 17 -14.252 9.319 -7.886 1.00 34.23 H ATOM 288 HB THR A 17 -17.237 9.138 -7.726 1.00 63.41 H ATOM 289 HG1 THR A 17 -15.353 7.399 -6.527 1.00 44.30 H ATOM 290 HG21 THR A 17 -16.588 8.627 -9.866 1.00 24.50 H ATOM 291 HG22 THR A 17 -16.503 7.024 -9.135 1.00 52.41 H ATOM 292 HG23 THR A 17 -15.032 7.972 -9.355 1.00 60.12 H ATOM 293 N ALA A 18 -15.134 12.100 -7.502 1.00 72.22 N ATOM 294 CA ALA A 18 -15.423 13.426 -8.033 1.00 13.34 C ATOM 295 C ALA A 18 -16.915 13.597 -8.301 1.00 3.45 C ATOM 296 O ALA A 18 -17.393 14.712 -8.514 1.00 1.33 O ATOM 297 CB ALA A 18 -14.625 13.672 -9.304 1.00 60.34 C ATOM 298 H ALA A 18 -14.619 12.018 -6.673 1.00 44.41 H ATOM 299 HA ALA A 18 -15.114 14.155 -7.297 1.00 31.34 H ATOM 300 HB1 ALA A 18 -15.237 14.208 -10.015 1.00 34.11 H ATOM 301 HB2 ALA A 18 -13.748 14.256 -9.071 1.00 44.34 H ATOM 302 HB3 ALA A 18 -14.325 12.725 -9.729 1.00 54.31 H TER 303 ALA A 18 ENDMDL MODEL 6 ATOM 1 N VAL A 1 1.864 -0.999 -3.742 1.00 12.30 N ATOM 2 CA VAL A 1 1.780 0.181 -2.889 1.00 60.21 C ATOM 3 C VAL A 1 3.020 0.314 -2.012 1.00 50.22 C ATOM 4 O VAL A 1 3.492 -0.664 -1.434 1.00 34.23 O ATOM 5 CB VAL A 1 0.531 0.135 -1.989 1.00 52.22 C ATOM 6 CG1 VAL A 1 -0.736 0.183 -2.830 1.00 45.55 C ATOM 7 CG2 VAL A 1 0.551 -1.108 -1.113 1.00 3.24 C ATOM 8 H1 VAL A 1 1.261 -1.077 -4.510 1.00 55.32 H ATOM 9 HA VAL A 1 1.707 1.050 -3.527 1.00 31.30 H ATOM 10 HB VAL A 1 0.543 1.003 -1.347 1.00 11.42 H ATOM 11 HG11 VAL A 1 -0.749 -0.658 -3.508 1.00 53.42 H ATOM 12 HG12 VAL A 1 -1.600 0.141 -2.184 1.00 24.42 H ATOM 13 HG13 VAL A 1 -0.755 1.102 -3.398 1.00 54.31 H ATOM 14 HG21 VAL A 1 -0.437 -1.286 -0.716 1.00 51.31 H ATOM 15 HG22 VAL A 1 0.862 -1.958 -1.702 1.00 11.32 H ATOM 16 HG23 VAL A 1 1.245 -0.963 -0.297 1.00 42.51 H ATOM 17 N ALA A 2 3.543 1.532 -1.918 1.00 43.21 N ATOM 18 CA ALA A 2 4.727 1.795 -1.110 1.00 23.55 C ATOM 19 C ALA A 2 4.443 2.849 -0.046 1.00 11.34 C ATOM 20 O ALA A 2 4.495 2.567 1.152 1.00 40.52 O ATOM 21 CB ALA A 2 5.884 2.234 -1.995 1.00 22.32 C ATOM 22 H ALA A 2 3.122 2.272 -2.403 1.00 0.00 H ATOM 23 HA ALA A 2 5.009 0.872 -0.622 1.00 4.53 H ATOM 24 HB1 ALA A 2 5.707 1.903 -3.008 1.00 13.01 H ATOM 25 HB2 ALA A 2 5.963 3.310 -1.976 1.00 4.34 H ATOM 26 HB3 ALA A 2 6.802 1.798 -1.629 1.00 41.14 H ATOM 27 N PHE A 3 4.143 4.065 -0.490 1.00 15.22 N ATOM 28 CA PHE A 3 3.851 5.163 0.425 1.00 65.02 C ATOM 29 C PHE A 3 2.531 4.929 1.153 1.00 71.14 C ATOM 30 O PHE A 3 1.623 4.289 0.623 1.00 51.31 O ATOM 31 CB PHE A 3 3.799 6.489 -0.337 1.00 11.13 C ATOM 32 CG PHE A 3 5.143 6.959 -0.816 1.00 33.21 C ATOM 33 CD1 PHE A 3 6.125 7.327 0.089 1.00 44.43 C ATOM 34 CD2 PHE A 3 5.423 7.031 -2.171 1.00 4.13 C ATOM 35 CE1 PHE A 3 7.362 7.761 -0.350 1.00 24.23 C ATOM 36 CE2 PHE A 3 6.659 7.463 -2.615 1.00 51.31 C ATOM 37 CZ PHE A 3 7.630 7.828 -1.703 1.00 71.41 C ATOM 38 H PHE A 3 4.117 4.228 -1.456 1.00 53.13 H ATOM 39 HA PHE A 3 4.647 5.207 1.152 1.00 30.25 H ATOM 40 HB2 PHE A 3 3.161 6.375 -1.200 1.00 52.20 H ATOM 41 HB3 PHE A 3 3.391 7.251 0.310 1.00 54.02 H ATOM 42 HD1 PHE A 3 5.918 7.275 1.147 1.00 22.35 H ATOM 43 HD2 PHE A 3 4.664 6.746 -2.885 1.00 60.14 H ATOM 44 HE1 PHE A 3 8.120 8.045 0.365 1.00 21.24 H ATOM 45 HE2 PHE A 3 6.864 7.514 -3.674 1.00 44.20 H ATOM 46 HZ PHE A 3 8.595 8.166 -2.048 1.00 45.10 H ATOM 47 N ALA A 4 2.433 5.451 2.371 1.00 52.54 N ATOM 48 CA ALA A 4 1.224 5.301 3.171 1.00 0.32 C ATOM 49 C ALA A 4 0.201 6.378 2.828 1.00 54.25 C ATOM 50 O ALA A 4 -1.007 6.159 2.936 1.00 63.03 O ATOM 51 CB ALA A 4 1.564 5.347 4.654 1.00 53.14 C ATOM 52 H ALA A 4 3.191 5.951 2.739 1.00 51.12 H ATOM 53 HA ALA A 4 0.798 4.332 2.954 1.00 24.04 H ATOM 54 HB1 ALA A 4 1.406 6.349 5.027 1.00 20.53 H ATOM 55 HB2 ALA A 4 0.928 4.658 5.190 1.00 45.12 H ATOM 56 HB3 ALA A 4 2.597 5.069 4.794 1.00 24.25 H ATOM 57 N LEU A 5 0.690 7.542 2.414 1.00 74.12 N ATOM 58 CA LEU A 5 -0.183 8.654 2.055 1.00 51.34 C ATOM 59 C LEU A 5 -0.905 8.377 0.740 1.00 14.20 C ATOM 60 O LEU A 5 -2.110 8.603 0.621 1.00 72.21 O ATOM 61 CB LEU A 5 0.626 9.948 1.942 1.00 22.52 C ATOM 62 CG LEU A 5 -0.121 11.238 2.277 1.00 15.55 C ATOM 63 CD1 LEU A 5 -1.321 11.415 1.359 1.00 64.21 C ATOM 64 CD2 LEU A 5 -0.559 11.238 3.735 1.00 52.11 C ATOM 65 H LEU A 5 1.660 7.657 2.348 1.00 62.11 H ATOM 66 HA LEU A 5 -0.917 8.766 2.838 1.00 34.34 H ATOM 67 HB2 LEU A 5 1.468 9.870 2.613 1.00 63.25 H ATOM 68 HB3 LEU A 5 0.984 10.026 0.925 1.00 32.52 H ATOM 69 HG LEU A 5 0.541 12.080 2.126 1.00 14.14 H ATOM 70 HD11 LEU A 5 -1.162 10.856 0.449 1.00 34.33 H ATOM 71 HD12 LEU A 5 -1.441 12.461 1.122 1.00 55.51 H ATOM 72 HD13 LEU A 5 -2.210 11.053 1.855 1.00 42.44 H ATOM 73 HD21 LEU A 5 -1.616 11.024 3.793 1.00 0.42 H ATOM 74 HD22 LEU A 5 -0.363 12.207 4.169 1.00 1.24 H ATOM 75 HD23 LEU A 5 -0.008 10.483 4.276 1.00 22.21 H ATOM 76 N THR A 6 -0.162 7.884 -0.246 1.00 3.34 N ATOM 77 CA THR A 6 -0.731 7.575 -1.551 1.00 43.02 C ATOM 78 C THR A 6 -1.902 6.608 -1.425 1.00 60.43 C ATOM 79 O THR A 6 -2.835 6.638 -2.229 1.00 62.02 O ATOM 80 CB THR A 6 0.324 6.966 -2.494 1.00 24.12 C ATOM 81 OG1 THR A 6 0.792 5.720 -1.966 1.00 32.41 O ATOM 82 CG2 THR A 6 1.498 7.916 -2.679 1.00 11.24 C ATOM 83 H THR A 6 0.793 7.726 -0.090 1.00 13.34 H ATOM 84 HA THR A 6 -1.084 8.498 -1.988 1.00 64.24 H ATOM 85 HB THR A 6 -0.133 6.791 -3.457 1.00 55.30 H ATOM 86 HG1 THR A 6 0.758 5.048 -2.652 1.00 14.41 H ATOM 87 HG21 THR A 6 1.977 8.085 -1.726 1.00 40.12 H ATOM 88 HG22 THR A 6 1.141 8.856 -3.074 1.00 5.04 H ATOM 89 HG23 THR A 6 2.208 7.482 -3.367 1.00 34.00 H ATOM 90 N LEU A 7 -1.849 5.750 -0.412 1.00 43.21 N ATOM 91 CA LEU A 7 -2.907 4.773 -0.180 1.00 42.12 C ATOM 92 C LEU A 7 -4.230 5.466 0.126 1.00 14.35 C ATOM 93 O LEU A 7 -5.241 5.213 -0.528 1.00 1.31 O ATOM 94 CB LEU A 7 -2.526 3.843 0.973 1.00 3.43 C ATOM 95 CG LEU A 7 -2.586 2.345 0.676 1.00 72.25 C ATOM 96 CD1 LEU A 7 -2.135 1.542 1.886 1.00 60.45 C ATOM 97 CD2 LEU A 7 -3.993 1.940 0.259 1.00 43.32 C ATOM 98 H LEU A 7 -1.080 5.774 0.195 1.00 33.00 H ATOM 99 HA LEU A 7 -3.021 4.188 -1.081 1.00 3.23 H ATOM 100 HB2 LEU A 7 -1.515 4.081 1.269 1.00 35.13 H ATOM 101 HB3 LEU A 7 -3.197 4.046 1.796 1.00 70.13 H ATOM 102 HG LEU A 7 -1.916 2.119 -0.143 1.00 11.43 H ATOM 103 HD11 LEU A 7 -2.996 1.265 2.475 1.00 23.30 H ATOM 104 HD12 LEU A 7 -1.465 2.140 2.485 1.00 31.12 H ATOM 105 HD13 LEU A 7 -1.622 0.650 1.555 1.00 53.12 H ATOM 106 HD21 LEU A 7 -4.266 2.466 -0.644 1.00 1.01 H ATOM 107 HD22 LEU A 7 -4.687 2.192 1.047 1.00 73.33 H ATOM 108 HD23 LEU A 7 -4.023 0.875 0.079 1.00 5.23 H ATOM 109 N ASN A 8 -4.216 6.344 1.125 1.00 62.51 N ATOM 110 CA ASN A 8 -5.415 7.075 1.517 1.00 1.02 C ATOM 111 C ASN A 8 -5.939 7.921 0.361 1.00 44.32 C ATOM 112 O ASN A 8 -7.148 8.024 0.150 1.00 1.22 O ATOM 113 CB ASN A 8 -5.121 7.967 2.725 1.00 41.43 C ATOM 114 CG ASN A 8 -5.249 7.222 4.039 1.00 1.23 C ATOM 115 OD1 ASN A 8 -5.966 7.653 4.942 1.00 32.24 O ATOM 116 ND2 ASN A 8 -4.551 6.098 4.152 1.00 35.20 N ATOM 117 H ASN A 8 -3.379 6.503 1.610 1.00 71.44 H ATOM 118 HA ASN A 8 -6.169 6.353 1.790 1.00 73.40 H ATOM 119 HB2 ASN A 8 -4.113 8.349 2.646 1.00 20.51 H ATOM 120 HB3 ASN A 8 -5.815 8.795 2.731 1.00 24.44 H ATOM 121 HD21 ASN A 8 -4.001 5.816 3.392 1.00 71.34 H ATOM 122 HD22 ASN A 8 -4.616 5.596 4.991 1.00 33.40 H ATOM 123 N LEU A 9 -5.021 8.525 -0.386 1.00 61.12 N ATOM 124 CA LEU A 9 -5.389 9.362 -1.523 1.00 12.24 C ATOM 125 C LEU A 9 -6.027 8.528 -2.629 1.00 43.44 C ATOM 126 O LEU A 9 -6.949 8.981 -3.309 1.00 23.35 O ATOM 127 CB LEU A 9 -4.159 10.093 -2.063 1.00 64.41 C ATOM 128 CG LEU A 9 -4.379 10.945 -3.313 1.00 54.12 C ATOM 129 CD1 LEU A 9 -5.274 12.133 -2.998 1.00 14.43 C ATOM 130 CD2 LEU A 9 -3.048 11.414 -3.881 1.00 4.01 C ATOM 131 H LEU A 9 -4.073 8.405 -0.169 1.00 51.44 H ATOM 132 HA LEU A 9 -6.108 10.091 -1.178 1.00 62.10 H ATOM 133 HB2 LEU A 9 -3.789 10.740 -1.283 1.00 32.12 H ATOM 134 HB3 LEU A 9 -3.410 9.349 -2.296 1.00 43.04 H ATOM 135 HG LEU A 9 -4.873 10.347 -4.067 1.00 31.23 H ATOM 136 HD11 LEU A 9 -6.263 11.782 -2.743 1.00 24.13 H ATOM 137 HD12 LEU A 9 -5.334 12.779 -3.862 1.00 25.24 H ATOM 138 HD13 LEU A 9 -4.861 12.684 -2.165 1.00 53.02 H ATOM 139 HD21 LEU A 9 -2.826 12.403 -3.509 1.00 52.31 H ATOM 140 HD22 LEU A 9 -3.105 11.439 -4.959 1.00 73.31 H ATOM 141 HD23 LEU A 9 -2.267 10.731 -3.578 1.00 2.41 H ATOM 142 N TYR A 10 -5.531 7.308 -2.804 1.00 10.52 N ATOM 143 CA TYR A 10 -6.052 6.411 -3.828 1.00 41.12 C ATOM 144 C TYR A 10 -7.462 5.946 -3.479 1.00 32.33 C ATOM 145 O TYR A 10 -8.393 6.108 -4.267 1.00 14.03 O ATOM 146 CB TYR A 10 -5.130 5.202 -3.993 1.00 70.32 C ATOM 147 CG TYR A 10 -4.295 5.245 -5.253 1.00 25.33 C ATOM 148 CD1 TYR A 10 -3.532 6.363 -5.566 1.00 54.52 C ATOM 149 CD2 TYR A 10 -4.268 4.167 -6.130 1.00 1.35 C ATOM 150 CE1 TYR A 10 -2.768 6.408 -6.716 1.00 60.41 C ATOM 151 CE2 TYR A 10 -3.505 4.202 -7.281 1.00 13.12 C ATOM 152 CZ TYR A 10 -2.757 5.324 -7.570 1.00 14.41 C ATOM 153 OH TYR A 10 -1.998 5.363 -8.717 1.00 4.55 O ATOM 154 H TYR A 10 -4.796 7.004 -2.231 1.00 51.34 H ATOM 155 HA TYR A 10 -6.085 6.956 -4.760 1.00 74.34 H ATOM 156 HB2 TYR A 10 -4.457 5.153 -3.151 1.00 50.12 H ATOM 157 HB3 TYR A 10 -5.728 4.303 -4.022 1.00 74.12 H ATOM 158 HD1 TYR A 10 -3.543 7.210 -4.895 1.00 43.55 H ATOM 159 HD2 TYR A 10 -4.855 3.290 -5.900 1.00 73.02 H ATOM 160 HE1 TYR A 10 -2.182 7.286 -6.943 1.00 1.12 H ATOM 161 HE2 TYR A 10 -3.497 3.354 -7.950 1.00 12.22 H ATOM 162 HH TYR A 10 -1.427 4.592 -8.749 1.00 21.05 H ATOM 163 N GLN A 11 -7.610 5.367 -2.291 1.00 51.14 N ATOM 164 CA GLN A 11 -8.906 4.878 -1.837 1.00 33.13 C ATOM 165 C GLN A 11 -9.925 6.012 -1.774 1.00 25.51 C ATOM 166 O GLN A 11 -11.088 5.836 -2.136 1.00 51.43 O ATOM 167 CB GLN A 11 -8.773 4.219 -0.462 1.00 50.45 C ATOM 168 CG GLN A 11 -8.244 5.156 0.612 1.00 32.31 C ATOM 169 CD GLN A 11 -7.785 4.418 1.854 1.00 2.13 C ATOM 170 OE1 GLN A 11 -8.454 4.442 2.888 1.00 42.32 O ATOM 171 NE2 GLN A 11 -6.637 3.757 1.760 1.00 73.51 N ATOM 172 H GLN A 11 -6.830 5.267 -1.708 1.00 62.41 H ATOM 173 HA GLN A 11 -9.250 4.141 -2.547 1.00 0.12 H ATOM 174 HB2 GLN A 11 -9.743 3.861 -0.152 1.00 53.43 H ATOM 175 HB3 GLN A 11 -8.097 3.381 -0.542 1.00 74.44 H ATOM 176 HG2 GLN A 11 -7.408 5.708 0.211 1.00 44.04 H ATOM 177 HG3 GLN A 11 -9.029 5.844 0.889 1.00 1.11 H ATOM 178 HE21 GLN A 11 -6.157 3.783 0.905 1.00 35.31 H ATOM 179 HE22 GLN A 11 -6.316 3.272 2.548 1.00 73.24 H ATOM 180 N LYS A 12 -9.480 7.175 -1.311 1.00 65.21 N ATOM 181 CA LYS A 12 -10.351 8.339 -1.201 1.00 62.20 C ATOM 182 C LYS A 12 -10.786 8.825 -2.580 1.00 33.22 C ATOM 183 O LYS A 12 -11.978 8.993 -2.841 1.00 44.15 O ATOM 184 CB LYS A 12 -9.637 9.467 -0.453 1.00 21.00 C ATOM 185 CG LYS A 12 -10.502 10.696 -0.237 1.00 14.32 C ATOM 186 CD LYS A 12 -9.717 11.978 -0.461 1.00 70.43 C ATOM 187 CE LYS A 12 -9.476 12.231 -1.941 1.00 43.35 C ATOM 188 NZ LYS A 12 -8.859 13.565 -2.182 1.00 43.02 N ATOM 189 H LYS A 12 -8.541 7.253 -1.038 1.00 30.35 H ATOM 190 HA LYS A 12 -11.227 8.046 -0.643 1.00 22.15 H ATOM 191 HB2 LYS A 12 -9.322 9.100 0.513 1.00 71.43 H ATOM 192 HB3 LYS A 12 -8.764 9.762 -1.018 1.00 74.33 H ATOM 193 HG2 LYS A 12 -11.331 10.669 -0.929 1.00 63.30 H ATOM 194 HG3 LYS A 12 -10.877 10.688 0.777 1.00 74.51 H ATOM 195 HD2 LYS A 12 -10.274 12.807 -0.052 1.00 4.43 H ATOM 196 HD3 LYS A 12 -8.764 11.898 0.042 1.00 64.14 H ATOM 197 HE2 LYS A 12 -8.817 11.466 -2.322 1.00 31.31 H ATOM 198 HE3 LYS A 12 -10.422 12.183 -2.460 1.00 63.43 H ATOM 199 HZ1 LYS A 12 -9.149 14.233 -1.439 1.00 64.55 H ATOM 200 HZ2 LYS A 12 -9.161 13.937 -3.105 1.00 73.13 H ATOM 201 HZ3 LYS A 12 -7.822 13.485 -2.177 1.00 1.44 H ATOM 202 N TYR A 13 -9.815 9.047 -3.458 1.00 24.03 N ATOM 203 CA TYR A 13 -10.098 9.514 -4.809 1.00 50.44 C ATOM 204 C TYR A 13 -11.052 8.563 -5.526 1.00 1.41 C ATOM 205 O TYR A 13 -11.968 8.996 -6.224 1.00 13.23 O ATOM 206 CB TYR A 13 -8.800 9.650 -5.607 1.00 71.24 C ATOM 207 CG TYR A 13 -9.003 10.181 -7.008 1.00 72.14 C ATOM 208 CD1 TYR A 13 -8.994 11.547 -7.263 1.00 33.05 C ATOM 209 CD2 TYR A 13 -9.205 9.317 -8.078 1.00 11.13 C ATOM 210 CE1 TYR A 13 -9.180 12.037 -8.541 1.00 12.03 C ATOM 211 CE2 TYR A 13 -9.390 9.798 -9.359 1.00 53.13 C ATOM 212 CZ TYR A 13 -9.377 11.159 -9.586 1.00 32.32 C ATOM 213 OH TYR A 13 -9.563 11.642 -10.861 1.00 22.22 O ATOM 214 H TYR A 13 -8.884 8.895 -3.190 1.00 72.23 H ATOM 215 HA TYR A 13 -10.565 10.485 -4.734 1.00 13.35 H ATOM 216 HB2 TYR A 13 -8.136 10.325 -5.090 1.00 54.54 H ATOM 217 HB3 TYR A 13 -8.330 8.680 -5.685 1.00 13.23 H ATOM 218 HD1 TYR A 13 -8.840 12.233 -6.442 1.00 24.41 H ATOM 219 HD2 TYR A 13 -9.215 8.252 -7.897 1.00 32.03 H ATOM 220 HE1 TYR A 13 -9.170 13.102 -8.719 1.00 2.33 H ATOM 221 HE2 TYR A 13 -9.545 9.111 -10.178 1.00 31.43 H ATOM 222 HH TYR A 13 -10.343 12.200 -10.881 1.00 15.33 H ATOM 223 N GLU A 14 -10.828 7.265 -5.347 1.00 13.32 N ATOM 224 CA GLU A 14 -11.668 6.252 -5.976 1.00 45.31 C ATOM 225 C GLU A 14 -13.024 6.161 -5.282 1.00 45.41 C ATOM 226 O GLU A 14 -14.034 5.838 -5.907 1.00 63.23 O ATOM 227 CB GLU A 14 -10.973 4.890 -5.942 1.00 64.52 C ATOM 228 CG GLU A 14 -10.379 4.476 -7.278 1.00 71.43 C ATOM 229 CD GLU A 14 -9.284 3.437 -7.133 1.00 43.14 C ATOM 230 OE1 GLU A 14 -9.184 2.826 -6.049 1.00 74.01 O ATOM 231 OE2 GLU A 14 -8.526 3.236 -8.105 1.00 62.45 O ATOM 232 H GLU A 14 -10.082 6.982 -4.779 1.00 4.32 H ATOM 233 HA GLU A 14 -11.822 6.542 -7.004 1.00 62.35 H ATOM 234 HB2 GLU A 14 -10.177 4.922 -5.212 1.00 51.55 H ATOM 235 HB3 GLU A 14 -11.691 4.140 -5.644 1.00 52.41 H ATOM 236 HG2 GLU A 14 -11.164 4.064 -7.895 1.00 13.43 H ATOM 237 HG3 GLU A 14 -9.965 5.349 -7.760 1.00 52.30 H ATOM 238 N LYS A 15 -13.038 6.449 -3.985 1.00 31.21 N ATOM 239 CA LYS A 15 -14.268 6.401 -3.204 1.00 33.11 C ATOM 240 C LYS A 15 -15.235 7.495 -3.644 1.00 54.14 C ATOM 241 O LYS A 15 -16.320 7.211 -4.155 1.00 22.10 O ATOM 242 CB LYS A 15 -13.957 6.551 -1.713 1.00 45.01 C ATOM 243 CG LYS A 15 -15.195 6.675 -0.842 1.00 63.42 C ATOM 244 CD LYS A 15 -14.834 6.757 0.632 1.00 61.14 C ATOM 245 CE LYS A 15 -15.942 6.194 1.509 1.00 44.21 C ATOM 246 NZ LYS A 15 -15.864 6.715 2.902 1.00 74.11 N ATOM 247 H LYS A 15 -12.200 6.700 -3.542 1.00 11.41 H ATOM 248 HA LYS A 15 -14.730 5.440 -3.371 1.00 75.13 H ATOM 249 HB2 LYS A 15 -13.396 5.687 -1.386 1.00 54.41 H ATOM 250 HB3 LYS A 15 -13.353 7.436 -1.571 1.00 64.24 H ATOM 251 HG2 LYS A 15 -15.732 7.569 -1.121 1.00 30.04 H ATOM 252 HG3 LYS A 15 -15.824 5.810 -1.002 1.00 4.12 H ATOM 253 HD2 LYS A 15 -13.931 6.191 0.805 1.00 63.24 H ATOM 254 HD3 LYS A 15 -14.668 7.792 0.895 1.00 12.03 H ATOM 255 HE2 LYS A 15 -16.895 6.469 1.083 1.00 25.14 H ATOM 256 HE3 LYS A 15 -15.854 5.118 1.530 1.00 21.14 H ATOM 257 HZ1 LYS A 15 -16.586 7.449 3.050 1.00 33.50 H ATOM 258 HZ2 LYS A 15 -14.926 7.127 3.078 1.00 65.35 H ATOM 259 HZ3 LYS A 15 -16.024 5.944 3.581 1.00 74.20 H ATOM 260 N LEU A 16 -14.836 8.746 -3.445 1.00 52.43 N ATOM 261 CA LEU A 16 -15.667 9.884 -3.824 1.00 12.13 C ATOM 262 C LEU A 16 -15.967 9.866 -5.319 1.00 44.23 C ATOM 263 O LEU A 16 -17.090 10.142 -5.743 1.00 3.34 O ATOM 264 CB LEU A 16 -14.975 11.195 -3.446 1.00 64.33 C ATOM 265 CG LEU A 16 -14.321 11.235 -2.065 1.00 23.43 C ATOM 266 CD1 LEU A 16 -13.774 12.623 -1.773 1.00 4.30 C ATOM 267 CD2 LEU A 16 -15.315 10.815 -0.992 1.00 22.22 C ATOM 268 H LEU A 16 -13.962 8.910 -3.034 1.00 52.24 H ATOM 269 HA LEU A 16 -16.598 9.809 -3.282 1.00 11.14 H ATOM 270 HB2 LEU A 16 -14.207 11.387 -4.181 1.00 35.54 H ATOM 271 HB3 LEU A 16 -15.714 11.982 -3.487 1.00 20.05 H ATOM 272 HG LEU A 16 -13.493 10.539 -2.045 1.00 44.41 H ATOM 273 HD11 LEU A 16 -13.520 13.113 -2.701 1.00 72.41 H ATOM 274 HD12 LEU A 16 -12.891 12.540 -1.157 1.00 4.12 H ATOM 275 HD13 LEU A 16 -14.522 13.203 -1.252 1.00 70.23 H ATOM 276 HD21 LEU A 16 -15.027 11.248 -0.045 1.00 54.04 H ATOM 277 HD22 LEU A 16 -15.320 9.738 -0.908 1.00 73.04 H ATOM 278 HD23 LEU A 16 -16.303 11.160 -1.262 1.00 24.24 H ATOM 279 N THR A 17 -14.955 9.537 -6.116 1.00 43.34 N ATOM 280 CA THR A 17 -15.109 9.482 -7.565 1.00 32.05 C ATOM 281 C THR A 17 -15.614 10.811 -8.115 1.00 34.23 C ATOM 282 O THR A 17 -16.250 10.856 -9.168 1.00 1.05 O ATOM 283 CB THR A 17 -16.081 8.363 -7.983 1.00 74.04 C ATOM 284 OG1 THR A 17 -16.154 7.368 -6.957 1.00 34.44 O ATOM 285 CG2 THR A 17 -15.637 7.721 -9.289 1.00 21.43 C ATOM 286 H THR A 17 -14.084 9.328 -5.719 1.00 64.24 H ATOM 287 HA THR A 17 -14.142 9.269 -7.995 1.00 45.43 H ATOM 288 HB THR A 17 -17.062 8.794 -8.127 1.00 20.01 H ATOM 289 HG1 THR A 17 -16.795 6.697 -7.206 1.00 10.03 H ATOM 290 HG21 THR A 17 -16.006 6.707 -9.334 1.00 41.15 H ATOM 291 HG22 THR A 17 -14.558 7.713 -9.337 1.00 50.13 H ATOM 292 HG23 THR A 17 -16.031 8.285 -10.120 1.00 51.43 H ATOM 293 N ALA A 18 -15.327 11.891 -7.396 1.00 11.11 N ATOM 294 CA ALA A 18 -15.750 13.222 -7.814 1.00 73.33 C ATOM 295 C ALA A 18 -17.254 13.267 -8.063 1.00 71.54 C ATOM 296 O ALA A 18 -18.028 12.605 -7.370 1.00 2.33 O ATOM 297 CB ALA A 18 -14.994 13.648 -9.064 1.00 25.24 C ATOM 298 H ALA A 18 -14.817 11.791 -6.565 1.00 73.23 H ATOM 299 HA ALA A 18 -15.506 13.914 -7.022 1.00 11.35 H ATOM 300 HB1 ALA A 18 -14.709 12.771 -9.627 1.00 43.23 H ATOM 301 HB2 ALA A 18 -15.627 14.277 -9.671 1.00 20.21 H ATOM 302 HB3 ALA A 18 -14.108 14.196 -8.778 1.00 72.13 H TER 303 ALA A 18 ENDMDL MODEL 7 ATOM 1 N VAL A 1 3.838 -0.928 -2.409 1.00 25.21 N ATOM 2 CA VAL A 1 3.947 0.524 -2.330 1.00 35.42 C ATOM 3 C VAL A 1 4.837 0.946 -1.166 1.00 73.13 C ATOM 4 O VAL A 1 4.719 0.421 -0.059 1.00 43.15 O ATOM 5 CB VAL A 1 2.563 1.181 -2.168 1.00 42.45 C ATOM 6 CG1 VAL A 1 1.656 0.809 -3.331 1.00 51.33 C ATOM 7 CG2 VAL A 1 1.935 0.781 -0.842 1.00 51.51 C ATOM 8 H1 VAL A 1 4.508 -1.483 -1.957 1.00 3.40 H ATOM 9 HA VAL A 1 4.384 0.877 -3.252 1.00 64.32 H ATOM 10 HB VAL A 1 2.694 2.254 -2.172 1.00 22.41 H ATOM 11 HG11 VAL A 1 0.952 1.609 -3.508 1.00 52.12 H ATOM 12 HG12 VAL A 1 2.253 0.651 -4.217 1.00 73.45 H ATOM 13 HG13 VAL A 1 1.118 -0.096 -3.092 1.00 71.31 H ATOM 14 HG21 VAL A 1 2.000 -0.289 -0.721 1.00 32.52 H ATOM 15 HG22 VAL A 1 2.461 1.268 -0.034 1.00 54.43 H ATOM 16 HG23 VAL A 1 0.897 1.083 -0.829 1.00 63.43 H ATOM 17 N ALA A 2 5.727 1.898 -1.425 1.00 11.21 N ATOM 18 CA ALA A 2 6.636 2.393 -0.399 1.00 12.35 C ATOM 19 C ALA A 2 5.980 3.491 0.432 1.00 42.41 C ATOM 20 O ALA A 2 6.267 3.640 1.620 1.00 43.51 O ATOM 21 CB ALA A 2 7.920 2.905 -1.033 1.00 64.23 C ATOM 22 H ALA A 2 5.772 2.278 -2.327 1.00 64.30 H ATOM 23 HA ALA A 2 6.888 1.567 0.251 1.00 41.14 H ATOM 24 HB1 ALA A 2 8.464 3.500 -0.314 1.00 22.10 H ATOM 25 HB2 ALA A 2 8.528 2.067 -1.341 1.00 21.11 H ATOM 26 HB3 ALA A 2 7.680 3.511 -1.894 1.00 32.21 H ATOM 27 N PHE A 3 5.099 4.259 -0.201 1.00 33.24 N ATOM 28 CA PHE A 3 4.403 5.345 0.480 1.00 44.11 C ATOM 29 C PHE A 3 2.973 4.942 0.827 1.00 3.14 C ATOM 30 O PHE A 3 2.206 4.527 -0.040 1.00 52.13 O ATOM 31 CB PHE A 3 4.393 6.600 -0.395 1.00 62.05 C ATOM 32 CG PHE A 3 5.326 7.674 0.086 1.00 14.53 C ATOM 33 CD1 PHE A 3 5.242 8.152 1.384 1.00 21.23 C ATOM 34 CD2 PHE A 3 6.285 8.208 -0.759 1.00 61.42 C ATOM 35 CE1 PHE A 3 6.099 9.140 1.831 1.00 52.31 C ATOM 36 CE2 PHE A 3 7.145 9.196 -0.318 1.00 72.11 C ATOM 37 CZ PHE A 3 7.051 9.664 0.978 1.00 33.31 C ATOM 38 H PHE A 3 4.912 4.091 -1.148 1.00 71.23 H ATOM 39 HA PHE A 3 4.937 5.558 1.393 1.00 12.03 H ATOM 40 HB2 PHE A 3 4.687 6.332 -1.399 1.00 52.43 H ATOM 41 HB3 PHE A 3 3.394 7.009 -0.414 1.00 4.03 H ATOM 42 HD1 PHE A 3 4.497 7.743 2.053 1.00 61.15 H ATOM 43 HD2 PHE A 3 6.359 7.844 -1.773 1.00 63.35 H ATOM 44 HE1 PHE A 3 6.022 9.504 2.845 1.00 23.41 H ATOM 45 HE2 PHE A 3 7.888 9.604 -0.987 1.00 30.41 H ATOM 46 HZ PHE A 3 7.721 10.435 1.325 1.00 4.41 H ATOM 47 N ALA A 4 2.623 5.067 2.103 1.00 2.24 N ATOM 48 CA ALA A 4 1.286 4.718 2.566 1.00 30.24 C ATOM 49 C ALA A 4 0.282 5.813 2.221 1.00 21.52 C ATOM 50 O ALA A 4 -0.903 5.542 2.022 1.00 11.24 O ATOM 51 CB ALA A 4 1.297 4.463 4.066 1.00 33.43 C ATOM 52 H ALA A 4 3.280 5.404 2.748 1.00 35.33 H ATOM 53 HA ALA A 4 0.990 3.803 2.073 1.00 41.35 H ATOM 54 HB1 ALA A 4 0.503 3.774 4.319 1.00 65.10 H ATOM 55 HB2 ALA A 4 2.247 4.038 4.352 1.00 4.12 H ATOM 56 HB3 ALA A 4 1.145 5.394 4.591 1.00 45.23 H ATOM 57 N LEU A 5 0.763 7.049 2.152 1.00 12.02 N ATOM 58 CA LEU A 5 -0.093 8.186 1.831 1.00 33.15 C ATOM 59 C LEU A 5 -0.825 7.961 0.512 1.00 13.33 C ATOM 60 O LEU A 5 -2.013 8.261 0.389 1.00 14.45 O ATOM 61 CB LEU A 5 0.736 9.469 1.755 1.00 24.25 C ATOM 62 CG LEU A 5 0.104 10.715 2.376 1.00 21.25 C ATOM 63 CD1 LEU A 5 1.169 11.754 2.691 1.00 23.42 C ATOM 64 CD2 LEU A 5 -0.952 11.296 1.448 1.00 33.00 C ATOM 65 H LEU A 5 1.716 7.202 2.321 1.00 55.24 H ATOM 66 HA LEU A 5 -0.823 8.285 2.622 1.00 65.33 H ATOM 67 HB2 LEU A 5 1.673 9.287 2.260 1.00 51.11 H ATOM 68 HB3 LEU A 5 0.926 9.678 0.712 1.00 20.41 H ATOM 69 HG LEU A 5 -0.379 10.441 3.305 1.00 40.25 H ATOM 70 HD11 LEU A 5 1.467 11.662 3.725 1.00 52.22 H ATOM 71 HD12 LEU A 5 0.771 12.742 2.517 1.00 14.02 H ATOM 72 HD13 LEU A 5 2.027 11.594 2.054 1.00 53.34 H ATOM 73 HD21 LEU A 5 -1.408 10.500 0.879 1.00 72.14 H ATOM 74 HD22 LEU A 5 -0.490 12.002 0.774 1.00 25.12 H ATOM 75 HD23 LEU A 5 -1.708 11.800 2.033 1.00 31.44 H ATOM 76 N THR A 6 -0.109 7.429 -0.473 1.00 41.11 N ATOM 77 CA THR A 6 -0.690 7.163 -1.783 1.00 21.21 C ATOM 78 C THR A 6 -1.904 6.248 -1.670 1.00 53.41 C ATOM 79 O THR A 6 -2.837 6.336 -2.470 1.00 63.23 O ATOM 80 CB THR A 6 0.337 6.518 -2.733 1.00 4.43 C ATOM 81 OG1 THR A 6 0.795 5.275 -2.189 1.00 13.10 O ATOM 82 CG2 THR A 6 1.522 7.446 -2.958 1.00 61.40 C ATOM 83 H THR A 6 0.833 7.212 -0.314 1.00 22.40 H ATOM 84 HA THR A 6 -1.000 8.106 -2.208 1.00 41.33 H ATOM 85 HB THR A 6 -0.141 6.332 -3.684 1.00 14.44 H ATOM 86 HG1 THR A 6 0.321 4.550 -2.605 1.00 4.41 H ATOM 87 HG21 THR A 6 1.692 8.034 -2.069 1.00 63.10 H ATOM 88 HG22 THR A 6 1.312 8.102 -3.789 1.00 44.42 H ATOM 89 HG23 THR A 6 2.402 6.859 -3.176 1.00 21.34 H ATOM 90 N LEU A 7 -1.888 5.372 -0.672 1.00 71.32 N ATOM 91 CA LEU A 7 -2.990 4.440 -0.454 1.00 4.41 C ATOM 92 C LEU A 7 -4.265 5.185 -0.074 1.00 12.34 C ATOM 93 O LEU A 7 -5.321 4.970 -0.667 1.00 13.34 O ATOM 94 CB LEU A 7 -2.625 3.437 0.642 1.00 75.13 C ATOM 95 CG LEU A 7 -3.272 2.056 0.529 1.00 54.01 C ATOM 96 CD1 LEU A 7 -2.417 1.008 1.224 1.00 74.33 C ATOM 97 CD2 LEU A 7 -4.677 2.075 1.115 1.00 44.50 C ATOM 98 H LEU A 7 -1.118 5.349 -0.067 1.00 41.33 H ATOM 99 HA LEU A 7 -3.160 3.907 -1.377 1.00 52.02 H ATOM 100 HB2 LEU A 7 -1.555 3.303 0.624 1.00 21.44 H ATOM 101 HB3 LEU A 7 -2.918 3.864 1.591 1.00 62.05 H ATOM 102 HG LEU A 7 -3.348 1.785 -0.515 1.00 55.22 H ATOM 103 HD11 LEU A 7 -2.048 1.405 2.157 1.00 41.33 H ATOM 104 HD12 LEU A 7 -1.584 0.745 0.589 1.00 30.31 H ATOM 105 HD13 LEU A 7 -3.014 0.128 1.417 1.00 25.24 H ATOM 106 HD21 LEU A 7 -4.945 1.081 1.439 1.00 10.25 H ATOM 107 HD22 LEU A 7 -5.375 2.410 0.363 1.00 55.05 H ATOM 108 HD23 LEU A 7 -4.705 2.750 1.958 1.00 14.42 H ATOM 109 N ASN A 8 -4.158 6.064 0.918 1.00 31.52 N ATOM 110 CA ASN A 8 -5.303 6.842 1.377 1.00 41.13 C ATOM 111 C ASN A 8 -5.814 7.761 0.271 1.00 60.30 C ATOM 112 O ASN A 8 -7.022 7.904 0.077 1.00 42.15 O ATOM 113 CB ASN A 8 -4.924 7.668 2.607 1.00 12.53 C ATOM 114 CG ASN A 8 -5.896 7.474 3.755 1.00 2.44 C ATOM 115 OD1 ASN A 8 -6.850 8.236 3.911 1.00 53.20 O ATOM 116 ND2 ASN A 8 -5.656 6.451 4.567 1.00 61.34 N ATOM 117 H ASN A 8 -3.289 6.191 1.352 1.00 1.15 H ATOM 118 HA ASN A 8 -6.087 6.151 1.646 1.00 73.23 H ATOM 119 HB2 ASN A 8 -3.939 7.375 2.941 1.00 15.13 H ATOM 120 HB3 ASN A 8 -4.913 8.715 2.342 1.00 60.11 H ATOM 121 HD21 ASN A 8 -4.877 5.886 4.382 1.00 64.23 H ATOM 122 HD22 ASN A 8 -6.269 6.302 5.317 1.00 63.33 H ATOM 123 N LEU A 9 -4.887 8.380 -0.451 1.00 51.32 N ATOM 124 CA LEU A 9 -5.243 9.285 -1.539 1.00 2.22 C ATOM 125 C LEU A 9 -5.992 8.543 -2.641 1.00 43.54 C ATOM 126 O LEU A 9 -6.996 9.031 -3.160 1.00 13.11 O ATOM 127 CB LEU A 9 -3.987 9.943 -2.113 1.00 63.30 C ATOM 128 CG LEU A 9 -4.218 11.142 -3.033 1.00 3.11 C ATOM 129 CD1 LEU A 9 -3.007 12.062 -3.025 1.00 65.22 C ATOM 130 CD2 LEU A 9 -4.527 10.677 -4.448 1.00 72.23 C ATOM 131 H LEU A 9 -3.941 8.226 -0.249 1.00 40.43 H ATOM 132 HA LEU A 9 -5.888 10.051 -1.135 1.00 3.33 H ATOM 133 HB2 LEU A 9 -3.379 10.274 -1.285 1.00 61.40 H ATOM 134 HB3 LEU A 9 -3.449 9.192 -2.675 1.00 1.22 H ATOM 135 HG LEU A 9 -5.067 11.706 -2.672 1.00 43.31 H ATOM 136 HD11 LEU A 9 -2.278 11.692 -2.320 1.00 31.31 H ATOM 137 HD12 LEU A 9 -3.312 13.057 -2.738 1.00 53.13 H ATOM 138 HD13 LEU A 9 -2.570 12.091 -4.013 1.00 32.50 H ATOM 139 HD21 LEU A 9 -5.584 10.477 -4.538 1.00 75.42 H ATOM 140 HD22 LEU A 9 -3.970 9.776 -4.660 1.00 54.04 H ATOM 141 HD23 LEU A 9 -4.245 11.448 -5.151 1.00 0.05 H ATOM 142 N TYR A 10 -5.497 7.362 -2.993 1.00 74.22 N ATOM 143 CA TYR A 10 -6.119 6.552 -4.034 1.00 55.43 C ATOM 144 C TYR A 10 -7.521 6.115 -3.620 1.00 30.03 C ATOM 145 O TYR A 10 -8.487 6.312 -4.356 1.00 51.30 O ATOM 146 CB TYR A 10 -5.259 5.325 -4.338 1.00 22.13 C ATOM 147 CG TYR A 10 -5.373 4.844 -5.767 1.00 22.45 C ATOM 148 CD1 TYR A 10 -4.689 5.483 -6.793 1.00 4.23 C ATOM 149 CD2 TYR A 10 -6.164 3.748 -6.090 1.00 53.31 C ATOM 150 CE1 TYR A 10 -4.791 5.047 -8.099 1.00 44.35 C ATOM 151 CE2 TYR A 10 -6.271 3.304 -7.394 1.00 50.40 C ATOM 152 CZ TYR A 10 -5.583 3.957 -8.395 1.00 43.51 C ATOM 153 OH TYR A 10 -5.686 3.519 -9.695 1.00 42.35 O ATOM 154 H TYR A 10 -4.694 7.026 -2.544 1.00 10.25 H ATOM 155 HA TYR A 10 -6.193 7.158 -4.926 1.00 24.11 H ATOM 156 HB2 TYR A 10 -4.223 5.564 -4.151 1.00 15.42 H ATOM 157 HB3 TYR A 10 -5.559 4.514 -3.689 1.00 44.54 H ATOM 158 HD1 TYR A 10 -4.069 6.336 -6.557 1.00 44.35 H ATOM 159 HD2 TYR A 10 -6.702 3.239 -5.304 1.00 33.22 H ATOM 160 HE1 TYR A 10 -4.251 5.558 -8.883 1.00 53.25 H ATOM 161 HE2 TYR A 10 -6.891 2.451 -7.626 1.00 54.21 H ATOM 162 HH TYR A 10 -6.489 3.003 -9.796 1.00 52.44 H ATOM 163 N GLN A 11 -7.622 5.521 -2.435 1.00 71.42 N ATOM 164 CA GLN A 11 -8.905 5.055 -1.922 1.00 21.13 C ATOM 165 C GLN A 11 -9.884 6.214 -1.772 1.00 15.22 C ATOM 166 O GLN A 11 -11.058 6.099 -2.124 1.00 75.23 O ATOM 167 CB GLN A 11 -8.715 4.354 -0.575 1.00 52.52 C ATOM 168 CG GLN A 11 -9.527 3.077 -0.434 1.00 62.23 C ATOM 169 CD GLN A 11 -10.989 3.344 -0.137 1.00 52.15 C ATOM 170 OE1 GLN A 11 -11.328 3.948 0.881 1.00 24.20 O ATOM 171 NE2 GLN A 11 -11.866 2.895 -1.028 1.00 0.20 N ATOM 172 H GLN A 11 -6.816 5.392 -1.895 1.00 4.04 H ATOM 173 HA GLN A 11 -9.309 4.348 -2.631 1.00 3.32 H ATOM 174 HB2 GLN A 11 -7.671 4.107 -0.455 1.00 40.52 H ATOM 175 HB3 GLN A 11 -9.010 5.031 0.214 1.00 61.14 H ATOM 176 HG2 GLN A 11 -9.459 2.519 -1.356 1.00 72.15 H ATOM 177 HG3 GLN A 11 -9.112 2.490 0.372 1.00 72.44 H ATOM 178 HE21 GLN A 11 -11.524 2.422 -1.816 1.00 21.44 H ATOM 179 HE22 GLN A 11 -12.818 3.053 -0.861 1.00 4.31 H ATOM 180 N LYS A 12 -9.395 7.332 -1.246 1.00 23.20 N ATOM 181 CA LYS A 12 -10.226 8.514 -1.049 1.00 63.35 C ATOM 182 C LYS A 12 -10.753 9.036 -2.382 1.00 44.02 C ATOM 183 O LYS A 12 -11.942 9.323 -2.521 1.00 60.41 O ATOM 184 CB LYS A 12 -9.429 9.610 -0.339 1.00 10.21 C ATOM 185 CG LYS A 12 -10.263 10.823 0.035 1.00 53.23 C ATOM 186 CD LYS A 12 -9.476 12.113 -0.127 1.00 21.34 C ATOM 187 CE LYS A 12 -9.221 12.430 -1.592 1.00 3.30 C ATOM 188 NZ LYS A 12 -7.783 12.715 -1.856 1.00 11.35 N ATOM 189 H LYS A 12 -8.450 7.363 -0.984 1.00 71.22 H ATOM 190 HA LYS A 12 -11.064 8.231 -0.431 1.00 23.14 H ATOM 191 HB2 LYS A 12 -9.002 9.200 0.565 1.00 54.42 H ATOM 192 HB3 LYS A 12 -8.629 9.936 -0.989 1.00 34.24 H ATOM 193 HG2 LYS A 12 -11.132 10.862 -0.605 1.00 52.33 H ATOM 194 HG3 LYS A 12 -10.577 10.730 1.065 1.00 64.31 H ATOM 195 HD2 LYS A 12 -10.036 12.924 0.313 1.00 13.25 H ATOM 196 HD3 LYS A 12 -8.527 12.011 0.381 1.00 32.14 H ATOM 197 HE2 LYS A 12 -9.526 11.585 -2.189 1.00 34.33 H ATOM 198 HE3 LYS A 12 -9.807 13.295 -1.866 1.00 43.15 H ATOM 199 HZ1 LYS A 12 -7.273 12.840 -0.958 1.00 41.31 H ATOM 200 HZ2 LYS A 12 -7.689 13.584 -2.420 1.00 0.13 H ATOM 201 HZ3 LYS A 12 -7.353 11.927 -2.380 1.00 2.12 H ATOM 202 N TYR A 13 -9.861 9.156 -3.359 1.00 60.04 N ATOM 203 CA TYR A 13 -10.236 9.645 -4.681 1.00 34.31 C ATOM 204 C TYR A 13 -11.245 8.710 -5.341 1.00 70.42 C ATOM 205 O TYR A 13 -12.183 9.157 -5.999 1.00 53.25 O ATOM 206 CB TYR A 13 -8.997 9.784 -5.567 1.00 55.30 C ATOM 207 CG TYR A 13 -9.297 10.332 -6.944 1.00 44.21 C ATOM 208 CD1 TYR A 13 -9.367 11.701 -7.169 1.00 11.55 C ATOM 209 CD2 TYR A 13 -9.508 9.480 -8.021 1.00 41.23 C ATOM 210 CE1 TYR A 13 -9.641 12.206 -8.425 1.00 1.31 C ATOM 211 CE2 TYR A 13 -9.781 9.976 -9.281 1.00 42.25 C ATOM 212 CZ TYR A 13 -9.847 11.340 -9.478 1.00 62.21 C ATOM 213 OH TYR A 13 -10.118 11.839 -10.731 1.00 74.34 O ATOM 214 H TYR A 13 -8.928 8.912 -3.188 1.00 64.20 H ATOM 215 HA TYR A 13 -10.691 10.617 -4.558 1.00 44.03 H ATOM 216 HB2 TYR A 13 -8.296 10.451 -5.091 1.00 2.43 H ATOM 217 HB3 TYR A 13 -8.539 8.814 -5.688 1.00 62.22 H ATOM 218 HD1 TYR A 13 -9.205 12.377 -6.341 1.00 42.53 H ATOM 219 HD2 TYR A 13 -9.456 8.412 -7.864 1.00 44.52 H ATOM 220 HE1 TYR A 13 -9.692 13.274 -8.579 1.00 51.01 H ATOM 221 HE2 TYR A 13 -9.942 9.298 -10.107 1.00 14.14 H ATOM 222 HH TYR A 13 -10.268 12.785 -10.673 1.00 53.32 H ATOM 223 N GLU A 14 -11.043 7.408 -5.159 1.00 14.32 N ATOM 224 CA GLU A 14 -11.935 6.410 -5.737 1.00 22.53 C ATOM 225 C GLU A 14 -13.258 6.357 -4.978 1.00 23.31 C ATOM 226 O GLU A 14 -14.291 5.981 -5.533 1.00 3.43 O ATOM 227 CB GLU A 14 -11.270 5.031 -5.722 1.00 55.21 C ATOM 228 CG GLU A 14 -10.573 4.678 -7.025 1.00 31.21 C ATOM 229 CD GLU A 14 -11.523 4.105 -8.059 1.00 14.15 C ATOM 230 OE1 GLU A 14 -12.143 4.898 -8.798 1.00 11.42 O ATOM 231 OE2 GLU A 14 -11.648 2.865 -8.128 1.00 63.42 O ATOM 232 H GLU A 14 -10.277 7.113 -4.624 1.00 13.33 H ATOM 233 HA GLU A 14 -12.132 6.693 -6.760 1.00 23.14 H ATOM 234 HB2 GLU A 14 -10.539 5.006 -4.927 1.00 74.44 H ATOM 235 HB3 GLU A 14 -12.025 4.284 -5.528 1.00 75.42 H ATOM 236 HG2 GLU A 14 -10.121 5.570 -7.430 1.00 42.51 H ATOM 237 HG3 GLU A 14 -9.804 3.947 -6.820 1.00 53.33 H ATOM 238 N LYS A 15 -13.218 6.735 -3.705 1.00 31.02 N ATOM 239 CA LYS A 15 -14.412 6.732 -2.868 1.00 0.32 C ATOM 240 C LYS A 15 -15.260 7.974 -3.126 1.00 30.34 C ATOM 241 O LYS A 15 -16.490 7.915 -3.097 1.00 71.42 O ATOM 242 CB LYS A 15 -14.023 6.665 -1.389 1.00 51.51 C ATOM 243 CG LYS A 15 -15.206 6.469 -0.457 1.00 73.54 C ATOM 244 CD LYS A 15 -14.785 5.815 0.848 1.00 12.44 C ATOM 245 CE LYS A 15 -15.874 5.929 1.905 1.00 63.43 C ATOM 246 NZ LYS A 15 -15.309 5.959 3.282 1.00 22.42 N ATOM 247 H LYS A 15 -12.364 7.024 -3.319 1.00 13.24 H ATOM 248 HA LYS A 15 -14.991 5.857 -3.119 1.00 32.31 H ATOM 249 HB2 LYS A 15 -13.338 5.843 -1.246 1.00 71.23 H ATOM 250 HB3 LYS A 15 -13.528 7.587 -1.118 1.00 25.53 H ATOM 251 HG2 LYS A 15 -15.646 7.431 -0.241 1.00 34.55 H ATOM 252 HG3 LYS A 15 -15.936 5.838 -0.946 1.00 13.44 H ATOM 253 HD2 LYS A 15 -14.581 4.770 0.669 1.00 40.31 H ATOM 254 HD3 LYS A 15 -13.891 6.302 1.212 1.00 62.41 H ATOM 255 HE2 LYS A 15 -16.430 6.837 1.733 1.00 14.13 H ATOM 256 HE3 LYS A 15 -16.534 5.079 1.814 1.00 15.10 H ATOM 257 HZ1 LYS A 15 -15.714 6.753 3.818 1.00 62.25 H ATOM 258 HZ2 LYS A 15 -14.276 6.072 3.242 1.00 43.40 H ATOM 259 HZ3 LYS A 15 -15.529 5.072 3.778 1.00 33.32 H ATOM 260 N LEU A 16 -14.596 9.096 -3.379 1.00 0.05 N ATOM 261 CA LEU A 16 -15.289 10.352 -3.643 1.00 52.04 C ATOM 262 C LEU A 16 -16.038 10.291 -4.971 1.00 44.51 C ATOM 263 O LEU A 16 -16.984 11.046 -5.198 1.00 74.42 O ATOM 264 CB LEU A 16 -14.294 11.513 -3.659 1.00 3.45 C ATOM 265 CG LEU A 16 -13.732 11.934 -2.300 1.00 21.41 C ATOM 266 CD1 LEU A 16 -12.609 12.944 -2.476 1.00 22.20 C ATOM 267 CD2 LEU A 16 -14.834 12.507 -1.421 1.00 72.31 C ATOM 268 H LEU A 16 -13.617 9.081 -3.388 1.00 24.13 H ATOM 269 HA LEU A 16 -16.003 10.510 -2.849 1.00 2.54 H ATOM 270 HB2 LEU A 16 -13.463 11.229 -4.286 1.00 30.43 H ATOM 271 HB3 LEU A 16 -14.792 12.369 -4.091 1.00 11.41 H ATOM 272 HG LEU A 16 -13.324 11.065 -1.802 1.00 24.11 H ATOM 273 HD11 LEU A 16 -12.014 12.981 -1.576 1.00 40.21 H ATOM 274 HD12 LEU A 16 -13.029 13.919 -2.670 1.00 54.34 H ATOM 275 HD13 LEU A 16 -11.986 12.648 -3.308 1.00 13.40 H ATOM 276 HD21 LEU A 16 -14.428 13.291 -0.800 1.00 52.11 H ATOM 277 HD22 LEU A 16 -15.238 11.724 -0.796 1.00 14.44 H ATOM 278 HD23 LEU A 16 -15.619 12.910 -2.045 1.00 62.11 H ATOM 279 N THR A 17 -15.608 9.387 -5.846 1.00 12.10 N ATOM 280 CA THR A 17 -16.238 9.227 -7.151 1.00 23.24 C ATOM 281 C THR A 17 -16.063 10.478 -8.003 1.00 43.31 C ATOM 282 O THR A 17 -16.827 10.716 -8.938 1.00 62.30 O ATOM 283 CB THR A 17 -17.741 8.918 -7.015 1.00 64.20 C ATOM 284 OG1 THR A 17 -17.962 8.042 -5.904 1.00 74.11 O ATOM 285 CG2 THR A 17 -18.279 8.279 -8.286 1.00 65.34 C ATOM 286 H THR A 17 -14.849 8.815 -5.607 1.00 12.30 H ATOM 287 HA THR A 17 -15.764 8.394 -7.649 1.00 62.25 H ATOM 288 HB THR A 17 -18.269 9.845 -6.844 1.00 72.31 H ATOM 289 HG1 THR A 17 -17.230 7.425 -5.832 1.00 74.40 H ATOM 290 HG21 THR A 17 -17.465 7.829 -8.835 1.00 23.44 H ATOM 291 HG22 THR A 17 -18.749 9.034 -8.898 1.00 14.32 H ATOM 292 HG23 THR A 17 -19.003 7.520 -8.029 1.00 41.23 H ATOM 293 N ALA A 18 -15.051 11.276 -7.675 1.00 35.33 N ATOM 294 CA ALA A 18 -14.775 12.502 -8.413 1.00 22.15 C ATOM 295 C ALA A 18 -16.026 13.366 -8.530 1.00 2.11 C ATOM 296 O ALA A 18 -16.441 14.008 -7.564 1.00 73.12 O ATOM 297 CB ALA A 18 -14.226 12.175 -9.793 1.00 63.42 C ATOM 298 H ALA A 18 -14.477 11.033 -6.919 1.00 71.40 H ATOM 299 HA ALA A 18 -14.018 13.053 -7.872 1.00 72.05 H ATOM 300 HB1 ALA A 18 -15.034 12.176 -10.511 1.00 4.14 H ATOM 301 HB2 ALA A 18 -13.493 12.916 -10.074 1.00 41.20 H ATOM 302 HB3 ALA A 18 -13.763 11.199 -9.774 1.00 43.41 H TER 303 ALA A 18 ENDMDL MODEL 8 ATOM 1 N VAL A 1 3.243 -0.380 -0.851 1.00 0.13 N ATOM 2 CA VAL A 1 3.835 0.288 -2.004 1.00 21.23 C ATOM 3 C VAL A 1 4.858 1.331 -1.569 1.00 43.01 C ATOM 4 O VAL A 1 5.034 2.355 -2.229 1.00 25.22 O ATOM 5 CB VAL A 1 2.760 0.969 -2.871 1.00 11.32 C ATOM 6 CG1 VAL A 1 1.877 -0.071 -3.543 1.00 21.31 C ATOM 7 CG2 VAL A 1 1.926 1.925 -2.031 1.00 43.52 C ATOM 8 H1 VAL A 1 2.551 0.083 -0.334 1.00 30.22 H ATOM 9 HA VAL A 1 4.331 -0.461 -2.605 1.00 1.43 H ATOM 10 HB VAL A 1 3.256 1.540 -3.642 1.00 25.21 H ATOM 11 HG11 VAL A 1 2.192 -0.201 -4.568 1.00 74.51 H ATOM 12 HG12 VAL A 1 1.963 -1.011 -3.017 1.00 13.45 H ATOM 13 HG13 VAL A 1 0.850 0.261 -3.522 1.00 54.21 H ATOM 14 HG21 VAL A 1 1.593 2.748 -2.646 1.00 0.20 H ATOM 15 HG22 VAL A 1 1.070 1.402 -1.634 1.00 75.44 H ATOM 16 HG23 VAL A 1 2.525 2.305 -1.216 1.00 1.21 H ATOM 17 N ALA A 2 5.531 1.064 -0.455 1.00 21.53 N ATOM 18 CA ALA A 2 6.539 1.978 0.067 1.00 22.11 C ATOM 19 C ALA A 2 5.968 3.380 0.248 1.00 54.02 C ATOM 20 O ALA A 2 6.685 4.374 0.131 1.00 61.34 O ATOM 21 CB ALA A 2 7.748 2.014 -0.856 1.00 70.43 C ATOM 22 H ALA A 2 5.346 0.231 0.027 1.00 20.31 H ATOM 23 HA ALA A 2 6.862 1.605 1.029 1.00 43.15 H ATOM 24 HB1 ALA A 2 7.531 2.641 -1.708 1.00 55.43 H ATOM 25 HB2 ALA A 2 8.597 2.412 -0.322 1.00 2.40 H ATOM 26 HB3 ALA A 2 7.972 1.013 -1.194 1.00 60.12 H ATOM 27 N PHE A 3 4.672 3.453 0.533 1.00 12.51 N ATOM 28 CA PHE A 3 4.003 4.735 0.728 1.00 24.23 C ATOM 29 C PHE A 3 2.569 4.532 1.209 1.00 43.52 C ATOM 30 O PHE A 3 1.758 3.907 0.527 1.00 14.14 O ATOM 31 CB PHE A 3 4.008 5.540 -0.573 1.00 5.13 C ATOM 32 CG PHE A 3 4.639 6.896 -0.436 1.00 3.33 C ATOM 33 CD1 PHE A 3 3.910 7.968 0.054 1.00 61.12 C ATOM 34 CD2 PHE A 3 5.961 7.100 -0.797 1.00 64.31 C ATOM 35 CE1 PHE A 3 4.488 9.217 0.182 1.00 54.25 C ATOM 36 CE2 PHE A 3 6.544 8.346 -0.671 1.00 43.42 C ATOM 37 CZ PHE A 3 5.806 9.407 -0.183 1.00 22.25 C ATOM 38 H PHE A 3 4.152 2.626 0.614 1.00 64.13 H ATOM 39 HA PHE A 3 4.549 5.281 1.482 1.00 62.01 H ATOM 40 HB2 PHE A 3 4.558 4.994 -1.324 1.00 23.50 H ATOM 41 HB3 PHE A 3 2.991 5.678 -0.906 1.00 60.11 H ATOM 42 HD1 PHE A 3 2.878 7.821 0.339 1.00 74.53 H ATOM 43 HD2 PHE A 3 6.540 6.272 -1.180 1.00 74.14 H ATOM 44 HE1 PHE A 3 3.907 10.044 0.564 1.00 64.11 H ATOM 45 HE2 PHE A 3 7.575 8.492 -0.957 1.00 4.22 H ATOM 46 HZ PHE A 3 6.260 10.382 -0.083 1.00 34.30 H ATOM 47 N ALA A 4 2.266 5.066 2.387 1.00 12.15 N ATOM 48 CA ALA A 4 0.930 4.946 2.959 1.00 24.13 C ATOM 49 C ALA A 4 0.038 6.102 2.518 1.00 25.45 C ATOM 50 O ALA A 4 -1.184 5.967 2.456 1.00 73.21 O ATOM 51 CB ALA A 4 1.010 4.887 4.478 1.00 53.24 C ATOM 52 H ALA A 4 2.956 5.553 2.884 1.00 40.35 H ATOM 53 HA ALA A 4 0.500 4.018 2.610 1.00 52.53 H ATOM 54 HB1 ALA A 4 2.012 4.615 4.774 1.00 3.55 H ATOM 55 HB2 ALA A 4 0.762 5.854 4.888 1.00 13.54 H ATOM 56 HB3 ALA A 4 0.313 4.150 4.846 1.00 74.41 H ATOM 57 N LEU A 5 0.657 7.237 2.215 1.00 51.35 N ATOM 58 CA LEU A 5 -0.082 8.418 1.780 1.00 65.02 C ATOM 59 C LEU A 5 -0.856 8.134 0.496 1.00 5.25 C ATOM 60 O LEU A 5 -2.039 8.455 0.388 1.00 15.41 O ATOM 61 CB LEU A 5 0.876 9.591 1.563 1.00 52.13 C ATOM 62 CG LEU A 5 0.224 10.954 1.324 1.00 63.31 C ATOM 63 CD1 LEU A 5 0.728 11.971 2.336 1.00 42.02 C ATOM 64 CD2 LEU A 5 0.494 11.432 -0.095 1.00 55.14 C ATOM 65 H LEU A 5 1.633 7.284 2.284 1.00 51.14 H ATOM 66 HA LEU A 5 -0.783 8.676 2.559 1.00 22.45 H ATOM 67 HB2 LEU A 5 1.502 9.673 2.438 1.00 50.13 H ATOM 68 HB3 LEU A 5 1.489 9.361 0.703 1.00 5.42 H ATOM 69 HG LEU A 5 -0.846 10.861 1.449 1.00 22.02 H ATOM 70 HD11 LEU A 5 0.605 12.967 1.937 1.00 22.51 H ATOM 71 HD12 LEU A 5 1.774 11.790 2.538 1.00 54.44 H ATOM 72 HD13 LEU A 5 0.164 11.877 3.252 1.00 13.11 H ATOM 73 HD21 LEU A 5 1.544 11.657 -0.206 1.00 72.03 H ATOM 74 HD22 LEU A 5 -0.088 12.321 -0.292 1.00 31.25 H ATOM 75 HD23 LEU A 5 0.214 10.658 -0.795 1.00 63.33 H ATOM 76 N THR A 6 -0.180 7.528 -0.475 1.00 24.35 N ATOM 77 CA THR A 6 -0.803 7.199 -1.750 1.00 54.31 C ATOM 78 C THR A 6 -2.015 6.295 -1.553 1.00 43.11 C ATOM 79 O THR A 6 -2.959 6.324 -2.343 1.00 53.42 O ATOM 80 CB THR A 6 0.191 6.506 -2.700 1.00 25.11 C ATOM 81 OG1 THR A 6 -0.430 6.260 -3.966 1.00 52.53 O ATOM 82 CG2 THR A 6 0.681 5.193 -2.107 1.00 10.53 C ATOM 83 H THR A 6 0.761 7.297 -0.328 1.00 45.02 H ATOM 84 HA THR A 6 -1.126 8.122 -2.211 1.00 62.30 H ATOM 85 HB THR A 6 1.041 7.158 -2.845 1.00 23.32 H ATOM 86 HG1 THR A 6 -0.228 6.981 -4.568 1.00 5.35 H ATOM 87 HG21 THR A 6 1.637 4.939 -2.538 1.00 25.24 H ATOM 88 HG22 THR A 6 -0.031 4.412 -2.325 1.00 74.30 H ATOM 89 HG23 THR A 6 0.784 5.298 -1.037 1.00 2.40 H ATOM 90 N LEU A 7 -1.982 5.493 -0.495 1.00 32.22 N ATOM 91 CA LEU A 7 -3.079 4.579 -0.193 1.00 51.51 C ATOM 92 C LEU A 7 -4.360 5.349 0.111 1.00 14.00 C ATOM 93 O LEU A 7 -5.390 5.138 -0.529 1.00 23.54 O ATOM 94 CB LEU A 7 -2.713 3.686 0.993 1.00 13.15 C ATOM 95 CG LEU A 7 -3.198 2.238 0.918 1.00 61.12 C ATOM 96 CD1 LEU A 7 -2.205 1.382 0.146 1.00 53.51 C ATOM 97 CD2 LEU A 7 -3.417 1.675 2.315 1.00 43.04 C ATOM 98 H LEU A 7 -1.203 5.514 0.098 1.00 0.33 H ATOM 99 HA LEU A 7 -3.243 3.960 -1.062 1.00 51.35 H ATOM 100 HB2 LEU A 7 -1.637 3.671 1.076 1.00 34.42 H ATOM 101 HB3 LEU A 7 -3.135 4.131 1.884 1.00 42.23 H ATOM 102 HG LEU A 7 -4.143 2.208 0.392 1.00 4.04 H ATOM 103 HD11 LEU A 7 -2.518 1.310 -0.885 1.00 20.34 H ATOM 104 HD12 LEU A 7 -2.167 0.395 0.581 1.00 24.22 H ATOM 105 HD13 LEU A 7 -1.226 1.835 0.195 1.00 42.43 H ATOM 106 HD21 LEU A 7 -2.475 1.334 2.717 1.00 64.12 H ATOM 107 HD22 LEU A 7 -4.108 0.847 2.264 1.00 32.11 H ATOM 108 HD23 LEU A 7 -3.824 2.445 2.953 1.00 11.53 H ATOM 109 N ASN A 8 -4.289 6.244 1.091 1.00 45.33 N ATOM 110 CA ASN A 8 -5.443 7.047 1.479 1.00 44.13 C ATOM 111 C ASN A 8 -5.887 7.950 0.332 1.00 0.43 C ATOM 112 O ASN A 8 -7.076 8.227 0.170 1.00 34.13 O ATOM 113 CB ASN A 8 -5.111 7.893 2.710 1.00 31.30 C ATOM 114 CG ASN A 8 -4.797 7.044 3.927 1.00 70.22 C ATOM 115 OD1 ASN A 8 -5.239 5.899 4.030 1.00 11.40 O ATOM 116 ND2 ASN A 8 -4.030 7.603 4.856 1.00 60.52 N ATOM 117 H ASN A 8 -3.440 6.368 1.564 1.00 25.04 H ATOM 118 HA ASN A 8 -6.249 6.372 1.723 1.00 2.00 H ATOM 119 HB2 ASN A 8 -4.251 8.510 2.494 1.00 12.03 H ATOM 120 HB3 ASN A 8 -5.954 8.526 2.943 1.00 72.52 H ATOM 121 HD21 ASN A 8 -3.714 8.518 4.706 1.00 10.34 H ATOM 122 HD22 ASN A 8 -3.811 7.076 5.653 1.00 63.25 H ATOM 123 N LEU A 9 -4.924 8.407 -0.461 1.00 73.00 N ATOM 124 CA LEU A 9 -5.216 9.279 -1.594 1.00 25.12 C ATOM 125 C LEU A 9 -6.040 8.546 -2.647 1.00 51.12 C ATOM 126 O LEU A 9 -7.045 9.064 -3.134 1.00 54.01 O ATOM 127 CB LEU A 9 -3.915 9.793 -2.214 1.00 53.13 C ATOM 128 CG LEU A 9 -4.037 10.421 -3.603 1.00 62.23 C ATOM 129 CD1 LEU A 9 -4.965 11.625 -3.566 1.00 4.25 C ATOM 130 CD2 LEU A 9 -2.666 10.818 -4.131 1.00 22.21 C ATOM 131 H LEU A 9 -3.996 8.152 -0.282 1.00 5.31 H ATOM 132 HA LEU A 9 -5.787 10.119 -1.227 1.00 63.30 H ATOM 133 HB2 LEU A 9 -3.504 10.538 -1.550 1.00 61.52 H ATOM 134 HB3 LEU A 9 -3.231 8.959 -2.286 1.00 14.25 H ATOM 135 HG LEU A 9 -4.461 9.695 -4.284 1.00 23.04 H ATOM 136 HD11 LEU A 9 -5.138 11.914 -2.540 1.00 20.10 H ATOM 137 HD12 LEU A 9 -5.905 11.370 -4.032 1.00 2.03 H ATOM 138 HD13 LEU A 9 -4.510 12.447 -4.100 1.00 22.34 H ATOM 139 HD21 LEU A 9 -2.141 11.386 -3.378 1.00 22.25 H ATOM 140 HD22 LEU A 9 -2.783 11.420 -5.020 1.00 33.02 H ATOM 141 HD23 LEU A 9 -2.101 9.928 -4.371 1.00 52.40 H ATOM 142 N TYR A 10 -5.609 7.338 -2.993 1.00 14.02 N ATOM 143 CA TYR A 10 -6.308 6.534 -3.989 1.00 25.44 C ATOM 144 C TYR A 10 -7.691 6.129 -3.489 1.00 60.50 C ATOM 145 O TYR A 10 -8.690 6.308 -4.184 1.00 53.52 O ATOM 146 CB TYR A 10 -5.491 5.286 -4.331 1.00 11.23 C ATOM 147 CG TYR A 10 -4.818 5.355 -5.683 1.00 1.12 C ATOM 148 CD1 TYR A 10 -3.703 6.159 -5.885 1.00 43.01 C ATOM 149 CD2 TYR A 10 -5.297 4.618 -6.758 1.00 74.41 C ATOM 150 CE1 TYR A 10 -3.085 6.226 -7.119 1.00 24.21 C ATOM 151 CE2 TYR A 10 -4.685 4.677 -7.995 1.00 1.01 C ATOM 152 CZ TYR A 10 -3.579 5.483 -8.170 1.00 71.43 C ATOM 153 OH TYR A 10 -2.967 5.546 -9.401 1.00 70.32 O ATOM 154 H TYR A 10 -4.802 6.979 -2.570 1.00 22.13 H ATOM 155 HA TYR A 10 -6.420 7.134 -4.880 1.00 34.53 H ATOM 156 HB2 TYR A 10 -4.723 5.151 -3.585 1.00 41.41 H ATOM 157 HB3 TYR A 10 -6.144 4.425 -4.328 1.00 43.41 H ATOM 158 HD1 TYR A 10 -3.318 6.740 -5.060 1.00 24.05 H ATOM 159 HD2 TYR A 10 -6.164 3.988 -6.617 1.00 70.23 H ATOM 160 HE1 TYR A 10 -2.219 6.856 -7.257 1.00 4.32 H ATOM 161 HE2 TYR A 10 -5.072 4.096 -8.818 1.00 72.45 H ATOM 162 HH TYR A 10 -2.532 6.396 -9.499 1.00 24.13 H ATOM 163 N GLN A 11 -7.739 5.581 -2.279 1.00 10.32 N ATOM 164 CA GLN A 11 -8.999 5.150 -1.685 1.00 53.33 C ATOM 165 C GLN A 11 -9.976 6.316 -1.575 1.00 50.42 C ATOM 166 O GLN A 11 -11.151 6.191 -1.921 1.00 10.00 O ATOM 167 CB GLN A 11 -8.755 4.542 -0.303 1.00 42.03 C ATOM 168 CG GLN A 11 -9.263 3.116 -0.168 1.00 34.14 C ATOM 169 CD GLN A 11 -10.775 3.027 -0.233 1.00 33.22 C ATOM 170 OE1 GLN A 11 -11.482 3.766 0.452 1.00 14.52 O ATOM 171 NE2 GLN A 11 -11.280 2.118 -1.059 1.00 50.34 N ATOM 172 H GLN A 11 -6.908 5.464 -1.774 1.00 11.33 H ATOM 173 HA GLN A 11 -9.428 4.397 -2.329 1.00 52.40 H ATOM 174 HB2 GLN A 11 -7.693 4.544 -0.105 1.00 35.41 H ATOM 175 HB3 GLN A 11 -9.252 5.150 0.438 1.00 54.33 H ATOM 176 HG2 GLN A 11 -8.849 2.522 -0.968 1.00 63.43 H ATOM 177 HG3 GLN A 11 -8.934 2.719 0.781 1.00 13.14 H ATOM 178 HE21 GLN A 11 -10.656 1.563 -1.573 1.00 1.01 H ATOM 179 HE22 GLN A 11 -12.254 2.039 -1.121 1.00 21.53 H ATOM 180 N LYS A 12 -9.483 7.451 -1.091 1.00 3.11 N ATOM 181 CA LYS A 12 -10.311 8.641 -0.935 1.00 42.24 C ATOM 182 C LYS A 12 -10.827 9.125 -2.287 1.00 11.13 C ATOM 183 O LYS A 12 -12.016 9.406 -2.443 1.00 45.34 O ATOM 184 CB LYS A 12 -9.515 9.756 -0.253 1.00 22.22 C ATOM 185 CG LYS A 12 -10.327 11.013 0.004 1.00 3.41 C ATOM 186 CD LYS A 12 -9.561 12.263 -0.396 1.00 42.24 C ATOM 187 CE LYS A 12 -9.344 12.326 -1.901 1.00 21.05 C ATOM 188 NZ LYS A 12 -8.899 13.677 -2.341 1.00 2.12 N ATOM 189 H LYS A 12 -8.538 7.489 -0.832 1.00 45.44 H ATOM 190 HA LYS A 12 -11.154 8.380 -0.314 1.00 22.11 H ATOM 191 HB2 LYS A 12 -9.146 9.390 0.694 1.00 13.45 H ATOM 192 HB3 LYS A 12 -8.674 10.017 -0.880 1.00 12.15 H ATOM 193 HG2 LYS A 12 -11.240 10.965 -0.570 1.00 32.12 H ATOM 194 HG3 LYS A 12 -10.564 11.069 1.057 1.00 5.22 H ATOM 195 HD2 LYS A 12 -10.122 13.133 -0.088 1.00 43.15 H ATOM 196 HD3 LYS A 12 -8.599 12.259 0.097 1.00 12.25 H ATOM 197 HE2 LYS A 12 -8.592 11.602 -2.173 1.00 44.02 H ATOM 198 HE3 LYS A 12 -10.273 12.083 -2.395 1.00 41.32 H ATOM 199 HZ1 LYS A 12 -9.267 14.403 -1.694 1.00 3.32 H ATOM 200 HZ2 LYS A 12 -9.249 13.873 -3.300 1.00 42.25 H ATOM 201 HZ3 LYS A 12 -7.860 13.727 -2.346 1.00 71.13 H ATOM 202 N TYR A 13 -9.928 9.218 -3.260 1.00 5.45 N ATOM 203 CA TYR A 13 -10.292 9.669 -4.597 1.00 55.23 C ATOM 204 C TYR A 13 -11.288 8.710 -5.242 1.00 54.35 C ATOM 205 O TYR A 13 -12.220 9.134 -5.926 1.00 31.34 O ATOM 206 CB TYR A 13 -9.045 9.793 -5.474 1.00 54.23 C ATOM 207 CG TYR A 13 -9.266 10.609 -6.728 1.00 61.55 C ATOM 208 CD1 TYR A 13 -9.491 11.978 -6.660 1.00 62.22 C ATOM 209 CD2 TYR A 13 -9.248 10.009 -7.982 1.00 51.30 C ATOM 210 CE1 TYR A 13 -9.693 12.726 -7.803 1.00 54.25 C ATOM 211 CE2 TYR A 13 -9.448 10.750 -9.131 1.00 13.12 C ATOM 212 CZ TYR A 13 -9.671 12.108 -9.036 1.00 50.03 C ATOM 213 OH TYR A 13 -9.871 12.850 -10.178 1.00 10.34 O ATOM 214 H TYR A 13 -8.995 8.980 -3.074 1.00 14.24 H ATOM 215 HA TYR A 13 -10.754 10.641 -4.505 1.00 50.53 H ATOM 216 HB2 TYR A 13 -8.260 10.266 -4.906 1.00 45.20 H ATOM 217 HB3 TYR A 13 -8.724 8.806 -5.772 1.00 43.13 H ATOM 218 HD1 TYR A 13 -9.507 12.459 -5.693 1.00 32.01 H ATOM 219 HD2 TYR A 13 -9.073 8.945 -8.053 1.00 15.41 H ATOM 220 HE1 TYR A 13 -9.867 13.790 -7.730 1.00 33.42 H ATOM 221 HE2 TYR A 13 -9.431 10.267 -10.096 1.00 71.54 H ATOM 222 HH TYR A 13 -10.414 12.352 -10.792 1.00 74.33 H ATOM 223 N GLU A 14 -11.083 7.416 -5.019 1.00 75.10 N ATOM 224 CA GLU A 14 -11.963 6.396 -5.579 1.00 0.35 C ATOM 225 C GLU A 14 -13.295 6.360 -4.836 1.00 35.03 C ATOM 226 O GLU A 14 -14.321 5.969 -5.394 1.00 43.45 O ATOM 227 CB GLU A 14 -11.293 5.022 -5.514 1.00 51.11 C ATOM 228 CG GLU A 14 -11.600 4.138 -6.711 1.00 52.54 C ATOM 229 CD GLU A 14 -11.301 2.675 -6.449 1.00 5.42 C ATOM 230 OE1 GLU A 14 -11.771 2.150 -5.418 1.00 71.22 O ATOM 231 OE2 GLU A 14 -10.596 2.056 -7.273 1.00 2.30 O ATOM 232 H GLU A 14 -10.323 7.140 -4.466 1.00 11.53 H ATOM 233 HA GLU A 14 -12.147 6.648 -6.612 1.00 15.22 H ATOM 234 HB2 GLU A 14 -10.223 5.159 -5.458 1.00 32.30 H ATOM 235 HB3 GLU A 14 -11.629 4.513 -4.622 1.00 42.35 H ATOM 236 HG2 GLU A 14 -12.647 4.237 -6.956 1.00 51.04 H ATOM 237 HG3 GLU A 14 -11.003 4.468 -7.549 1.00 12.52 H ATOM 238 N LYS A 15 -13.273 6.770 -3.572 1.00 21.41 N ATOM 239 CA LYS A 15 -14.478 6.786 -2.751 1.00 25.54 C ATOM 240 C LYS A 15 -15.334 8.008 -3.065 1.00 0.13 C ATOM 241 O LYS A 15 -16.562 7.924 -3.109 1.00 31.32 O ATOM 242 CB LYS A 15 -14.107 6.777 -1.266 1.00 34.23 C ATOM 243 CG LYS A 15 -15.284 6.494 -0.347 1.00 43.33 C ATOM 244 CD LYS A 15 -14.860 5.689 0.869 1.00 32.25 C ATOM 245 CE LYS A 15 -16.053 5.328 1.742 1.00 61.02 C ATOM 246 NZ LYS A 15 -15.650 4.518 2.925 1.00 71.24 N ATOM 247 H LYS A 15 -12.425 7.070 -3.182 1.00 65.40 H ATOM 248 HA LYS A 15 -15.045 5.896 -2.977 1.00 30.43 H ATOM 249 HB2 LYS A 15 -13.357 6.018 -1.099 1.00 3.53 H ATOM 250 HB3 LYS A 15 -13.697 7.741 -1.004 1.00 2.42 H ATOM 251 HG2 LYS A 15 -15.704 7.432 -0.016 1.00 43.31 H ATOM 252 HG3 LYS A 15 -16.030 5.937 -0.895 1.00 33.31 H ATOM 253 HD2 LYS A 15 -14.382 4.779 0.540 1.00 62.45 H ATOM 254 HD3 LYS A 15 -14.163 6.273 1.452 1.00 5.44 H ATOM 255 HE2 LYS A 15 -16.521 6.238 2.083 1.00 55.44 H ATOM 256 HE3 LYS A 15 -16.756 4.761 1.150 1.00 32.11 H ATOM 257 HZ1 LYS A 15 -14.909 5.012 3.461 1.00 50.10 H ATOM 258 HZ2 LYS A 15 -15.283 3.594 2.617 1.00 53.54 H ATOM 259 HZ3 LYS A 15 -16.469 4.363 3.547 1.00 63.42 H ATOM 260 N LEU A 16 -14.679 9.143 -3.284 1.00 32.15 N ATOM 261 CA LEU A 16 -15.381 10.383 -3.595 1.00 41.35 C ATOM 262 C LEU A 16 -16.045 10.303 -4.966 1.00 43.45 C ATOM 263 O LEU A 16 -16.991 11.037 -5.255 1.00 4.43 O ATOM 264 CB LEU A 16 -14.411 11.565 -3.554 1.00 10.42 C ATOM 265 CG LEU A 16 -13.943 12.001 -2.165 1.00 15.42 C ATOM 266 CD1 LEU A 16 -12.917 13.118 -2.273 1.00 42.13 C ATOM 267 CD2 LEU A 16 -15.128 12.444 -1.318 1.00 21.31 C ATOM 268 H LEU A 16 -13.701 9.148 -3.235 1.00 2.14 H ATOM 269 HA LEU A 16 -16.145 10.529 -2.847 1.00 33.43 H ATOM 270 HB2 LEU A 16 -13.537 11.296 -4.127 1.00 53.52 H ATOM 271 HB3 LEU A 16 -14.900 12.409 -4.020 1.00 4.52 H ATOM 272 HG LEU A 16 -13.473 11.163 -1.671 1.00 25.33 H ATOM 273 HD11 LEU A 16 -13.403 14.070 -2.124 1.00 33.04 H ATOM 274 HD12 LEU A 16 -12.463 13.096 -3.253 1.00 21.30 H ATOM 275 HD13 LEU A 16 -12.154 12.980 -1.521 1.00 13.24 H ATOM 276 HD21 LEU A 16 -14.773 13.015 -0.473 1.00 61.11 H ATOM 277 HD22 LEU A 16 -15.663 11.574 -0.966 1.00 23.01 H ATOM 278 HD23 LEU A 16 -15.789 13.055 -1.915 1.00 2.30 H ATOM 279 N THR A 17 -15.544 9.405 -5.809 1.00 51.23 N ATOM 280 CA THR A 17 -16.089 9.228 -7.150 1.00 4.15 C ATOM 281 C THR A 17 -15.886 10.480 -7.995 1.00 54.31 C ATOM 282 O THR A 17 -16.596 10.699 -8.976 1.00 51.42 O ATOM 283 CB THR A 17 -17.591 8.889 -7.105 1.00 45.25 C ATOM 284 OG1 THR A 17 -17.897 8.176 -5.902 1.00 64.54 O ATOM 285 CG2 THR A 17 -17.993 8.055 -8.312 1.00 63.13 C ATOM 286 H THR A 17 -14.790 8.850 -5.522 1.00 21.35 H ATOM 287 HA THR A 17 -15.568 8.403 -7.615 1.00 13.34 H ATOM 288 HB THR A 17 -18.153 9.812 -7.121 1.00 22.03 H ATOM 289 HG1 THR A 17 -18.687 7.647 -6.036 1.00 71.21 H ATOM 290 HG21 THR A 17 -19.055 8.152 -8.478 1.00 70.41 H ATOM 291 HG22 THR A 17 -17.750 7.018 -8.131 1.00 1.44 H ATOM 292 HG23 THR A 17 -17.459 8.403 -9.184 1.00 62.41 H ATOM 293 N ALA A 18 -14.913 11.299 -7.609 1.00 32.23 N ATOM 294 CA ALA A 18 -14.616 12.528 -8.334 1.00 31.05 C ATOM 295 C ALA A 18 -15.874 13.367 -8.531 1.00 32.23 C ATOM 296 O ALA A 18 -15.833 14.595 -8.446 1.00 23.22 O ATOM 297 CB ALA A 18 -13.977 12.207 -9.677 1.00 12.43 C ATOM 298 H ALA A 18 -14.382 11.070 -6.818 1.00 63.42 H ATOM 299 HA ALA A 18 -13.905 13.096 -7.751 1.00 21.44 H ATOM 300 HB1 ALA A 18 -13.238 11.431 -9.546 1.00 62.52 H ATOM 301 HB2 ALA A 18 -14.737 11.870 -10.365 1.00 74.41 H ATOM 302 HB3 ALA A 18 -13.503 13.094 -10.070 1.00 22.10 H TER 303 ALA A 18 ENDMDL MODEL 9 ATOM 1 N VAL A 1 -0.588 -0.029 -0.732 1.00 1.42 N ATOM 2 CA VAL A 1 0.096 -0.481 -1.937 1.00 44.12 C ATOM 3 C VAL A 1 0.735 0.688 -2.678 1.00 52.53 C ATOM 4 O VAL A 1 0.940 0.631 -3.890 1.00 70.23 O ATOM 5 CB VAL A 1 -0.868 -1.213 -2.889 1.00 52.32 C ATOM 6 CG1 VAL A 1 -1.243 -2.575 -2.326 1.00 62.34 C ATOM 7 CG2 VAL A 1 -2.110 -0.370 -3.140 1.00 20.44 C ATOM 8 H1 VAL A 1 -1.534 -0.251 -0.608 1.00 12.23 H ATOM 9 HA VAL A 1 0.871 -1.173 -1.641 1.00 63.35 H ATOM 10 HB VAL A 1 -0.365 -1.364 -3.833 1.00 0.31 H ATOM 11 HG11 VAL A 1 -2.304 -2.735 -2.447 1.00 14.41 H ATOM 12 HG12 VAL A 1 -0.700 -3.345 -2.855 1.00 24.13 H ATOM 13 HG13 VAL A 1 -0.991 -2.612 -1.277 1.00 31.44 H ATOM 14 HG21 VAL A 1 -1.973 0.611 -2.711 1.00 25.24 H ATOM 15 HG22 VAL A 1 -2.274 -0.279 -4.203 1.00 62.40 H ATOM 16 HG23 VAL A 1 -2.966 -0.846 -2.683 1.00 52.22 H ATOM 17 N ALA A 2 1.047 1.749 -1.941 1.00 42.32 N ATOM 18 CA ALA A 2 1.665 2.932 -2.528 1.00 11.11 C ATOM 19 C ALA A 2 1.992 3.968 -1.458 1.00 44.22 C ATOM 20 O ALA A 2 1.321 4.994 -1.347 1.00 41.44 O ATOM 21 CB ALA A 2 0.753 3.534 -3.587 1.00 34.24 C ATOM 22 H ALA A 2 0.859 1.735 -0.980 1.00 0.52 H ATOM 23 HA ALA A 2 2.582 2.625 -3.010 1.00 51.24 H ATOM 24 HB1 ALA A 2 1.112 4.517 -3.853 1.00 14.42 H ATOM 25 HB2 ALA A 2 0.751 2.901 -4.462 1.00 1.52 H ATOM 26 HB3 ALA A 2 -0.251 3.610 -3.195 1.00 42.33 H ATOM 27 N PHE A 3 3.028 3.693 -0.672 1.00 12.12 N ATOM 28 CA PHE A 3 3.443 4.601 0.391 1.00 42.21 C ATOM 29 C PHE A 3 2.319 4.805 1.403 1.00 63.43 C ATOM 30 O PHE A 3 1.253 4.200 1.292 1.00 24.44 O ATOM 31 CB PHE A 3 3.865 5.949 -0.197 1.00 44.22 C ATOM 32 CG PHE A 3 5.339 6.218 -0.084 1.00 31.52 C ATOM 33 CD1 PHE A 3 5.961 6.231 1.154 1.00 14.34 C ATOM 34 CD2 PHE A 3 6.102 6.455 -1.215 1.00 43.43 C ATOM 35 CE1 PHE A 3 7.316 6.479 1.261 1.00 21.25 C ATOM 36 CE2 PHE A 3 7.458 6.703 -1.114 1.00 44.14 C ATOM 37 CZ PHE A 3 8.066 6.714 0.126 1.00 62.24 C ATOM 38 H PHE A 3 3.524 2.859 -0.809 1.00 70.23 H ATOM 39 HA PHE A 3 4.288 4.157 0.894 1.00 62.12 H ATOM 40 HB2 PHE A 3 3.604 5.975 -1.244 1.00 72.13 H ATOM 41 HB3 PHE A 3 3.342 6.739 0.320 1.00 21.01 H ATOM 42 HD1 PHE A 3 5.376 6.047 2.044 1.00 72.35 H ATOM 43 HD2 PHE A 3 5.627 6.447 -2.186 1.00 65.05 H ATOM 44 HE1 PHE A 3 7.789 6.486 2.232 1.00 1.42 H ATOM 45 HE2 PHE A 3 8.042 6.886 -2.005 1.00 14.33 H ATOM 46 HZ PHE A 3 9.125 6.908 0.207 1.00 63.32 H ATOM 47 N ALA A 4 2.567 5.660 2.389 1.00 51.52 N ATOM 48 CA ALA A 4 1.576 5.945 3.420 1.00 45.43 C ATOM 49 C ALA A 4 0.694 7.124 3.023 1.00 45.33 C ATOM 50 O ALA A 4 -0.444 7.243 3.479 1.00 63.43 O ATOM 51 CB ALA A 4 2.263 6.221 4.749 1.00 10.52 C ATOM 52 H ALA A 4 3.436 6.112 2.423 1.00 73.01 H ATOM 53 HA ALA A 4 0.956 5.068 3.538 1.00 2.51 H ATOM 54 HB1 ALA A 4 2.277 5.317 5.341 1.00 52.44 H ATOM 55 HB2 ALA A 4 3.276 6.550 4.570 1.00 54.43 H ATOM 56 HB3 ALA A 4 1.723 6.991 5.280 1.00 74.10 H ATOM 57 N LEU A 5 1.226 7.995 2.172 1.00 62.33 N ATOM 58 CA LEU A 5 0.487 9.166 1.713 1.00 21.14 C ATOM 59 C LEU A 5 -0.259 8.866 0.417 1.00 1.21 C ATOM 60 O LEU A 5 -1.479 9.012 0.342 1.00 75.21 O ATOM 61 CB LEU A 5 1.439 10.345 1.506 1.00 10.35 C ATOM 62 CG LEU A 5 1.028 11.663 2.164 1.00 10.04 C ATOM 63 CD1 LEU A 5 1.994 12.026 3.282 1.00 60.15 C ATOM 64 CD2 LEU A 5 0.962 12.778 1.131 1.00 63.35 C ATOM 65 H LEU A 5 2.137 7.847 1.843 1.00 2.20 H ATOM 66 HA LEU A 5 -0.232 9.424 2.477 1.00 63.40 H ATOM 67 HB2 LEU A 5 2.403 10.065 1.902 1.00 42.21 H ATOM 68 HB3 LEU A 5 1.524 10.518 0.443 1.00 62.31 H ATOM 69 HG LEU A 5 0.044 11.550 2.599 1.00 61.25 H ATOM 70 HD11 LEU A 5 3.003 12.026 2.899 1.00 42.24 H ATOM 71 HD12 LEU A 5 1.911 11.302 4.078 1.00 23.33 H ATOM 72 HD13 LEU A 5 1.752 13.008 3.662 1.00 61.24 H ATOM 73 HD21 LEU A 5 1.902 12.833 0.601 1.00 54.21 H ATOM 74 HD22 LEU A 5 0.772 13.718 1.627 1.00 23.31 H ATOM 75 HD23 LEU A 5 0.165 12.573 0.431 1.00 71.23 H ATOM 76 N THR A 6 0.483 8.444 -0.603 1.00 13.35 N ATOM 77 CA THR A 6 -0.108 8.123 -1.895 1.00 61.35 C ATOM 78 C THR A 6 -1.230 7.102 -1.749 1.00 35.04 C ATOM 79 O THR A 6 -2.157 7.061 -2.560 1.00 3.33 O ATOM 80 CB THR A 6 0.947 7.572 -2.873 1.00 71.35 C ATOM 81 OG1 THR A 6 2.253 7.677 -2.296 1.00 31.44 O ATOM 82 CG2 THR A 6 0.908 8.328 -4.193 1.00 65.41 C ATOM 83 H THR A 6 1.450 8.348 -0.481 1.00 2.32 H ATOM 84 HA THR A 6 -0.514 9.033 -2.312 1.00 72.13 H ATOM 85 HB THR A 6 0.729 6.531 -3.065 1.00 71.23 H ATOM 86 HG1 THR A 6 2.523 8.598 -2.279 1.00 54.21 H ATOM 87 HG21 THR A 6 -0.100 8.327 -4.578 1.00 61.15 H ATOM 88 HG22 THR A 6 1.565 7.846 -4.903 1.00 1.51 H ATOM 89 HG23 THR A 6 1.233 9.345 -4.034 1.00 51.25 H ATOM 90 N LEU A 7 -1.143 6.279 -0.709 1.00 51.14 N ATOM 91 CA LEU A 7 -2.153 5.257 -0.455 1.00 51.55 C ATOM 92 C LEU A 7 -3.480 5.892 -0.050 1.00 44.02 C ATOM 93 O LEU A 7 -4.519 5.616 -0.647 1.00 70.24 O ATOM 94 CB LEU A 7 -1.676 4.302 0.640 1.00 71.14 C ATOM 95 CG LEU A 7 -2.749 3.410 1.266 1.00 64.11 C ATOM 96 CD1 LEU A 7 -2.171 2.048 1.618 1.00 30.22 C ATOM 97 CD2 LEU A 7 -3.342 4.075 2.499 1.00 22.14 C ATOM 98 H LEU A 7 -0.382 6.360 -0.098 1.00 32.51 H ATOM 99 HA LEU A 7 -2.298 4.701 -1.369 1.00 74.04 H ATOM 100 HB2 LEU A 7 -0.921 3.660 0.213 1.00 42.34 H ATOM 101 HB3 LEU A 7 -1.237 4.897 1.428 1.00 30.41 H ATOM 102 HG LEU A 7 -3.545 3.259 0.550 1.00 32.04 H ATOM 103 HD11 LEU A 7 -1.738 1.601 0.736 1.00 50.40 H ATOM 104 HD12 LEU A 7 -2.957 1.410 1.996 1.00 42.43 H ATOM 105 HD13 LEU A 7 -1.409 2.165 2.375 1.00 64.05 H ATOM 106 HD21 LEU A 7 -3.159 3.456 3.365 1.00 31.10 H ATOM 107 HD22 LEU A 7 -4.406 4.200 2.364 1.00 61.23 H ATOM 108 HD23 LEU A 7 -2.881 5.042 2.643 1.00 35.25 H ATOM 109 N ASN A 8 -3.435 6.746 0.968 1.00 61.53 N ATOM 110 CA ASN A 8 -4.633 7.421 1.452 1.00 53.12 C ATOM 111 C ASN A 8 -5.247 8.290 0.358 1.00 11.24 C ATOM 112 O ASN A 8 -6.465 8.307 0.174 1.00 1.41 O ATOM 113 CB ASN A 8 -4.302 8.279 2.675 1.00 64.14 C ATOM 114 CG ASN A 8 -5.534 8.630 3.486 1.00 23.53 C ATOM 115 OD1 ASN A 8 -6.232 7.748 3.988 1.00 42.23 O ATOM 116 ND2 ASN A 8 -5.806 9.922 3.619 1.00 53.40 N ATOM 117 H ASN A 8 -2.576 6.925 1.404 1.00 41.21 H ATOM 118 HA ASN A 8 -5.348 6.664 1.737 1.00 1.05 H ATOM 119 HB2 ASN A 8 -3.617 7.738 3.311 1.00 20.54 H ATOM 120 HB3 ASN A 8 -3.835 9.196 2.348 1.00 24.22 H ATOM 121 HD21 ASN A 8 -5.206 10.569 3.192 1.00 61.32 H ATOM 122 HD22 ASN A 8 -6.597 10.177 4.139 1.00 3.33 H ATOM 123 N LEU A 9 -4.396 9.010 -0.365 1.00 14.04 N ATOM 124 CA LEU A 9 -4.854 9.882 -1.441 1.00 71.42 C ATOM 125 C LEU A 9 -5.502 9.071 -2.560 1.00 1.55 C ATOM 126 O LEU A 9 -6.583 9.413 -3.041 1.00 65.51 O ATOM 127 CB LEU A 9 -3.684 10.696 -1.997 1.00 74.43 C ATOM 128 CG LEU A 9 -3.742 12.204 -1.756 1.00 51.54 C ATOM 129 CD1 LEU A 9 -4.854 12.834 -2.581 1.00 1.41 C ATOM 130 CD2 LEU A 9 -3.939 12.501 -0.277 1.00 11.30 C ATOM 131 H LEU A 9 -3.438 8.955 -0.171 1.00 23.20 H ATOM 132 HA LEU A 9 -5.589 10.557 -1.030 1.00 53.43 H ATOM 133 HB2 LEU A 9 -2.778 10.323 -1.545 1.00 51.21 H ATOM 134 HB3 LEU A 9 -3.646 10.531 -3.065 1.00 30.02 H ATOM 135 HG LEU A 9 -2.806 12.648 -2.066 1.00 3.13 H ATOM 136 HD11 LEU A 9 -4.444 13.620 -3.197 1.00 60.14 H ATOM 137 HD12 LEU A 9 -5.602 13.248 -1.920 1.00 44.15 H ATOM 138 HD13 LEU A 9 -5.307 12.081 -3.210 1.00 4.54 H ATOM 139 HD21 LEU A 9 -3.462 11.731 0.311 1.00 14.41 H ATOM 140 HD22 LEU A 9 -4.995 12.524 -0.053 1.00 13.35 H ATOM 141 HD23 LEU A 9 -3.500 13.460 -0.041 1.00 30.23 H ATOM 142 N TYR A 10 -4.836 7.997 -2.966 1.00 62.25 N ATOM 143 CA TYR A 10 -5.346 7.138 -4.028 1.00 74.32 C ATOM 144 C TYR A 10 -6.652 6.469 -3.608 1.00 3.32 C ATOM 145 O TYR A 10 -7.652 6.533 -4.322 1.00 64.44 O ATOM 146 CB TYR A 10 -4.310 6.074 -4.394 1.00 74.45 C ATOM 147 CG TYR A 10 -4.827 5.034 -5.364 1.00 4.32 C ATOM 148 CD1 TYR A 10 -4.737 5.231 -6.736 1.00 42.04 C ATOM 149 CD2 TYR A 10 -5.405 3.856 -4.907 1.00 42.34 C ATOM 150 CE1 TYR A 10 -5.208 4.285 -7.626 1.00 23.31 C ATOM 151 CE2 TYR A 10 -5.877 2.904 -5.790 1.00 21.15 C ATOM 152 CZ TYR A 10 -5.776 3.123 -7.148 1.00 34.43 C ATOM 153 OH TYR A 10 -6.247 2.177 -8.030 1.00 22.14 O ATOM 154 H TYR A 10 -3.979 7.776 -2.544 1.00 54.42 H ATOM 155 HA TYR A 10 -5.534 7.756 -4.894 1.00 12.13 H ATOM 156 HB2 TYR A 10 -3.456 6.553 -4.847 1.00 54.13 H ATOM 157 HB3 TYR A 10 -3.996 5.563 -3.496 1.00 71.31 H ATOM 158 HD1 TYR A 10 -4.291 6.142 -7.108 1.00 42.30 H ATOM 159 HD2 TYR A 10 -5.482 3.688 -3.843 1.00 14.41 H ATOM 160 HE1 TYR A 10 -5.129 4.455 -8.690 1.00 0.34 H ATOM 161 HE2 TYR A 10 -6.323 1.994 -5.415 1.00 42.13 H ATOM 162 HH TYR A 10 -6.119 1.301 -7.658 1.00 2.13 H ATOM 163 N GLN A 11 -6.633 5.830 -2.443 1.00 21.32 N ATOM 164 CA GLN A 11 -7.815 5.149 -1.926 1.00 44.24 C ATOM 165 C GLN A 11 -8.990 6.114 -1.808 1.00 20.21 C ATOM 166 O GLN A 11 -10.120 5.779 -2.162 1.00 74.52 O ATOM 167 CB GLN A 11 -7.514 4.523 -0.563 1.00 43.44 C ATOM 168 CG GLN A 11 -8.702 3.799 0.049 1.00 2.42 C ATOM 169 CD GLN A 11 -9.572 4.713 0.890 1.00 24.11 C ATOM 170 OE1 GLN A 11 -10.768 4.857 0.636 1.00 43.20 O ATOM 171 NE2 GLN A 11 -8.974 5.336 1.899 1.00 30.12 N ATOM 172 H GLN A 11 -5.806 5.815 -1.919 1.00 65.30 H ATOM 173 HA GLN A 11 -8.076 4.366 -2.622 1.00 14.23 H ATOM 174 HB2 GLN A 11 -6.707 3.815 -0.676 1.00 4.10 H ATOM 175 HB3 GLN A 11 -7.205 5.303 0.117 1.00 14.22 H ATOM 176 HG2 GLN A 11 -9.305 3.386 -0.746 1.00 5.21 H ATOM 177 HG3 GLN A 11 -8.335 2.999 0.675 1.00 73.13 H ATOM 178 HE21 GLN A 11 -8.017 5.174 2.041 1.00 34.12 H ATOM 179 HE22 GLN A 11 -9.512 5.933 2.458 1.00 31.14 H ATOM 180 N LYS A 12 -8.716 7.314 -1.307 1.00 31.41 N ATOM 181 CA LYS A 12 -9.750 8.328 -1.142 1.00 1.51 C ATOM 182 C LYS A 12 -10.292 8.778 -2.495 1.00 42.10 C ATOM 183 O LYS A 12 -11.498 8.735 -2.737 1.00 13.23 O ATOM 184 CB LYS A 12 -9.194 9.532 -0.378 1.00 13.25 C ATOM 185 CG LYS A 12 -10.145 10.716 -0.333 1.00 32.25 C ATOM 186 CD LYS A 12 -9.805 11.745 -1.397 1.00 53.04 C ATOM 187 CE LYS A 12 -11.017 12.082 -2.253 1.00 44.43 C ATOM 188 NZ LYS A 12 -11.676 13.342 -1.809 1.00 71.53 N ATOM 189 H LYS A 12 -7.795 7.522 -1.042 1.00 71.03 H ATOM 190 HA LYS A 12 -10.556 7.892 -0.572 1.00 62.40 H ATOM 191 HB2 LYS A 12 -8.979 9.231 0.637 1.00 11.11 H ATOM 192 HB3 LYS A 12 -8.277 9.852 -0.851 1.00 52.01 H ATOM 193 HG2 LYS A 12 -11.153 10.363 -0.497 1.00 3.23 H ATOM 194 HG3 LYS A 12 -10.079 11.182 0.640 1.00 11.22 H ATOM 195 HD2 LYS A 12 -9.457 12.647 -0.916 1.00 65.43 H ATOM 196 HD3 LYS A 12 -9.026 11.349 -2.033 1.00 25.14 H ATOM 197 HE2 LYS A 12 -10.697 12.196 -3.278 1.00 21.42 H ATOM 198 HE3 LYS A 12 -11.726 11.271 -2.185 1.00 71.13 H ATOM 199 HZ1 LYS A 12 -11.381 14.133 -2.416 1.00 31.10 H ATOM 200 HZ2 LYS A 12 -11.412 13.555 -0.826 1.00 53.10 H ATOM 201 HZ3 LYS A 12 -12.710 13.242 -1.865 1.00 3.40 H ATOM 202 N TYR A 13 -9.393 9.208 -3.374 1.00 31.42 N ATOM 203 CA TYR A 13 -9.782 9.666 -4.702 1.00 64.14 C ATOM 204 C TYR A 13 -10.633 8.618 -5.413 1.00 14.24 C ATOM 205 O TYR A 13 -11.626 8.946 -6.061 1.00 51.34 O ATOM 206 CB TYR A 13 -8.541 9.983 -5.539 1.00 23.34 C ATOM 207 CG TYR A 13 -8.849 10.296 -6.985 1.00 52.13 C ATOM 208 CD1 TYR A 13 -8.944 9.283 -7.931 1.00 63.51 C ATOM 209 CD2 TYR A 13 -9.045 11.605 -7.407 1.00 12.44 C ATOM 210 CE1 TYR A 13 -9.225 9.564 -9.254 1.00 63.01 C ATOM 211 CE2 TYR A 13 -9.328 11.896 -8.727 1.00 50.11 C ATOM 212 CZ TYR A 13 -9.417 10.872 -9.647 1.00 45.11 C ATOM 213 OH TYR A 13 -9.697 11.158 -10.964 1.00 23.33 O ATOM 214 H TYR A 13 -8.446 9.218 -3.123 1.00 41.40 H ATOM 215 HA TYR A 13 -10.364 10.568 -4.585 1.00 33.21 H ATOM 216 HB2 TYR A 13 -8.038 10.838 -5.115 1.00 1.13 H ATOM 217 HB3 TYR A 13 -7.874 9.133 -5.518 1.00 34.32 H ATOM 218 HD1 TYR A 13 -8.793 8.259 -7.620 1.00 70.32 H ATOM 219 HD2 TYR A 13 -8.975 12.405 -6.683 1.00 43.15 H ATOM 220 HE1 TYR A 13 -9.294 8.763 -9.975 1.00 34.42 H ATOM 221 HE2 TYR A 13 -9.478 12.920 -9.035 1.00 43.32 H ATOM 222 HH TYR A 13 -10.113 10.396 -11.375 1.00 3.24 H ATOM 223 N GLU A 14 -10.237 7.356 -5.283 1.00 61.14 N ATOM 224 CA GLU A 14 -10.964 6.259 -5.913 1.00 5.53 C ATOM 225 C GLU A 14 -12.267 5.975 -5.172 1.00 72.24 C ATOM 226 O GLU A 14 -13.260 5.564 -5.774 1.00 64.21 O ATOM 227 CB GLU A 14 -10.098 4.998 -5.947 1.00 50.14 C ATOM 228 CG GLU A 14 -10.408 4.079 -7.117 1.00 50.21 C ATOM 229 CD GLU A 14 -11.369 2.967 -6.746 1.00 73.32 C ATOM 230 OE1 GLU A 14 -11.254 2.432 -5.624 1.00 32.03 O ATOM 231 OE2 GLU A 14 -12.237 2.631 -7.579 1.00 52.23 O ATOM 232 H GLU A 14 -9.437 7.158 -4.753 1.00 71.40 H ATOM 233 HA GLU A 14 -11.195 6.553 -6.925 1.00 55.32 H ATOM 234 HB2 GLU A 14 -9.060 5.290 -6.010 1.00 70.21 H ATOM 235 HB3 GLU A 14 -10.252 4.446 -5.032 1.00 74.53 H ATOM 236 HG2 GLU A 14 -10.848 4.664 -7.911 1.00 63.11 H ATOM 237 HG3 GLU A 14 -9.486 3.637 -7.465 1.00 50.23 H ATOM 238 N LYS A 15 -12.257 6.196 -3.862 1.00 60.13 N ATOM 239 CA LYS A 15 -13.437 5.965 -3.038 1.00 30.34 C ATOM 240 C LYS A 15 -14.551 6.943 -3.396 1.00 74.31 C ATOM 241 O LYS A 15 -15.612 6.542 -3.877 1.00 72.21 O ATOM 242 CB LYS A 15 -13.083 6.100 -1.555 1.00 21.21 C ATOM 243 CG LYS A 15 -14.246 5.807 -0.623 1.00 24.43 C ATOM 244 CD LYS A 15 -14.331 4.327 -0.286 1.00 11.40 C ATOM 245 CE LYS A 15 -15.685 3.747 -0.665 1.00 30.15 C ATOM 246 NZ LYS A 15 -15.955 3.875 -2.123 1.00 71.04 N ATOM 247 H LYS A 15 -11.435 6.524 -3.439 1.00 71.34 H ATOM 248 HA LYS A 15 -13.782 4.960 -3.226 1.00 70.55 H ATOM 249 HB2 LYS A 15 -12.282 5.413 -1.325 1.00 3.15 H ATOM 250 HB3 LYS A 15 -12.745 7.109 -1.368 1.00 50.15 H ATOM 251 HG2 LYS A 15 -14.112 6.366 0.292 1.00 72.44 H ATOM 252 HG3 LYS A 15 -15.165 6.111 -1.102 1.00 51.22 H ATOM 253 HD2 LYS A 15 -13.561 3.798 -0.828 1.00 13.41 H ATOM 254 HD3 LYS A 15 -14.179 4.200 0.776 1.00 25.45 H ATOM 255 HE2 LYS A 15 -15.703 2.702 -0.394 1.00 45.33 H ATOM 256 HE3 LYS A 15 -16.453 4.273 -0.117 1.00 52.12 H ATOM 257 HZ1 LYS A 15 -16.813 3.344 -2.376 1.00 42.22 H ATOM 258 HZ2 LYS A 15 -15.154 3.499 -2.669 1.00 64.42 H ATOM 259 HZ3 LYS A 15 -16.092 4.875 -2.375 1.00 70.40 H ATOM 260 N LEU A 16 -14.304 8.226 -3.160 1.00 50.44 N ATOM 261 CA LEU A 16 -15.286 9.262 -3.460 1.00 54.41 C ATOM 262 C LEU A 16 -15.491 9.400 -4.965 1.00 62.14 C ATOM 263 O LEU A 16 -16.522 9.896 -5.421 1.00 1.22 O ATOM 264 CB LEU A 16 -14.841 10.601 -2.870 1.00 43.51 C ATOM 265 CG LEU A 16 -14.941 10.732 -1.350 1.00 20.31 C ATOM 266 CD1 LEU A 16 -13.773 10.029 -0.676 1.00 21.13 C ATOM 267 CD2 LEU A 16 -14.991 12.197 -0.942 1.00 74.03 C ATOM 268 H LEU A 16 -13.441 8.485 -2.776 1.00 61.20 H ATOM 269 HA LEU A 16 -16.223 8.972 -3.007 1.00 4.21 H ATOM 270 HB2 LEU A 16 -13.810 10.758 -3.148 1.00 2.32 H ATOM 271 HB3 LEU A 16 -15.452 11.376 -3.311 1.00 14.03 H ATOM 272 HG LEU A 16 -15.853 10.259 -1.014 1.00 34.43 H ATOM 273 HD11 LEU A 16 -12.969 9.906 -1.385 1.00 62.12 H ATOM 274 HD12 LEU A 16 -14.092 9.060 -0.321 1.00 61.14 H ATOM 275 HD13 LEU A 16 -13.430 10.622 0.159 1.00 23.15 H ATOM 276 HD21 LEU A 16 -15.218 12.803 -1.806 1.00 55.34 H ATOM 277 HD22 LEU A 16 -14.034 12.491 -0.537 1.00 71.54 H ATOM 278 HD23 LEU A 16 -15.757 12.336 -0.193 1.00 20.14 H ATOM 279 N THR A 17 -14.502 8.955 -5.735 1.00 31.01 N ATOM 280 CA THR A 17 -14.573 9.027 -7.189 1.00 15.12 C ATOM 281 C THR A 17 -14.608 10.474 -7.666 1.00 54.34 C ATOM 282 O THR A 17 -15.063 10.762 -8.773 1.00 63.44 O ATOM 283 CB THR A 17 -15.814 8.290 -7.728 1.00 13.54 C ATOM 284 OG1 THR A 17 -16.255 7.313 -6.778 1.00 2.50 O ATOM 285 CG2 THR A 17 -15.508 7.613 -9.055 1.00 24.13 C ATOM 286 H THR A 17 -13.706 8.570 -5.313 1.00 61.11 H ATOM 287 HA THR A 17 -13.693 8.547 -7.590 1.00 61.32 H ATOM 288 HB THR A 17 -16.604 9.012 -7.883 1.00 5.23 H ATOM 289 HG1 THR A 17 -17.123 6.990 -7.031 1.00 22.21 H ATOM 290 HG21 THR A 17 -16.377 7.067 -9.389 1.00 24.44 H ATOM 291 HG22 THR A 17 -14.680 6.930 -8.928 1.00 14.23 H ATOM 292 HG23 THR A 17 -15.248 8.361 -9.789 1.00 60.20 H ATOM 293 N ALA A 18 -14.125 11.382 -6.825 1.00 12.23 N ATOM 294 CA ALA A 18 -14.099 12.800 -7.163 1.00 21.23 C ATOM 295 C ALA A 18 -15.471 13.280 -7.623 1.00 71.01 C ATOM 296 O ALA A 18 -16.098 14.116 -6.971 1.00 3.01 O ATOM 297 CB ALA A 18 -13.056 13.067 -8.238 1.00 71.30 C ATOM 298 H ALA A 18 -13.777 11.091 -5.956 1.00 41.33 H ATOM 299 HA ALA A 18 -13.815 13.349 -6.276 1.00 51.15 H ATOM 300 HB1 ALA A 18 -13.458 13.758 -8.964 1.00 52.14 H ATOM 301 HB2 ALA A 18 -12.173 13.493 -7.785 1.00 73.42 H ATOM 302 HB3 ALA A 18 -12.799 12.139 -8.727 1.00 43.34 H TER 303 ALA A 18 ENDMDL MODEL 10 ATOM 1 N VAL A 1 1.058 2.559 -5.415 1.00 35.55 N ATOM 2 CA VAL A 1 0.984 2.605 -3.959 1.00 50.42 C ATOM 3 C VAL A 1 2.346 2.331 -3.331 1.00 13.10 C ATOM 4 O VAL A 1 2.595 1.241 -2.817 1.00 64.05 O ATOM 5 CB VAL A 1 -0.035 1.586 -3.416 1.00 23.04 C ATOM 6 CG1 VAL A 1 -0.238 1.779 -1.920 1.00 64.05 C ATOM 7 CG2 VAL A 1 -1.356 1.704 -4.161 1.00 4.12 C ATOM 8 H1 VAL A 1 1.730 3.101 -5.877 1.00 21.02 H ATOM 9 HA VAL A 1 0.659 3.595 -3.673 1.00 10.21 H ATOM 10 HB VAL A 1 0.358 0.593 -3.578 1.00 5.13 H ATOM 11 HG11 VAL A 1 -0.036 0.850 -1.407 1.00 42.14 H ATOM 12 HG12 VAL A 1 0.435 2.544 -1.561 1.00 63.22 H ATOM 13 HG13 VAL A 1 -1.258 2.079 -1.732 1.00 1.02 H ATOM 14 HG21 VAL A 1 -2.149 1.291 -3.556 1.00 0.41 H ATOM 15 HG22 VAL A 1 -1.561 2.744 -4.365 1.00 12.44 H ATOM 16 HG23 VAL A 1 -1.294 1.160 -5.093 1.00 3.54 H ATOM 17 N ALA A 2 3.223 3.328 -3.375 1.00 43.12 N ATOM 18 CA ALA A 2 4.559 3.195 -2.808 1.00 44.40 C ATOM 19 C ALA A 2 4.594 3.683 -1.364 1.00 34.05 C ATOM 20 O ALA A 2 4.746 2.891 -0.434 1.00 25.53 O ATOM 21 CB ALA A 2 5.569 3.962 -3.650 1.00 13.11 C ATOM 22 H ALA A 2 2.965 4.173 -3.798 1.00 43.41 H ATOM 23 HA ALA A 2 4.829 2.149 -2.831 1.00 3.32 H ATOM 24 HB1 ALA A 2 6.553 3.856 -3.216 1.00 75.32 H ATOM 25 HB2 ALA A 2 5.573 3.567 -4.655 1.00 30.03 H ATOM 26 HB3 ALA A 2 5.297 5.007 -3.674 1.00 71.33 H ATOM 27 N PHE A 3 4.451 4.992 -1.182 1.00 60.32 N ATOM 28 CA PHE A 3 4.467 5.585 0.150 1.00 44.22 C ATOM 29 C PHE A 3 3.288 5.088 0.981 1.00 2.30 C ATOM 30 O PHE A 3 2.500 4.260 0.527 1.00 61.44 O ATOM 31 CB PHE A 3 4.430 7.112 0.052 1.00 75.44 C ATOM 32 CG PHE A 3 5.589 7.693 -0.706 1.00 21.50 C ATOM 33 CD1 PHE A 3 5.524 7.856 -2.080 1.00 55.33 C ATOM 34 CD2 PHE A 3 6.744 8.075 -0.044 1.00 4.32 C ATOM 35 CE1 PHE A 3 6.589 8.390 -2.780 1.00 25.23 C ATOM 36 CE2 PHE A 3 7.813 8.610 -0.738 1.00 25.10 C ATOM 37 CZ PHE A 3 7.735 8.768 -2.108 1.00 3.23 C ATOM 38 H PHE A 3 4.333 5.572 -1.963 1.00 53.42 H ATOM 39 HA PHE A 3 5.385 5.287 0.633 1.00 35.35 H ATOM 40 HB2 PHE A 3 3.522 7.411 -0.451 1.00 62.54 H ATOM 41 HB3 PHE A 3 4.439 7.529 1.047 1.00 11.30 H ATOM 42 HD1 PHE A 3 4.628 7.562 -2.607 1.00 72.12 H ATOM 43 HD2 PHE A 3 6.806 7.952 1.028 1.00 3.15 H ATOM 44 HE1 PHE A 3 6.526 8.513 -3.851 1.00 32.24 H ATOM 45 HE2 PHE A 3 8.708 8.905 -0.209 1.00 73.31 H ATOM 46 HZ PHE A 3 8.570 9.185 -2.652 1.00 75.00 H ATOM 47 N ALA A 4 3.175 5.601 2.202 1.00 71.00 N ATOM 48 CA ALA A 4 2.092 5.211 3.097 1.00 42.33 C ATOM 49 C ALA A 4 0.873 6.107 2.906 1.00 41.31 C ATOM 50 O ALA A 4 -0.264 5.677 3.107 1.00 43.43 O ATOM 51 CB ALA A 4 2.561 5.256 4.543 1.00 22.04 C ATOM 52 H ALA A 4 3.835 6.258 2.508 1.00 75.15 H ATOM 53 HA ALA A 4 1.818 4.192 2.864 1.00 15.43 H ATOM 54 HB1 ALA A 4 1.820 5.761 5.146 1.00 41.44 H ATOM 55 HB2 ALA A 4 2.697 4.249 4.909 1.00 51.12 H ATOM 56 HB3 ALA A 4 3.498 5.790 4.602 1.00 72.04 H ATOM 57 N LEU A 5 1.116 7.354 2.518 1.00 2.30 N ATOM 58 CA LEU A 5 0.037 8.312 2.301 1.00 64.04 C ATOM 59 C LEU A 5 -0.688 8.026 0.990 1.00 54.32 C ATOM 60 O LEU A 5 -1.899 8.227 0.880 1.00 5.24 O ATOM 61 CB LEU A 5 0.590 9.738 2.291 1.00 54.54 C ATOM 62 CG LEU A 5 -0.016 10.700 3.314 1.00 21.20 C ATOM 63 CD1 LEU A 5 0.684 10.560 4.657 1.00 34.41 C ATOM 64 CD2 LEU A 5 0.069 12.134 2.814 1.00 40.44 C ATOM 65 H LEU A 5 2.042 7.639 2.374 1.00 24.21 H ATOM 66 HA LEU A 5 -0.664 8.212 3.116 1.00 62.33 H ATOM 67 HB2 LEU A 5 1.651 9.683 2.477 1.00 41.32 H ATOM 68 HB3 LEU A 5 0.419 10.151 1.306 1.00 4.23 H ATOM 69 HG LEU A 5 -1.060 10.455 3.455 1.00 63.01 H ATOM 70 HD11 LEU A 5 0.318 9.679 5.163 1.00 10.01 H ATOM 71 HD12 LEU A 5 0.482 11.432 5.261 1.00 74.11 H ATOM 72 HD13 LEU A 5 1.749 10.470 4.500 1.00 33.44 H ATOM 73 HD21 LEU A 5 0.054 12.140 1.734 1.00 44.41 H ATOM 74 HD22 LEU A 5 0.986 12.584 3.164 1.00 24.42 H ATOM 75 HD23 LEU A 5 -0.774 12.697 3.189 1.00 24.01 H ATOM 76 N THR A 6 0.058 7.554 -0.004 1.00 23.14 N ATOM 77 CA THR A 6 -0.513 7.239 -1.307 1.00 15.14 C ATOM 78 C THR A 6 -1.706 6.299 -1.171 1.00 64.33 C ATOM 79 O THR A 6 -2.659 6.373 -1.947 1.00 54.13 O ATOM 80 CB THR A 6 0.531 6.595 -2.238 1.00 30.13 C ATOM 81 OG1 THR A 6 1.125 5.460 -1.597 1.00 12.30 O ATOM 82 CG2 THR A 6 1.613 7.596 -2.612 1.00 2.41 C ATOM 83 H THR A 6 1.017 7.415 0.145 1.00 71.10 H ATOM 84 HA THR A 6 -0.845 8.163 -1.757 1.00 54.22 H ATOM 85 HB THR A 6 0.034 6.270 -3.141 1.00 21.14 H ATOM 86 HG1 THR A 6 1.672 5.756 -0.865 1.00 72.11 H ATOM 87 HG21 THR A 6 1.522 7.850 -3.657 1.00 42.22 H ATOM 88 HG22 THR A 6 2.585 7.161 -2.431 1.00 12.23 H ATOM 89 HG23 THR A 6 1.501 8.488 -2.013 1.00 54.25 H ATOM 90 N LEU A 7 -1.646 5.415 -0.182 1.00 34.25 N ATOM 91 CA LEU A 7 -2.723 4.459 0.056 1.00 4.12 C ATOM 92 C LEU A 7 -4.030 5.179 0.372 1.00 21.31 C ATOM 93 O LEU A 7 -5.050 4.946 -0.275 1.00 30.43 O ATOM 94 CB LEU A 7 -2.353 3.521 1.206 1.00 31.42 C ATOM 95 CG LEU A 7 -3.287 2.330 1.428 1.00 52.41 C ATOM 96 CD1 LEU A 7 -2.531 1.167 2.050 1.00 62.23 C ATOM 97 CD2 LEU A 7 -4.465 2.732 2.304 1.00 43.52 C ATOM 98 H LEU A 7 -0.861 5.404 0.404 1.00 60.42 H ATOM 99 HA LEU A 7 -2.854 3.878 -0.844 1.00 72.31 H ATOM 100 HB2 LEU A 7 -1.365 3.133 1.012 1.00 2.32 H ATOM 101 HB3 LEU A 7 -2.337 4.104 2.116 1.00 72.00 H ATOM 102 HG LEU A 7 -3.676 2.003 0.473 1.00 3.12 H ATOM 103 HD11 LEU A 7 -2.129 1.468 3.005 1.00 1.21 H ATOM 104 HD12 LEU A 7 -1.723 0.872 1.396 1.00 12.11 H ATOM 105 HD13 LEU A 7 -3.204 0.333 2.188 1.00 3.11 H ATOM 106 HD21 LEU A 7 -5.148 3.342 1.731 1.00 5.33 H ATOM 107 HD22 LEU A 7 -4.105 3.294 3.153 1.00 14.24 H ATOM 108 HD23 LEU A 7 -4.976 1.845 2.649 1.00 2.32 H ATOM 109 N ASN A 8 -3.990 6.056 1.370 1.00 74.12 N ATOM 110 CA ASN A 8 -5.172 6.811 1.770 1.00 2.45 C ATOM 111 C ASN A 8 -5.716 7.629 0.603 1.00 35.11 C ATOM 112 O ASN A 8 -6.898 7.540 0.266 1.00 10.24 O ATOM 113 CB ASN A 8 -4.838 7.736 2.943 1.00 32.32 C ATOM 114 CG ASN A 8 -4.926 7.027 4.281 1.00 25.10 C ATOM 115 OD1 ASN A 8 -6.017 6.747 4.777 1.00 24.45 O ATOM 116 ND2 ASN A 8 -3.773 6.734 4.871 1.00 23.24 N ATOM 117 H ASN A 8 -3.147 6.199 1.848 1.00 32.54 H ATOM 118 HA ASN A 8 -5.926 6.105 2.083 1.00 12.44 H ATOM 119 HB2 ASN A 8 -3.833 8.112 2.822 1.00 3.12 H ATOM 120 HB3 ASN A 8 -5.530 8.564 2.949 1.00 11.43 H ATOM 121 HD21 ASN A 8 -2.942 6.988 4.417 1.00 21.44 H ATOM 122 HD22 ASN A 8 -3.800 6.275 5.737 1.00 60.01 H ATOM 123 N LEU A 9 -4.848 8.424 -0.011 1.00 43.22 N ATOM 124 CA LEU A 9 -5.240 9.258 -1.142 1.00 75.21 C ATOM 125 C LEU A 9 -5.886 8.418 -2.240 1.00 21.35 C ATOM 126 O LEU A 9 -6.858 8.839 -2.867 1.00 63.14 O ATOM 127 CB LEU A 9 -4.025 10.000 -1.700 1.00 60.15 C ATOM 128 CG LEU A 9 -4.311 11.026 -2.798 1.00 63.50 C ATOM 129 CD1 LEU A 9 -4.367 12.429 -2.215 1.00 50.14 C ATOM 130 CD2 LEU A 9 -3.257 10.942 -3.893 1.00 11.51 C ATOM 131 H LEU A 9 -3.920 8.452 0.302 1.00 10.32 H ATOM 132 HA LEU A 9 -5.961 9.979 -0.787 1.00 40.52 H ATOM 133 HB2 LEU A 9 -3.548 10.516 -0.882 1.00 12.33 H ATOM 134 HB3 LEU A 9 -3.345 9.263 -2.104 1.00 31.23 H ATOM 135 HG LEU A 9 -5.273 10.810 -3.242 1.00 10.13 H ATOM 136 HD11 LEU A 9 -3.527 13.003 -2.576 1.00 63.41 H ATOM 137 HD12 LEU A 9 -4.329 12.373 -1.138 1.00 3.25 H ATOM 138 HD13 LEU A 9 -5.287 12.908 -2.518 1.00 30.30 H ATOM 139 HD21 LEU A 9 -2.296 11.224 -3.489 1.00 62.15 H ATOM 140 HD22 LEU A 9 -3.521 11.613 -4.697 1.00 41.32 H ATOM 141 HD23 LEU A 9 -3.208 9.931 -4.269 1.00 74.15 H ATOM 142 N TYR A 10 -5.341 7.227 -2.464 1.00 2.32 N ATOM 143 CA TYR A 10 -5.863 6.328 -3.485 1.00 72.34 C ATOM 144 C TYR A 10 -7.285 5.888 -3.148 1.00 64.55 C ATOM 145 O TYR A 10 -8.193 6.005 -3.970 1.00 41.14 O ATOM 146 CB TYR A 10 -4.958 5.103 -3.627 1.00 72.32 C ATOM 147 CG TYR A 10 -5.449 4.102 -4.649 1.00 34.04 C ATOM 148 CD1 TYR A 10 -5.591 4.456 -5.985 1.00 3.22 C ATOM 149 CD2 TYR A 10 -5.773 2.803 -4.278 1.00 30.23 C ATOM 150 CE1 TYR A 10 -6.040 3.546 -6.922 1.00 22.54 C ATOM 151 CE2 TYR A 10 -6.221 1.885 -5.208 1.00 14.12 C ATOM 152 CZ TYR A 10 -6.353 2.261 -6.528 1.00 53.23 C ATOM 153 OH TYR A 10 -6.801 1.350 -7.458 1.00 0.44 O ATOM 154 H TYR A 10 -4.568 6.947 -1.931 1.00 4.21 H ATOM 155 HA TYR A 10 -5.877 6.863 -4.423 1.00 51.33 H ATOM 156 HB2 TYR A 10 -3.973 5.424 -3.927 1.00 3.45 H ATOM 157 HB3 TYR A 10 -4.893 4.599 -2.674 1.00 12.43 H ATOM 158 HD1 TYR A 10 -5.344 5.463 -6.290 1.00 13.01 H ATOM 159 HD2 TYR A 10 -5.669 2.512 -3.242 1.00 61.44 H ATOM 160 HE1 TYR A 10 -6.143 3.839 -7.956 1.00 11.42 H ATOM 161 HE2 TYR A 10 -6.467 0.880 -4.900 1.00 74.50 H ATOM 162 HH TYR A 10 -7.721 1.532 -7.666 1.00 25.31 H ATOM 163 N GLN A 11 -7.468 5.381 -1.933 1.00 62.14 N ATOM 164 CA GLN A 11 -8.778 4.923 -1.487 1.00 31.11 C ATOM 165 C GLN A 11 -9.801 6.052 -1.554 1.00 33.21 C ATOM 166 O GLN A 11 -10.959 5.835 -1.914 1.00 24.11 O ATOM 167 CB GLN A 11 -8.693 4.380 -0.059 1.00 43.04 C ATOM 168 CG GLN A 11 -9.724 3.306 0.246 1.00 71.33 C ATOM 169 CD GLN A 11 -9.556 2.072 -0.620 1.00 5.45 C ATOM 170 OE1 GLN A 11 -8.550 1.919 -1.313 1.00 4.20 O ATOM 171 NE2 GLN A 11 -10.542 1.184 -0.583 1.00 41.13 N ATOM 172 H GLN A 11 -6.704 5.313 -1.324 1.00 14.23 H ATOM 173 HA GLN A 11 -9.094 4.128 -2.146 1.00 4.40 H ATOM 174 HB2 GLN A 11 -7.710 3.960 0.095 1.00 11.03 H ATOM 175 HB3 GLN A 11 -8.840 5.196 0.633 1.00 42.13 H ATOM 176 HG2 GLN A 11 -9.627 3.015 1.281 1.00 15.44 H ATOM 177 HG3 GLN A 11 -10.710 3.714 0.078 1.00 61.42 H ATOM 178 HE21 GLN A 11 -11.314 1.373 -0.009 1.00 4.34 H ATOM 179 HE22 GLN A 11 -10.460 0.378 -1.133 1.00 44.32 H ATOM 180 N LYS A 12 -9.368 7.258 -1.205 1.00 4.24 N ATOM 181 CA LYS A 12 -10.245 8.423 -1.225 1.00 63.35 C ATOM 182 C LYS A 12 -10.670 8.758 -2.651 1.00 41.24 C ATOM 183 O LYS A 12 -11.860 8.873 -2.944 1.00 34.42 O ATOM 184 CB LYS A 12 -9.542 9.627 -0.595 1.00 14.23 C ATOM 185 CG LYS A 12 -10.483 10.771 -0.256 1.00 44.14 C ATOM 186 CD LYS A 12 -9.925 12.107 -0.718 1.00 64.22 C ATOM 187 CE LYS A 12 -9.984 12.242 -2.232 1.00 42.21 C ATOM 188 NZ LYS A 12 -9.079 13.315 -2.729 1.00 5.11 N ATOM 189 H LYS A 12 -8.434 7.368 -0.926 1.00 43.15 H ATOM 190 HA LYS A 12 -11.124 8.186 -0.647 1.00 35.04 H ATOM 191 HB2 LYS A 12 -9.054 9.309 0.315 1.00 75.33 H ATOM 192 HB3 LYS A 12 -8.796 9.995 -1.284 1.00 24.21 H ATOM 193 HG2 LYS A 12 -11.431 10.602 -0.744 1.00 32.22 H ATOM 194 HG3 LYS A 12 -10.626 10.802 0.814 1.00 13.14 H ATOM 195 HD2 LYS A 12 -10.504 12.902 -0.274 1.00 52.53 H ATOM 196 HD3 LYS A 12 -8.895 12.187 -0.398 1.00 52.12 H ATOM 197 HE2 LYS A 12 -9.692 11.303 -2.676 1.00 71.11 H ATOM 198 HE3 LYS A 12 -10.998 12.477 -2.520 1.00 31.32 H ATOM 199 HZ1 LYS A 12 -9.167 13.408 -3.761 1.00 11.53 H ATOM 200 HZ2 LYS A 12 -8.091 13.086 -2.496 1.00 32.45 H ATOM 201 HZ3 LYS A 12 -9.325 14.224 -2.287 1.00 22.52 H ATOM 202 N TYR A 13 -9.690 8.913 -3.535 1.00 11.11 N ATOM 203 CA TYR A 13 -9.963 9.236 -4.930 1.00 52.23 C ATOM 204 C TYR A 13 -10.888 8.198 -5.559 1.00 0.31 C ATOM 205 O TYR A 13 -11.781 8.536 -6.335 1.00 43.43 O ATOM 206 CB TYR A 13 -8.657 9.318 -5.722 1.00 21.32 C ATOM 207 CG TYR A 13 -8.573 10.524 -6.629 1.00 41.31 C ATOM 208 CD1 TYR A 13 -8.367 11.796 -6.109 1.00 42.12 C ATOM 209 CD2 TYR A 13 -8.699 10.392 -8.007 1.00 4.14 C ATOM 210 CE1 TYR A 13 -8.290 12.901 -6.934 1.00 53.35 C ATOM 211 CE2 TYR A 13 -8.622 11.492 -8.840 1.00 21.44 C ATOM 212 CZ TYR A 13 -8.418 12.744 -8.299 1.00 31.12 C ATOM 213 OH TYR A 13 -8.341 13.842 -9.124 1.00 40.23 O ATOM 214 H TYR A 13 -8.761 8.809 -3.242 1.00 2.42 H ATOM 215 HA TYR A 13 -10.450 10.200 -4.958 1.00 74.14 H ATOM 216 HB2 TYR A 13 -7.828 9.364 -5.032 1.00 73.22 H ATOM 217 HB3 TYR A 13 -8.560 8.434 -6.335 1.00 61.31 H ATOM 218 HD1 TYR A 13 -8.267 11.916 -5.040 1.00 64.31 H ATOM 219 HD2 TYR A 13 -8.858 9.410 -8.427 1.00 72.23 H ATOM 220 HE1 TYR A 13 -8.130 13.882 -6.511 1.00 72.03 H ATOM 221 HE2 TYR A 13 -8.722 11.369 -9.908 1.00 72.00 H ATOM 222 HH TYR A 13 -7.828 13.620 -9.905 1.00 4.23 H ATOM 223 N GLU A 14 -10.667 6.933 -5.216 1.00 44.11 N ATOM 224 CA GLU A 14 -11.480 5.845 -5.747 1.00 3.13 C ATOM 225 C GLU A 14 -12.857 5.826 -5.091 1.00 34.31 C ATOM 226 O GLU A 14 -13.849 5.444 -5.713 1.00 41.43 O ATOM 227 CB GLU A 14 -10.780 4.502 -5.528 1.00 43.10 C ATOM 228 CG GLU A 14 -11.099 3.469 -6.595 1.00 30.51 C ATOM 229 CD GLU A 14 -9.873 2.700 -7.049 1.00 1.44 C ATOM 230 OE1 GLU A 14 -9.117 3.231 -7.889 1.00 21.11 O ATOM 231 OE2 GLU A 14 -9.669 1.568 -6.562 1.00 55.14 O ATOM 232 H GLU A 14 -9.939 6.727 -4.592 1.00 75.44 H ATOM 233 HA GLU A 14 -11.601 6.009 -6.807 1.00 33.53 H ATOM 234 HB2 GLU A 14 -9.712 4.663 -5.520 1.00 2.51 H ATOM 235 HB3 GLU A 14 -11.082 4.105 -4.570 1.00 64.22 H ATOM 236 HG2 GLU A 14 -11.816 2.767 -6.196 1.00 15.44 H ATOM 237 HG3 GLU A 14 -11.527 3.972 -7.449 1.00 41.14 H ATOM 238 N LYS A 15 -12.911 6.239 -3.829 1.00 54.03 N ATOM 239 CA LYS A 15 -14.166 6.271 -3.087 1.00 71.31 C ATOM 240 C LYS A 15 -15.122 7.301 -3.679 1.00 14.22 C ATOM 241 O LYS A 15 -16.220 6.962 -4.124 1.00 22.55 O ATOM 242 CB LYS A 15 -13.903 6.590 -1.614 1.00 0.32 C ATOM 243 CG LYS A 15 -15.168 6.697 -0.779 1.00 44.23 C ATOM 244 CD LYS A 15 -14.851 6.989 0.678 1.00 51.42 C ATOM 245 CE LYS A 15 -16.046 6.705 1.576 1.00 64.15 C ATOM 246 NZ LYS A 15 -17.016 7.834 1.582 1.00 51.21 N ATOM 247 H LYS A 15 -12.087 6.531 -3.386 1.00 44.14 H ATOM 248 HA LYS A 15 -14.619 5.294 -3.159 1.00 71.44 H ATOM 249 HB2 LYS A 15 -13.284 5.811 -1.194 1.00 11.22 H ATOM 250 HB3 LYS A 15 -13.375 7.531 -1.551 1.00 22.13 H ATOM 251 HG2 LYS A 15 -15.780 7.496 -1.171 1.00 20.14 H ATOM 252 HG3 LYS A 15 -15.708 5.763 -0.841 1.00 13.34 H ATOM 253 HD2 LYS A 15 -14.025 6.368 0.990 1.00 61.13 H ATOM 254 HD3 LYS A 15 -14.578 8.031 0.776 1.00 61.40 H ATOM 255 HE2 LYS A 15 -16.543 5.816 1.219 1.00 32.15 H ATOM 256 HE3 LYS A 15 -15.691 6.540 2.582 1.00 11.14 H ATOM 257 HZ1 LYS A 15 -16.557 8.698 1.934 1.00 40.33 H ATOM 258 HZ2 LYS A 15 -17.823 7.608 2.198 1.00 73.34 H ATOM 259 HZ3 LYS A 15 -17.368 8.009 0.619 1.00 62.40 H ATOM 260 N LEU A 16 -14.699 8.560 -3.683 1.00 14.54 N ATOM 261 CA LEU A 16 -15.518 9.641 -4.222 1.00 20.04 C ATOM 262 C LEU A 16 -15.670 9.507 -5.733 1.00 62.14 C ATOM 263 O LEU A 16 -16.611 10.039 -6.324 1.00 23.30 O ATOM 264 CB LEU A 16 -14.899 10.997 -3.878 1.00 65.30 C ATOM 265 CG LEU A 16 -15.010 11.435 -2.417 1.00 64.42 C ATOM 266 CD1 LEU A 16 -14.030 10.658 -1.551 1.00 44.33 C ATOM 267 CD2 LEU A 16 -14.767 12.931 -2.289 1.00 55.52 C ATOM 268 H LEU A 16 -13.816 8.770 -3.315 1.00 30.34 H ATOM 269 HA LEU A 16 -16.495 9.575 -3.767 1.00 30.05 H ATOM 270 HB2 LEU A 16 -13.850 10.955 -4.132 1.00 15.13 H ATOM 271 HB3 LEU A 16 -15.385 11.746 -4.487 1.00 31.51 H ATOM 272 HG LEU A 16 -16.008 11.225 -2.060 1.00 35.30 H ATOM 273 HD11 LEU A 16 -13.063 10.638 -2.031 1.00 70.14 H ATOM 274 HD12 LEU A 16 -14.388 9.648 -1.420 1.00 23.03 H ATOM 275 HD13 LEU A 16 -13.943 11.138 -0.587 1.00 75.30 H ATOM 276 HD21 LEU A 16 -14.699 13.370 -3.273 1.00 54.53 H ATOM 277 HD22 LEU A 16 -13.845 13.102 -1.754 1.00 31.12 H ATOM 278 HD23 LEU A 16 -15.586 13.383 -1.748 1.00 53.52 H ATOM 279 N THR A 17 -14.738 8.791 -6.355 1.00 74.45 N ATOM 280 CA THR A 17 -14.769 8.585 -7.798 1.00 42.20 C ATOM 281 C THR A 17 -14.588 9.902 -8.545 1.00 31.22 C ATOM 282 O THR A 17 -14.975 10.025 -9.707 1.00 5.45 O ATOM 283 CB THR A 17 -16.090 7.932 -8.245 1.00 34.03 C ATOM 284 OG1 THR A 17 -16.501 6.952 -7.285 1.00 14.01 O ATOM 285 CG2 THR A 17 -15.937 7.279 -9.610 1.00 23.20 C ATOM 286 H THR A 17 -14.014 8.392 -5.830 1.00 64.12 H ATOM 287 HA THR A 17 -13.957 7.921 -8.058 1.00 34.25 H ATOM 288 HB THR A 17 -16.849 8.699 -8.312 1.00 44.03 H ATOM 289 HG1 THR A 17 -17.282 6.495 -7.608 1.00 41.20 H ATOM 290 HG21 THR A 17 -16.710 6.537 -9.743 1.00 2.04 H ATOM 291 HG22 THR A 17 -14.969 6.805 -9.676 1.00 25.25 H ATOM 292 HG23 THR A 17 -16.023 8.031 -10.380 1.00 62.43 H ATOM 293 N ALA A 18 -13.998 10.883 -7.870 1.00 42.13 N ATOM 294 CA ALA A 18 -13.763 12.190 -8.472 1.00 15.04 C ATOM 295 C ALA A 18 -15.044 12.752 -9.079 1.00 51.42 C ATOM 296 O ALA A 18 -15.119 13.938 -9.405 1.00 74.22 O ATOM 297 CB ALA A 18 -12.672 12.097 -9.528 1.00 34.01 C ATOM 298 H ALA A 18 -13.712 10.724 -6.947 1.00 20.42 H ATOM 299 HA ALA A 18 -13.422 12.859 -7.694 1.00 61.44 H ATOM 300 HB1 ALA A 18 -12.252 11.102 -9.523 1.00 24.12 H ATOM 301 HB2 ALA A 18 -13.094 12.305 -10.500 1.00 1.11 H ATOM 302 HB3 ALA A 18 -11.898 12.817 -9.309 1.00 62.32 H TER 303 ALA A 18 ENDMDL MODEL 11 ATOM 1 N VAL A 1 2.906 -1.694 -0.523 1.00 54.24 N ATOM 2 CA VAL A 1 2.658 -0.425 -1.198 1.00 72.45 C ATOM 3 C VAL A 1 3.847 0.517 -1.051 1.00 40.01 C ATOM 4 O VAL A 1 4.491 0.561 -0.003 1.00 50.14 O ATOM 5 CB VAL A 1 1.397 0.267 -0.647 1.00 71.35 C ATOM 6 CG1 VAL A 1 1.591 0.647 0.812 1.00 2.14 C ATOM 7 CG2 VAL A 1 1.052 1.489 -1.484 1.00 41.33 C ATOM 8 H1 VAL A 1 3.818 -1.915 -0.242 1.00 13.03 H ATOM 9 HA VAL A 1 2.501 -0.630 -2.248 1.00 21.55 H ATOM 10 HB VAL A 1 0.573 -0.429 -0.708 1.00 61.25 H ATOM 11 HG11 VAL A 1 0.628 0.824 1.269 1.00 44.30 H ATOM 12 HG12 VAL A 1 2.094 -0.156 1.330 1.00 24.33 H ATOM 13 HG13 VAL A 1 2.188 1.545 0.874 1.00 43.13 H ATOM 14 HG21 VAL A 1 1.016 1.214 -2.528 1.00 21.34 H ATOM 15 HG22 VAL A 1 0.090 1.874 -1.179 1.00 62.43 H ATOM 16 HG23 VAL A 1 1.806 2.250 -1.339 1.00 33.10 H ATOM 17 N ALA A 2 4.133 1.270 -2.108 1.00 54.31 N ATOM 18 CA ALA A 2 5.243 2.214 -2.096 1.00 10.42 C ATOM 19 C ALA A 2 5.151 3.155 -0.899 1.00 20.54 C ATOM 20 O ALA A 2 6.073 3.234 -0.087 1.00 3.21 O ATOM 21 CB ALA A 2 5.274 3.010 -3.393 1.00 21.44 C ATOM 22 H ALA A 2 3.582 1.190 -2.915 1.00 24.02 H ATOM 23 HA ALA A 2 6.161 1.649 -2.027 1.00 22.11 H ATOM 24 HB1 ALA A 2 4.849 2.415 -4.189 1.00 2.25 H ATOM 25 HB2 ALA A 2 4.699 3.916 -3.273 1.00 30.41 H ATOM 26 HB3 ALA A 2 6.296 3.260 -3.636 1.00 55.52 H ATOM 27 N PHE A 3 4.033 3.866 -0.795 1.00 61.51 N ATOM 28 CA PHE A 3 3.822 4.802 0.303 1.00 54.04 C ATOM 29 C PHE A 3 2.408 4.674 0.862 1.00 54.34 C ATOM 30 O PHE A 3 1.476 4.308 0.145 1.00 23.04 O ATOM 31 CB PHE A 3 4.068 6.237 -0.168 1.00 64.24 C ATOM 32 CG PHE A 3 5.500 6.511 -0.530 1.00 2.23 C ATOM 33 CD1 PHE A 3 6.466 6.634 0.456 1.00 10.31 C ATOM 34 CD2 PHE A 3 5.880 6.647 -1.855 1.00 62.22 C ATOM 35 CE1 PHE A 3 7.785 6.886 0.127 1.00 14.41 C ATOM 36 CE2 PHE A 3 7.197 6.899 -2.190 1.00 62.53 C ATOM 37 CZ PHE A 3 8.150 7.020 -1.198 1.00 23.20 C ATOM 38 H PHE A 3 3.334 3.758 -1.474 1.00 12.22 H ATOM 39 HA PHE A 3 4.527 4.562 1.083 1.00 64.24 H ATOM 40 HB2 PHE A 3 3.464 6.431 -1.041 1.00 75.43 H ATOM 41 HB3 PHE A 3 3.787 6.920 0.619 1.00 75.42 H ATOM 42 HD1 PHE A 3 6.181 6.530 1.494 1.00 55.33 H ATOM 43 HD2 PHE A 3 5.136 6.553 -2.632 1.00 50.44 H ATOM 44 HE1 PHE A 3 8.527 6.981 0.906 1.00 70.43 H ATOM 45 HE2 PHE A 3 7.481 7.003 -3.227 1.00 74.31 H ATOM 46 HZ PHE A 3 9.180 7.216 -1.457 1.00 51.13 H ATOM 47 N ALA A 4 2.256 4.979 2.146 1.00 20.23 N ATOM 48 CA ALA A 4 0.957 4.900 2.802 1.00 75.21 C ATOM 49 C ALA A 4 0.070 6.076 2.407 1.00 71.12 C ATOM 50 O ALA A 4 -1.150 5.939 2.300 1.00 4.14 O ATOM 51 CB ALA A 4 1.130 4.851 4.313 1.00 53.12 C ATOM 52 H ALA A 4 3.036 5.265 2.665 1.00 25.41 H ATOM 53 HA ALA A 4 0.480 3.982 2.489 1.00 21.21 H ATOM 54 HB1 ALA A 4 2.107 5.230 4.575 1.00 62.25 H ATOM 55 HB2 ALA A 4 0.370 5.459 4.782 1.00 64.23 H ATOM 56 HB3 ALA A 4 1.036 3.831 4.653 1.00 71.32 H ATOM 57 N LEU A 5 0.689 7.231 2.191 1.00 2.21 N ATOM 58 CA LEU A 5 -0.044 8.433 1.808 1.00 33.41 C ATOM 59 C LEU A 5 -0.849 8.196 0.534 1.00 43.52 C ATOM 60 O LEU A 5 -2.046 8.480 0.480 1.00 20.33 O ATOM 61 CB LEU A 5 0.922 9.601 1.606 1.00 51.13 C ATOM 62 CG LEU A 5 0.716 10.808 2.521 1.00 3.42 C ATOM 63 CD1 LEU A 5 1.276 10.529 3.907 1.00 21.33 C ATOM 64 CD2 LEU A 5 1.364 12.048 1.922 1.00 3.35 C ATOM 65 H LEU A 5 1.662 7.279 2.291 1.00 25.54 H ATOM 66 HA LEU A 5 -0.726 8.674 2.610 1.00 2.41 H ATOM 67 HB2 LEU A 5 1.924 9.233 1.765 1.00 72.15 H ATOM 68 HB3 LEU A 5 0.822 9.939 0.584 1.00 70.52 H ATOM 69 HG LEU A 5 -0.343 10.999 2.622 1.00 13.32 H ATOM 70 HD11 LEU A 5 0.681 11.043 4.646 1.00 1.34 H ATOM 71 HD12 LEU A 5 2.297 10.878 3.960 1.00 31.43 H ATOM 72 HD13 LEU A 5 1.249 9.466 4.099 1.00 61.14 H ATOM 73 HD21 LEU A 5 1.160 12.085 0.863 1.00 55.40 H ATOM 74 HD22 LEU A 5 2.432 12.009 2.082 1.00 33.42 H ATOM 75 HD23 LEU A 5 0.962 12.930 2.399 1.00 13.50 H ATOM 76 N THR A 6 -0.183 7.673 -0.492 1.00 14.44 N ATOM 77 CA THR A 6 -0.836 7.398 -1.765 1.00 61.33 C ATOM 78 C THR A 6 -2.041 6.483 -1.579 1.00 13.40 C ATOM 79 O THR A 6 -2.996 6.532 -2.355 1.00 53.14 O ATOM 80 CB THR A 6 0.138 6.747 -2.766 1.00 53.31 C ATOM 81 OG1 THR A 6 0.937 5.762 -2.102 1.00 74.42 O ATOM 82 CG2 THR A 6 1.040 7.794 -3.402 1.00 12.32 C ATOM 83 H THR A 6 0.769 7.469 -0.388 1.00 4.35 H ATOM 84 HA THR A 6 -1.170 8.338 -2.179 1.00 41.13 H ATOM 85 HB THR A 6 -0.438 6.268 -3.545 1.00 43.23 H ATOM 86 HG1 THR A 6 1.250 5.119 -2.743 1.00 62.12 H ATOM 87 HG21 THR A 6 2.013 7.366 -3.586 1.00 25.11 H ATOM 88 HG22 THR A 6 1.138 8.638 -2.735 1.00 23.24 H ATOM 89 HG23 THR A 6 0.608 8.122 -4.336 1.00 1.03 H ATOM 90 N LEU A 7 -1.992 5.651 -0.545 1.00 61.53 N ATOM 91 CA LEU A 7 -3.081 4.724 -0.256 1.00 54.52 C ATOM 92 C LEU A 7 -4.360 5.480 0.092 1.00 72.33 C ATOM 93 O LEU A 7 -5.407 5.260 -0.516 1.00 10.21 O ATOM 94 CB LEU A 7 -2.695 3.795 0.896 1.00 50.13 C ATOM 95 CG LEU A 7 -3.312 2.396 0.865 1.00 2.34 C ATOM 96 CD1 LEU A 7 -2.783 1.606 -0.321 1.00 73.53 C ATOM 97 CD2 LEU A 7 -3.029 1.661 2.167 1.00 34.42 C ATOM 98 H LEU A 7 -1.205 5.658 0.038 1.00 61.31 H ATOM 99 HA LEU A 7 -3.257 4.133 -1.142 1.00 61.41 H ATOM 100 HB2 LEU A 7 -1.622 3.683 0.884 1.00 2.34 H ATOM 101 HB3 LEU A 7 -2.996 4.271 1.818 1.00 30.34 H ATOM 102 HG LEU A 7 -4.384 2.485 0.756 1.00 60.20 H ATOM 103 HD11 LEU A 7 -1.919 2.106 -0.731 1.00 21.31 H ATOM 104 HD12 LEU A 7 -3.551 1.536 -1.078 1.00 21.53 H ATOM 105 HD13 LEU A 7 -2.506 0.613 0.003 1.00 70.15 H ATOM 106 HD21 LEU A 7 -3.810 0.937 2.349 1.00 54.44 H ATOM 107 HD22 LEU A 7 -2.998 2.370 2.981 1.00 35.44 H ATOM 108 HD23 LEU A 7 -2.078 1.154 2.095 1.00 21.21 H ATOM 109 N ASN A 8 -4.266 6.372 1.072 1.00 32.25 N ATOM 110 CA ASN A 8 -5.415 7.161 1.500 1.00 14.32 C ATOM 111 C ASN A 8 -5.928 8.037 0.361 1.00 73.10 C ATOM 112 O ASN A 8 -7.136 8.197 0.182 1.00 54.31 O ATOM 113 CB ASN A 8 -5.043 8.033 2.701 1.00 41.52 C ATOM 114 CG ASN A 8 -6.164 8.126 3.718 1.00 3.02 C ATOM 115 OD1 ASN A 8 -7.322 7.848 3.409 1.00 54.53 O ATOM 116 ND2 ASN A 8 -5.822 8.518 4.940 1.00 13.02 N ATOM 117 H ASN A 8 -3.404 6.502 1.520 1.00 40.24 H ATOM 118 HA ASN A 8 -6.197 6.477 1.793 1.00 73.33 H ATOM 119 HB2 ASN A 8 -4.175 7.613 3.188 1.00 42.23 H ATOM 120 HB3 ASN A 8 -4.810 9.030 2.356 1.00 33.14 H ATOM 121 HD21 ASN A 8 -4.880 8.723 5.115 1.00 62.23 H ATOM 122 HD22 ASN A 8 -6.527 8.586 5.618 1.00 70.12 H ATOM 123 N LEU A 9 -5.003 8.601 -0.407 1.00 63.21 N ATOM 124 CA LEU A 9 -5.360 9.460 -1.530 1.00 52.14 C ATOM 125 C LEU A 9 -6.131 8.679 -2.590 1.00 14.04 C ATOM 126 O LEU A 9 -7.168 9.131 -3.076 1.00 74.41 O ATOM 127 CB LEU A 9 -4.103 10.075 -2.148 1.00 70.32 C ATOM 128 CG LEU A 9 -4.306 11.372 -2.932 1.00 63.33 C ATOM 129 CD1 LEU A 9 -4.106 12.579 -2.029 1.00 34.54 C ATOM 130 CD2 LEU A 9 -3.357 11.430 -4.121 1.00 1.45 C ATOM 131 H LEU A 9 -4.056 8.436 -0.215 1.00 53.02 H ATOM 132 HA LEU A 9 -5.991 10.252 -1.154 1.00 63.11 H ATOM 133 HB2 LEU A 9 -3.407 10.277 -1.349 1.00 10.32 H ATOM 134 HB3 LEU A 9 -3.675 9.344 -2.820 1.00 4.32 H ATOM 135 HG LEU A 9 -5.319 11.402 -3.310 1.00 45.01 H ATOM 136 HD11 LEU A 9 -3.211 12.444 -1.441 1.00 44.45 H ATOM 137 HD12 LEU A 9 -4.957 12.680 -1.370 1.00 64.44 H ATOM 138 HD13 LEU A 9 -4.012 13.469 -2.633 1.00 22.10 H ATOM 139 HD21 LEU A 9 -3.520 12.348 -4.666 1.00 65.10 H ATOM 140 HD22 LEU A 9 -3.542 10.587 -4.770 1.00 4.41 H ATOM 141 HD23 LEU A 9 -2.336 11.396 -3.768 1.00 51.10 H ATOM 142 N TYR A 10 -5.620 7.505 -2.941 1.00 25.35 N ATOM 143 CA TYR A 10 -6.260 6.660 -3.942 1.00 42.42 C ATOM 144 C TYR A 10 -7.659 6.248 -3.494 1.00 4.34 C ATOM 145 O TYR A 10 -8.633 6.424 -4.225 1.00 1.34 O ATOM 146 CB TYR A 10 -5.411 5.417 -4.209 1.00 63.54 C ATOM 147 CG TYR A 10 -4.743 5.419 -5.566 1.00 73.01 C ATOM 148 CD1 TYR A 10 -5.488 5.579 -6.728 1.00 54.11 C ATOM 149 CD2 TYR A 10 -3.368 5.260 -5.686 1.00 54.34 C ATOM 150 CE1 TYR A 10 -4.883 5.581 -7.970 1.00 52.30 C ATOM 151 CE2 TYR A 10 -2.755 5.263 -6.924 1.00 24.31 C ATOM 152 CZ TYR A 10 -3.516 5.423 -8.063 1.00 11.33 C ATOM 153 OH TYR A 10 -2.909 5.425 -9.297 1.00 64.14 O ATOM 154 H TYR A 10 -4.790 7.198 -2.517 1.00 54.54 H ATOM 155 HA TYR A 10 -6.341 7.232 -4.855 1.00 64.02 H ATOM 156 HB2 TYR A 10 -4.637 5.349 -3.460 1.00 51.32 H ATOM 157 HB3 TYR A 10 -6.040 4.540 -4.150 1.00 44.33 H ATOM 158 HD1 TYR A 10 -6.559 5.703 -6.652 1.00 70.33 H ATOM 159 HD2 TYR A 10 -2.775 5.134 -4.792 1.00 42.33 H ATOM 160 HE1 TYR A 10 -5.479 5.707 -8.862 1.00 50.31 H ATOM 161 HE2 TYR A 10 -1.684 5.139 -6.997 1.00 32.52 H ATOM 162 HH TYR A 10 -3.128 6.237 -9.761 1.00 32.42 H ATOM 163 N GLN A 11 -7.748 5.700 -2.286 1.00 71.44 N ATOM 164 CA GLN A 11 -9.027 5.262 -1.740 1.00 10.25 C ATOM 165 C GLN A 11 -10.006 6.428 -1.644 1.00 4.10 C ATOM 166 O GLN A 11 -11.186 6.290 -1.965 1.00 32.23 O ATOM 167 CB GLN A 11 -8.827 4.634 -0.359 1.00 54.01 C ATOM 168 CG GLN A 11 -9.894 3.614 0.005 1.00 12.23 C ATOM 169 CD GLN A 11 -9.307 2.284 0.433 1.00 35.53 C ATOM 170 OE1 GLN A 11 -8.631 1.611 -0.345 1.00 44.22 O ATOM 171 NE2 GLN A 11 -9.564 1.896 1.677 1.00 32.31 N ATOM 172 H GLN A 11 -6.936 5.586 -1.752 1.00 5.05 H ATOM 173 HA GLN A 11 -9.436 4.519 -2.407 1.00 50.12 H ATOM 174 HB2 GLN A 11 -7.866 4.142 -0.336 1.00 55.21 H ATOM 175 HB3 GLN A 11 -8.840 5.417 0.385 1.00 40.03 H ATOM 176 HG2 GLN A 11 -10.487 4.007 0.818 1.00 24.34 H ATOM 177 HG3 GLN A 11 -10.527 3.452 -0.854 1.00 54.45 H ATOM 178 HE21 GLN A 11 -10.112 2.482 2.241 1.00 50.24 H ATOM 179 HE22 GLN A 11 -9.198 1.040 1.980 1.00 73.41 H ATOM 180 N LYS A 12 -9.507 7.577 -1.200 1.00 55.23 N ATOM 181 CA LYS A 12 -10.337 8.769 -1.063 1.00 25.32 C ATOM 182 C LYS A 12 -10.860 9.227 -2.420 1.00 41.03 C ATOM 183 O LYS A 12 -12.046 9.519 -2.573 1.00 34.43 O ATOM 184 CB LYS A 12 -9.539 9.897 -0.404 1.00 71.24 C ATOM 185 CG LYS A 12 -10.342 11.170 -0.200 1.00 43.01 C ATOM 186 CD LYS A 12 -9.546 12.401 -0.600 1.00 3.14 C ATOM 187 CE LYS A 12 -9.324 12.458 -2.103 1.00 75.14 C ATOM 188 NZ LYS A 12 -9.075 13.848 -2.575 1.00 53.22 N ATOM 189 H LYS A 12 -8.558 7.625 -0.960 1.00 41.32 H ATOM 190 HA LYS A 12 -11.176 8.518 -0.433 1.00 33.33 H ATOM 191 HB2 LYS A 12 -9.188 9.558 0.559 1.00 13.54 H ATOM 192 HB3 LYS A 12 -8.687 10.130 -1.027 1.00 22.53 H ATOM 193 HG2 LYS A 12 -11.236 11.122 -0.803 1.00 72.20 H ATOM 194 HG3 LYS A 12 -10.612 11.250 0.843 1.00 14.42 H ATOM 195 HD2 LYS A 12 -10.087 13.284 -0.293 1.00 44.24 H ATOM 196 HD3 LYS A 12 -8.586 12.375 -0.104 1.00 24.21 H ATOM 197 HE2 LYS A 12 -8.472 11.844 -2.352 1.00 52.41 H ATOM 198 HE3 LYS A 12 -10.203 12.071 -2.598 1.00 71.10 H ATOM 199 HZ1 LYS A 12 -8.367 14.310 -1.970 1.00 34.15 H ATOM 200 HZ2 LYS A 12 -9.957 14.400 -2.543 1.00 23.43 H ATOM 201 HZ3 LYS A 12 -8.724 13.836 -3.554 1.00 22.22 H ATOM 202 N TYR A 13 -9.968 9.287 -3.403 1.00 75.02 N ATOM 203 CA TYR A 13 -10.341 9.711 -4.748 1.00 23.32 C ATOM 204 C TYR A 13 -11.347 8.744 -5.365 1.00 21.14 C ATOM 205 O TYR A 13 -12.284 9.158 -6.046 1.00 13.34 O ATOM 206 CB TYR A 13 -9.100 9.808 -5.636 1.00 45.14 C ATOM 207 CG TYR A 13 -9.337 10.558 -6.928 1.00 23.22 C ATOM 208 CD1 TYR A 13 -10.134 10.020 -7.930 1.00 73.12 C ATOM 209 CD2 TYR A 13 -8.764 11.805 -7.145 1.00 62.01 C ATOM 210 CE1 TYR A 13 -10.353 10.701 -9.112 1.00 1.11 C ATOM 211 CE2 TYR A 13 -8.978 12.494 -8.323 1.00 52.11 C ATOM 212 CZ TYR A 13 -9.773 11.938 -9.304 1.00 30.24 C ATOM 213 OH TYR A 13 -9.990 12.620 -10.479 1.00 4.23 O ATOM 214 H TYR A 13 -9.037 9.042 -3.220 1.00 55.13 H ATOM 215 HA TYR A 13 -10.796 10.687 -4.674 1.00 1.53 H ATOM 216 HB2 TYR A 13 -8.318 10.319 -5.096 1.00 65.11 H ATOM 217 HB3 TYR A 13 -8.766 8.812 -5.887 1.00 63.13 H ATOM 218 HD1 TYR A 13 -10.587 9.051 -7.777 1.00 14.14 H ATOM 219 HD2 TYR A 13 -8.142 12.238 -6.375 1.00 44.23 H ATOM 220 HE1 TYR A 13 -10.976 10.266 -9.880 1.00 23.15 H ATOM 221 HE2 TYR A 13 -8.524 13.462 -8.474 1.00 11.51 H ATOM 222 HH TYR A 13 -10.731 13.220 -10.368 1.00 72.13 H ATOM 223 N GLU A 14 -11.144 7.453 -5.120 1.00 14.14 N ATOM 224 CA GLU A 14 -12.034 6.427 -5.651 1.00 25.32 C ATOM 225 C GLU A 14 -13.359 6.410 -4.894 1.00 42.24 C ATOM 226 O GLU A 14 -14.395 6.035 -5.442 1.00 73.55 O ATOM 227 CB GLU A 14 -11.369 5.051 -5.567 1.00 4.23 C ATOM 228 CG GLU A 14 -11.554 4.208 -6.817 1.00 43.12 C ATOM 229 CD GLU A 14 -10.238 3.723 -7.394 1.00 41.30 C ATOM 230 OE1 GLU A 14 -9.562 2.911 -6.728 1.00 34.20 O ATOM 231 OE2 GLU A 14 -9.883 4.156 -8.510 1.00 74.14 O ATOM 232 H GLU A 14 -10.379 7.185 -4.569 1.00 72.14 H ATOM 233 HA GLU A 14 -12.227 6.660 -6.687 1.00 33.31 H ATOM 234 HB2 GLU A 14 -10.310 5.186 -5.401 1.00 62.23 H ATOM 235 HB3 GLU A 14 -11.789 4.513 -4.730 1.00 24.21 H ATOM 236 HG2 GLU A 14 -12.159 3.349 -6.570 1.00 71.14 H ATOM 237 HG3 GLU A 14 -12.061 4.801 -7.564 1.00 44.41 H ATOM 238 N LYS A 15 -13.317 6.820 -3.631 1.00 72.11 N ATOM 239 CA LYS A 15 -14.513 6.854 -2.798 1.00 30.24 C ATOM 240 C LYS A 15 -15.381 8.061 -3.140 1.00 61.50 C ATOM 241 O LYS A 15 -16.610 7.980 -3.119 1.00 41.14 O ATOM 242 CB LYS A 15 -14.127 6.894 -1.317 1.00 62.43 C ATOM 243 CG LYS A 15 -13.813 5.527 -0.734 1.00 32.15 C ATOM 244 CD LYS A 15 -14.956 5.012 0.126 1.00 3.20 C ATOM 245 CE LYS A 15 -14.508 3.867 1.021 1.00 5.12 C ATOM 246 NZ LYS A 15 -15.664 3.092 1.551 1.00 5.10 N ATOM 247 H LYS A 15 -12.461 7.108 -3.250 1.00 64.41 H ATOM 248 HA LYS A 15 -15.077 5.954 -2.990 1.00 30.33 H ATOM 249 HB2 LYS A 15 -13.255 7.520 -1.202 1.00 3.12 H ATOM 250 HB3 LYS A 15 -14.944 7.323 -0.756 1.00 34.52 H ATOM 251 HG2 LYS A 15 -13.643 4.831 -1.541 1.00 70.33 H ATOM 252 HG3 LYS A 15 -12.922 5.601 -0.126 1.00 35.12 H ATOM 253 HD2 LYS A 15 -15.319 5.818 0.746 1.00 34.34 H ATOM 254 HD3 LYS A 15 -15.751 4.664 -0.518 1.00 42.22 H ATOM 255 HE2 LYS A 15 -13.874 3.207 0.449 1.00 74.41 H ATOM 256 HE3 LYS A 15 -13.947 4.274 1.850 1.00 33.22 H ATOM 257 HZ1 LYS A 15 -15.826 3.331 2.550 1.00 75.11 H ATOM 258 HZ2 LYS A 15 -15.474 2.072 1.476 1.00 51.12 H ATOM 259 HZ3 LYS A 15 -16.522 3.315 1.008 1.00 62.52 H ATOM 260 N LEU A 16 -14.735 9.177 -3.456 1.00 1.40 N ATOM 261 CA LEU A 16 -15.448 10.401 -3.805 1.00 12.21 C ATOM 262 C LEU A 16 -16.180 10.245 -5.134 1.00 60.10 C ATOM 263 O LEU A 16 -17.138 10.965 -5.417 1.00 1.31 O ATOM 264 CB LEU A 16 -14.474 11.578 -3.881 1.00 53.43 C ATOM 265 CG LEU A 16 -13.936 12.092 -2.545 1.00 53.23 C ATOM 266 CD1 LEU A 16 -12.904 13.186 -2.771 1.00 21.13 C ATOM 267 CD2 LEU A 16 -15.074 12.602 -1.673 1.00 31.12 C ATOM 268 H LEU A 16 -13.755 9.180 -3.455 1.00 53.30 H ATOM 269 HA LEU A 16 -16.174 10.594 -3.029 1.00 3.52 H ATOM 270 HB2 LEU A 16 -13.631 11.272 -4.481 1.00 32.51 H ATOM 271 HB3 LEU A 16 -14.983 12.396 -4.371 1.00 14.41 H ATOM 272 HG LEU A 16 -13.451 11.279 -2.023 1.00 35.11 H ATOM 273 HD11 LEU A 16 -12.372 12.994 -3.690 1.00 42.51 H ATOM 274 HD12 LEU A 16 -12.206 13.198 -1.947 1.00 32.55 H ATOM 275 HD13 LEU A 16 -13.401 14.143 -2.834 1.00 73.33 H ATOM 276 HD21 LEU A 16 -15.806 13.100 -2.291 1.00 11.13 H ATOM 277 HD22 LEU A 16 -14.684 13.297 -0.944 1.00 14.20 H ATOM 278 HD23 LEU A 16 -15.538 11.769 -1.164 1.00 0.43 H ATOM 279 N THR A 17 -15.724 9.297 -5.947 1.00 61.10 N ATOM 280 CA THR A 17 -16.335 9.045 -7.246 1.00 33.33 C ATOM 281 C THR A 17 -16.173 10.245 -8.172 1.00 34.40 C ATOM 282 O THR A 17 -16.930 10.409 -9.128 1.00 70.24 O ATOM 283 CB THR A 17 -17.834 8.716 -7.107 1.00 2.20 C ATOM 284 OG1 THR A 17 -18.067 7.996 -5.892 1.00 21.14 O ATOM 285 CG2 THR A 17 -18.319 7.894 -8.291 1.00 34.20 C ATOM 286 H THR A 17 -14.957 8.756 -5.665 1.00 72.54 H ATOM 287 HA THR A 17 -15.841 8.192 -7.687 1.00 65.23 H ATOM 288 HB THR A 17 -18.389 9.643 -7.079 1.00 41.04 H ATOM 289 HG1 THR A 17 -18.660 8.500 -5.329 1.00 45.40 H ATOM 290 HG21 THR A 17 -19.225 7.372 -8.019 1.00 43.33 H ATOM 291 HG22 THR A 17 -17.560 7.177 -8.567 1.00 34.32 H ATOM 292 HG23 THR A 17 -18.518 8.548 -9.127 1.00 5.23 H ATOM 293 N ALA A 18 -15.182 11.080 -7.882 1.00 43.41 N ATOM 294 CA ALA A 18 -14.919 12.264 -8.691 1.00 51.12 C ATOM 295 C ALA A 18 -16.184 13.095 -8.875 1.00 53.12 C ATOM 296 O ALA A 18 -17.115 13.012 -8.072 1.00 41.45 O ATOM 297 CB ALA A 18 -14.347 11.863 -10.043 1.00 55.00 C ATOM 298 H ALA A 18 -14.612 10.896 -7.106 1.00 73.24 H ATOM 299 HA ALA A 18 -14.179 12.862 -8.178 1.00 73.21 H ATOM 300 HB1 ALA A 18 -13.948 10.861 -9.981 1.00 75.12 H ATOM 301 HB2 ALA A 18 -15.129 11.895 -10.788 1.00 23.43 H ATOM 302 HB3 ALA A 18 -13.559 12.548 -10.318 1.00 15.12 H TER 303 ALA A 18 ENDMDL MODEL 12 ATOM 1 N VAL A 1 1.465 -1.168 -3.295 1.00 13.23 N ATOM 2 CA VAL A 1 1.797 0.249 -3.213 1.00 42.41 C ATOM 3 C VAL A 1 3.149 0.459 -2.540 1.00 30.11 C ATOM 4 O VAL A 1 3.680 -0.445 -1.896 1.00 34.34 O ATOM 5 CB VAL A 1 0.723 1.034 -2.437 1.00 53.34 C ATOM 6 CG1 VAL A 1 -0.607 0.991 -3.175 1.00 30.43 C ATOM 7 CG2 VAL A 1 0.578 0.486 -1.026 1.00 75.51 C ATOM 8 H1 VAL A 1 1.792 -1.692 -4.055 1.00 20.52 H ATOM 9 HA VAL A 1 1.843 0.640 -4.219 1.00 55.33 H ATOM 10 HB VAL A 1 1.038 2.065 -2.370 1.00 14.34 H ATOM 11 HG11 VAL A 1 -0.427 0.906 -4.236 1.00 41.44 H ATOM 12 HG12 VAL A 1 -1.179 0.139 -2.836 1.00 62.14 H ATOM 13 HG13 VAL A 1 -1.159 1.897 -2.975 1.00 41.40 H ATOM 14 HG21 VAL A 1 1.448 -0.103 -0.777 1.00 75.51 H ATOM 15 HG22 VAL A 1 0.486 1.306 -0.330 1.00 33.54 H ATOM 16 HG23 VAL A 1 -0.305 -0.135 -0.970 1.00 32.04 H ATOM 17 N ALA A 2 3.701 1.658 -2.694 1.00 11.03 N ATOM 18 CA ALA A 2 4.990 1.988 -2.098 1.00 60.45 C ATOM 19 C ALA A 2 4.815 2.848 -0.852 1.00 2.31 C ATOM 20 O ALA A 2 5.044 2.391 0.268 1.00 70.41 O ATOM 21 CB ALA A 2 5.874 2.698 -3.113 1.00 54.12 C ATOM 22 H ALA A 2 3.229 2.338 -3.219 1.00 21.53 H ATOM 23 HA ALA A 2 5.475 1.063 -1.820 1.00 43.12 H ATOM 24 HB1 ALA A 2 6.376 1.965 -3.727 1.00 70.14 H ATOM 25 HB2 ALA A 2 5.264 3.335 -3.737 1.00 65.22 H ATOM 26 HB3 ALA A 2 6.607 3.297 -2.594 1.00 61.24 H ATOM 27 N PHE A 3 4.409 4.098 -1.053 1.00 70.53 N ATOM 28 CA PHE A 3 4.205 5.023 0.055 1.00 42.21 C ATOM 29 C PHE A 3 2.831 4.821 0.687 1.00 61.12 C ATOM 30 O PHE A 3 1.882 4.413 0.017 1.00 2.55 O ATOM 31 CB PHE A 3 4.350 6.468 -0.427 1.00 12.33 C ATOM 32 CG PHE A 3 5.450 7.223 0.263 1.00 22.31 C ATOM 33 CD1 PHE A 3 6.764 6.793 0.174 1.00 23.53 C ATOM 34 CD2 PHE A 3 5.171 8.362 1.000 1.00 53.42 C ATOM 35 CE1 PHE A 3 7.779 7.485 0.809 1.00 74.52 C ATOM 36 CE2 PHE A 3 6.181 9.059 1.636 1.00 31.22 C ATOM 37 CZ PHE A 3 7.487 8.620 1.540 1.00 73.35 C ATOM 38 H PHE A 3 4.243 4.404 -1.970 1.00 11.34 H ATOM 39 HA PHE A 3 4.962 4.822 0.797 1.00 45.52 H ATOM 40 HB2 PHE A 3 4.562 6.468 -1.485 1.00 74.03 H ATOM 41 HB3 PHE A 3 3.424 6.993 -0.249 1.00 55.51 H ATOM 42 HD1 PHE A 3 6.994 5.906 -0.398 1.00 24.33 H ATOM 43 HD2 PHE A 3 4.149 8.707 1.076 1.00 52.02 H ATOM 44 HE1 PHE A 3 8.799 7.139 0.731 1.00 12.34 H ATOM 45 HE2 PHE A 3 5.949 9.946 2.207 1.00 71.14 H ATOM 46 HZ PHE A 3 8.277 9.162 2.036 1.00 24.24 H ATOM 47 N ALA A 4 2.733 5.108 1.981 1.00 44.33 N ATOM 48 CA ALA A 4 1.476 4.960 2.703 1.00 23.34 C ATOM 49 C ALA A 4 0.520 6.103 2.381 1.00 35.44 C ATOM 50 O ALA A 4 -0.700 5.946 2.460 1.00 43.13 O ATOM 51 CB ALA A 4 1.734 4.891 4.201 1.00 32.44 C ATOM 52 H ALA A 4 3.525 5.429 2.460 1.00 3.21 H ATOM 53 HA ALA A 4 1.024 4.028 2.397 1.00 35.54 H ATOM 54 HB1 ALA A 4 2.739 4.534 4.377 1.00 55.21 H ATOM 55 HB2 ALA A 4 1.620 5.874 4.632 1.00 52.22 H ATOM 56 HB3 ALA A 4 1.027 4.214 4.657 1.00 72.51 H ATOM 57 N LEU A 5 1.079 7.252 2.020 1.00 71.03 N ATOM 58 CA LEU A 5 0.275 8.423 1.686 1.00 32.42 C ATOM 59 C LEU A 5 -0.529 8.186 0.412 1.00 41.04 C ATOM 60 O LEU A 5 -1.735 8.433 0.370 1.00 62.34 O ATOM 61 CB LEU A 5 1.172 9.650 1.517 1.00 54.33 C ATOM 62 CG LEU A 5 1.361 10.520 2.760 1.00 24.42 C ATOM 63 CD1 LEU A 5 2.536 10.020 3.587 1.00 60.33 C ATOM 64 CD2 LEU A 5 1.565 11.976 2.367 1.00 32.41 C ATOM 65 H LEU A 5 2.055 7.316 1.976 1.00 44.04 H ATOM 66 HA LEU A 5 -0.410 8.597 2.502 1.00 14.33 H ATOM 67 HB2 LEU A 5 2.145 9.308 1.201 1.00 20.54 H ATOM 68 HB3 LEU A 5 0.741 10.269 0.742 1.00 61.32 H ATOM 69 HG LEU A 5 0.473 10.459 3.373 1.00 33.23 H ATOM 70 HD11 LEU A 5 3.154 10.856 3.876 1.00 65.23 H ATOM 71 HD12 LEU A 5 3.120 9.326 3.000 1.00 74.11 H ATOM 72 HD13 LEU A 5 2.167 9.521 4.471 1.00 2.02 H ATOM 73 HD21 LEU A 5 1.528 12.595 3.250 1.00 2.44 H ATOM 74 HD22 LEU A 5 0.784 12.276 1.684 1.00 63.35 H ATOM 75 HD23 LEU A 5 2.526 12.088 1.887 1.00 63.20 H ATOM 76 N THR A 6 0.147 7.704 -0.627 1.00 75.21 N ATOM 77 CA THR A 6 -0.504 7.432 -1.903 1.00 12.54 C ATOM 78 C THR A 6 -1.729 6.545 -1.717 1.00 35.22 C ATOM 79 O THR A 6 -2.705 6.651 -2.462 1.00 65.00 O ATOM 80 CB THR A 6 0.461 6.755 -2.893 1.00 24.52 C ATOM 81 OG1 THR A 6 1.533 6.127 -2.180 1.00 43.22 O ATOM 82 CG2 THR A 6 1.025 7.767 -3.878 1.00 40.22 C ATOM 83 H THR A 6 1.106 7.528 -0.532 1.00 32.32 H ATOM 84 HA THR A 6 -0.816 8.376 -2.325 1.00 51.54 H ATOM 85 HB THR A 6 -0.083 6.002 -3.445 1.00 31.32 H ATOM 86 HG1 THR A 6 2.241 6.762 -2.042 1.00 73.23 H ATOM 87 HG21 THR A 6 1.627 7.256 -4.614 1.00 72.13 H ATOM 88 HG22 THR A 6 1.636 8.483 -3.349 1.00 10.32 H ATOM 89 HG23 THR A 6 0.213 8.281 -4.371 1.00 32.24 H ATOM 90 N LEU A 7 -1.674 5.670 -0.719 1.00 35.13 N ATOM 91 CA LEU A 7 -2.781 4.763 -0.434 1.00 53.22 C ATOM 92 C LEU A 7 -4.028 5.539 -0.021 1.00 71.21 C ATOM 93 O LEU A 7 -5.127 5.268 -0.503 1.00 13.04 O ATOM 94 CB LEU A 7 -2.390 3.779 0.670 1.00 43.43 C ATOM 95 CG LEU A 7 -2.665 2.303 0.382 1.00 53.11 C ATOM 96 CD1 LEU A 7 -2.284 1.446 1.579 1.00 63.35 C ATOM 97 CD2 LEU A 7 -4.128 2.095 0.019 1.00 73.41 C ATOM 98 H LEU A 7 -0.871 5.632 -0.159 1.00 72.13 H ATOM 99 HA LEU A 7 -2.998 4.211 -1.337 1.00 1.52 H ATOM 100 HB2 LEU A 7 -1.331 3.889 0.850 1.00 73.12 H ATOM 101 HB3 LEU A 7 -2.935 4.051 1.562 1.00 11.04 H ATOM 102 HG LEU A 7 -2.063 1.988 -0.459 1.00 41.32 H ATOM 103 HD11 LEU A 7 -2.921 1.691 2.415 1.00 64.12 H ATOM 104 HD12 LEU A 7 -1.254 1.635 1.843 1.00 63.42 H ATOM 105 HD13 LEU A 7 -2.405 0.402 1.327 1.00 44.23 H ATOM 106 HD21 LEU A 7 -4.432 1.099 0.306 1.00 11.12 H ATOM 107 HD22 LEU A 7 -4.255 2.217 -1.047 1.00 32.14 H ATOM 108 HD23 LEU A 7 -4.735 2.821 0.539 1.00 13.53 H ATOM 109 N ASN A 8 -3.848 6.506 0.873 1.00 70.13 N ATOM 110 CA ASN A 8 -4.958 7.322 1.349 1.00 14.45 C ATOM 111 C ASN A 8 -5.583 8.113 0.204 1.00 11.31 C ATOM 112 O ASN A 8 -6.783 8.011 -0.054 1.00 71.41 O ATOM 113 CB ASN A 8 -4.482 8.279 2.444 1.00 20.04 C ATOM 114 CG ASN A 8 -4.543 7.654 3.825 1.00 62.02 C ATOM 115 OD1 ASN A 8 -5.312 6.723 4.063 1.00 22.43 O ATOM 116 ND2 ASN A 8 -3.730 8.165 4.742 1.00 50.50 N ATOM 117 H ASN A 8 -2.947 6.674 1.220 1.00 14.52 H ATOM 118 HA ASN A 8 -5.704 6.659 1.762 1.00 3.53 H ATOM 119 HB2 ASN A 8 -3.459 8.564 2.245 1.00 53.34 H ATOM 120 HB3 ASN A 8 -5.105 9.161 2.440 1.00 22.23 H ATOM 121 HD21 ASN A 8 -3.145 8.907 4.481 1.00 63.04 H ATOM 122 HD22 ASN A 8 -3.748 7.780 5.643 1.00 73.13 H ATOM 123 N LEU A 9 -4.762 8.902 -0.480 1.00 24.10 N ATOM 124 CA LEU A 9 -5.233 9.711 -1.599 1.00 65.41 C ATOM 125 C LEU A 9 -5.971 8.851 -2.620 1.00 31.54 C ATOM 126 O LEU A 9 -7.067 9.196 -3.061 1.00 13.53 O ATOM 127 CB LEU A 9 -4.056 10.422 -2.270 1.00 73.25 C ATOM 128 CG LEU A 9 -4.416 11.426 -3.366 1.00 10.21 C ATOM 129 CD1 LEU A 9 -5.233 12.573 -2.791 1.00 72.13 C ATOM 130 CD2 LEU A 9 -3.158 11.952 -4.042 1.00 21.43 C ATOM 131 H LEU A 9 -3.816 8.942 -0.228 1.00 21.05 H ATOM 132 HA LEU A 9 -5.915 10.451 -1.209 1.00 30.22 H ATOM 133 HB2 LEU A 9 -3.509 10.950 -1.505 1.00 62.20 H ATOM 134 HB3 LEU A 9 -3.421 9.666 -2.709 1.00 65.20 H ATOM 135 HG LEU A 9 -5.018 10.931 -4.116 1.00 2.32 H ATOM 136 HD11 LEU A 9 -4.853 13.510 -3.168 1.00 43.11 H ATOM 137 HD12 LEU A 9 -5.161 12.562 -1.714 1.00 22.12 H ATOM 138 HD13 LEU A 9 -6.267 12.460 -3.083 1.00 70.33 H ATOM 139 HD21 LEU A 9 -2.662 12.651 -3.386 1.00 13.35 H ATOM 140 HD22 LEU A 9 -3.425 12.448 -4.963 1.00 14.33 H ATOM 141 HD23 LEU A 9 -2.494 11.127 -4.258 1.00 31.25 H ATOM 142 N TYR A 10 -5.365 7.728 -2.989 1.00 24.02 N ATOM 143 CA TYR A 10 -5.964 6.818 -3.957 1.00 54.15 C ATOM 144 C TYR A 10 -7.311 6.303 -3.459 1.00 72.34 C ATOM 145 O TYR A 10 -8.310 6.352 -4.177 1.00 21.23 O ATOM 146 CB TYR A 10 -5.026 5.642 -4.233 1.00 40.00 C ATOM 147 CG TYR A 10 -5.492 4.747 -5.359 1.00 22.53 C ATOM 148 CD1 TYR A 10 -5.209 5.058 -6.683 1.00 0.40 C ATOM 149 CD2 TYR A 10 -6.215 3.589 -5.099 1.00 15.45 C ATOM 150 CE1 TYR A 10 -5.633 4.244 -7.715 1.00 31.41 C ATOM 151 CE2 TYR A 10 -6.642 2.768 -6.124 1.00 13.11 C ATOM 152 CZ TYR A 10 -6.349 3.099 -7.430 1.00 41.53 C ATOM 153 OH TYR A 10 -6.774 2.285 -8.455 1.00 25.33 O ATOM 154 H TYR A 10 -4.492 7.506 -2.602 1.00 42.32 H ATOM 155 HA TYR A 10 -6.119 7.366 -4.876 1.00 25.33 H ATOM 156 HB2 TYR A 10 -4.051 6.022 -4.495 1.00 4.24 H ATOM 157 HB3 TYR A 10 -4.945 5.039 -3.341 1.00 25.33 H ATOM 158 HD1 TYR A 10 -4.648 5.955 -6.903 1.00 10.22 H ATOM 159 HD2 TYR A 10 -6.444 3.333 -4.074 1.00 41.10 H ATOM 160 HE1 TYR A 10 -5.403 4.502 -8.738 1.00 54.51 H ATOM 161 HE2 TYR A 10 -7.203 1.872 -5.901 1.00 52.43 H ATOM 162 HH TYR A 10 -7.369 2.774 -9.027 1.00 45.53 H ATOM 163 N GLN A 11 -7.329 5.809 -2.225 1.00 41.53 N ATOM 164 CA GLN A 11 -8.552 5.285 -1.630 1.00 74.24 C ATOM 165 C GLN A 11 -9.660 6.333 -1.650 1.00 31.11 C ATOM 166 O GLN A 11 -10.796 6.045 -2.027 1.00 60.55 O ATOM 167 CB GLN A 11 -8.291 4.828 -0.194 1.00 11.51 C ATOM 168 CG GLN A 11 -9.471 4.111 0.441 1.00 74.23 C ATOM 169 CD GLN A 11 -9.606 4.406 1.922 1.00 71.24 C ATOM 170 OE1 GLN A 11 -9.262 3.578 2.765 1.00 23.42 O ATOM 171 NE2 GLN A 11 -10.109 5.591 2.246 1.00 52.10 N ATOM 172 H GLN A 11 -6.500 5.798 -1.703 1.00 73.33 H ATOM 173 HA GLN A 11 -8.868 4.435 -2.216 1.00 63.05 H ATOM 174 HB2 GLN A 11 -7.445 4.158 -0.190 1.00 61.21 H ATOM 175 HB3 GLN A 11 -8.057 5.694 0.409 1.00 34.50 H ATOM 176 HG2 GLN A 11 -10.377 4.425 -0.057 1.00 31.24 H ATOM 177 HG3 GLN A 11 -9.341 3.047 0.311 1.00 71.44 H ATOM 178 HE21 GLN A 11 -10.363 6.200 1.520 1.00 31.04 H ATOM 179 HE22 GLN A 11 -10.208 5.808 3.196 1.00 72.24 H ATOM 180 N LYS A 12 -9.323 7.551 -1.240 1.00 64.13 N ATOM 181 CA LYS A 12 -10.288 8.644 -1.211 1.00 65.31 C ATOM 182 C LYS A 12 -10.815 8.941 -2.611 1.00 34.11 C ATOM 183 O LYS A 12 -12.025 8.959 -2.838 1.00 35.43 O ATOM 184 CB LYS A 12 -9.647 9.901 -0.618 1.00 74.03 C ATOM 185 CG LYS A 12 -10.626 11.045 -0.417 1.00 72.12 C ATOM 186 CD LYS A 12 -10.039 12.369 -0.878 1.00 73.50 C ATOM 187 CE LYS A 12 -10.141 12.528 -2.387 1.00 62.02 C ATOM 188 NZ LYS A 12 -10.799 13.809 -2.767 1.00 33.44 N ATOM 189 H LYS A 12 -8.401 7.719 -0.951 1.00 42.41 H ATOM 190 HA LYS A 12 -11.113 8.341 -0.585 1.00 21.21 H ATOM 191 HB2 LYS A 12 -9.214 9.653 0.339 1.00 34.45 H ATOM 192 HB3 LYS A 12 -8.864 10.238 -1.281 1.00 44.14 H ATOM 193 HG2 LYS A 12 -11.523 10.844 -0.985 1.00 24.10 H ATOM 194 HG3 LYS A 12 -10.871 11.116 0.633 1.00 15.20 H ATOM 195 HD2 LYS A 12 -10.579 13.176 -0.405 1.00 64.22 H ATOM 196 HD3 LYS A 12 -8.999 12.411 -0.589 1.00 65.23 H ATOM 197 HE2 LYS A 12 -9.146 12.507 -2.806 1.00 75.40 H ATOM 198 HE3 LYS A 12 -10.717 11.705 -2.785 1.00 4.21 H ATOM 199 HZ1 LYS A 12 -10.449 14.582 -2.167 1.00 2.31 H ATOM 200 HZ2 LYS A 12 -11.829 13.730 -2.646 1.00 35.31 H ATOM 201 HZ3 LYS A 12 -10.595 14.035 -3.761 1.00 22.32 H ATOM 202 N TYR A 13 -9.901 9.172 -3.546 1.00 50.22 N ATOM 203 CA TYR A 13 -10.275 9.469 -4.924 1.00 1.52 C ATOM 204 C TYR A 13 -11.143 8.358 -5.505 1.00 33.44 C ATOM 205 O TYR A 13 -12.096 8.619 -6.238 1.00 14.15 O ATOM 206 CB TYR A 13 -9.025 9.657 -5.785 1.00 4.55 C ATOM 207 CG TYR A 13 -8.881 11.054 -6.346 1.00 64.24 C ATOM 208 CD1 TYR A 13 -8.390 12.092 -5.563 1.00 63.55 C ATOM 209 CD2 TYR A 13 -9.236 11.336 -7.660 1.00 33.25 C ATOM 210 CE1 TYR A 13 -8.257 13.369 -6.072 1.00 50.12 C ATOM 211 CE2 TYR A 13 -9.106 12.610 -8.177 1.00 64.11 C ATOM 212 CZ TYR A 13 -8.616 13.623 -7.380 1.00 2.14 C ATOM 213 OH TYR A 13 -8.485 14.894 -7.891 1.00 35.00 O ATOM 214 H TYR A 13 -8.952 9.144 -3.304 1.00 42.25 H ATOM 215 HA TYR A 13 -10.841 10.389 -4.923 1.00 1.53 H ATOM 216 HB2 TYR A 13 -8.150 9.449 -5.188 1.00 12.35 H ATOM 217 HB3 TYR A 13 -9.060 8.967 -6.615 1.00 14.52 H ATOM 218 HD1 TYR A 13 -8.109 11.889 -4.540 1.00 14.43 H ATOM 219 HD2 TYR A 13 -9.620 10.540 -8.281 1.00 71.23 H ATOM 220 HE1 TYR A 13 -7.873 14.163 -5.448 1.00 72.22 H ATOM 221 HE2 TYR A 13 -9.387 12.809 -9.201 1.00 0.24 H ATOM 222 HH TYR A 13 -8.156 14.844 -8.791 1.00 44.13 H ATOM 223 N GLU A 14 -10.806 7.116 -5.170 1.00 43.11 N ATOM 224 CA GLU A 14 -11.554 5.964 -5.658 1.00 72.23 C ATOM 225 C GLU A 14 -12.904 5.854 -4.955 1.00 1.01 C ATOM 226 O GLU A 14 -13.872 5.345 -5.520 1.00 31.42 O ATOM 227 CB GLU A 14 -10.751 4.679 -5.447 1.00 64.10 C ATOM 228 CG GLU A 14 -11.126 3.562 -6.406 1.00 61.30 C ATOM 229 CD GLU A 14 -10.740 2.191 -5.885 1.00 3.12 C ATOM 230 OE1 GLU A 14 -9.586 2.033 -5.433 1.00 33.55 O ATOM 231 OE2 GLU A 14 -11.590 1.278 -5.929 1.00 63.42 O ATOM 232 H GLU A 14 -10.035 6.972 -4.582 1.00 33.20 H ATOM 233 HA GLU A 14 -11.723 6.102 -6.715 1.00 71.25 H ATOM 234 HB2 GLU A 14 -9.701 4.899 -5.576 1.00 52.41 H ATOM 235 HB3 GLU A 14 -10.914 4.329 -4.438 1.00 61.24 H ATOM 236 HG2 GLU A 14 -12.194 3.582 -6.562 1.00 50.33 H ATOM 237 HG3 GLU A 14 -10.622 3.728 -7.347 1.00 34.10 H ATOM 238 N LYS A 15 -12.960 6.335 -3.718 1.00 14.14 N ATOM 239 CA LYS A 15 -14.190 6.293 -2.935 1.00 70.11 C ATOM 240 C LYS A 15 -15.223 7.268 -3.491 1.00 45.41 C ATOM 241 O LYS A 15 -16.313 6.868 -3.901 1.00 64.53 O ATOM 242 CB LYS A 15 -13.898 6.623 -1.470 1.00 1.23 C ATOM 243 CG LYS A 15 -14.068 5.439 -0.534 1.00 4.02 C ATOM 244 CD LYS A 15 -15.533 5.168 -0.238 1.00 31.32 C ATOM 245 CE LYS A 15 -15.712 4.476 1.105 1.00 63.32 C ATOM 246 NZ LYS A 15 -17.097 4.631 1.629 1.00 2.20 N ATOM 247 H LYS A 15 -12.155 6.729 -3.321 1.00 41.51 H ATOM 248 HA LYS A 15 -14.589 5.292 -2.997 1.00 65.41 H ATOM 249 HB2 LYS A 15 -12.881 6.977 -1.389 1.00 24.33 H ATOM 250 HB3 LYS A 15 -14.569 7.407 -1.149 1.00 41.33 H ATOM 251 HG2 LYS A 15 -13.636 4.563 -0.995 1.00 34.35 H ATOM 252 HG3 LYS A 15 -13.555 5.649 0.394 1.00 11.23 H ATOM 253 HD2 LYS A 15 -16.068 6.106 -0.220 1.00 62.33 H ATOM 254 HD3 LYS A 15 -15.937 4.535 -1.016 1.00 13.33 H ATOM 255 HE2 LYS A 15 -15.497 3.425 0.985 1.00 73.12 H ATOM 256 HE3 LYS A 15 -15.018 4.906 1.812 1.00 42.13 H ATOM 257 HZ1 LYS A 15 -17.071 4.978 2.609 1.00 35.00 H ATOM 258 HZ2 LYS A 15 -17.591 3.716 1.609 1.00 41.11 H ATOM 259 HZ3 LYS A 15 -17.625 5.310 1.046 1.00 55.44 H ATOM 260 N LEU A 16 -14.872 8.550 -3.503 1.00 74.22 N ATOM 261 CA LEU A 16 -15.769 9.583 -4.011 1.00 24.02 C ATOM 262 C LEU A 16 -15.964 9.442 -5.517 1.00 15.11 C ATOM 263 O LEU A 16 -16.953 9.921 -6.073 1.00 73.24 O ATOM 264 CB LEU A 16 -15.215 10.971 -3.685 1.00 1.23 C ATOM 265 CG LEU A 16 -15.301 11.401 -2.220 1.00 23.23 C ATOM 266 CD1 LEU A 16 -14.252 10.678 -1.389 1.00 64.02 C ATOM 267 CD2 LEU A 16 -15.136 12.909 -2.096 1.00 20.54 C ATOM 268 H LEU A 16 -13.991 8.808 -3.163 1.00 42.33 H ATOM 269 HA LEU A 16 -16.724 9.462 -3.523 1.00 31.43 H ATOM 270 HB2 LEU A 16 -14.175 10.989 -3.974 1.00 35.22 H ATOM 271 HB3 LEU A 16 -15.763 11.692 -4.275 1.00 33.14 H ATOM 272 HG LEU A 16 -16.274 11.137 -1.830 1.00 32.40 H ATOM 273 HD11 LEU A 16 -14.558 9.655 -1.233 1.00 72.12 H ATOM 274 HD12 LEU A 16 -14.146 11.172 -0.435 1.00 24.45 H ATOM 275 HD13 LEU A 16 -13.305 10.696 -1.910 1.00 74.31 H ATOM 276 HD21 LEU A 16 -15.778 13.401 -2.811 1.00 24.20 H ATOM 277 HD22 LEU A 16 -14.108 13.175 -2.290 1.00 64.04 H ATOM 278 HD23 LEU A 16 -15.405 13.219 -1.096 1.00 62.21 H ATOM 279 N THR A 17 -15.016 8.780 -6.173 1.00 33.35 N ATOM 280 CA THR A 17 -15.085 8.574 -7.614 1.00 3.32 C ATOM 281 C THR A 17 -15.004 9.900 -8.362 1.00 71.34 C ATOM 282 O THR A 17 -15.436 10.002 -9.510 1.00 45.23 O ATOM 283 CB THR A 17 -16.382 7.848 -8.017 1.00 1.22 C ATOM 284 OG1 THR A 17 -16.730 6.878 -7.022 1.00 42.43 O ATOM 285 CG2 THR A 17 -16.222 7.164 -9.366 1.00 31.41 C ATOM 286 H THR A 17 -14.253 8.422 -5.674 1.00 23.25 H ATOM 287 HA THR A 17 -14.247 7.957 -7.903 1.00 25.12 H ATOM 288 HB THR A 17 -17.176 8.577 -8.091 1.00 53.15 H ATOM 289 HG1 THR A 17 -17.656 6.977 -6.789 1.00 52.03 H ATOM 290 HG21 THR A 17 -15.276 6.645 -9.396 1.00 44.41 H ATOM 291 HG22 THR A 17 -16.252 7.904 -10.151 1.00 42.23 H ATOM 292 HG23 THR A 17 -17.025 6.456 -9.508 1.00 31.34 H ATOM 293 N ALA A 18 -14.448 10.912 -7.705 1.00 52.43 N ATOM 294 CA ALA A 18 -14.309 12.231 -8.310 1.00 44.05 C ATOM 295 C ALA A 18 -15.639 12.720 -8.873 1.00 2.50 C ATOM 296 O ALA A 18 -15.848 13.923 -9.040 1.00 33.31 O ATOM 297 CB ALA A 18 -13.250 12.201 -9.403 1.00 73.12 C ATOM 298 H ALA A 18 -14.123 10.769 -6.792 1.00 60.43 H ATOM 299 HA ALA A 18 -13.979 12.917 -7.543 1.00 53.23 H ATOM 300 HB1 ALA A 18 -13.205 11.210 -9.832 1.00 51.30 H ATOM 301 HB2 ALA A 18 -13.506 12.915 -10.172 1.00 12.04 H ATOM 302 HB3 ALA A 18 -12.290 12.455 -8.981 1.00 23.34 H TER 303 ALA A 18 ENDMDL MODEL 13 ATOM 1 N VAL A 1 3.387 -0.741 -3.352 1.00 53.53 N ATOM 2 CA VAL A 1 3.656 0.648 -3.000 1.00 5.25 C ATOM 3 C VAL A 1 4.587 0.738 -1.795 1.00 51.42 C ATOM 4 O VAL A 1 4.715 -0.212 -1.024 1.00 72.13 O ATOM 5 CB VAL A 1 2.355 1.411 -2.687 1.00 62.04 C ATOM 6 CG1 VAL A 1 1.494 1.530 -3.935 1.00 55.21 C ATOM 7 CG2 VAL A 1 1.591 0.724 -1.566 1.00 24.24 C ATOM 8 H1 VAL A 1 2.625 -0.947 -3.934 1.00 3.41 H ATOM 9 HA VAL A 1 4.132 1.122 -3.846 1.00 62.52 H ATOM 10 HB VAL A 1 2.615 2.407 -2.360 1.00 23.10 H ATOM 11 HG11 VAL A 1 0.975 2.478 -3.925 1.00 22.20 H ATOM 12 HG12 VAL A 1 2.120 1.470 -4.813 1.00 2.41 H ATOM 13 HG13 VAL A 1 0.772 0.727 -3.952 1.00 70.50 H ATOM 14 HG21 VAL A 1 1.084 -0.146 -1.955 1.00 23.30 H ATOM 15 HG22 VAL A 1 2.282 0.423 -0.792 1.00 65.45 H ATOM 16 HG23 VAL A 1 0.865 1.408 -1.152 1.00 10.41 H ATOM 17 N ALA A 2 5.235 1.888 -1.640 1.00 14.53 N ATOM 18 CA ALA A 2 6.152 2.104 -0.528 1.00 13.34 C ATOM 19 C ALA A 2 5.769 3.349 0.266 1.00 33.44 C ATOM 20 O ALA A 2 6.624 4.006 0.861 1.00 73.34 O ATOM 21 CB ALA A 2 7.581 2.220 -1.037 1.00 12.01 C ATOM 22 H ALA A 2 5.091 2.609 -2.288 1.00 11.34 H ATOM 23 HA ALA A 2 6.096 1.243 0.123 1.00 41.21 H ATOM 24 HB1 ALA A 2 7.622 2.956 -1.827 1.00 71.41 H ATOM 25 HB2 ALA A 2 8.228 2.524 -0.228 1.00 33.05 H ATOM 26 HB3 ALA A 2 7.905 1.263 -1.418 1.00 43.40 H ATOM 27 N PHE A 3 4.479 3.667 0.272 1.00 54.52 N ATOM 28 CA PHE A 3 3.983 4.835 0.992 1.00 74.34 C ATOM 29 C PHE A 3 2.540 4.623 1.443 1.00 64.01 C ATOM 30 O PHE A 3 1.752 3.977 0.754 1.00 73.22 O ATOM 31 CB PHE A 3 4.075 6.082 0.110 1.00 61.53 C ATOM 32 CG PHE A 3 5.443 6.701 0.089 1.00 63.11 C ATOM 33 CD1 PHE A 3 5.905 7.430 1.173 1.00 31.43 C ATOM 34 CD2 PHE A 3 6.268 6.554 -1.015 1.00 1.03 C ATOM 35 CE1 PHE A 3 7.163 8.001 1.156 1.00 1.12 C ATOM 36 CE2 PHE A 3 7.528 7.123 -1.037 1.00 74.03 C ATOM 37 CZ PHE A 3 7.976 7.847 0.050 1.00 31.42 C ATOM 38 H PHE A 3 3.845 3.104 -0.221 1.00 0.41 H ATOM 39 HA PHE A 3 4.603 4.974 1.863 1.00 22.23 H ATOM 40 HB2 PHE A 3 3.816 5.817 -0.904 1.00 61.43 H ATOM 41 HB3 PHE A 3 3.379 6.823 0.473 1.00 63.32 H ATOM 42 HD1 PHE A 3 5.271 7.550 2.039 1.00 0.44 H ATOM 43 HD2 PHE A 3 5.918 5.987 -1.866 1.00 41.54 H ATOM 44 HE1 PHE A 3 7.512 8.566 2.008 1.00 55.21 H ATOM 45 HE2 PHE A 3 8.160 7.000 -1.904 1.00 3.12 H ATOM 46 HZ PHE A 3 8.959 8.293 0.034 1.00 22.54 H ATOM 47 N ALA A 4 2.204 5.172 2.605 1.00 11.04 N ATOM 48 CA ALA A 4 0.857 5.045 3.149 1.00 43.23 C ATOM 49 C ALA A 4 -0.043 6.173 2.654 1.00 24.34 C ATOM 50 O ALA A 4 -1.238 5.975 2.434 1.00 52.15 O ATOM 51 CB ALA A 4 0.901 5.031 4.670 1.00 60.54 C ATOM 52 H ALA A 4 2.877 5.676 3.109 1.00 71.52 H ATOM 53 HA ALA A 4 0.450 4.101 2.816 1.00 45.14 H ATOM 54 HB1 ALA A 4 0.514 5.965 5.049 1.00 40.21 H ATOM 55 HB2 ALA A 4 0.298 4.214 5.039 1.00 43.41 H ATOM 56 HB3 ALA A 4 1.921 4.903 4.999 1.00 63.02 H ATOM 57 N LEU A 5 0.538 7.355 2.483 1.00 23.02 N ATOM 58 CA LEU A 5 -0.212 8.515 2.015 1.00 2.42 C ATOM 59 C LEU A 5 -0.922 8.211 0.700 1.00 65.32 C ATOM 60 O LEU A 5 -2.124 8.437 0.563 1.00 34.23 O ATOM 61 CB LEU A 5 0.722 9.714 1.838 1.00 24.31 C ATOM 62 CG LEU A 5 0.045 11.065 1.608 1.00 34.04 C ATOM 63 CD1 LEU A 5 0.764 12.161 2.379 1.00 30.24 C ATOM 64 CD2 LEU A 5 0.002 11.395 0.123 1.00 23.25 C ATOM 65 H LEU A 5 1.494 7.451 2.676 1.00 50.04 H ATOM 66 HA LEU A 5 -0.953 8.754 2.763 1.00 1.42 H ATOM 67 HB2 LEU A 5 1.328 9.795 2.728 1.00 61.25 H ATOM 68 HB3 LEU A 5 1.359 9.513 0.988 1.00 20.21 H ATOM 69 HG LEU A 5 -0.973 11.016 1.970 1.00 12.22 H ATOM 70 HD11 LEU A 5 0.751 13.074 1.804 1.00 71.22 H ATOM 71 HD12 LEU A 5 1.786 11.863 2.559 1.00 64.11 H ATOM 72 HD13 LEU A 5 0.266 12.323 3.324 1.00 35.31 H ATOM 73 HD21 LEU A 5 0.981 11.242 -0.307 1.00 54.12 H ATOM 74 HD22 LEU A 5 -0.292 12.426 -0.008 1.00 33.45 H ATOM 75 HD23 LEU A 5 -0.713 10.751 -0.368 1.00 21.00 H ATOM 76 N THR A 6 -0.169 7.694 -0.267 1.00 32.22 N ATOM 77 CA THR A 6 -0.726 7.357 -1.571 1.00 22.21 C ATOM 78 C THR A 6 -1.941 6.448 -1.432 1.00 34.44 C ATOM 79 O THR A 6 -2.860 6.492 -2.251 1.00 11.32 O ATOM 80 CB THR A 6 0.319 6.664 -2.466 1.00 3.03 C ATOM 81 OG1 THR A 6 -0.272 6.299 -3.718 1.00 13.43 O ATOM 82 CG2 THR A 6 0.879 5.425 -1.784 1.00 25.02 C ATOM 83 H THR A 6 0.783 7.537 -0.097 1.00 61.25 H ATOM 84 HA THR A 6 -1.029 8.276 -2.052 1.00 25.41 H ATOM 85 HB THR A 6 1.130 7.355 -2.647 1.00 23.10 H ATOM 86 HG1 THR A 6 -0.321 7.072 -4.286 1.00 64.01 H ATOM 87 HG21 THR A 6 0.548 4.543 -2.311 1.00 40.44 H ATOM 88 HG22 THR A 6 0.529 5.386 -0.763 1.00 11.20 H ATOM 89 HG23 THR A 6 1.958 5.466 -1.793 1.00 25.11 H ATOM 90 N LEU A 7 -1.942 5.624 -0.390 1.00 24.34 N ATOM 91 CA LEU A 7 -3.046 4.703 -0.142 1.00 51.32 C ATOM 92 C LEU A 7 -4.320 5.464 0.213 1.00 4.03 C ATOM 93 O LEU A 7 -5.352 5.302 -0.435 1.00 74.10 O ATOM 94 CB LEU A 7 -2.686 3.734 0.985 1.00 3.43 C ATOM 95 CG LEU A 7 -2.850 2.247 0.670 1.00 3.23 C ATOM 96 CD1 LEU A 7 -4.282 1.943 0.260 1.00 52.20 C ATOM 97 CD2 LEU A 7 -1.879 1.823 -0.422 1.00 42.21 C ATOM 98 H LEU A 7 -1.182 5.634 0.229 1.00 62.44 H ATOM 99 HA LEU A 7 -3.218 4.141 -1.048 1.00 0.11 H ATOM 100 HB2 LEU A 7 -1.653 3.904 1.250 1.00 54.32 H ATOM 101 HB3 LEU A 7 -3.315 3.966 1.833 1.00 74.42 H ATOM 102 HG LEU A 7 -2.628 1.671 1.558 1.00 31.01 H ATOM 103 HD11 LEU A 7 -4.550 2.553 -0.589 1.00 74.14 H ATOM 104 HD12 LEU A 7 -4.946 2.161 1.083 1.00 33.34 H ATOM 105 HD13 LEU A 7 -4.367 0.899 -0.004 1.00 50.22 H ATOM 106 HD21 LEU A 7 -1.684 0.764 -0.340 1.00 12.35 H ATOM 107 HD22 LEU A 7 -0.953 2.369 -0.312 1.00 55.33 H ATOM 108 HD23 LEU A 7 -2.310 2.037 -1.390 1.00 21.45 H ATOM 109 N ASN A 8 -4.237 6.296 1.246 1.00 2.14 N ATOM 110 CA ASN A 8 -5.382 7.084 1.687 1.00 35.41 C ATOM 111 C ASN A 8 -5.863 8.014 0.577 1.00 24.31 C ATOM 112 O ASN A 8 -7.064 8.220 0.401 1.00 31.20 O ATOM 113 CB ASN A 8 -5.019 7.899 2.930 1.00 54.12 C ATOM 114 CG ASN A 8 -6.162 7.977 3.924 1.00 3.12 C ATOM 115 OD1 ASN A 8 -6.317 7.104 4.778 1.00 23.11 O ATOM 116 ND2 ASN A 8 -6.968 9.026 3.817 1.00 15.42 N ATOM 117 H ASN A 8 -3.386 6.382 1.724 1.00 5.42 H ATOM 118 HA ASN A 8 -6.179 6.399 1.937 1.00 61.11 H ATOM 119 HB2 ASN A 8 -4.173 7.440 3.419 1.00 4.32 H ATOM 120 HB3 ASN A 8 -4.757 8.903 2.631 1.00 70.22 H ATOM 121 HD21 ASN A 8 -6.784 9.682 3.113 1.00 53.53 H ATOM 122 HD22 ASN A 8 -7.715 9.102 4.448 1.00 42.12 H ATOM 123 N LEU A 9 -4.916 8.572 -0.169 1.00 54.53 N ATOM 124 CA LEU A 9 -5.242 9.481 -1.264 1.00 21.44 C ATOM 125 C LEU A 9 -5.977 8.746 -2.381 1.00 4.35 C ATOM 126 O LEU A 9 -7.004 9.213 -2.873 1.00 42.13 O ATOM 127 CB LEU A 9 -3.968 10.125 -1.813 1.00 53.44 C ATOM 128 CG LEU A 9 -4.131 10.951 -3.090 1.00 12.20 C ATOM 129 CD1 LEU A 9 -4.975 12.187 -2.822 1.00 13.52 C ATOM 130 CD2 LEU A 9 -2.771 11.343 -3.649 1.00 72.31 C ATOM 131 H LEU A 9 -3.977 8.370 0.019 1.00 44.32 H ATOM 132 HA LEU A 9 -5.887 10.253 -0.872 1.00 43.32 H ATOM 133 HB2 LEU A 9 -3.570 10.774 -1.049 1.00 3.22 H ATOM 134 HB3 LEU A 9 -3.260 9.335 -2.018 1.00 31.24 H ATOM 135 HG LEU A 9 -4.641 10.355 -3.834 1.00 62.14 H ATOM 136 HD11 LEU A 9 -5.966 12.041 -3.223 1.00 73.35 H ATOM 137 HD12 LEU A 9 -4.518 13.044 -3.294 1.00 55.53 H ATOM 138 HD13 LEU A 9 -5.039 12.356 -1.757 1.00 21.44 H ATOM 139 HD21 LEU A 9 -2.341 10.501 -4.171 1.00 3.01 H ATOM 140 HD22 LEU A 9 -2.120 11.636 -2.839 1.00 32.33 H ATOM 141 HD23 LEU A 9 -2.888 12.170 -4.334 1.00 12.32 H ATOM 142 N TYR A 10 -5.445 7.594 -2.774 1.00 2.34 N ATOM 143 CA TYR A 10 -6.050 6.795 -3.832 1.00 62.04 C ATOM 144 C TYR A 10 -7.422 6.279 -3.409 1.00 42.12 C ATOM 145 O TYR A 10 -8.388 6.362 -4.167 1.00 30.31 O ATOM 146 CB TYR A 10 -5.141 5.620 -4.196 1.00 24.22 C ATOM 147 CG TYR A 10 -5.583 4.872 -5.433 1.00 72.02 C ATOM 148 CD1 TYR A 10 -5.897 5.551 -6.604 1.00 42.21 C ATOM 149 CD2 TYR A 10 -5.689 3.487 -5.431 1.00 64.33 C ATOM 150 CE1 TYR A 10 -6.302 4.872 -7.737 1.00 13.40 C ATOM 151 CE2 TYR A 10 -6.092 2.799 -6.560 1.00 2.52 C ATOM 152 CZ TYR A 10 -6.398 3.497 -7.710 1.00 23.30 C ATOM 153 OH TYR A 10 -6.801 2.816 -8.836 1.00 30.12 O ATOM 154 H TYR A 10 -4.625 7.274 -2.343 1.00 1.22 H ATOM 155 HA TYR A 10 -6.168 7.428 -4.700 1.00 25.13 H ATOM 156 HB2 TYR A 10 -4.141 5.987 -4.371 1.00 14.30 H ATOM 157 HB3 TYR A 10 -5.123 4.920 -3.373 1.00 64.34 H ATOM 158 HD1 TYR A 10 -5.821 6.629 -6.622 1.00 71.12 H ATOM 159 HD2 TYR A 10 -5.449 2.944 -4.529 1.00 23.35 H ATOM 160 HE1 TYR A 10 -6.542 5.418 -8.638 1.00 23.20 H ATOM 161 HE2 TYR A 10 -6.167 1.722 -6.539 1.00 11.32 H ATOM 162 HH TYR A 10 -6.473 3.267 -9.617 1.00 64.01 H ATOM 163 N GLN A 11 -7.498 5.748 -2.193 1.00 63.43 N ATOM 164 CA GLN A 11 -8.751 5.218 -1.668 1.00 43.15 C ATOM 165 C GLN A 11 -9.818 6.306 -1.605 1.00 44.14 C ATOM 166 O GLN A 11 -10.951 6.105 -2.041 1.00 53.24 O ATOM 167 CB GLN A 11 -8.533 4.619 -0.278 1.00 11.42 C ATOM 168 CG GLN A 11 -9.479 3.474 0.046 1.00 25.12 C ATOM 169 CD GLN A 11 -9.115 2.194 -0.680 1.00 60.12 C ATOM 170 OE1 GLN A 11 -8.057 2.099 -1.304 1.00 14.33 O ATOM 171 NE2 GLN A 11 -9.992 1.200 -0.603 1.00 61.33 N ATOM 172 H GLN A 11 -6.693 5.710 -1.637 1.00 4.41 H ATOM 173 HA GLN A 11 -9.087 4.440 -2.337 1.00 32.14 H ATOM 174 HB2 GLN A 11 -7.520 4.252 -0.212 1.00 31.34 H ATOM 175 HB3 GLN A 11 -8.675 5.394 0.461 1.00 54.31 H ATOM 176 HG2 GLN A 11 -9.447 3.287 1.109 1.00 4.24 H ATOM 177 HG3 GLN A 11 -10.480 3.760 -0.238 1.00 14.00 H ATOM 178 HE21 GLN A 11 -10.814 1.347 -0.090 1.00 12.12 H ATOM 179 HE22 GLN A 11 -9.783 0.361 -1.064 1.00 1.50 H ATOM 180 N LYS A 12 -9.448 7.460 -1.059 1.00 65.44 N ATOM 181 CA LYS A 12 -10.372 8.581 -0.939 1.00 44.14 C ATOM 182 C LYS A 12 -10.869 9.025 -2.311 1.00 50.41 C ATOM 183 O LYS A 12 -12.073 9.149 -2.535 1.00 54.22 O ATOM 184 CB LYS A 12 -9.693 9.753 -0.227 1.00 13.32 C ATOM 185 CG LYS A 12 -10.623 10.925 0.037 1.00 32.12 C ATOM 186 CD LYS A 12 -9.891 12.252 -0.068 1.00 53.43 C ATOM 187 CE LYS A 12 -9.476 12.547 -1.501 1.00 43.43 C ATOM 188 NZ LYS A 12 -7.995 12.583 -1.653 1.00 42.12 N ATOM 189 H LYS A 12 -8.529 7.559 -0.730 1.00 14.43 H ATOM 190 HA LYS A 12 -11.216 8.254 -0.352 1.00 71.21 H ATOM 191 HB2 LYS A 12 -9.306 9.408 0.720 1.00 24.32 H ATOM 192 HB3 LYS A 12 -8.872 10.103 -0.836 1.00 71.21 H ATOM 193 HG2 LYS A 12 -11.423 10.909 -0.688 1.00 71.31 H ATOM 194 HG3 LYS A 12 -11.035 10.829 1.032 1.00 3.00 H ATOM 195 HD2 LYS A 12 -10.544 13.042 0.275 1.00 64.31 H ATOM 196 HD3 LYS A 12 -9.008 12.217 0.554 1.00 60.14 H ATOM 197 HE2 LYS A 12 -9.876 11.779 -2.144 1.00 74.31 H ATOM 198 HE3 LYS A 12 -9.882 13.506 -1.790 1.00 20.41 H ATOM 199 HZ1 LYS A 12 -7.602 13.395 -1.136 1.00 43.10 H ATOM 200 HZ2 LYS A 12 -7.741 12.670 -2.658 1.00 60.32 H ATOM 201 HZ3 LYS A 12 -7.576 11.709 -1.276 1.00 2.42 H ATOM 202 N TYR A 13 -9.935 9.262 -3.226 1.00 13.54 N ATOM 203 CA TYR A 13 -10.279 9.694 -4.575 1.00 73.23 C ATOM 204 C TYR A 13 -11.188 8.676 -5.257 1.00 72.15 C ATOM 205 O TYR A 13 -12.114 9.042 -5.981 1.00 21.31 O ATOM 206 CB TYR A 13 -9.012 9.900 -5.406 1.00 64.21 C ATOM 207 CG TYR A 13 -9.175 10.909 -6.520 1.00 51.10 C ATOM 208 CD1 TYR A 13 -9.717 10.539 -7.745 1.00 12.22 C ATOM 209 CD2 TYR A 13 -8.787 12.232 -6.348 1.00 64.14 C ATOM 210 CE1 TYR A 13 -9.868 11.458 -8.766 1.00 21.42 C ATOM 211 CE2 TYR A 13 -8.935 13.157 -7.363 1.00 40.32 C ATOM 212 CZ TYR A 13 -9.476 12.765 -8.570 1.00 42.40 C ATOM 213 OH TYR A 13 -9.624 13.684 -9.584 1.00 21.11 O ATOM 214 H TYR A 13 -8.992 9.146 -2.987 1.00 41.33 H ATOM 215 HA TYR A 13 -10.805 10.635 -4.499 1.00 63.50 H ATOM 216 HB2 TYR A 13 -8.219 10.245 -4.761 1.00 25.32 H ATOM 217 HB3 TYR A 13 -8.724 8.958 -5.851 1.00 1.34 H ATOM 218 HD1 TYR A 13 -10.024 9.514 -7.895 1.00 45.02 H ATOM 219 HD2 TYR A 13 -8.363 12.535 -5.402 1.00 1.41 H ATOM 220 HE1 TYR A 13 -10.292 11.151 -9.711 1.00 4.30 H ATOM 221 HE2 TYR A 13 -8.628 14.181 -7.210 1.00 45.33 H ATOM 222 HH TYR A 13 -9.218 13.344 -10.385 1.00 4.52 H ATOM 223 N GLU A 14 -10.916 7.397 -5.020 1.00 61.51 N ATOM 224 CA GLU A 14 -11.709 6.325 -5.612 1.00 3.14 C ATOM 225 C GLU A 14 -13.067 6.212 -4.926 1.00 74.33 C ATOM 226 O GLU A 14 -14.046 5.771 -5.530 1.00 64.22 O ATOM 227 CB GLU A 14 -10.962 4.993 -5.512 1.00 10.24 C ATOM 228 CG GLU A 14 -9.978 4.760 -6.646 1.00 11.42 C ATOM 229 CD GLU A 14 -10.658 4.316 -7.926 1.00 53.32 C ATOM 230 OE1 GLU A 14 -10.906 3.101 -8.075 1.00 41.21 O ATOM 231 OE2 GLU A 14 -10.943 5.183 -8.779 1.00 63.10 O ATOM 232 H GLU A 14 -10.164 7.168 -4.434 1.00 54.03 H ATOM 233 HA GLU A 14 -11.863 6.563 -6.653 1.00 51.01 H ATOM 234 HB2 GLU A 14 -10.418 4.968 -4.579 1.00 42.50 H ATOM 235 HB3 GLU A 14 -11.683 4.189 -5.518 1.00 52.22 H ATOM 236 HG2 GLU A 14 -9.447 5.680 -6.839 1.00 41.21 H ATOM 237 HG3 GLU A 14 -9.276 3.997 -6.345 1.00 62.10 H ATOM 238 N LYS A 15 -13.120 6.612 -3.661 1.00 13.44 N ATOM 239 CA LYS A 15 -14.358 6.557 -2.891 1.00 44.42 C ATOM 240 C LYS A 15 -15.261 7.739 -3.228 1.00 41.33 C ATOM 241 O LYS A 15 -16.487 7.632 -3.175 1.00 62.11 O ATOM 242 CB LYS A 15 -14.050 6.548 -1.392 1.00 51.21 C ATOM 243 CG LYS A 15 -15.206 6.058 -0.537 1.00 63.51 C ATOM 244 CD LYS A 15 -15.096 6.562 0.892 1.00 41.42 C ATOM 245 CE LYS A 15 -13.964 5.876 1.640 1.00 25.20 C ATOM 246 NZ LYS A 15 -13.735 6.484 2.980 1.00 35.42 N ATOM 247 H LYS A 15 -12.307 6.955 -3.233 1.00 64.44 H ATOM 248 HA LYS A 15 -14.869 5.643 -3.151 1.00 13.13 H ATOM 249 HB2 LYS A 15 -13.200 5.906 -1.215 1.00 73.50 H ATOM 250 HB3 LYS A 15 -13.802 7.553 -1.082 1.00 25.13 H ATOM 251 HG2 LYS A 15 -16.133 6.412 -0.963 1.00 4.55 H ATOM 252 HG3 LYS A 15 -15.202 4.977 -0.529 1.00 22.32 H ATOM 253 HD2 LYS A 15 -14.908 7.626 0.876 1.00 75.24 H ATOM 254 HD3 LYS A 15 -16.026 6.367 1.406 1.00 73.20 H ATOM 255 HE2 LYS A 15 -14.212 4.833 1.765 1.00 52.11 H ATOM 256 HE3 LYS A 15 -13.059 5.963 1.056 1.00 72.30 H ATOM 257 HZ1 LYS A 15 -12.885 7.082 2.961 1.00 13.05 H ATOM 258 HZ2 LYS A 15 -13.606 5.737 3.693 1.00 1.52 H ATOM 259 HZ3 LYS A 15 -14.552 7.068 3.251 1.00 21.12 H ATOM 260 N LEU A 16 -14.648 8.866 -3.576 1.00 75.44 N ATOM 261 CA LEU A 16 -15.398 10.068 -3.924 1.00 62.02 C ATOM 262 C LEU A 16 -16.160 9.876 -5.231 1.00 70.43 C ATOM 263 O LEU A 16 -17.142 10.569 -5.499 1.00 1.24 O ATOM 264 CB LEU A 16 -14.453 11.265 -4.043 1.00 42.01 C ATOM 265 CG LEU A 16 -13.891 11.809 -2.729 1.00 45.34 C ATOM 266 CD1 LEU A 16 -12.798 12.832 -3.000 1.00 1.15 C ATOM 267 CD2 LEU A 16 -15.000 12.422 -1.887 1.00 73.52 C ATOM 268 H LEU A 16 -13.670 8.890 -3.601 1.00 5.35 H ATOM 269 HA LEU A 16 -16.107 10.257 -3.132 1.00 71.22 H ATOM 270 HB2 LEU A 16 -13.620 10.968 -4.661 1.00 43.33 H ATOM 271 HB3 LEU A 16 -14.993 12.065 -4.530 1.00 32.35 H ATOM 272 HG LEU A 16 -13.453 10.995 -2.168 1.00 14.34 H ATOM 273 HD11 LEU A 16 -11.847 12.328 -3.087 1.00 53.43 H ATOM 274 HD12 LEU A 16 -12.757 13.539 -2.184 1.00 71.11 H ATOM 275 HD13 LEU A 16 -13.015 13.356 -3.919 1.00 1.10 H ATOM 276 HD21 LEU A 16 -15.731 12.883 -2.535 1.00 20.41 H ATOM 277 HD22 LEU A 16 -14.581 13.167 -1.228 1.00 14.31 H ATOM 278 HD23 LEU A 16 -15.475 11.648 -1.300 1.00 41.34 H ATOM 279 N THR A 17 -15.703 8.927 -6.043 1.00 41.10 N ATOM 280 CA THR A 17 -16.342 8.642 -7.322 1.00 4.14 C ATOM 281 C THR A 17 -16.233 9.832 -8.268 1.00 1.21 C ATOM 282 O THR A 17 -17.018 9.965 -9.206 1.00 15.23 O ATOM 283 CB THR A 17 -17.828 8.280 -7.139 1.00 3.12 C ATOM 284 OG1 THR A 17 -18.067 7.858 -5.792 1.00 0.04 O ATOM 285 CG2 THR A 17 -18.238 7.176 -8.102 1.00 12.51 C ATOM 286 H THR A 17 -14.916 8.408 -5.774 1.00 74.14 H ATOM 287 HA THR A 17 -15.838 7.795 -7.764 1.00 72.15 H ATOM 288 HB THR A 17 -18.424 9.158 -7.345 1.00 31.54 H ATOM 289 HG1 THR A 17 -18.991 7.618 -5.691 1.00 14.13 H ATOM 290 HG21 THR A 17 -19.190 7.423 -8.547 1.00 14.43 H ATOM 291 HG22 THR A 17 -18.323 6.243 -7.565 1.00 53.31 H ATOM 292 HG23 THR A 17 -17.493 7.080 -8.877 1.00 63.41 H ATOM 293 N ALA A 18 -15.254 10.695 -8.016 1.00 62.12 N ATOM 294 CA ALA A 18 -15.041 11.873 -8.848 1.00 21.20 C ATOM 295 C ALA A 18 -16.330 12.671 -9.009 1.00 1.41 C ATOM 296 O ALA A 18 -16.560 13.648 -8.294 1.00 20.41 O ATOM 297 CB ALA A 18 -14.496 11.466 -10.209 1.00 52.12 C ATOM 298 H ALA A 18 -14.660 10.534 -7.254 1.00 2.53 H ATOM 299 HA ALA A 18 -14.302 12.495 -8.363 1.00 71.31 H ATOM 300 HB1 ALA A 18 -15.239 10.882 -10.733 1.00 61.02 H ATOM 301 HB2 ALA A 18 -14.263 12.351 -10.782 1.00 73.05 H ATOM 302 HB3 ALA A 18 -13.602 10.876 -10.077 1.00 44.30 H TER 303 ALA A 18 ENDMDL MODEL 14 ATOM 1 N VAL A 1 2.378 -0.795 -3.578 1.00 41.04 N ATOM 2 CA VAL A 1 2.927 0.532 -3.328 1.00 2.21 C ATOM 3 C VAL A 1 3.801 0.539 -2.079 1.00 21.33 C ATOM 4 O VAL A 1 3.693 -0.345 -1.229 1.00 2.21 O ATOM 5 CB VAL A 1 1.810 1.580 -3.165 1.00 42.20 C ATOM 6 CG1 VAL A 1 1.107 1.822 -4.492 1.00 33.31 C ATOM 7 CG2 VAL A 1 0.818 1.140 -2.099 1.00 25.22 C ATOM 8 H1 VAL A 1 2.907 -1.584 -3.338 1.00 32.14 H ATOM 9 HA VAL A 1 3.531 0.810 -4.180 1.00 1.05 H ATOM 10 HB VAL A 1 2.260 2.509 -2.847 1.00 14.41 H ATOM 11 HG11 VAL A 1 1.309 0.998 -5.161 1.00 42.43 H ATOM 12 HG12 VAL A 1 0.042 1.899 -4.326 1.00 41.44 H ATOM 13 HG13 VAL A 1 1.471 2.739 -4.930 1.00 42.04 H ATOM 14 HG21 VAL A 1 1.211 0.281 -1.574 1.00 54.43 H ATOM 15 HG22 VAL A 1 0.660 1.948 -1.400 1.00 72.23 H ATOM 16 HG23 VAL A 1 -0.120 0.878 -2.566 1.00 13.25 H ATOM 17 N ALA A 2 4.667 1.542 -1.974 1.00 73.40 N ATOM 18 CA ALA A 2 5.558 1.665 -0.827 1.00 70.12 C ATOM 19 C ALA A 2 5.348 2.994 -0.109 1.00 64.14 C ATOM 20 O ALA A 2 6.253 3.503 0.552 1.00 44.20 O ATOM 21 CB ALA A 2 7.007 1.524 -1.268 1.00 25.42 C ATOM 22 H ALA A 2 4.706 2.215 -2.684 1.00 52.33 H ATOM 23 HA ALA A 2 5.335 0.859 -0.143 1.00 61.31 H ATOM 24 HB1 ALA A 2 7.311 2.416 -1.796 1.00 11.13 H ATOM 25 HB2 ALA A 2 7.635 1.387 -0.400 1.00 65.01 H ATOM 26 HB3 ALA A 2 7.103 0.669 -1.920 1.00 63.14 H ATOM 27 N PHE A 3 4.150 3.551 -0.245 1.00 13.53 N ATOM 28 CA PHE A 3 3.822 4.823 0.390 1.00 60.11 C ATOM 29 C PHE A 3 2.531 4.712 1.195 1.00 75.00 C ATOM 30 O PHE A 3 1.600 4.010 0.801 1.00 34.14 O ATOM 31 CB PHE A 3 3.686 5.923 -0.664 1.00 41.35 C ATOM 32 CG PHE A 3 4.987 6.592 -1.004 1.00 3.31 C ATOM 33 CD1 PHE A 3 5.903 5.972 -1.839 1.00 2.44 C ATOM 34 CD2 PHE A 3 5.295 7.841 -0.488 1.00 32.12 C ATOM 35 CE1 PHE A 3 7.101 6.585 -2.153 1.00 44.43 C ATOM 36 CE2 PHE A 3 6.491 8.459 -0.799 1.00 61.13 C ATOM 37 CZ PHE A 3 7.396 7.830 -1.632 1.00 61.10 C ATOM 38 H PHE A 3 3.469 3.097 -0.785 1.00 4.11 H ATOM 39 HA PHE A 3 4.629 5.076 1.060 1.00 62.32 H ATOM 40 HB2 PHE A 3 3.287 5.495 -1.572 1.00 2.42 H ATOM 41 HB3 PHE A 3 3.008 6.680 -0.299 1.00 72.44 H ATOM 42 HD1 PHE A 3 5.674 4.998 -2.247 1.00 15.11 H ATOM 43 HD2 PHE A 3 4.589 8.334 0.164 1.00 32.44 H ATOM 44 HE1 PHE A 3 7.806 6.091 -2.805 1.00 25.43 H ATOM 45 HE2 PHE A 3 6.719 9.432 -0.390 1.00 63.22 H ATOM 46 HZ PHE A 3 8.331 8.311 -1.877 1.00 62.11 H ATOM 47 N ALA A 4 2.483 5.410 2.325 1.00 70.10 N ATOM 48 CA ALA A 4 1.306 5.392 3.185 1.00 24.42 C ATOM 49 C ALA A 4 0.326 6.494 2.798 1.00 70.52 C ATOM 50 O ALA A 4 -0.882 6.364 3.002 1.00 2.24 O ATOM 51 CB ALA A 4 1.716 5.536 4.643 1.00 24.13 C ATOM 52 H ALA A 4 3.257 5.951 2.585 1.00 1.14 H ATOM 53 HA ALA A 4 0.821 4.434 3.066 1.00 31.44 H ATOM 54 HB1 ALA A 4 2.794 5.557 4.713 1.00 44.43 H ATOM 55 HB2 ALA A 4 1.311 6.454 5.042 1.00 62.12 H ATOM 56 HB3 ALA A 4 1.336 4.698 5.208 1.00 13.45 H ATOM 57 N LEU A 5 0.852 7.577 2.238 1.00 3.34 N ATOM 58 CA LEU A 5 0.023 8.703 1.823 1.00 40.24 C ATOM 59 C LEU A 5 -0.739 8.375 0.542 1.00 4.14 C ATOM 60 O LEU A 5 -1.880 8.800 0.359 1.00 31.54 O ATOM 61 CB LEU A 5 0.887 9.948 1.611 1.00 60.41 C ATOM 62 CG LEU A 5 0.171 11.292 1.743 1.00 0.31 C ATOM 63 CD1 LEU A 5 -0.361 11.477 3.156 1.00 51.03 C ATOM 64 CD2 LEU A 5 1.106 12.433 1.370 1.00 41.31 C ATOM 65 H LEU A 5 1.821 7.623 2.101 1.00 22.50 H ATOM 66 HA LEU A 5 -0.689 8.899 2.611 1.00 61.14 H ATOM 67 HB2 LEU A 5 1.684 9.925 2.338 1.00 33.44 H ATOM 68 HB3 LEU A 5 1.308 9.892 0.617 1.00 73.11 H ATOM 69 HG LEU A 5 -0.671 11.313 1.065 1.00 62.04 H ATOM 70 HD11 LEU A 5 -1.248 10.876 3.288 1.00 40.13 H ATOM 71 HD12 LEU A 5 -0.604 12.517 3.316 1.00 42.23 H ATOM 72 HD13 LEU A 5 0.392 11.170 3.867 1.00 52.11 H ATOM 73 HD21 LEU A 5 0.532 13.335 1.221 1.00 13.42 H ATOM 74 HD22 LEU A 5 1.630 12.185 0.459 1.00 41.33 H ATOM 75 HD23 LEU A 5 1.821 12.588 2.165 1.00 31.44 H ATOM 76 N THR A 6 -0.100 7.615 -0.342 1.00 31.54 N ATOM 77 CA THR A 6 -0.717 7.228 -1.604 1.00 50.12 C ATOM 78 C THR A 6 -1.936 6.342 -1.372 1.00 42.52 C ATOM 79 O THR A 6 -2.866 6.325 -2.180 1.00 22.43 O ATOM 80 CB THR A 6 0.280 6.483 -2.512 1.00 32.24 C ATOM 81 OG1 THR A 6 0.979 5.486 -1.757 1.00 54.41 O ATOM 82 CG2 THR A 6 1.278 7.451 -3.129 1.00 75.23 C ATOM 83 H THR A 6 0.808 7.307 -0.139 1.00 0.44 H ATOM 84 HA THR A 6 -1.030 8.129 -2.112 1.00 61.10 H ATOM 85 HB THR A 6 -0.271 6.001 -3.307 1.00 33.14 H ATOM 86 HG1 THR A 6 0.372 5.066 -1.142 1.00 41.53 H ATOM 87 HG21 THR A 6 2.162 6.911 -3.433 1.00 33.23 H ATOM 88 HG22 THR A 6 1.547 8.203 -2.402 1.00 61.34 H ATOM 89 HG23 THR A 6 0.832 7.926 -3.991 1.00 21.32 H ATOM 90 N LEU A 7 -1.926 5.609 -0.265 1.00 11.13 N ATOM 91 CA LEU A 7 -3.032 4.721 0.074 1.00 34.44 C ATOM 92 C LEU A 7 -4.291 5.518 0.400 1.00 12.10 C ATOM 93 O LEU A 7 -5.345 5.303 -0.196 1.00 54.34 O ATOM 94 CB LEU A 7 -2.655 3.834 1.263 1.00 42.34 C ATOM 95 CG LEU A 7 -2.947 2.342 1.106 1.00 21.40 C ATOM 96 CD1 LEU A 7 -2.134 1.756 -0.038 1.00 75.14 C ATOM 97 CD2 LEU A 7 -2.654 1.602 2.403 1.00 34.04 C ATOM 98 H LEU A 7 -1.158 5.666 0.340 1.00 24.31 H ATOM 99 HA LEU A 7 -3.229 4.095 -0.783 1.00 72.41 H ATOM 100 HB2 LEU A 7 -1.596 3.947 1.436 1.00 43.41 H ATOM 101 HB3 LEU A 7 -3.199 4.190 2.126 1.00 52.32 H ATOM 102 HG LEU A 7 -3.994 2.209 0.873 1.00 35.31 H ATOM 103 HD11 LEU A 7 -1.483 2.515 -0.443 1.00 10.50 H ATOM 104 HD12 LEU A 7 -2.802 1.405 -0.811 1.00 53.23 H ATOM 105 HD13 LEU A 7 -1.542 0.930 0.327 1.00 70.31 H ATOM 106 HD21 LEU A 7 -1.699 1.105 2.327 1.00 43.21 H ATOM 107 HD22 LEU A 7 -3.428 0.870 2.582 1.00 70.20 H ATOM 108 HD23 LEU A 7 -2.630 2.307 3.222 1.00 72.11 H ATOM 109 N ASN A 8 -4.172 6.441 1.349 1.00 21.11 N ATOM 110 CA ASN A 8 -5.300 7.272 1.753 1.00 50.30 C ATOM 111 C ASN A 8 -5.807 8.108 0.581 1.00 21.24 C ATOM 112 O ASN A 8 -7.010 8.177 0.329 1.00 75.25 O ATOM 113 CB ASN A 8 -4.897 8.188 2.910 1.00 1.14 C ATOM 114 CG ASN A 8 -5.938 8.220 4.012 1.00 34.02 C ATOM 115 OD1 ASN A 8 -5.853 7.469 4.984 1.00 11.11 O ATOM 116 ND2 ASN A 8 -6.929 9.092 3.865 1.00 41.02 N ATOM 117 H ASN A 8 -3.305 6.566 1.789 1.00 60.32 H ATOM 118 HA ASN A 8 -6.093 6.618 2.083 1.00 64.31 H ATOM 119 HB2 ASN A 8 -3.966 7.837 3.332 1.00 50.13 H ATOM 120 HB3 ASN A 8 -4.763 9.192 2.538 1.00 44.35 H ATOM 121 HD21 ASN A 8 -6.932 9.658 3.065 1.00 55.33 H ATOM 122 HD22 ASN A 8 -7.616 9.134 4.563 1.00 44.23 H ATOM 123 N LEU A 9 -4.881 8.741 -0.131 1.00 32.41 N ATOM 124 CA LEU A 9 -5.233 9.572 -1.277 1.00 73.51 C ATOM 125 C LEU A 9 -5.961 8.754 -2.339 1.00 54.02 C ATOM 126 O LEU A 9 -7.003 9.168 -2.850 1.00 24.31 O ATOM 127 CB LEU A 9 -3.977 10.205 -1.877 1.00 52.44 C ATOM 128 CG LEU A 9 -4.208 11.373 -2.838 1.00 21.31 C ATOM 129 CD1 LEU A 9 -4.114 12.699 -2.099 1.00 61.50 C ATOM 130 CD2 LEU A 9 -3.207 11.326 -3.984 1.00 14.34 C ATOM 131 H LEU A 9 -3.939 8.647 0.119 1.00 44.42 H ATOM 132 HA LEU A 9 -5.891 10.354 -0.929 1.00 43.32 H ATOM 133 HB2 LEU A 9 -3.366 10.563 -1.063 1.00 52.42 H ATOM 134 HB3 LEU A 9 -3.443 9.434 -2.414 1.00 41.42 H ATOM 135 HG LEU A 9 -5.202 11.295 -3.257 1.00 63.41 H ATOM 136 HD11 LEU A 9 -4.112 13.509 -2.812 1.00 63.33 H ATOM 137 HD12 LEU A 9 -3.202 12.725 -1.521 1.00 63.34 H ATOM 138 HD13 LEU A 9 -4.961 12.803 -1.437 1.00 75.34 H ATOM 139 HD21 LEU A 9 -2.237 11.639 -3.627 1.00 73.21 H ATOM 140 HD22 LEU A 9 -3.533 11.989 -4.772 1.00 4.33 H ATOM 141 HD23 LEU A 9 -3.144 10.318 -4.365 1.00 60.53 H ATOM 142 N TYR A 10 -5.408 7.591 -2.666 1.00 12.35 N ATOM 143 CA TYR A 10 -6.005 6.715 -3.667 1.00 3.41 C ATOM 144 C TYR A 10 -7.379 6.230 -3.217 1.00 30.54 C ATOM 145 O TYR A 10 -8.340 6.257 -3.984 1.00 74.53 O ATOM 146 CB TYR A 10 -5.091 5.518 -3.937 1.00 15.32 C ATOM 147 CG TYR A 10 -5.540 4.665 -5.102 1.00 44.52 C ATOM 148 CD1 TYR A 10 -5.710 5.216 -6.366 1.00 44.45 C ATOM 149 CD2 TYR A 10 -5.794 3.309 -4.939 1.00 41.41 C ATOM 150 CE1 TYR A 10 -6.119 4.441 -7.434 1.00 54.41 C ATOM 151 CE2 TYR A 10 -6.203 2.527 -6.001 1.00 64.52 C ATOM 152 CZ TYR A 10 -6.364 3.097 -7.247 1.00 32.04 C ATOM 153 OH TYR A 10 -6.773 2.321 -8.307 1.00 24.21 O ATOM 154 H TYR A 10 -4.578 7.316 -2.224 1.00 20.12 H ATOM 155 HA TYR A 10 -6.117 7.283 -4.579 1.00 71.32 H ATOM 156 HB2 TYR A 10 -4.096 5.875 -4.151 1.00 61.22 H ATOM 157 HB3 TYR A 10 -5.063 4.891 -3.058 1.00 23.01 H ATOM 158 HD1 TYR A 10 -5.517 6.270 -6.510 1.00 70.23 H ATOM 159 HD2 TYR A 10 -5.667 2.866 -3.962 1.00 63.20 H ATOM 160 HE1 TYR A 10 -6.246 4.888 -8.410 1.00 21.54 H ATOM 161 HE2 TYR A 10 -6.395 1.474 -5.855 1.00 22.15 H ATOM 162 HH TYR A 10 -7.711 2.457 -8.460 1.00 64.13 H ATOM 163 N GLN A 11 -7.462 5.786 -1.966 1.00 52.43 N ATOM 164 CA GLN A 11 -8.718 5.294 -1.413 1.00 12.32 C ATOM 165 C GLN A 11 -9.801 6.366 -1.483 1.00 72.14 C ATOM 166 O GLN A 11 -10.928 6.098 -1.901 1.00 12.44 O ATOM 167 CB GLN A 11 -8.521 4.847 0.037 1.00 63.14 C ATOM 168 CG GLN A 11 -7.823 3.503 0.169 1.00 73.43 C ATOM 169 CD GLN A 11 -8.791 2.336 0.126 1.00 41.43 C ATOM 170 OE1 GLN A 11 -9.338 2.007 -0.927 1.00 64.03 O ATOM 171 NE2 GLN A 11 -9.008 1.704 1.273 1.00 3.21 N ATOM 172 H GLN A 11 -6.661 5.790 -1.404 1.00 3.05 H ATOM 173 HA GLN A 11 -9.030 4.446 -2.002 1.00 72.34 H ATOM 174 HB2 GLN A 11 -7.928 5.588 0.552 1.00 14.01 H ATOM 175 HB3 GLN A 11 -9.487 4.775 0.513 1.00 31.34 H ATOM 176 HG2 GLN A 11 -7.119 3.396 -0.643 1.00 22.51 H ATOM 177 HG3 GLN A 11 -7.293 3.478 1.109 1.00 34.34 H ATOM 178 HE21 GLN A 11 -8.538 2.023 2.073 1.00 60.04 H ATOM 179 HE22 GLN A 11 -9.629 0.947 1.274 1.00 10.54 H ATOM 180 N LYS A 12 -9.452 7.580 -1.073 1.00 14.43 N ATOM 181 CA LYS A 12 -10.393 8.694 -1.090 1.00 14.02 C ATOM 182 C LYS A 12 -10.828 9.017 -2.516 1.00 13.13 C ATOM 183 O LYS A 12 -12.021 9.058 -2.817 1.00 34.41 O ATOM 184 CB LYS A 12 -9.764 9.931 -0.445 1.00 23.32 C ATOM 185 CG LYS A 12 -10.761 11.039 -0.153 1.00 23.23 C ATOM 186 CD LYS A 12 -10.171 12.409 -0.440 1.00 51.41 C ATOM 187 CE LYS A 12 -10.055 12.664 -1.935 1.00 52.02 C ATOM 188 NZ LYS A 12 -9.086 13.753 -2.239 1.00 24.31 N ATOM 189 H LYS A 12 -8.538 7.732 -0.751 1.00 35.12 H ATOM 190 HA LYS A 12 -11.262 8.403 -0.518 1.00 41.35 H ATOM 191 HB2 LYS A 12 -9.298 9.639 0.485 1.00 12.32 H ATOM 192 HB3 LYS A 12 -9.007 10.322 -1.109 1.00 43.31 H ATOM 193 HG2 LYS A 12 -11.634 10.898 -0.772 1.00 61.51 H ATOM 194 HG3 LYS A 12 -11.044 10.990 0.889 1.00 32.01 H ATOM 195 HD2 LYS A 12 -10.809 13.165 -0.006 1.00 74.34 H ATOM 196 HD3 LYS A 12 -9.187 12.469 0.004 1.00 73.32 H ATOM 197 HE2 LYS A 12 -9.727 11.756 -2.417 1.00 44.23 H ATOM 198 HE3 LYS A 12 -11.027 12.942 -2.316 1.00 1.22 H ATOM 199 HZ1 LYS A 12 -8.434 13.451 -2.991 1.00 3.40 H ATOM 200 HZ2 LYS A 12 -8.533 13.986 -1.389 1.00 15.31 H ATOM 201 HZ3 LYS A 12 -9.592 14.604 -2.554 1.00 40.42 H ATOM 202 N TYR A 13 -9.854 9.245 -3.389 1.00 62.21 N ATOM 203 CA TYR A 13 -10.136 9.565 -4.783 1.00 54.12 C ATOM 204 C TYR A 13 -11.052 8.517 -5.408 1.00 54.21 C ATOM 205 O TYR A 13 -11.955 8.846 -6.178 1.00 4.05 O ATOM 206 CB TYR A 13 -8.834 9.661 -5.580 1.00 75.04 C ATOM 207 CG TYR A 13 -8.877 10.689 -6.688 1.00 0.40 C ATOM 208 CD1 TYR A 13 -9.214 12.011 -6.423 1.00 71.14 C ATOM 209 CD2 TYR A 13 -8.579 10.339 -7.999 1.00 42.33 C ATOM 210 CE1 TYR A 13 -9.255 12.953 -7.433 1.00 1.45 C ATOM 211 CE2 TYR A 13 -8.616 11.275 -9.015 1.00 4.55 C ATOM 212 CZ TYR A 13 -8.955 12.581 -8.726 1.00 63.02 C ATOM 213 OH TYR A 13 -8.993 13.517 -9.734 1.00 2.20 O ATOM 214 H TYR A 13 -8.922 9.198 -3.089 1.00 51.23 H ATOM 215 HA TYR A 13 -10.634 10.523 -4.809 1.00 52.41 H ATOM 216 HB2 TYR A 13 -8.030 9.927 -4.912 1.00 50.23 H ATOM 217 HB3 TYR A 13 -8.622 8.701 -6.027 1.00 33.41 H ATOM 218 HD1 TYR A 13 -9.448 12.299 -5.409 1.00 13.32 H ATOM 219 HD2 TYR A 13 -8.314 9.316 -8.222 1.00 24.20 H ATOM 220 HE1 TYR A 13 -9.520 13.976 -7.207 1.00 21.20 H ATOM 221 HE2 TYR A 13 -8.381 10.984 -10.028 1.00 2.32 H ATOM 222 HH TYR A 13 -8.408 13.246 -10.445 1.00 63.42 H ATOM 223 N GLU A 14 -10.813 7.254 -5.070 1.00 1.01 N ATOM 224 CA GLU A 14 -11.616 6.157 -5.598 1.00 0.34 C ATOM 225 C GLU A 14 -12.990 6.121 -4.934 1.00 62.43 C ATOM 226 O GLU A 14 -13.981 5.735 -5.554 1.00 33.11 O ATOM 227 CB GLU A 14 -10.899 4.822 -5.385 1.00 1.43 C ATOM 228 CG GLU A 14 -11.320 3.742 -6.367 1.00 20.04 C ATOM 229 CD GLU A 14 -12.395 2.832 -5.806 1.00 75.45 C ATOM 230 OE1 GLU A 14 -12.046 1.870 -5.091 1.00 70.42 O ATOM 231 OE2 GLU A 14 -13.587 3.082 -6.084 1.00 33.14 O ATOM 232 H GLU A 14 -10.079 7.055 -4.452 1.00 10.23 H ATOM 233 HA GLU A 14 -11.745 6.321 -6.657 1.00 33.33 H ATOM 234 HB2 GLU A 14 -9.835 4.979 -5.487 1.00 31.52 H ATOM 235 HB3 GLU A 14 -11.108 4.471 -4.385 1.00 5.42 H ATOM 236 HG2 GLU A 14 -11.699 4.214 -7.261 1.00 34.24 H ATOM 237 HG3 GLU A 14 -10.456 3.143 -6.616 1.00 11.41 H ATOM 238 N LYS A 15 -13.040 6.524 -3.669 1.00 54.34 N ATOM 239 CA LYS A 15 -14.291 6.539 -2.920 1.00 0.31 C ATOM 240 C LYS A 15 -15.260 7.565 -3.499 1.00 1.32 C ATOM 241 O LYS A 15 -16.334 7.213 -3.988 1.00 11.10 O ATOM 242 CB LYS A 15 -14.022 6.851 -1.446 1.00 34.52 C ATOM 243 CG LYS A 15 -15.215 6.591 -0.542 1.00 55.23 C ATOM 244 CD LYS A 15 -15.240 5.154 -0.050 1.00 20.12 C ATOM 245 CE LYS A 15 -16.633 4.744 0.404 1.00 63.12 C ATOM 246 NZ LYS A 15 -16.847 5.016 1.852 1.00 22.11 N ATOM 247 H LYS A 15 -12.216 6.821 -3.229 1.00 63.31 H ATOM 248 HA LYS A 15 -14.736 5.559 -2.997 1.00 24.32 H ATOM 249 HB2 LYS A 15 -13.200 6.239 -1.105 1.00 43.33 H ATOM 250 HB3 LYS A 15 -13.748 7.892 -1.354 1.00 60.35 H ATOM 251 HG2 LYS A 15 -15.160 7.251 0.310 1.00 12.54 H ATOM 252 HG3 LYS A 15 -16.123 6.789 -1.095 1.00 33.44 H ATOM 253 HD2 LYS A 15 -14.929 4.502 -0.852 1.00 62.14 H ATOM 254 HD3 LYS A 15 -14.556 5.056 0.782 1.00 74.23 H ATOM 255 HE2 LYS A 15 -17.361 5.297 -0.169 1.00 70.00 H ATOM 256 HE3 LYS A 15 -16.759 3.687 0.222 1.00 33.20 H ATOM 257 HZ1 LYS A 15 -17.863 5.100 2.054 1.00 54.33 H ATOM 258 HZ2 LYS A 15 -16.376 5.903 2.122 1.00 3.12 H ATOM 259 HZ3 LYS A 15 -16.454 4.241 2.423 1.00 31.32 H ATOM 260 N LEU A 16 -14.874 8.835 -3.441 1.00 44.04 N ATOM 261 CA LEU A 16 -15.708 9.913 -3.962 1.00 21.23 C ATOM 262 C LEU A 16 -15.816 9.832 -5.481 1.00 14.40 C ATOM 263 O LEU A 16 -16.756 10.361 -6.077 1.00 21.14 O ATOM 264 CB LEU A 16 -15.136 11.271 -3.551 1.00 22.30 C ATOM 265 CG LEU A 16 -15.298 11.650 -2.078 1.00 65.44 C ATOM 266 CD1 LEU A 16 -14.299 10.890 -1.219 1.00 41.10 C ATOM 267 CD2 LEU A 16 -15.131 13.151 -1.893 1.00 22.35 C ATOM 268 H LEU A 16 -14.007 9.054 -3.040 1.00 53.01 H ATOM 269 HA LEU A 16 -16.694 9.803 -3.536 1.00 52.10 H ATOM 270 HB2 LEU A 16 -14.081 11.267 -3.777 1.00 64.02 H ATOM 271 HB3 LEU A 16 -15.627 12.029 -4.145 1.00 22.33 H ATOM 272 HG LEU A 16 -16.292 11.380 -1.751 1.00 31.41 H ATOM 273 HD11 LEU A 16 -14.771 10.009 -0.812 1.00 14.23 H ATOM 274 HD12 LEU A 16 -13.963 11.524 -0.412 1.00 41.30 H ATOM 275 HD13 LEU A 16 -13.452 10.599 -1.824 1.00 34.45 H ATOM 276 HD21 LEU A 16 -16.074 13.643 -2.077 1.00 43.23 H ATOM 277 HD22 LEU A 16 -14.390 13.519 -2.587 1.00 23.32 H ATOM 278 HD23 LEU A 16 -14.809 13.355 -0.881 1.00 71.44 H ATOM 279 N THR A 17 -14.850 9.166 -6.104 1.00 24.51 N ATOM 280 CA THR A 17 -14.837 9.015 -7.553 1.00 64.54 C ATOM 281 C THR A 17 -14.674 10.363 -8.245 1.00 50.13 C ATOM 282 O THR A 17 -15.032 10.520 -9.412 1.00 35.10 O ATOM 283 CB THR A 17 -16.127 8.343 -8.060 1.00 20.22 C ATOM 284 OG1 THR A 17 -16.695 7.531 -7.026 1.00 12.42 O ATOM 285 CG2 THR A 17 -15.846 7.487 -9.286 1.00 54.41 C ATOM 286 H THR A 17 -14.128 8.767 -5.574 1.00 61.34 H ATOM 287 HA THR A 17 -14.000 8.383 -7.815 1.00 51.05 H ATOM 288 HB THR A 17 -16.834 9.114 -8.331 1.00 43.11 H ATOM 289 HG1 THR A 17 -16.076 6.837 -6.787 1.00 73.13 H ATOM 290 HG21 THR A 17 -15.159 6.698 -9.024 1.00 20.53 H ATOM 291 HG22 THR A 17 -15.411 8.101 -10.061 1.00 24.31 H ATOM 292 HG23 THR A 17 -16.770 7.057 -9.644 1.00 0.32 H ATOM 293 N ALA A 18 -14.131 11.334 -7.518 1.00 42.15 N ATOM 294 CA ALA A 18 -13.918 12.669 -8.064 1.00 12.01 C ATOM 295 C ALA A 18 -15.198 13.218 -8.686 1.00 64.24 C ATOM 296 O ALA A 18 -15.160 14.168 -9.470 1.00 32.43 O ATOM 297 CB ALA A 18 -12.796 12.647 -9.092 1.00 34.25 C ATOM 298 H ALA A 18 -13.865 11.148 -6.594 1.00 33.31 H ATOM 299 HA ALA A 18 -13.618 13.317 -7.253 1.00 63.00 H ATOM 300 HB1 ALA A 18 -12.146 13.494 -8.931 1.00 42.42 H ATOM 301 HB2 ALA A 18 -12.231 11.733 -8.987 1.00 4.22 H ATOM 302 HB3 ALA A 18 -13.217 12.698 -10.085 1.00 12.55 H TER 303 ALA A 18 ENDMDL MODEL 15 ATOM 1 N VAL A 1 2.600 -1.224 -2.088 1.00 13.41 N ATOM 2 CA VAL A 1 2.589 0.216 -2.319 1.00 62.24 C ATOM 3 C VAL A 1 3.849 0.871 -1.765 1.00 21.14 C ATOM 4 O VAL A 1 4.399 0.428 -0.757 1.00 13.15 O ATOM 5 CB VAL A 1 1.355 0.878 -1.679 1.00 52.32 C ATOM 6 CG1 VAL A 1 0.076 0.244 -2.204 1.00 32.24 C ATOM 7 CG2 VAL A 1 1.425 0.781 -0.163 1.00 0.23 C ATOM 8 H1 VAL A 1 2.945 -1.568 -1.238 1.00 34.50 H ATOM 9 HA VAL A 1 2.548 0.382 -3.386 1.00 43.21 H ATOM 10 HB VAL A 1 1.350 1.923 -1.952 1.00 41.31 H ATOM 11 HG11 VAL A 1 -0.653 1.016 -2.403 1.00 61.24 H ATOM 12 HG12 VAL A 1 0.289 -0.297 -3.114 1.00 53.44 H ATOM 13 HG13 VAL A 1 -0.317 -0.438 -1.464 1.00 12.14 H ATOM 14 HG21 VAL A 1 0.430 0.652 0.237 1.00 62.13 H ATOM 15 HG22 VAL A 1 2.038 -0.063 0.115 1.00 33.41 H ATOM 16 HG23 VAL A 1 1.858 1.687 0.237 1.00 61.21 H ATOM 17 N ALA A 2 4.301 1.929 -2.430 1.00 23.22 N ATOM 18 CA ALA A 2 5.495 2.647 -2.002 1.00 2.22 C ATOM 19 C ALA A 2 5.309 3.242 -0.610 1.00 54.23 C ATOM 20 O ALA A 2 6.009 2.873 0.333 1.00 51.13 O ATOM 21 CB ALA A 2 5.841 3.739 -3.003 1.00 43.40 C ATOM 22 H ALA A 2 3.820 2.234 -3.226 1.00 55.24 H ATOM 23 HA ALA A 2 6.316 1.945 -1.975 1.00 32.51 H ATOM 24 HB1 ALA A 2 6.219 3.289 -3.909 1.00 64.13 H ATOM 25 HB2 ALA A 2 4.956 4.314 -3.229 1.00 13.45 H ATOM 26 HB3 ALA A 2 6.595 4.388 -2.582 1.00 33.14 H ATOM 27 N PHE A 3 4.361 4.166 -0.489 1.00 33.41 N ATOM 28 CA PHE A 3 4.083 4.813 0.788 1.00 43.42 C ATOM 29 C PHE A 3 2.610 4.675 1.159 1.00 53.31 C ATOM 30 O PHE A 3 1.806 4.173 0.374 1.00 15.15 O ATOM 31 CB PHE A 3 4.469 6.293 0.728 1.00 64.32 C ATOM 32 CG PHE A 3 5.910 6.522 0.372 1.00 44.24 C ATOM 33 CD1 PHE A 3 6.922 6.117 1.227 1.00 62.20 C ATOM 34 CD2 PHE A 3 6.253 7.143 -0.819 1.00 21.22 C ATOM 35 CE1 PHE A 3 8.249 6.328 0.902 1.00 72.51 C ATOM 36 CE2 PHE A 3 7.578 7.356 -1.150 1.00 22.15 C ATOM 37 CZ PHE A 3 8.577 6.947 -0.288 1.00 63.33 C ATOM 38 H PHE A 3 3.835 4.418 -1.277 1.00 64.14 H ATOM 39 HA PHE A 3 4.680 4.325 1.543 1.00 73.22 H ATOM 40 HB2 PHE A 3 3.862 6.786 -0.016 1.00 12.12 H ATOM 41 HB3 PHE A 3 4.289 6.744 1.692 1.00 75.33 H ATOM 42 HD1 PHE A 3 6.667 5.631 2.158 1.00 41.44 H ATOM 43 HD2 PHE A 3 5.472 7.463 -1.494 1.00 13.33 H ATOM 44 HE1 PHE A 3 9.028 6.006 1.577 1.00 42.43 H ATOM 45 HE2 PHE A 3 7.831 7.840 -2.081 1.00 2.30 H ATOM 46 HZ PHE A 3 9.613 7.113 -0.544 1.00 60.24 H ATOM 47 N ALA A 4 2.264 5.125 2.361 1.00 71.41 N ATOM 48 CA ALA A 4 0.888 5.053 2.836 1.00 12.03 C ATOM 49 C ALA A 4 0.084 6.264 2.375 1.00 31.10 C ATOM 50 O ALA A 4 -1.124 6.172 2.153 1.00 52.00 O ATOM 51 CB ALA A 4 0.859 4.945 4.354 1.00 73.33 C ATOM 52 H ALA A 4 2.950 5.515 2.941 1.00 23.30 H ATOM 53 HA ALA A 4 0.439 4.159 2.427 1.00 25.25 H ATOM 54 HB1 ALA A 4 1.220 3.971 4.651 1.00 34.31 H ATOM 55 HB2 ALA A 4 1.490 5.709 4.781 1.00 2.12 H ATOM 56 HB3 ALA A 4 -0.154 5.076 4.704 1.00 30.02 H ATOM 57 N LEU A 5 0.761 7.398 2.233 1.00 14.22 N ATOM 58 CA LEU A 5 0.109 8.629 1.799 1.00 72.24 C ATOM 59 C LEU A 5 -0.679 8.403 0.512 1.00 30.42 C ATOM 60 O LEU A 5 -1.889 8.628 0.464 1.00 42.43 O ATOM 61 CB LEU A 5 1.147 9.732 1.587 1.00 62.11 C ATOM 62 CG LEU A 5 0.847 11.074 2.255 1.00 35.12 C ATOM 63 CD1 LEU A 5 -0.428 11.679 1.688 1.00 41.33 C ATOM 64 CD2 LEU A 5 0.733 10.905 3.763 1.00 3.14 C ATOM 65 H LEU A 5 1.721 7.410 2.425 1.00 62.41 H ATOM 66 HA LEU A 5 -0.575 8.934 2.576 1.00 32.15 H ATOM 67 HB2 LEU A 5 2.091 9.376 1.971 1.00 72.33 H ATOM 68 HB3 LEU A 5 1.235 9.903 0.523 1.00 34.13 H ATOM 69 HG LEU A 5 1.659 11.759 2.055 1.00 71.15 H ATOM 70 HD11 LEU A 5 -0.670 12.581 2.229 1.00 34.35 H ATOM 71 HD12 LEU A 5 -1.237 10.971 1.786 1.00 54.21 H ATOM 72 HD13 LEU A 5 -0.281 11.914 0.644 1.00 44.44 H ATOM 73 HD21 LEU A 5 1.252 11.714 4.256 1.00 64.30 H ATOM 74 HD22 LEU A 5 1.175 9.963 4.054 1.00 50.32 H ATOM 75 HD23 LEU A 5 -0.308 10.917 4.050 1.00 55.53 H ATOM 76 N THR A 6 0.014 7.953 -0.529 1.00 44.02 N ATOM 77 CA THR A 6 -0.620 7.695 -1.816 1.00 22.12 C ATOM 78 C THR A 6 -1.815 6.761 -1.662 1.00 51.41 C ATOM 79 O THR A 6 -2.762 6.814 -2.448 1.00 60.23 O ATOM 80 CB THR A 6 0.374 7.078 -2.818 1.00 73.31 C ATOM 81 OG1 THR A 6 -0.321 6.645 -3.993 1.00 70.10 O ATOM 82 CG2 THR A 6 1.110 5.901 -2.196 1.00 33.15 C ATOM 83 H THR A 6 0.976 7.792 -0.428 1.00 53.34 H ATOM 84 HA THR A 6 -0.961 8.639 -2.215 1.00 15.14 H ATOM 85 HB THR A 6 1.098 7.831 -3.094 1.00 72.11 H ATOM 86 HG1 THR A 6 -1.094 7.198 -4.130 1.00 33.33 H ATOM 87 HG21 THR A 6 1.088 5.063 -2.876 1.00 4.01 H ATOM 88 HG22 THR A 6 0.628 5.624 -1.269 1.00 41.32 H ATOM 89 HG23 THR A 6 2.134 6.180 -2.000 1.00 2.14 H ATOM 90 N LEU A 7 -1.766 5.908 -0.645 1.00 53.03 N ATOM 91 CA LEU A 7 -2.847 4.962 -0.388 1.00 4.12 C ATOM 92 C LEU A 7 -4.131 5.692 -0.007 1.00 5.41 C ATOM 93 O LEU A 7 -5.183 5.471 -0.605 1.00 5.40 O ATOM 94 CB LEU A 7 -2.448 3.993 0.727 1.00 42.14 C ATOM 95 CG LEU A 7 -3.079 2.602 0.664 1.00 62.20 C ATOM 96 CD1 LEU A 7 -2.324 1.632 1.560 1.00 44.32 C ATOM 97 CD2 LEU A 7 -4.547 2.664 1.060 1.00 22.40 C ATOM 98 H LEU A 7 -0.986 5.913 -0.053 1.00 50.31 H ATOM 99 HA LEU A 7 -3.020 4.403 -1.295 1.00 34.20 H ATOM 100 HB2 LEU A 7 -1.376 3.872 0.691 1.00 31.32 H ATOM 101 HB3 LEU A 7 -2.727 4.442 1.669 1.00 24.05 H ATOM 102 HG LEU A 7 -3.021 2.232 -0.351 1.00 5.34 H ATOM 103 HD11 LEU A 7 -2.961 0.796 1.802 1.00 21.55 H ATOM 104 HD12 LEU A 7 -2.030 2.136 2.469 1.00 44.45 H ATOM 105 HD13 LEU A 7 -1.443 1.278 1.044 1.00 20.44 H ATOM 106 HD21 LEU A 7 -5.081 3.295 0.365 1.00 23.24 H ATOM 107 HD22 LEU A 7 -4.633 3.071 2.057 1.00 74.33 H ATOM 108 HD23 LEU A 7 -4.967 1.668 1.040 1.00 12.50 H ATOM 109 N ASN A 8 -4.035 6.565 0.991 1.00 31.01 N ATOM 110 CA ASN A 8 -5.189 7.330 1.451 1.00 62.52 C ATOM 111 C ASN A 8 -5.710 8.245 0.347 1.00 63.22 C ATOM 112 O ASN A 8 -6.919 8.396 0.170 1.00 53.30 O ATOM 113 CB ASN A 8 -4.820 8.158 2.683 1.00 21.54 C ATOM 114 CG ASN A 8 -5.902 8.126 3.746 1.00 44.32 C ATOM 115 OD1 ASN A 8 -6.249 7.064 4.262 1.00 15.22 O ATOM 116 ND2 ASN A 8 -6.439 9.294 4.077 1.00 53.51 N ATOM 117 H ASN A 8 -3.169 6.698 1.429 1.00 24.22 H ATOM 118 HA ASN A 8 -5.965 6.629 1.718 1.00 34.10 H ATOM 119 HB2 ASN A 8 -3.909 7.766 3.113 1.00 12.00 H ATOM 120 HB3 ASN A 8 -4.661 9.183 2.387 1.00 52.32 H ATOM 121 HD21 ASN A 8 -6.113 10.100 3.624 1.00 63.12 H ATOM 122 HD22 ASN A 8 -7.140 9.303 4.762 1.00 53.34 H ATOM 123 N LEU A 9 -4.789 8.852 -0.394 1.00 13.44 N ATOM 124 CA LEU A 9 -5.155 9.753 -1.482 1.00 22.33 C ATOM 125 C LEU A 9 -5.870 8.997 -2.597 1.00 32.02 C ATOM 126 O LEU A 9 -6.923 9.423 -3.073 1.00 64.13 O ATOM 127 CB LEU A 9 -3.909 10.445 -2.037 1.00 51.22 C ATOM 128 CG LEU A 9 -4.120 11.309 -3.281 1.00 63.23 C ATOM 129 CD1 LEU A 9 -4.878 12.578 -2.928 1.00 15.54 C ATOM 130 CD2 LEU A 9 -2.784 11.646 -3.929 1.00 15.12 C ATOM 131 H LEU A 9 -3.841 8.692 -0.205 1.00 54.52 H ATOM 132 HA LEU A 9 -5.824 10.500 -1.083 1.00 34.05 H ATOM 133 HB2 LEU A 9 -3.508 11.078 -1.260 1.00 72.41 H ATOM 134 HB3 LEU A 9 -3.188 9.679 -2.283 1.00 63.12 H ATOM 135 HG LEU A 9 -4.711 10.757 -3.999 1.00 65.33 H ATOM 136 HD11 LEU A 9 -4.189 13.314 -2.540 1.00 73.54 H ATOM 137 HD12 LEU A 9 -5.625 12.355 -2.180 1.00 3.24 H ATOM 138 HD13 LEU A 9 -5.361 12.967 -3.812 1.00 53.33 H ATOM 139 HD21 LEU A 9 -2.085 11.959 -3.168 1.00 64.04 H ATOM 140 HD22 LEU A 9 -2.923 12.445 -4.642 1.00 44.03 H ATOM 141 HD23 LEU A 9 -2.400 10.773 -4.436 1.00 41.12 H ATOM 142 N TYR A 10 -5.294 7.873 -3.007 1.00 24.21 N ATOM 143 CA TYR A 10 -5.876 7.057 -4.066 1.00 41.30 C ATOM 144 C TYR A 10 -7.235 6.506 -3.645 1.00 25.15 C ATOM 145 O TYR A 10 -8.225 6.653 -4.361 1.00 25.44 O ATOM 146 CB TYR A 10 -4.936 5.906 -4.427 1.00 43.25 C ATOM 147 CG TYR A 10 -5.251 5.262 -5.759 1.00 1.04 C ATOM 148 CD1 TYR A 10 -4.997 5.927 -6.952 1.00 32.31 C ATOM 149 CD2 TYR A 10 -5.802 3.988 -5.823 1.00 22.03 C ATOM 150 CE1 TYR A 10 -5.284 5.342 -8.170 1.00 54.22 C ATOM 151 CE2 TYR A 10 -6.091 3.395 -7.037 1.00 1.04 C ATOM 152 CZ TYR A 10 -5.831 4.076 -8.207 1.00 41.33 C ATOM 153 OH TYR A 10 -6.117 3.490 -9.419 1.00 31.01 O ATOM 154 H TYR A 10 -4.455 7.585 -2.589 1.00 34.03 H ATOM 155 HA TYR A 10 -6.009 7.686 -4.934 1.00 1.50 H ATOM 156 HB2 TYR A 10 -3.923 6.277 -4.471 1.00 14.21 H ATOM 157 HB3 TYR A 10 -5.002 5.143 -3.665 1.00 51.45 H ATOM 158 HD1 TYR A 10 -4.569 6.918 -6.919 1.00 44.02 H ATOM 159 HD2 TYR A 10 -6.004 3.457 -4.904 1.00 34.21 H ATOM 160 HE1 TYR A 10 -5.080 5.875 -9.087 1.00 54.21 H ATOM 161 HE2 TYR A 10 -6.519 2.404 -7.066 1.00 71.13 H ATOM 162 HH TYR A 10 -6.878 2.912 -9.323 1.00 3.02 H ATOM 163 N GLN A 11 -7.272 5.872 -2.477 1.00 71.10 N ATOM 164 CA GLN A 11 -8.509 5.298 -1.959 1.00 44.33 C ATOM 165 C GLN A 11 -9.587 6.367 -1.816 1.00 43.54 C ATOM 166 O GLN A 11 -10.734 6.164 -2.213 1.00 54.21 O ATOM 167 CB GLN A 11 -8.257 4.627 -0.608 1.00 75.41 C ATOM 168 CG GLN A 11 -9.349 3.649 -0.202 1.00 41.43 C ATOM 169 CD GLN A 11 -9.025 2.913 1.083 1.00 41.41 C ATOM 170 OE1 GLN A 11 -9.007 3.505 2.163 1.00 62.32 O ATOM 171 NE2 GLN A 11 -8.767 1.615 0.973 1.00 2.52 N ATOM 172 H GLN A 11 -6.450 5.788 -1.952 1.00 65.42 H ATOM 173 HA GLN A 11 -8.849 4.554 -2.663 1.00 64.12 H ATOM 174 HB2 GLN A 11 -7.322 4.090 -0.655 1.00 20.52 H ATOM 175 HB3 GLN A 11 -8.187 5.390 0.152 1.00 15.25 H ATOM 176 HG2 GLN A 11 -10.270 4.196 -0.063 1.00 71.53 H ATOM 177 HG3 GLN A 11 -9.477 2.925 -0.993 1.00 31.32 H ATOM 178 HE21 GLN A 11 -8.798 1.212 0.080 1.00 34.41 H ATOM 179 HE22 GLN A 11 -8.554 1.115 1.787 1.00 4.55 H ATOM 180 N LYS A 12 -9.211 7.507 -1.247 1.00 4.42 N ATOM 181 CA LYS A 12 -10.144 8.610 -1.052 1.00 12.33 C ATOM 182 C LYS A 12 -10.711 9.086 -2.386 1.00 5.34 C ATOM 183 O LYS A 12 -11.922 9.244 -2.536 1.00 14.25 O ATOM 184 CB LYS A 12 -9.451 9.772 -0.336 1.00 61.02 C ATOM 185 CG LYS A 12 -10.369 10.949 -0.057 1.00 40.31 C ATOM 186 CD LYS A 12 -9.688 12.273 -0.364 1.00 71.54 C ATOM 187 CE LYS A 12 -9.595 12.517 -1.863 1.00 34.12 C ATOM 188 NZ LYS A 12 -8.194 12.774 -2.297 1.00 73.22 N ATOM 189 H LYS A 12 -8.281 7.610 -0.951 1.00 72.10 H ATOM 190 HA LYS A 12 -10.956 8.253 -0.437 1.00 30.15 H ATOM 191 HB2 LYS A 12 -9.059 9.417 0.605 1.00 21.44 H ATOM 192 HB3 LYS A 12 -8.632 10.119 -0.949 1.00 65.14 H ATOM 193 HG2 LYS A 12 -11.252 10.860 -0.673 1.00 22.24 H ATOM 194 HG3 LYS A 12 -10.652 10.934 0.986 1.00 41.01 H ATOM 195 HD2 LYS A 12 -10.257 13.073 0.085 1.00 43.22 H ATOM 196 HD3 LYS A 12 -8.691 12.259 0.052 1.00 43.30 H ATOM 197 HE2 LYS A 12 -9.970 11.647 -2.380 1.00 63.10 H ATOM 198 HE3 LYS A 12 -10.204 13.374 -2.113 1.00 23.43 H ATOM 199 HZ1 LYS A 12 -8.044 12.402 -3.257 1.00 3.43 H ATOM 200 HZ2 LYS A 12 -7.528 12.308 -1.648 1.00 13.20 H ATOM 201 HZ3 LYS A 12 -8.002 13.796 -2.298 1.00 73.32 H ATOM 202 N TYR A 13 -9.827 9.312 -3.351 1.00 61.24 N ATOM 203 CA TYR A 13 -10.239 9.771 -4.673 1.00 32.44 C ATOM 204 C TYR A 13 -11.154 8.750 -5.343 1.00 11.03 C ATOM 205 O TYR A 13 -12.112 9.113 -6.024 1.00 13.11 O ATOM 206 CB TYR A 13 -9.014 10.028 -5.551 1.00 41.23 C ATOM 207 CG TYR A 13 -9.347 10.654 -6.887 1.00 13.13 C ATOM 208 CD1 TYR A 13 -9.552 12.024 -7.002 1.00 73.42 C ATOM 209 CD2 TYR A 13 -9.458 9.876 -8.033 1.00 14.34 C ATOM 210 CE1 TYR A 13 -9.858 12.600 -8.220 1.00 22.10 C ATOM 211 CE2 TYR A 13 -9.762 10.444 -9.255 1.00 10.23 C ATOM 212 CZ TYR A 13 -9.961 11.806 -9.343 1.00 50.23 C ATOM 213 OH TYR A 13 -10.265 12.375 -10.559 1.00 11.54 O ATOM 214 H TYR A 13 -8.874 9.168 -3.171 1.00 55.15 H ATOM 215 HA TYR A 13 -10.782 10.696 -4.548 1.00 4.40 H ATOM 216 HB2 TYR A 13 -8.341 10.693 -5.033 1.00 0.51 H ATOM 217 HB3 TYR A 13 -8.511 9.091 -5.740 1.00 74.21 H ATOM 218 HD1 TYR A 13 -9.471 12.643 -6.121 1.00 23.35 H ATOM 219 HD2 TYR A 13 -9.302 8.810 -7.959 1.00 73.45 H ATOM 220 HE1 TYR A 13 -10.014 13.666 -8.290 1.00 45.40 H ATOM 221 HE2 TYR A 13 -9.843 9.823 -10.134 1.00 74.23 H ATOM 222 HH TYR A 13 -10.801 13.160 -10.419 1.00 60.12 H ATOM 223 N GLU A 14 -10.850 7.471 -5.143 1.00 13.43 N ATOM 224 CA GLU A 14 -11.645 6.398 -5.728 1.00 22.45 C ATOM 225 C GLU A 14 -12.976 6.245 -4.996 1.00 45.23 C ATOM 226 O GLU A 14 -13.965 5.790 -5.571 1.00 24.11 O ATOM 227 CB GLU A 14 -10.871 5.078 -5.682 1.00 55.14 C ATOM 228 CG GLU A 14 -11.033 4.235 -6.936 1.00 30.21 C ATOM 229 CD GLU A 14 -10.433 4.893 -8.163 1.00 71.02 C ATOM 230 OE1 GLU A 14 -9.292 5.392 -8.070 1.00 22.20 O ATOM 231 OE2 GLU A 14 -11.104 4.910 -9.216 1.00 71.31 O ATOM 232 H GLU A 14 -10.074 7.245 -4.590 1.00 4.03 H ATOM 233 HA GLU A 14 -11.841 6.654 -6.758 1.00 34.34 H ATOM 234 HB2 GLU A 14 -9.821 5.294 -5.551 1.00 55.32 H ATOM 235 HB3 GLU A 14 -11.219 4.501 -4.838 1.00 63.54 H ATOM 236 HG2 GLU A 14 -10.544 3.285 -6.781 1.00 20.22 H ATOM 237 HG3 GLU A 14 -12.086 4.072 -7.111 1.00 72.35 H ATOM 238 N LYS A 15 -12.992 6.629 -3.724 1.00 71.13 N ATOM 239 CA LYS A 15 -14.200 6.537 -2.912 1.00 63.54 C ATOM 240 C LYS A 15 -15.133 7.711 -3.189 1.00 43.05 C ATOM 241 O LYS A 15 -16.355 7.558 -3.194 1.00 40.42 O ATOM 242 CB LYS A 15 -13.838 6.498 -1.426 1.00 0.51 C ATOM 243 CG LYS A 15 -13.492 5.109 -0.919 1.00 73.14 C ATOM 244 CD LYS A 15 -13.948 4.909 0.516 1.00 13.22 C ATOM 245 CE LYS A 15 -15.415 4.512 0.585 1.00 21.10 C ATOM 246 NZ LYS A 15 -15.868 4.304 1.988 1.00 0.23 N ATOM 247 H LYS A 15 -12.171 6.984 -3.322 1.00 34.04 H ATOM 248 HA LYS A 15 -14.706 5.620 -3.174 1.00 54.25 H ATOM 249 HB2 LYS A 15 -12.987 7.142 -1.258 1.00 51.22 H ATOM 250 HB3 LYS A 15 -14.677 6.869 -0.854 1.00 62.21 H ATOM 251 HG2 LYS A 15 -13.979 4.376 -1.545 1.00 61.14 H ATOM 252 HG3 LYS A 15 -12.421 4.974 -0.969 1.00 71.35 H ATOM 253 HD2 LYS A 15 -13.354 4.129 0.969 1.00 53.05 H ATOM 254 HD3 LYS A 15 -13.808 5.832 1.061 1.00 53.31 H ATOM 255 HE2 LYS A 15 -16.008 5.294 0.137 1.00 43.25 H ATOM 256 HE3 LYS A 15 -15.552 3.594 0.032 1.00 41.52 H ATOM 257 HZ1 LYS A 15 -15.513 5.070 2.596 1.00 62.22 H ATOM 258 HZ2 LYS A 15 -15.511 3.396 2.348 1.00 5.11 H ATOM 259 HZ3 LYS A 15 -16.907 4.296 2.031 1.00 61.12 H ATOM 260 N LEU A 16 -14.550 8.882 -3.421 1.00 64.13 N ATOM 261 CA LEU A 16 -15.329 10.083 -3.701 1.00 71.22 C ATOM 262 C LEU A 16 -16.036 9.971 -5.048 1.00 51.42 C ATOM 263 O LEU A 16 -17.030 10.654 -5.299 1.00 34.53 O ATOM 264 CB LEU A 16 -14.425 11.316 -3.687 1.00 42.44 C ATOM 265 CG LEU A 16 -13.934 11.773 -2.313 1.00 44.23 C ATOM 266 CD1 LEU A 16 -12.962 12.935 -2.453 1.00 12.02 C ATOM 267 CD2 LEU A 16 -15.109 12.162 -1.429 1.00 33.12 C ATOM 268 H LEU A 16 -13.572 8.941 -3.404 1.00 40.42 H ATOM 269 HA LEU A 16 -16.073 10.183 -2.925 1.00 11.10 H ATOM 270 HB2 LEU A 16 -13.558 11.098 -4.292 1.00 72.31 H ATOM 271 HB3 LEU A 16 -14.975 12.134 -4.132 1.00 21.31 H ATOM 272 HG LEU A 16 -13.410 10.957 -1.835 1.00 61.34 H ATOM 273 HD11 LEU A 16 -12.244 12.902 -1.648 1.00 64.11 H ATOM 274 HD12 LEU A 16 -13.507 13.867 -2.411 1.00 20.40 H ATOM 275 HD13 LEU A 16 -12.447 12.862 -3.400 1.00 33.13 H ATOM 276 HD21 LEU A 16 -14.744 12.661 -0.544 1.00 32.14 H ATOM 277 HD22 LEU A 16 -15.653 11.274 -1.143 1.00 73.43 H ATOM 278 HD23 LEU A 16 -15.765 12.826 -1.973 1.00 50.11 H ATOM 279 N THR A 17 -15.518 9.105 -5.913 1.00 63.11 N ATOM 280 CA THR A 17 -16.099 8.903 -7.234 1.00 72.11 C ATOM 281 C THR A 17 -15.996 10.167 -8.080 1.00 1.15 C ATOM 282 O THR A 17 -16.750 10.350 -9.034 1.00 74.13 O ATOM 283 CB THR A 17 -17.578 8.482 -7.139 1.00 1.24 C ATOM 284 OG1 THR A 17 -17.802 7.751 -5.928 1.00 11.32 O ATOM 285 CG2 THR A 17 -17.976 7.629 -8.333 1.00 60.32 C ATOM 286 H THR A 17 -14.724 8.591 -5.655 1.00 75.53 H ATOM 287 HA THR A 17 -15.552 8.109 -7.722 1.00 4.43 H ATOM 288 HB THR A 17 -18.190 9.373 -7.131 1.00 60.22 H ATOM 289 HG1 THR A 17 -18.744 7.605 -5.812 1.00 71.20 H ATOM 290 HG21 THR A 17 -17.106 7.117 -8.716 1.00 5.43 H ATOM 291 HG22 THR A 17 -18.390 8.260 -9.105 1.00 51.51 H ATOM 292 HG23 THR A 17 -18.715 6.903 -8.027 1.00 25.01 H ATOM 293 N ALA A 18 -15.056 11.037 -7.723 1.00 35.22 N ATOM 294 CA ALA A 18 -14.853 12.283 -8.451 1.00 20.00 C ATOM 295 C ALA A 18 -16.161 13.052 -8.600 1.00 35.30 C ATOM 296 O ALA A 18 -16.229 14.244 -8.300 1.00 53.54 O ATOM 297 CB ALA A 18 -14.245 12.003 -9.817 1.00 62.42 C ATOM 298 H ALA A 18 -14.486 10.835 -6.952 1.00 61.34 H ATOM 299 HA ALA A 18 -14.154 12.887 -7.890 1.00 71.02 H ATOM 300 HB1 ALA A 18 -14.876 12.427 -10.585 1.00 22.41 H ATOM 301 HB2 ALA A 18 -13.262 12.447 -9.872 1.00 14.32 H ATOM 302 HB3 ALA A 18 -14.166 10.936 -9.964 1.00 34.21 H TER 303 ALA A 18 ENDMDL MODEL 16 ATOM 1 N VAL A 1 5.934 5.336 -4.056 1.00 1.21 N ATOM 2 CA VAL A 1 5.147 5.308 -2.829 1.00 22.32 C ATOM 3 C VAL A 1 4.409 3.982 -2.680 1.00 52.21 C ATOM 4 O VAL A 1 3.364 3.770 -3.295 1.00 22.42 O ATOM 5 CB VAL A 1 4.125 6.459 -2.791 1.00 10.33 C ATOM 6 CG1 VAL A 1 3.294 6.394 -1.518 1.00 43.22 C ATOM 7 CG2 VAL A 1 4.831 7.802 -2.908 1.00 72.35 C ATOM 8 H1 VAL A 1 6.759 4.810 -4.107 1.00 20.31 H ATOM 9 HA VAL A 1 5.824 5.427 -1.995 1.00 51.32 H ATOM 10 HB VAL A 1 3.459 6.351 -3.634 1.00 64.15 H ATOM 11 HG11 VAL A 1 2.406 5.807 -1.699 1.00 15.45 H ATOM 12 HG12 VAL A 1 3.876 5.937 -0.731 1.00 72.22 H ATOM 13 HG13 VAL A 1 3.011 7.394 -1.222 1.00 73.43 H ATOM 14 HG21 VAL A 1 4.567 8.267 -3.847 1.00 31.44 H ATOM 15 HG22 VAL A 1 4.528 8.440 -2.092 1.00 35.31 H ATOM 16 HG23 VAL A 1 5.900 7.651 -2.870 1.00 1.53 H ATOM 17 N ALA A 2 4.959 3.094 -1.859 1.00 70.41 N ATOM 18 CA ALA A 2 4.351 1.789 -1.627 1.00 43.22 C ATOM 19 C ALA A 2 2.883 1.929 -1.239 1.00 62.41 C ATOM 20 O ALA A 2 2.007 1.328 -1.861 1.00 54.43 O ATOM 21 CB ALA A 2 5.115 1.035 -0.548 1.00 41.45 C ATOM 22 H ALA A 2 5.793 3.321 -1.397 1.00 54.55 H ATOM 23 HA ALA A 2 4.419 1.222 -2.544 1.00 75.24 H ATOM 24 HB1 ALA A 2 4.899 1.472 0.416 1.00 42.11 H ATOM 25 HB2 ALA A 2 4.812 -0.001 -0.551 1.00 3.01 H ATOM 26 HB3 ALA A 2 6.175 1.102 -0.745 1.00 13.01 H ATOM 27 N PHE A 3 2.622 2.724 -0.207 1.00 32.52 N ATOM 28 CA PHE A 3 1.259 2.940 0.265 1.00 3.34 C ATOM 29 C PHE A 3 1.240 3.908 1.445 1.00 30.33 C ATOM 30 O PHE A 3 0.475 3.732 2.393 1.00 24.13 O ATOM 31 CB PHE A 3 0.620 1.611 0.671 1.00 31.31 C ATOM 32 CG PHE A 3 1.480 0.786 1.586 1.00 40.32 C ATOM 33 CD1 PHE A 3 2.391 -0.122 1.070 1.00 12.33 C ATOM 34 CD2 PHE A 3 1.377 0.919 2.961 1.00 3.12 C ATOM 35 CE1 PHE A 3 3.184 -0.882 1.909 1.00 1.42 C ATOM 36 CE2 PHE A 3 2.168 0.162 3.805 1.00 42.31 C ATOM 37 CZ PHE A 3 3.072 -0.740 3.278 1.00 32.04 C ATOM 38 H PHE A 3 3.363 3.175 0.249 1.00 65.21 H ATOM 39 HA PHE A 3 0.693 3.370 -0.546 1.00 75.32 H ATOM 40 HB2 PHE A 3 -0.311 1.808 1.181 1.00 72.25 H ATOM 41 HB3 PHE A 3 0.424 1.028 -0.217 1.00 12.45 H ATOM 42 HD1 PHE A 3 2.479 -0.233 -0.001 1.00 62.54 H ATOM 43 HD2 PHE A 3 0.670 1.623 3.375 1.00 45.44 H ATOM 44 HE1 PHE A 3 3.889 -1.586 1.494 1.00 64.11 H ATOM 45 HE2 PHE A 3 2.078 0.275 4.875 1.00 23.31 H ATOM 46 HZ PHE A 3 3.691 -1.332 3.936 1.00 70.15 H ATOM 47 N ALA A 4 2.087 4.929 1.379 1.00 45.30 N ATOM 48 CA ALA A 4 2.167 5.926 2.440 1.00 65.41 C ATOM 49 C ALA A 4 1.218 7.089 2.174 1.00 73.54 C ATOM 50 O ALA A 4 0.245 7.288 2.902 1.00 13.20 O ATOM 51 CB ALA A 4 3.596 6.430 2.583 1.00 13.25 C ATOM 52 H ALA A 4 2.672 5.016 0.597 1.00 32.53 H ATOM 53 HA ALA A 4 1.885 5.449 3.368 1.00 63.34 H ATOM 54 HB1 ALA A 4 3.605 7.305 3.218 1.00 64.31 H ATOM 55 HB2 ALA A 4 4.207 5.658 3.025 1.00 65.22 H ATOM 56 HB3 ALA A 4 3.986 6.687 1.610 1.00 12.11 H ATOM 57 N LEU A 5 1.506 7.854 1.127 1.00 60.22 N ATOM 58 CA LEU A 5 0.677 8.998 0.764 1.00 4.55 C ATOM 59 C LEU A 5 -0.325 8.623 -0.322 1.00 33.31 C ATOM 60 O LEU A 5 -1.530 8.829 -0.169 1.00 43.44 O ATOM 61 CB LEU A 5 1.554 10.157 0.286 1.00 24.03 C ATOM 62 CG LEU A 5 2.239 10.977 1.381 1.00 74.13 C ATOM 63 CD1 LEU A 5 3.280 11.908 0.778 1.00 34.33 C ATOM 64 CD2 LEU A 5 1.210 11.768 2.176 1.00 24.54 C ATOM 65 H LEU A 5 2.294 7.645 0.584 1.00 3.10 H ATOM 66 HA LEU A 5 0.136 9.308 1.646 1.00 32.40 H ATOM 67 HB2 LEU A 5 2.324 9.748 -0.350 1.00 50.12 H ATOM 68 HB3 LEU A 5 0.931 10.826 -0.290 1.00 3.54 H ATOM 69 HG LEU A 5 2.745 10.306 2.061 1.00 64.02 H ATOM 70 HD11 LEU A 5 4.092 11.324 0.371 1.00 14.35 H ATOM 71 HD12 LEU A 5 3.659 12.567 1.545 1.00 52.54 H ATOM 72 HD13 LEU A 5 2.827 12.493 -0.008 1.00 55.23 H ATOM 73 HD21 LEU A 5 1.687 12.216 3.035 1.00 1.11 H ATOM 74 HD22 LEU A 5 0.424 11.105 2.506 1.00 31.31 H ATOM 75 HD23 LEU A 5 0.790 12.542 1.551 1.00 13.05 H ATOM 76 N THR A 6 0.179 8.067 -1.419 1.00 42.13 N ATOM 77 CA THR A 6 -0.672 7.661 -2.531 1.00 5.22 C ATOM 78 C THR A 6 -1.793 6.744 -2.058 1.00 34.20 C ATOM 79 O THR A 6 -2.869 6.701 -2.657 1.00 44.04 O ATOM 80 CB THR A 6 0.139 6.940 -3.625 1.00 0.54 C ATOM 81 OG1 THR A 6 0.600 5.675 -3.139 1.00 24.03 O ATOM 82 CG2 THR A 6 1.326 7.785 -4.063 1.00 62.50 C ATOM 83 H THR A 6 1.147 7.928 -1.482 1.00 3.34 H ATOM 84 HA THR A 6 -1.105 8.552 -2.962 1.00 12.05 H ATOM 85 HB THR A 6 -0.503 6.777 -4.478 1.00 41.45 H ATOM 86 HG1 THR A 6 0.494 5.011 -3.824 1.00 34.31 H ATOM 87 HG21 THR A 6 0.978 8.753 -4.389 1.00 71.24 H ATOM 88 HG22 THR A 6 1.837 7.293 -4.878 1.00 35.52 H ATOM 89 HG23 THR A 6 2.006 7.907 -3.233 1.00 45.35 H ATOM 90 N LEU A 7 -1.537 6.011 -0.980 1.00 14.43 N ATOM 91 CA LEU A 7 -2.527 5.094 -0.425 1.00 51.22 C ATOM 92 C LEU A 7 -3.814 5.832 -0.069 1.00 22.11 C ATOM 93 O LEU A 7 -4.903 5.433 -0.479 1.00 10.40 O ATOM 94 CB LEU A 7 -1.966 4.396 0.815 1.00 40.11 C ATOM 95 CG LEU A 7 -2.984 3.671 1.695 1.00 33.23 C ATOM 96 CD1 LEU A 7 -3.629 2.525 0.932 1.00 75.41 C ATOM 97 CD2 LEU A 7 -2.322 3.161 2.967 1.00 14.12 C ATOM 98 H LEU A 7 -0.663 6.088 -0.545 1.00 42.53 H ATOM 99 HA LEU A 7 -2.748 4.352 -1.177 1.00 75.42 H ATOM 100 HB2 LEU A 7 -1.238 3.671 0.485 1.00 74.41 H ATOM 101 HB3 LEU A 7 -1.476 5.145 1.421 1.00 31.55 H ATOM 102 HG LEU A 7 -3.765 4.364 1.978 1.00 63.10 H ATOM 103 HD11 LEU A 7 -3.040 1.630 1.061 1.00 71.55 H ATOM 104 HD12 LEU A 7 -3.680 2.775 -0.118 1.00 32.45 H ATOM 105 HD13 LEU A 7 -4.627 2.357 1.310 1.00 34.02 H ATOM 106 HD21 LEU A 7 -1.801 3.973 3.452 1.00 63.13 H ATOM 107 HD22 LEU A 7 -1.620 2.379 2.718 1.00 33.15 H ATOM 108 HD23 LEU A 7 -3.077 2.769 3.633 1.00 32.53 H ATOM 109 N ASN A 8 -3.679 6.911 0.696 1.00 70.35 N ATOM 110 CA ASN A 8 -4.831 7.706 1.106 1.00 60.44 C ATOM 111 C ASN A 8 -5.423 8.458 -0.082 1.00 74.01 C ATOM 112 O ASN A 8 -6.638 8.459 -0.287 1.00 41.23 O ATOM 113 CB ASN A 8 -4.430 8.695 2.202 1.00 71.12 C ATOM 114 CG ASN A 8 -5.556 8.957 3.184 1.00 43.45 C ATOM 115 OD1 ASN A 8 -6.068 8.036 3.819 1.00 70.54 O ATOM 116 ND2 ASN A 8 -5.946 10.220 3.312 1.00 52.12 N ATOM 117 H ASN A 8 -2.784 7.179 0.991 1.00 30.33 H ATOM 118 HA ASN A 8 -5.577 7.031 1.498 1.00 63.55 H ATOM 119 HB2 ASN A 8 -3.588 8.295 2.748 1.00 1.51 H ATOM 120 HB3 ASN A 8 -4.147 9.632 1.747 1.00 12.21 H ATOM 121 HD21 ASN A 8 -5.493 10.902 2.774 1.00 43.35 H ATOM 122 HD22 ASN A 8 -6.672 10.418 3.940 1.00 4.22 H ATOM 123 N LEU A 9 -4.558 9.096 -0.862 1.00 0.51 N ATOM 124 CA LEU A 9 -4.995 9.853 -2.031 1.00 24.34 C ATOM 125 C LEU A 9 -5.832 8.981 -2.961 1.00 52.52 C ATOM 126 O LEU A 9 -6.913 9.380 -3.396 1.00 11.14 O ATOM 127 CB LEU A 9 -3.785 10.408 -2.785 1.00 21.35 C ATOM 128 CG LEU A 9 -4.095 11.315 -3.976 1.00 22.40 C ATOM 129 CD1 LEU A 9 -3.086 12.449 -4.060 1.00 45.10 C ATOM 130 CD2 LEU A 9 -4.106 10.512 -5.269 1.00 32.34 C ATOM 131 H LEU A 9 -3.603 9.059 -0.648 1.00 2.11 H ATOM 132 HA LEU A 9 -5.602 10.676 -1.685 1.00 23.15 H ATOM 133 HB2 LEU A 9 -3.190 10.974 -2.084 1.00 73.12 H ATOM 134 HB3 LEU A 9 -3.209 9.568 -3.147 1.00 43.33 H ATOM 135 HG LEU A 9 -5.076 11.750 -3.843 1.00 44.32 H ATOM 136 HD11 LEU A 9 -2.923 12.710 -5.095 1.00 1.23 H ATOM 137 HD12 LEU A 9 -2.152 12.134 -3.617 1.00 53.11 H ATOM 138 HD13 LEU A 9 -3.465 13.308 -3.526 1.00 42.44 H ATOM 139 HD21 LEU A 9 -4.971 9.865 -5.283 1.00 52.53 H ATOM 140 HD22 LEU A 9 -3.209 9.914 -5.328 1.00 63.04 H ATOM 141 HD23 LEU A 9 -4.146 11.187 -6.111 1.00 63.23 H ATOM 142 N TYR A 10 -5.327 7.790 -3.261 1.00 52.24 N ATOM 143 CA TYR A 10 -6.029 6.862 -4.140 1.00 44.15 C ATOM 144 C TYR A 10 -7.310 6.354 -3.486 1.00 4.22 C ATOM 145 O TYR A 10 -8.378 6.367 -4.096 1.00 50.32 O ATOM 146 CB TYR A 10 -5.123 5.682 -4.498 1.00 40.52 C ATOM 147 CG TYR A 10 -5.773 4.679 -5.423 1.00 74.41 C ATOM 148 CD1 TYR A 10 -6.598 3.678 -4.924 1.00 71.31 C ATOM 149 CD2 TYR A 10 -5.563 4.730 -6.795 1.00 45.03 C ATOM 150 CE1 TYR A 10 -7.194 2.758 -5.765 1.00 60.21 C ATOM 151 CE2 TYR A 10 -6.155 3.815 -7.644 1.00 14.31 C ATOM 152 CZ TYR A 10 -6.970 2.831 -7.124 1.00 40.11 C ATOM 153 OH TYR A 10 -7.561 1.917 -7.966 1.00 12.10 O ATOM 154 H TYR A 10 -4.461 7.529 -2.884 1.00 73.23 H ATOM 155 HA TYR A 10 -6.286 7.393 -5.045 1.00 72.23 H ATOM 156 HB2 TYR A 10 -4.235 6.054 -4.985 1.00 43.02 H ATOM 157 HB3 TYR A 10 -4.842 5.166 -3.592 1.00 63.22 H ATOM 158 HD1 TYR A 10 -6.772 3.623 -3.859 1.00 62.11 H ATOM 159 HD2 TYR A 10 -4.923 5.502 -7.199 1.00 54.11 H ATOM 160 HE1 TYR A 10 -7.832 1.987 -5.359 1.00 32.03 H ATOM 161 HE2 TYR A 10 -5.980 3.872 -8.708 1.00 43.20 H ATOM 162 HH TYR A 10 -7.365 2.148 -8.877 1.00 71.01 H ATOM 163 N GLN A 11 -7.192 5.908 -2.239 1.00 75.13 N ATOM 164 CA GLN A 11 -8.341 5.395 -1.501 1.00 4.41 C ATOM 165 C GLN A 11 -9.474 6.416 -1.480 1.00 21.21 C ATOM 166 O GLN A 11 -10.631 6.080 -1.734 1.00 41.22 O ATOM 167 CB GLN A 11 -7.935 5.037 -0.070 1.00 62.44 C ATOM 168 CG GLN A 11 -9.047 4.379 0.731 1.00 61.14 C ATOM 169 CD GLN A 11 -8.635 4.070 2.157 1.00 50.15 C ATOM 170 OE1 GLN A 11 -7.914 3.105 2.412 1.00 71.15 O ATOM 171 NE2 GLN A 11 -9.092 4.890 3.096 1.00 45.43 N ATOM 172 H GLN A 11 -6.314 5.923 -1.807 1.00 0.23 H ATOM 173 HA GLN A 11 -8.685 4.504 -2.002 1.00 34.51 H ATOM 174 HB2 GLN A 11 -7.096 4.358 -0.106 1.00 70.33 H ATOM 175 HB3 GLN A 11 -7.636 5.938 0.443 1.00 11.52 H ATOM 176 HG2 GLN A 11 -9.898 5.044 0.754 1.00 23.44 H ATOM 177 HG3 GLN A 11 -9.326 3.456 0.244 1.00 40.12 H ATOM 178 HE21 GLN A 11 -9.662 5.638 2.819 1.00 53.21 H ATOM 179 HE22 GLN A 11 -8.842 4.714 4.026 1.00 64.12 H ATOM 180 N LYS A 12 -9.134 7.664 -1.175 1.00 32.54 N ATOM 181 CA LYS A 12 -10.122 8.735 -1.121 1.00 32.52 C ATOM 182 C LYS A 12 -10.720 8.993 -2.500 1.00 40.11 C ATOM 183 O LYS A 12 -11.939 8.975 -2.672 1.00 50.42 O ATOM 184 CB LYS A 12 -9.485 10.017 -0.581 1.00 14.03 C ATOM 185 CG LYS A 12 -10.475 11.153 -0.389 1.00 2.33 C ATOM 186 CD LYS A 12 -10.034 12.407 -1.125 1.00 4.34 C ATOM 187 CE LYS A 12 -10.706 12.522 -2.484 1.00 33.40 C ATOM 188 NZ LYS A 12 -11.434 13.812 -2.636 1.00 32.21 N ATOM 189 H LYS A 12 -8.195 7.869 -0.982 1.00 11.45 H ATOM 190 HA LYS A 12 -10.911 8.425 -0.452 1.00 41.11 H ATOM 191 HB2 LYS A 12 -9.026 9.803 0.373 1.00 63.52 H ATOM 192 HB3 LYS A 12 -8.723 10.345 -1.273 1.00 23.15 H ATOM 193 HG2 LYS A 12 -11.439 10.847 -0.767 1.00 43.23 H ATOM 194 HG3 LYS A 12 -10.554 11.375 0.666 1.00 31.12 H ATOM 195 HD2 LYS A 12 -10.294 13.272 -0.533 1.00 13.21 H ATOM 196 HD3 LYS A 12 -8.962 12.374 -1.264 1.00 53.03 H ATOM 197 HE2 LYS A 12 -9.951 12.452 -3.252 1.00 31.33 H ATOM 198 HE3 LYS A 12 -11.407 11.707 -2.593 1.00 53.35 H ATOM 199 HZ1 LYS A 12 -12.138 13.916 -1.878 1.00 55.40 H ATOM 200 HZ2 LYS A 12 -11.922 13.841 -3.554 1.00 62.43 H ATOM 201 HZ3 LYS A 12 -10.766 14.607 -2.586 1.00 71.01 H ATOM 202 N TYR A 13 -9.855 9.232 -3.479 1.00 62.54 N ATOM 203 CA TYR A 13 -10.298 9.495 -4.843 1.00 61.55 C ATOM 204 C TYR A 13 -11.221 8.386 -5.340 1.00 30.13 C ATOM 205 O TYR A 13 -12.230 8.650 -5.993 1.00 64.12 O ATOM 206 CB TYR A 13 -9.093 9.626 -5.777 1.00 13.32 C ATOM 207 CG TYR A 13 -9.367 10.466 -7.004 1.00 10.31 C ATOM 208 CD1 TYR A 13 -9.644 11.823 -6.893 1.00 10.41 C ATOM 209 CD2 TYR A 13 -9.350 9.903 -8.274 1.00 3.12 C ATOM 210 CE1 TYR A 13 -9.896 12.595 -8.011 1.00 65.11 C ATOM 211 CE2 TYR A 13 -9.599 10.667 -9.397 1.00 45.05 C ATOM 212 CZ TYR A 13 -9.871 12.012 -9.261 1.00 51.20 C ATOM 213 OH TYR A 13 -10.121 12.776 -10.378 1.00 2.42 O ATOM 214 H TYR A 13 -8.895 9.232 -3.280 1.00 53.45 H ATOM 215 HA TYR A 13 -10.843 10.427 -4.841 1.00 42.22 H ATOM 216 HB2 TYR A 13 -8.277 10.083 -5.238 1.00 55.23 H ATOM 217 HB3 TYR A 13 -8.794 8.643 -6.108 1.00 23.32 H ATOM 218 HD1 TYR A 13 -9.662 12.277 -5.912 1.00 54.04 H ATOM 219 HD2 TYR A 13 -9.136 8.849 -8.377 1.00 73.10 H ATOM 220 HE1 TYR A 13 -10.109 13.648 -7.905 1.00 2.42 H ATOM 221 HE2 TYR A 13 -9.580 10.211 -10.376 1.00 61.13 H ATOM 222 HH TYR A 13 -10.039 13.706 -10.154 1.00 1.41 H ATOM 223 N GLU A 14 -10.867 7.144 -5.023 1.00 53.10 N ATOM 224 CA GLU A 14 -11.664 5.995 -5.437 1.00 24.34 C ATOM 225 C GLU A 14 -12.942 5.893 -4.610 1.00 32.21 C ATOM 226 O GLU A 14 -13.974 5.430 -5.096 1.00 33.53 O ATOM 227 CB GLU A 14 -10.850 4.706 -5.299 1.00 1.34 C ATOM 228 CG GLU A 14 -10.200 4.255 -6.596 1.00 33.32 C ATOM 229 CD GLU A 14 -11.205 4.058 -7.714 1.00 54.41 C ATOM 230 OE1 GLU A 14 -12.374 3.738 -7.413 1.00 20.01 O ATOM 231 OE2 GLU A 14 -10.822 4.226 -8.891 1.00 74.41 O ATOM 232 H GLU A 14 -10.052 6.998 -4.500 1.00 22.32 H ATOM 233 HA GLU A 14 -11.930 6.132 -6.474 1.00 21.33 H ATOM 234 HB2 GLU A 14 -10.072 4.862 -4.565 1.00 54.54 H ATOM 235 HB3 GLU A 14 -11.503 3.918 -4.954 1.00 71.04 H ATOM 236 HG2 GLU A 14 -9.484 5.001 -6.904 1.00 2.42 H ATOM 237 HG3 GLU A 14 -9.690 3.319 -6.421 1.00 74.44 H ATOM 238 N LYS A 15 -12.866 6.329 -3.357 1.00 62.40 N ATOM 239 CA LYS A 15 -14.015 6.288 -2.461 1.00 14.10 C ATOM 240 C LYS A 15 -15.113 7.233 -2.941 1.00 22.41 C ATOM 241 O LYS A 15 -16.207 6.797 -3.302 1.00 61.01 O ATOM 242 CB LYS A 15 -13.593 6.661 -1.038 1.00 45.54 C ATOM 243 CG LYS A 15 -14.733 6.624 -0.035 1.00 45.24 C ATOM 244 CD LYS A 15 -14.614 5.432 0.900 1.00 41.34 C ATOM 245 CE LYS A 15 -14.756 4.118 0.148 1.00 73.23 C ATOM 246 NZ LYS A 15 -14.482 2.945 1.024 1.00 43.33 N ATOM 247 H LYS A 15 -12.015 6.687 -3.027 1.00 1.30 H ATOM 248 HA LYS A 15 -14.400 5.280 -2.460 1.00 71.41 H ATOM 249 HB2 LYS A 15 -12.829 5.972 -0.710 1.00 21.10 H ATOM 250 HB3 LYS A 15 -13.182 7.661 -1.048 1.00 54.24 H ATOM 251 HG2 LYS A 15 -14.714 7.531 0.551 1.00 73.12 H ATOM 252 HG3 LYS A 15 -15.669 6.558 -0.571 1.00 50.30 H ATOM 253 HD2 LYS A 15 -13.647 5.457 1.379 1.00 24.51 H ATOM 254 HD3 LYS A 15 -15.391 5.495 1.649 1.00 63.34 H ATOM 255 HE2 LYS A 15 -15.763 4.043 -0.233 1.00 51.45 H ATOM 256 HE3 LYS A 15 -14.058 4.112 -0.676 1.00 51.33 H ATOM 257 HZ1 LYS A 15 -14.703 3.178 2.013 1.00 40.13 H ATOM 258 HZ2 LYS A 15 -13.479 2.677 0.958 1.00 42.44 H ATOM 259 HZ3 LYS A 15 -15.065 2.136 0.730 1.00 23.24 H ATOM 260 N LEU A 16 -14.814 8.527 -2.944 1.00 25.14 N ATOM 261 CA LEU A 16 -15.775 9.533 -3.381 1.00 45.50 C ATOM 262 C LEU A 16 -16.041 9.417 -4.878 1.00 51.44 C ATOM 263 O LEU A 16 -17.074 9.870 -5.374 1.00 31.45 O ATOM 264 CB LEU A 16 -15.260 10.936 -3.050 1.00 74.32 C ATOM 265 CG LEU A 16 -15.291 11.331 -1.573 1.00 72.33 C ATOM 266 CD1 LEU A 16 -14.073 10.780 -0.848 1.00 34.11 C ATOM 267 CD2 LEU A 16 -15.362 12.844 -1.427 1.00 71.24 C ATOM 268 H LEU A 16 -13.926 8.813 -2.645 1.00 3.53 H ATOM 269 HA LEU A 16 -16.698 9.363 -2.849 1.00 34.32 H ATOM 270 HB2 LEU A 16 -14.238 11.001 -3.388 1.00 43.14 H ATOM 271 HB3 LEU A 16 -15.865 11.646 -3.597 1.00 23.05 H ATOM 272 HG LEU A 16 -16.173 10.908 -1.112 1.00 72.33 H ATOM 273 HD11 LEU A 16 -13.333 10.472 -1.570 1.00 61.03 H ATOM 274 HD12 LEU A 16 -14.366 9.931 -0.247 1.00 44.14 H ATOM 275 HD13 LEU A 16 -13.658 11.546 -0.209 1.00 61.14 H ATOM 276 HD21 LEU A 16 -16.393 13.162 -1.473 1.00 20.13 H ATOM 277 HD22 LEU A 16 -14.806 13.309 -2.228 1.00 61.40 H ATOM 278 HD23 LEU A 16 -14.936 13.134 -0.478 1.00 12.13 H ATOM 279 N THR A 17 -15.103 8.806 -5.596 1.00 14.23 N ATOM 280 CA THR A 17 -15.237 8.629 -7.036 1.00 50.21 C ATOM 281 C THR A 17 -15.244 9.972 -7.757 1.00 11.52 C ATOM 282 O THR A 17 -15.737 10.083 -8.879 1.00 65.32 O ATOM 283 CB THR A 17 -16.525 7.862 -7.391 1.00 0.42 C ATOM 284 OG1 THR A 17 -16.910 7.019 -6.299 1.00 44.41 O ATOM 285 CG2 THR A 17 -16.326 7.021 -8.642 1.00 74.24 C ATOM 286 H THR A 17 -14.303 8.467 -5.144 1.00 4.32 H ATOM 287 HA THR A 17 -14.392 8.051 -7.381 1.00 31.11 H ATOM 288 HB THR A 17 -17.312 8.579 -7.578 1.00 34.44 H ATOM 289 HG1 THR A 17 -16.124 6.678 -5.866 1.00 25.11 H ATOM 290 HG21 THR A 17 -15.808 6.110 -8.384 1.00 72.35 H ATOM 291 HG22 THR A 17 -15.742 7.576 -9.361 1.00 5.23 H ATOM 292 HG23 THR A 17 -17.288 6.780 -9.070 1.00 71.42 H ATOM 293 N ALA A 18 -14.694 10.992 -7.105 1.00 31.54 N ATOM 294 CA ALA A 18 -14.635 12.327 -7.685 1.00 41.21 C ATOM 295 C ALA A 18 -16.009 12.776 -8.170 1.00 40.35 C ATOM 296 O ALA A 18 -16.472 13.866 -7.831 1.00 34.34 O ATOM 297 CB ALA A 18 -13.632 12.362 -8.829 1.00 22.24 C ATOM 298 H ALA A 18 -14.318 10.841 -6.213 1.00 31.15 H ATOM 299 HA ALA A 18 -14.294 13.009 -6.919 1.00 52.22 H ATOM 300 HB1 ALA A 18 -14.126 12.083 -9.748 1.00 62.01 H ATOM 301 HB2 ALA A 18 -13.229 13.359 -8.924 1.00 0.02 H ATOM 302 HB3 ALA A 18 -12.831 11.667 -8.625 1.00 44.22 H TER 303 ALA A 18 ENDMDL MODEL 17 ATOM 1 N VAL A 1 4.705 -0.016 -2.504 1.00 45.41 N ATOM 2 CA VAL A 1 4.139 1.155 -3.164 1.00 23.13 C ATOM 3 C VAL A 1 4.793 2.438 -2.663 1.00 20.22 C ATOM 4 O VAL A 1 5.628 2.409 -1.759 1.00 14.31 O ATOM 5 CB VAL A 1 2.618 1.245 -2.939 1.00 3.02 C ATOM 6 CG1 VAL A 1 1.915 0.045 -3.554 1.00 62.15 C ATOM 7 CG2 VAL A 1 2.305 1.353 -1.454 1.00 61.11 C ATOM 8 H1 VAL A 1 5.674 -0.062 -2.361 1.00 12.11 H ATOM 9 HA VAL A 1 4.320 1.060 -4.225 1.00 2.53 H ATOM 10 HB VAL A 1 2.255 2.137 -3.428 1.00 33.13 H ATOM 11 HG11 VAL A 1 2.650 -0.626 -3.975 1.00 3.22 H ATOM 12 HG12 VAL A 1 1.349 -0.471 -2.793 1.00 0.12 H ATOM 13 HG13 VAL A 1 1.248 0.380 -4.335 1.00 13.34 H ATOM 14 HG21 VAL A 1 1.236 1.403 -1.314 1.00 33.41 H ATOM 15 HG22 VAL A 1 2.696 0.487 -0.941 1.00 4.33 H ATOM 16 HG23 VAL A 1 2.762 2.246 -1.053 1.00 43.12 H ATOM 17 N ALA A 2 4.407 3.563 -3.256 1.00 63.33 N ATOM 18 CA ALA A 2 4.954 4.857 -2.869 1.00 12.23 C ATOM 19 C ALA A 2 4.396 5.308 -1.523 1.00 52.01 C ATOM 20 O ALA A 2 3.440 6.082 -1.464 1.00 5.41 O ATOM 21 CB ALA A 2 4.659 5.897 -3.940 1.00 33.33 C ATOM 22 H ALA A 2 3.738 3.521 -3.971 1.00 22.13 H ATOM 23 HA ALA A 2 6.026 4.755 -2.786 1.00 45.44 H ATOM 24 HB1 ALA A 2 3.805 5.580 -4.522 1.00 0.45 H ATOM 25 HB2 ALA A 2 4.444 6.845 -3.471 1.00 11.31 H ATOM 26 HB3 ALA A 2 5.517 6.000 -4.587 1.00 10.45 H ATOM 27 N PHE A 3 4.997 4.818 -0.444 1.00 44.22 N ATOM 28 CA PHE A 3 4.559 5.170 0.902 1.00 60.35 C ATOM 29 C PHE A 3 3.121 4.719 1.140 1.00 53.40 C ATOM 30 O PHE A 3 2.474 4.174 0.246 1.00 15.25 O ATOM 31 CB PHE A 3 4.676 6.679 1.121 1.00 54.53 C ATOM 32 CG PHE A 3 5.986 7.252 0.661 1.00 12.52 C ATOM 33 CD1 PHE A 3 7.181 6.635 0.992 1.00 2.10 C ATOM 34 CD2 PHE A 3 6.022 8.409 -0.101 1.00 72.12 C ATOM 35 CE1 PHE A 3 8.389 7.160 0.570 1.00 34.45 C ATOM 36 CE2 PHE A 3 7.226 8.938 -0.526 1.00 20.31 C ATOM 37 CZ PHE A 3 8.411 8.313 -0.189 1.00 11.13 C ATOM 38 H PHE A 3 5.754 4.205 -0.556 1.00 21.12 H ATOM 39 HA PHE A 3 5.203 4.662 1.602 1.00 25.13 H ATOM 40 HB2 PHE A 3 3.887 7.177 0.576 1.00 4.11 H ATOM 41 HB3 PHE A 3 4.570 6.892 2.174 1.00 51.12 H ATOM 42 HD1 PHE A 3 7.165 5.732 1.587 1.00 53.35 H ATOM 43 HD2 PHE A 3 5.096 8.899 -0.365 1.00 3.31 H ATOM 44 HE1 PHE A 3 9.313 6.668 0.836 1.00 11.41 H ATOM 45 HE2 PHE A 3 7.241 9.840 -1.119 1.00 71.12 H ATOM 46 HZ PHE A 3 9.353 8.724 -0.520 1.00 11.14 H ATOM 47 N ALA A 4 2.628 4.951 2.352 1.00 13.22 N ATOM 48 CA ALA A 4 1.266 4.571 2.709 1.00 44.33 C ATOM 49 C ALA A 4 0.281 5.687 2.379 1.00 12.42 C ATOM 50 O ALA A 4 -0.900 5.435 2.137 1.00 52.14 O ATOM 51 CB ALA A 4 1.188 4.214 4.186 1.00 52.14 C ATOM 52 H ALA A 4 3.193 5.389 3.022 1.00 14.50 H ATOM 53 HA ALA A 4 1.004 3.693 2.137 1.00 63.24 H ATOM 54 HB1 ALA A 4 2.045 4.623 4.700 1.00 3.10 H ATOM 55 HB2 ALA A 4 0.284 4.626 4.608 1.00 54.42 H ATOM 56 HB3 ALA A 4 1.180 3.140 4.296 1.00 41.11 H ATOM 57 N LEU A 5 0.772 6.921 2.373 1.00 45.42 N ATOM 58 CA LEU A 5 -0.066 8.077 2.074 1.00 43.34 C ATOM 59 C LEU A 5 -0.800 7.890 0.750 1.00 63.43 C ATOM 60 O LEU A 5 -1.924 8.361 0.578 1.00 54.00 O ATOM 61 CB LEU A 5 0.784 9.349 2.023 1.00 33.41 C ATOM 62 CG LEU A 5 0.801 10.195 3.296 1.00 12.32 C ATOM 63 CD1 LEU A 5 2.033 9.880 4.130 1.00 13.24 C ATOM 64 CD2 LEU A 5 0.752 11.677 2.952 1.00 21.21 C ATOM 65 H LEU A 5 1.721 7.060 2.574 1.00 62.32 H ATOM 66 HA LEU A 5 -0.794 8.172 2.865 1.00 32.00 H ATOM 67 HB2 LEU A 5 1.800 9.059 1.806 1.00 60.45 H ATOM 68 HB3 LEU A 5 0.407 9.965 1.219 1.00 1.23 H ATOM 69 HG LEU A 5 -0.072 9.960 3.889 1.00 33.03 H ATOM 70 HD11 LEU A 5 1.806 9.081 4.819 1.00 31.15 H ATOM 71 HD12 LEU A 5 2.327 10.760 4.683 1.00 24.35 H ATOM 72 HD13 LEU A 5 2.840 9.577 3.480 1.00 40.43 H ATOM 73 HD21 LEU A 5 1.532 11.907 2.241 1.00 34.02 H ATOM 74 HD22 LEU A 5 0.899 12.259 3.850 1.00 43.34 H ATOM 75 HD23 LEU A 5 -0.210 11.915 2.522 1.00 12.03 H ATOM 76 N THR A 6 -0.157 7.196 -0.184 1.00 63.35 N ATOM 77 CA THR A 6 -0.748 6.944 -1.493 1.00 11.35 C ATOM 78 C THR A 6 -2.031 6.130 -1.369 1.00 23.34 C ATOM 79 O THR A 6 -2.959 6.289 -2.163 1.00 3.13 O ATOM 80 CB THR A 6 0.232 6.200 -2.418 1.00 61.35 C ATOM 81 OG1 THR A 6 0.980 5.237 -1.667 1.00 44.34 O ATOM 82 CG2 THR A 6 1.184 7.175 -3.095 1.00 23.54 C ATOM 83 H THR A 6 0.737 6.846 0.012 1.00 22.22 H ATOM 84 HA THR A 6 -0.981 7.899 -1.942 1.00 71.42 H ATOM 85 HB THR A 6 -0.336 5.687 -3.181 1.00 73.14 H ATOM 86 HG1 THR A 6 1.621 4.810 -2.242 1.00 13.51 H ATOM 87 HG21 THR A 6 1.887 7.553 -2.368 1.00 24.41 H ATOM 88 HG22 THR A 6 0.622 7.996 -3.512 1.00 53.51 H ATOM 89 HG23 THR A 6 1.719 6.667 -3.883 1.00 62.42 H ATOM 90 N LEU A 7 -2.077 5.257 -0.368 1.00 53.11 N ATOM 91 CA LEU A 7 -3.248 4.417 -0.139 1.00 41.15 C ATOM 92 C LEU A 7 -4.465 5.265 0.216 1.00 74.43 C ATOM 93 O LEU A 7 -5.518 5.149 -0.410 1.00 33.32 O ATOM 94 CB LEU A 7 -2.968 3.412 0.979 1.00 31.11 C ATOM 95 CG LEU A 7 -4.007 2.305 1.162 1.00 61.32 C ATOM 96 CD1 LEU A 7 -4.202 1.537 -0.136 1.00 75.22 C ATOM 97 CD2 LEU A 7 -3.591 1.364 2.283 1.00 35.51 C ATOM 98 H LEU A 7 -1.307 5.175 0.232 1.00 52.04 H ATOM 99 HA LEU A 7 -3.453 3.879 -1.053 1.00 0.10 H ATOM 100 HB2 LEU A 7 -2.018 2.943 0.772 1.00 15.13 H ATOM 101 HB3 LEU A 7 -2.902 3.961 1.907 1.00 2.44 H ATOM 102 HG LEU A 7 -4.955 2.750 1.432 1.00 43.04 H ATOM 103 HD11 LEU A 7 -4.608 2.197 -0.887 1.00 52.24 H ATOM 104 HD12 LEU A 7 -4.886 0.717 0.030 1.00 10.40 H ATOM 105 HD13 LEU A 7 -3.252 1.149 -0.472 1.00 4.42 H ATOM 106 HD21 LEU A 7 -4.465 0.866 2.677 1.00 22.14 H ATOM 107 HD22 LEU A 7 -3.113 1.930 3.069 1.00 74.41 H ATOM 108 HD23 LEU A 7 -2.900 0.628 1.898 1.00 71.11 H ATOM 109 N ASN A 8 -4.312 6.118 1.223 1.00 52.32 N ATOM 110 CA ASN A 8 -5.399 6.987 1.660 1.00 1.12 C ATOM 111 C ASN A 8 -5.875 7.880 0.518 1.00 20.32 C ATOM 112 O ASN A 8 -7.076 8.068 0.322 1.00 14.12 O ATOM 113 CB ASN A 8 -4.947 7.848 2.841 1.00 11.43 C ATOM 114 CG ASN A 8 -6.023 8.815 3.297 1.00 33.55 C ATOM 115 OD1 ASN A 8 -6.945 8.438 4.022 1.00 63.21 O ATOM 116 ND2 ASN A 8 -5.911 10.068 2.874 1.00 51.12 N ATOM 117 H ASN A 8 -3.448 6.165 1.683 1.00 13.11 H ATOM 118 HA ASN A 8 -6.218 6.359 1.977 1.00 51.34 H ATOM 119 HB2 ASN A 8 -4.693 7.205 3.671 1.00 3.44 H ATOM 120 HB3 ASN A 8 -4.077 8.418 2.552 1.00 25.33 H ATOM 121 HD21 ASN A 8 -5.151 10.296 2.299 1.00 41.43 H ATOM 122 HD22 ASN A 8 -6.593 10.714 3.154 1.00 22.32 H ATOM 123 N LEU A 9 -4.926 8.427 -0.233 1.00 24.40 N ATOM 124 CA LEU A 9 -5.247 9.299 -1.357 1.00 11.41 C ATOM 125 C LEU A 9 -5.965 8.526 -2.459 1.00 2.33 C ATOM 126 O LEU A 9 -6.965 8.990 -3.006 1.00 14.41 O ATOM 127 CB LEU A 9 -3.973 9.938 -1.913 1.00 31.11 C ATOM 128 CG LEU A 9 -4.126 11.343 -2.497 1.00 33.30 C ATOM 129 CD1 LEU A 9 -2.883 12.174 -2.220 1.00 53.24 C ATOM 130 CD2 LEU A 9 -4.401 11.272 -3.992 1.00 61.30 C ATOM 131 H LEU A 9 -3.986 8.240 -0.028 1.00 71.31 H ATOM 132 HA LEU A 9 -5.902 10.078 -0.995 1.00 20.11 H ATOM 133 HB2 LEU A 9 -3.253 9.990 -1.111 1.00 44.13 H ATOM 134 HB3 LEU A 9 -3.595 9.293 -2.694 1.00 3.35 H ATOM 135 HG LEU A 9 -4.967 11.833 -2.025 1.00 23.55 H ATOM 136 HD11 LEU A 9 -2.867 13.027 -2.881 1.00 44.35 H ATOM 137 HD12 LEU A 9 -2.003 11.572 -2.388 1.00 22.35 H ATOM 138 HD13 LEU A 9 -2.898 12.513 -1.195 1.00 22.23 H ATOM 139 HD21 LEU A 9 -3.533 10.876 -4.499 1.00 13.31 H ATOM 140 HD22 LEU A 9 -4.616 12.262 -4.365 1.00 74.03 H ATOM 141 HD23 LEU A 9 -5.249 10.627 -4.172 1.00 30.11 H ATOM 142 N TYR A 10 -5.448 7.345 -2.778 1.00 35.24 N ATOM 143 CA TYR A 10 -6.040 6.507 -3.814 1.00 63.02 C ATOM 144 C TYR A 10 -7.462 6.101 -3.441 1.00 53.22 C ATOM 145 O TYR A 10 -8.397 6.292 -4.218 1.00 51.33 O ATOM 146 CB TYR A 10 -5.184 5.259 -4.041 1.00 13.35 C ATOM 147 CG TYR A 10 -5.584 4.464 -5.263 1.00 12.50 C ATOM 148 CD1 TYR A 10 -6.634 3.556 -5.212 1.00 15.01 C ATOM 149 CD2 TYR A 10 -4.912 4.621 -6.469 1.00 24.15 C ATOM 150 CE1 TYR A 10 -7.003 2.827 -6.326 1.00 31.00 C ATOM 151 CE2 TYR A 10 -5.274 3.897 -7.588 1.00 13.31 C ATOM 152 CZ TYR A 10 -6.320 3.002 -7.512 1.00 34.53 C ATOM 153 OH TYR A 10 -6.684 2.278 -8.624 1.00 62.22 O ATOM 154 H TYR A 10 -4.650 7.029 -2.306 1.00 63.31 H ATOM 155 HA TYR A 10 -6.069 7.082 -4.728 1.00 74.34 H ATOM 156 HB2 TYR A 10 -4.153 5.555 -4.161 1.00 35.24 H ATOM 157 HB3 TYR A 10 -5.270 4.611 -3.180 1.00 53.54 H ATOM 158 HD1 TYR A 10 -7.167 3.421 -4.282 1.00 14.53 H ATOM 159 HD2 TYR A 10 -4.092 5.323 -6.525 1.00 14.14 H ATOM 160 HE1 TYR A 10 -7.822 2.126 -6.267 1.00 34.41 H ATOM 161 HE2 TYR A 10 -4.740 4.033 -8.516 1.00 45.53 H ATOM 162 HH TYR A 10 -7.096 2.862 -9.265 1.00 35.21 H ATOM 163 N GLN A 11 -7.617 5.541 -2.246 1.00 25.21 N ATOM 164 CA GLN A 11 -8.925 5.108 -1.769 1.00 25.31 C ATOM 165 C GLN A 11 -9.894 6.283 -1.696 1.00 70.24 C ATOM 166 O GLN A 11 -11.063 6.161 -2.062 1.00 73.52 O ATOM 167 CB GLN A 11 -8.797 4.451 -0.393 1.00 73.44 C ATOM 168 CG GLN A 11 -10.113 3.920 0.151 1.00 35.43 C ATOM 169 CD GLN A 11 -9.925 3.018 1.355 1.00 35.13 C ATOM 170 OE1 GLN A 11 -9.465 1.883 1.229 1.00 22.15 O ATOM 171 NE2 GLN A 11 -10.282 3.519 2.532 1.00 2.32 N ATOM 172 H GLN A 11 -6.833 5.415 -1.672 1.00 42.31 H ATOM 173 HA GLN A 11 -9.309 4.383 -2.470 1.00 33.52 H ATOM 174 HB2 GLN A 11 -8.103 3.627 -0.464 1.00 22.11 H ATOM 175 HB3 GLN A 11 -8.411 5.178 0.305 1.00 31.14 H ATOM 176 HG2 GLN A 11 -10.732 4.756 0.441 1.00 73.01 H ATOM 177 HG3 GLN A 11 -10.610 3.359 -0.627 1.00 23.52 H ATOM 178 HE21 GLN A 11 -10.643 4.431 2.556 1.00 24.23 H ATOM 179 HE22 GLN A 11 -10.172 2.958 3.327 1.00 41.02 H ATOM 180 N LYS A 12 -9.401 7.422 -1.222 1.00 30.43 N ATOM 181 CA LYS A 12 -10.222 8.620 -1.101 1.00 54.35 C ATOM 182 C LYS A 12 -10.717 9.080 -2.469 1.00 51.41 C ATOM 183 O LYS A 12 -11.891 9.411 -2.636 1.00 73.13 O ATOM 184 CB LYS A 12 -9.428 9.743 -0.431 1.00 23.03 C ATOM 185 CG LYS A 12 -10.230 11.015 -0.221 1.00 55.22 C ATOM 186 CD LYS A 12 -9.423 12.250 -0.584 1.00 1.21 C ATOM 187 CE LYS A 12 -9.131 12.307 -2.075 1.00 64.14 C ATOM 188 NZ LYS A 12 -7.709 12.658 -2.349 1.00 75.32 N ATOM 189 H LYS A 12 -8.461 7.457 -0.946 1.00 44.10 H ATOM 190 HA LYS A 12 -11.076 8.378 -0.486 1.00 64.54 H ATOM 191 HB2 LYS A 12 -9.082 9.397 0.532 1.00 12.35 H ATOM 192 HB3 LYS A 12 -8.572 9.980 -1.047 1.00 20.43 H ATOM 193 HG2 LYS A 12 -11.113 10.980 -0.843 1.00 3.11 H ATOM 194 HG3 LYS A 12 -10.522 11.079 0.818 1.00 51.14 H ATOM 195 HD2 LYS A 12 -9.982 13.131 -0.305 1.00 34.43 H ATOM 196 HD3 LYS A 12 -8.487 12.229 -0.043 1.00 13.51 H ATOM 197 HE2 LYS A 12 -9.344 11.341 -2.508 1.00 3.33 H ATOM 198 HE3 LYS A 12 -9.770 13.052 -2.526 1.00 22.20 H ATOM 199 HZ1 LYS A 12 -7.653 13.589 -2.809 1.00 32.22 H ATOM 200 HZ2 LYS A 12 -7.281 11.947 -2.976 1.00 23.10 H ATOM 201 HZ3 LYS A 12 -7.171 12.689 -1.460 1.00 74.40 H ATOM 202 N TYR A 13 -9.815 9.098 -3.444 1.00 71.20 N ATOM 203 CA TYR A 13 -10.160 9.518 -4.797 1.00 0.21 C ATOM 204 C TYR A 13 -11.156 8.552 -5.430 1.00 71.34 C ATOM 205 O TYR A 13 -12.071 8.965 -6.143 1.00 25.05 O ATOM 206 CB TYR A 13 -8.901 9.610 -5.661 1.00 54.24 C ATOM 207 CG TYR A 13 -9.106 10.376 -6.949 1.00 61.10 C ATOM 208 CD1 TYR A 13 -9.451 11.722 -6.932 1.00 60.24 C ATOM 209 CD2 TYR A 13 -8.955 9.754 -8.182 1.00 72.40 C ATOM 210 CE1 TYR A 13 -9.640 12.425 -8.106 1.00 44.42 C ATOM 211 CE2 TYR A 13 -9.140 10.450 -9.361 1.00 33.42 C ATOM 212 CZ TYR A 13 -9.483 11.785 -9.318 1.00 4.12 C ATOM 213 OH TYR A 13 -9.669 12.482 -10.490 1.00 33.42 O ATOM 214 H TYR A 13 -8.895 8.823 -3.249 1.00 42.14 H ATOM 215 HA TYR A 13 -10.614 10.496 -4.735 1.00 13.23 H ATOM 216 HB2 TYR A 13 -8.124 10.106 -5.101 1.00 42.24 H ATOM 217 HB3 TYR A 13 -8.575 8.613 -5.916 1.00 65.25 H ATOM 218 HD1 TYR A 13 -9.573 12.221 -5.982 1.00 32.32 H ATOM 219 HD2 TYR A 13 -8.687 8.707 -8.212 1.00 54.21 H ATOM 220 HE1 TYR A 13 -9.907 13.471 -8.073 1.00 54.32 H ATOM 221 HE2 TYR A 13 -9.018 9.948 -10.310 1.00 1.34 H ATOM 222 HH TYR A 13 -10.029 11.893 -11.158 1.00 13.24 H ATOM 223 N GLU A 14 -10.971 7.262 -5.164 1.00 41.53 N ATOM 224 CA GLU A 14 -11.853 6.237 -5.708 1.00 62.53 C ATOM 225 C GLU A 14 -13.197 6.236 -4.986 1.00 51.01 C ATOM 226 O GLU A 14 -14.217 5.834 -5.547 1.00 64.13 O ATOM 227 CB GLU A 14 -11.199 4.858 -5.594 1.00 34.33 C ATOM 228 CG GLU A 14 -11.395 3.987 -6.824 1.00 13.25 C ATOM 229 CD GLU A 14 -12.086 2.675 -6.506 1.00 2.23 C ATOM 230 OE1 GLU A 14 -13.212 2.712 -5.968 1.00 31.22 O ATOM 231 OE2 GLU A 14 -11.499 1.611 -6.795 1.00 51.34 O ATOM 232 H GLU A 14 -10.224 6.995 -4.590 1.00 4.25 H ATOM 233 HA GLU A 14 -12.018 6.460 -6.751 1.00 54.42 H ATOM 234 HB2 GLU A 14 -10.139 4.987 -5.434 1.00 51.22 H ATOM 235 HB3 GLU A 14 -11.622 4.343 -4.743 1.00 64.33 H ATOM 236 HG2 GLU A 14 -11.996 4.528 -7.540 1.00 22.23 H ATOM 237 HG3 GLU A 14 -10.429 3.773 -7.255 1.00 5.10 H ATOM 238 N LYS A 15 -13.191 6.689 -3.737 1.00 51.00 N ATOM 239 CA LYS A 15 -14.408 6.742 -2.936 1.00 54.51 C ATOM 240 C LYS A 15 -15.230 7.982 -3.277 1.00 21.31 C ATOM 241 O LYS A 15 -16.460 7.933 -3.313 1.00 12.15 O ATOM 242 CB LYS A 15 -14.063 6.741 -1.445 1.00 70.43 C ATOM 243 CG LYS A 15 -15.264 6.514 -0.543 1.00 42.10 C ATOM 244 CD LYS A 15 -15.168 5.187 0.190 1.00 23.15 C ATOM 245 CE LYS A 15 -16.543 4.661 0.574 1.00 45.04 C ATOM 246 NZ LYS A 15 -16.629 4.340 2.025 1.00 22.02 N ATOM 247 H LYS A 15 -12.347 6.996 -3.344 1.00 43.12 H ATOM 248 HA LYS A 15 -14.993 5.864 -3.163 1.00 14.04 H ATOM 249 HB2 LYS A 15 -13.344 5.958 -1.256 1.00 23.44 H ATOM 250 HB3 LYS A 15 -13.621 7.693 -1.189 1.00 74.02 H ATOM 251 HG2 LYS A 15 -15.313 7.312 0.183 1.00 24.33 H ATOM 252 HG3 LYS A 15 -16.161 6.518 -1.146 1.00 10.04 H ATOM 253 HD2 LYS A 15 -14.685 4.465 -0.451 1.00 23.20 H ATOM 254 HD3 LYS A 15 -14.581 5.323 1.088 1.00 41.20 H ATOM 255 HE2 LYS A 15 -17.280 5.412 0.335 1.00 0.04 H ATOM 256 HE3 LYS A 15 -16.743 3.766 0.003 1.00 2.20 H ATOM 257 HZ1 LYS A 15 -15.683 4.372 2.455 1.00 3.14 H ATOM 258 HZ2 LYS A 15 -17.026 3.388 2.157 1.00 31.21 H ATOM 259 HZ3 LYS A 15 -17.241 5.028 2.508 1.00 50.34 H ATOM 260 N LEU A 16 -14.543 9.091 -3.528 1.00 22.40 N ATOM 261 CA LEU A 16 -15.209 10.343 -3.868 1.00 12.11 C ATOM 262 C LEU A 16 -15.887 10.247 -5.231 1.00 62.10 C ATOM 263 O LEU A 16 -16.816 10.998 -5.530 1.00 4.32 O ATOM 264 CB LEU A 16 -14.203 11.496 -3.866 1.00 34.43 C ATOM 265 CG LEU A 16 -13.707 11.951 -2.493 1.00 13.01 C ATOM 266 CD1 LEU A 16 -12.539 12.913 -2.640 1.00 2.22 C ATOM 267 CD2 LEU A 16 -14.837 12.598 -1.705 1.00 73.22 C ATOM 268 H LEU A 16 -13.565 9.068 -3.484 1.00 65.32 H ATOM 269 HA LEU A 16 -15.962 10.532 -3.117 1.00 73.24 H ATOM 270 HB2 LEU A 16 -13.345 11.186 -4.441 1.00 63.03 H ATOM 271 HB3 LEU A 16 -14.671 12.343 -4.347 1.00 72.54 H ATOM 272 HG LEU A 16 -13.362 11.090 -1.938 1.00 21.40 H ATOM 273 HD11 LEU A 16 -11.960 12.646 -3.511 1.00 52.30 H ATOM 274 HD12 LEU A 16 -11.914 12.857 -1.761 1.00 64.21 H ATOM 275 HD13 LEU A 16 -12.914 13.920 -2.750 1.00 43.33 H ATOM 276 HD21 LEU A 16 -15.454 11.829 -1.264 1.00 55.33 H ATOM 277 HD22 LEU A 16 -15.436 13.205 -2.368 1.00 71.21 H ATOM 278 HD23 LEU A 16 -14.422 13.219 -0.925 1.00 13.22 H ATOM 279 N THR A 17 -15.417 9.315 -6.055 1.00 54.32 N ATOM 280 CA THR A 17 -15.978 9.119 -7.386 1.00 51.51 C ATOM 281 C THR A 17 -15.751 10.345 -8.264 1.00 63.42 C ATOM 282 O THR A 17 -16.463 10.558 -9.245 1.00 21.12 O ATOM 283 CB THR A 17 -17.488 8.822 -7.321 1.00 60.54 C ATOM 284 OG1 THR A 17 -17.802 8.148 -6.098 1.00 33.43 O ATOM 285 CG2 THR A 17 -17.922 7.967 -8.503 1.00 11.13 C ATOM 286 H THR A 17 -14.676 8.747 -5.760 1.00 4.32 H ATOM 287 HA THR A 17 -15.484 8.270 -7.835 1.00 3.13 H ATOM 288 HB THR A 17 -18.026 9.758 -7.356 1.00 51.13 H ATOM 289 HG1 THR A 17 -18.382 8.700 -5.568 1.00 11.03 H ATOM 290 HG21 THR A 17 -18.867 8.329 -8.880 1.00 64.21 H ATOM 291 HG22 THR A 17 -18.031 6.941 -8.184 1.00 74.02 H ATOM 292 HG23 THR A 17 -17.177 8.025 -9.282 1.00 2.11 H ATOM 293 N ALA A 18 -14.753 11.147 -7.906 1.00 73.41 N ATOM 294 CA ALA A 18 -14.431 12.349 -8.664 1.00 5.33 C ATOM 295 C ALA A 18 -15.668 13.215 -8.872 1.00 51.52 C ATOM 296 O ALA A 18 -15.578 14.328 -9.392 1.00 52.34 O ATOM 297 CB ALA A 18 -13.811 11.979 -10.003 1.00 73.03 C ATOM 298 H ALA A 18 -14.221 10.923 -7.114 1.00 51.24 H ATOM 299 HA ALA A 18 -13.700 12.912 -8.101 1.00 10.53 H ATOM 300 HB1 ALA A 18 -13.069 11.208 -9.855 1.00 34.31 H ATOM 301 HB2 ALA A 18 -14.581 11.616 -10.667 1.00 73.53 H ATOM 302 HB3 ALA A 18 -13.343 12.850 -10.436 1.00 55.34 H TER 303 ALA A 18 ENDMDL MODEL 18 ATOM 1 N VAL A 1 1.830 2.022 -5.428 1.00 61.50 N ATOM 2 CA VAL A 1 1.298 2.403 -4.125 1.00 50.24 C ATOM 3 C VAL A 1 2.136 1.815 -2.996 1.00 35.43 C ATOM 4 O VAL A 1 1.772 0.798 -2.405 1.00 2.35 O ATOM 5 CB VAL A 1 -0.163 1.944 -3.959 1.00 41.34 C ATOM 6 CG1 VAL A 1 -0.703 2.362 -2.600 1.00 62.20 C ATOM 7 CG2 VAL A 1 -1.027 2.503 -5.080 1.00 20.11 C ATOM 8 H1 VAL A 1 2.746 2.279 -5.664 1.00 74.23 H ATOM 9 HA VAL A 1 1.325 3.481 -4.056 1.00 53.15 H ATOM 10 HB VAL A 1 -0.189 0.866 -4.017 1.00 0.04 H ATOM 11 HG11 VAL A 1 0.035 2.963 -2.090 1.00 11.55 H ATOM 12 HG12 VAL A 1 -1.608 2.936 -2.733 1.00 33.43 H ATOM 13 HG13 VAL A 1 -0.917 1.481 -2.012 1.00 51.32 H ATOM 14 HG21 VAL A 1 -0.575 3.403 -5.469 1.00 62.34 H ATOM 15 HG22 VAL A 1 -1.110 1.770 -5.869 1.00 2.32 H ATOM 16 HG23 VAL A 1 -2.011 2.732 -4.697 1.00 21.44 H ATOM 17 N ALA A 2 3.259 2.461 -2.701 1.00 32.23 N ATOM 18 CA ALA A 2 4.147 2.003 -1.640 1.00 24.12 C ATOM 19 C ALA A 2 3.903 2.775 -0.348 1.00 21.03 C ATOM 20 O ALA A 2 3.491 2.202 0.661 1.00 1.12 O ATOM 21 CB ALA A 2 5.600 2.140 -2.072 1.00 73.32 C ATOM 22 H ALA A 2 3.495 3.265 -3.208 1.00 14.33 H ATOM 23 HA ALA A 2 3.947 0.956 -1.465 1.00 34.40 H ATOM 24 HB1 ALA A 2 5.788 1.483 -2.909 1.00 45.33 H ATOM 25 HB2 ALA A 2 5.794 3.161 -2.364 1.00 34.00 H ATOM 26 HB3 ALA A 2 6.246 1.871 -1.251 1.00 24.55 H ATOM 27 N PHE A 3 4.160 4.078 -0.385 1.00 4.21 N ATOM 28 CA PHE A 3 3.970 4.929 0.784 1.00 31.21 C ATOM 29 C PHE A 3 2.533 4.843 1.291 1.00 41.55 C ATOM 30 O PHE A 3 1.651 4.329 0.604 1.00 62.23 O ATOM 31 CB PHE A 3 4.319 6.380 0.448 1.00 53.14 C ATOM 32 CG PHE A 3 5.772 6.708 0.641 1.00 33.20 C ATOM 33 CD1 PHE A 3 6.748 6.044 -0.084 1.00 72.03 C ATOM 34 CD2 PHE A 3 6.161 7.679 1.549 1.00 43.42 C ATOM 35 CE1 PHE A 3 8.086 6.343 0.091 1.00 12.40 C ATOM 36 CE2 PHE A 3 7.498 7.983 1.728 1.00 14.31 C ATOM 37 CZ PHE A 3 8.461 7.314 0.999 1.00 21.33 C ATOM 38 H PHE A 3 4.487 4.477 -1.219 1.00 11.32 H ATOM 39 HA PHE A 3 4.634 4.579 1.559 1.00 34.54 H ATOM 40 HB2 PHE A 3 4.071 6.572 -0.585 1.00 54.24 H ATOM 41 HB3 PHE A 3 3.742 7.037 1.080 1.00 13.24 H ATOM 42 HD1 PHE A 3 6.455 5.284 -0.795 1.00 50.03 H ATOM 43 HD2 PHE A 3 5.409 8.203 2.120 1.00 3.24 H ATOM 44 HE1 PHE A 3 8.836 5.818 -0.481 1.00 22.34 H ATOM 45 HE2 PHE A 3 7.788 8.742 2.439 1.00 5.21 H ATOM 46 HZ PHE A 3 9.506 7.550 1.137 1.00 34.43 H ATOM 47 N ALA A 4 2.306 5.352 2.497 1.00 22.34 N ATOM 48 CA ALA A 4 0.977 5.335 3.096 1.00 63.30 C ATOM 49 C ALA A 4 0.153 6.532 2.636 1.00 12.22 C ATOM 50 O ALA A 4 -1.075 6.461 2.559 1.00 4.22 O ATOM 51 CB ALA A 4 1.082 5.315 4.614 1.00 43.22 C ATOM 52 H ALA A 4 3.050 5.749 2.996 1.00 22.43 H ATOM 53 HA ALA A 4 0.482 4.427 2.782 1.00 15.23 H ATOM 54 HB1 ALA A 4 1.906 4.681 4.909 1.00 41.44 H ATOM 55 HB2 ALA A 4 1.252 6.318 4.976 1.00 51.35 H ATOM 56 HB3 ALA A 4 0.164 4.931 5.033 1.00 44.11 H ATOM 57 N LEU A 5 0.834 7.632 2.332 1.00 34.43 N ATOM 58 CA LEU A 5 0.164 8.846 1.880 1.00 14.13 C ATOM 59 C LEU A 5 -0.641 8.584 0.611 1.00 44.11 C ATOM 60 O LEU A 5 -1.845 8.837 0.562 1.00 21.20 O ATOM 61 CB LEU A 5 1.188 9.954 1.629 1.00 20.11 C ATOM 62 CG LEU A 5 1.446 10.907 2.797 1.00 54.35 C ATOM 63 CD1 LEU A 5 1.973 10.145 4.002 1.00 31.30 C ATOM 64 CD2 LEU A 5 2.421 12.001 2.387 1.00 52.23 C ATOM 65 H LEU A 5 1.810 7.628 2.413 1.00 31.32 H ATOM 66 HA LEU A 5 -0.512 9.162 2.661 1.00 21.12 H ATOM 67 HB2 LEU A 5 2.126 9.485 1.372 1.00 15.23 H ATOM 68 HB3 LEU A 5 0.840 10.541 0.791 1.00 12.43 H ATOM 69 HG LEU A 5 0.514 11.378 3.081 1.00 23.41 H ATOM 70 HD11 LEU A 5 2.597 10.796 4.595 1.00 70.11 H ATOM 71 HD12 LEU A 5 2.553 9.298 3.667 1.00 73.45 H ATOM 72 HD13 LEU A 5 1.143 9.798 4.600 1.00 54.01 H ATOM 73 HD21 LEU A 5 1.872 12.842 1.990 1.00 2.41 H ATOM 74 HD22 LEU A 5 3.092 11.620 1.631 1.00 32.21 H ATOM 75 HD23 LEU A 5 2.991 12.316 3.249 1.00 42.24 H ATOM 76 N THR A 6 0.033 8.074 -0.415 1.00 72.55 N ATOM 77 CA THR A 6 -0.619 7.776 -1.685 1.00 25.12 C ATOM 78 C THR A 6 -1.765 6.789 -1.496 1.00 62.24 C ATOM 79 O THR A 6 -2.711 6.762 -2.285 1.00 3.00 O ATOM 80 CB THR A 6 0.379 7.198 -2.706 1.00 61.22 C ATOM 81 OG1 THR A 6 -0.319 6.751 -3.874 1.00 30.33 O ATOM 82 CG2 THR A 6 1.162 6.041 -2.103 1.00 52.21 C ATOM 83 H THR A 6 0.991 7.894 -0.315 1.00 71.02 H ATOM 84 HA THR A 6 -1.013 8.700 -2.082 1.00 34.22 H ATOM 85 HB THR A 6 1.074 7.976 -2.987 1.00 63.25 H ATOM 86 HG1 THR A 6 -0.375 7.469 -4.508 1.00 51.51 H ATOM 87 HG21 THR A 6 1.689 5.517 -2.886 1.00 32.11 H ATOM 88 HG22 THR A 6 0.480 5.363 -1.612 1.00 24.35 H ATOM 89 HG23 THR A 6 1.871 6.423 -1.384 1.00 64.12 H ATOM 90 N LEU A 7 -1.675 5.979 -0.447 1.00 74.12 N ATOM 91 CA LEU A 7 -2.707 4.989 -0.154 1.00 44.44 C ATOM 92 C LEU A 7 -4.022 5.667 0.215 1.00 12.02 C ATOM 93 O LEU A 7 -5.071 5.357 -0.349 1.00 1.45 O ATOM 94 CB LEU A 7 -2.254 4.074 0.984 1.00 22.32 C ATOM 95 CG LEU A 7 -2.419 2.573 0.745 1.00 75.44 C ATOM 96 CD1 LEU A 7 -1.430 1.785 1.589 1.00 33.15 C ATOM 97 CD2 LEU A 7 -3.846 2.139 1.047 1.00 33.51 C ATOM 98 H LEU A 7 -0.898 6.047 0.145 1.00 12.22 H ATOM 99 HA LEU A 7 -2.858 4.396 -1.044 1.00 15.32 H ATOM 100 HB2 LEU A 7 -1.208 4.266 1.167 1.00 62.32 H ATOM 101 HB3 LEU A 7 -2.825 4.334 1.864 1.00 1.51 H ATOM 102 HG LEU A 7 -2.216 2.356 -0.295 1.00 73.11 H ATOM 103 HD11 LEU A 7 -1.832 0.804 1.794 1.00 53.24 H ATOM 104 HD12 LEU A 7 -1.258 2.305 2.520 1.00 33.55 H ATOM 105 HD13 LEU A 7 -0.497 1.688 1.054 1.00 0.11 H ATOM 106 HD21 LEU A 7 -4.346 2.912 1.610 1.00 13.40 H ATOM 107 HD22 LEU A 7 -3.830 1.226 1.625 1.00 45.12 H ATOM 108 HD23 LEU A 7 -4.375 1.968 0.120 1.00 24.22 H ATOM 109 N ASN A 8 -3.958 6.595 1.165 1.00 62.32 N ATOM 110 CA ASN A 8 -5.144 7.318 1.609 1.00 60.14 C ATOM 111 C ASN A 8 -5.737 8.141 0.469 1.00 33.12 C ATOM 112 O ASN A 8 -6.953 8.160 0.270 1.00 3.31 O ATOM 113 CB ASN A 8 -4.799 8.231 2.787 1.00 41.35 C ATOM 114 CG ASN A 8 -5.991 9.040 3.259 1.00 12.53 C ATOM 115 OD1 ASN A 8 -6.080 10.242 3.005 1.00 32.23 O ATOM 116 ND2 ASN A 8 -6.915 8.384 3.951 1.00 21.42 N ATOM 117 H ASN A 8 -3.092 6.798 1.577 1.00 33.23 H ATOM 118 HA ASN A 8 -5.874 6.591 1.930 1.00 32.33 H ATOM 119 HB2 ASN A 8 -4.448 7.628 3.611 1.00 33.13 H ATOM 120 HB3 ASN A 8 -4.018 8.915 2.488 1.00 32.33 H ATOM 121 HD21 ASN A 8 -6.778 7.427 4.116 1.00 44.22 H ATOM 122 HD22 ASN A 8 -7.697 8.882 4.268 1.00 4.34 H ATOM 123 N LEU A 9 -4.872 8.819 -0.276 1.00 61.04 N ATOM 124 CA LEU A 9 -5.309 9.644 -1.397 1.00 73.12 C ATOM 125 C LEU A 9 -5.977 8.792 -2.472 1.00 50.21 C ATOM 126 O LEU A 9 -7.043 9.140 -2.981 1.00 1.10 O ATOM 127 CB LEU A 9 -4.121 10.400 -1.994 1.00 61.53 C ATOM 128 CG LEU A 9 -4.085 11.906 -1.735 1.00 42.13 C ATOM 129 CD1 LEU A 9 -2.654 12.421 -1.776 1.00 32.52 C ATOM 130 CD2 LEU A 9 -4.947 12.642 -2.750 1.00 13.51 C ATOM 131 H LEU A 9 -3.916 8.764 -0.069 1.00 40.32 H ATOM 132 HA LEU A 9 -6.028 10.358 -1.023 1.00 21.44 H ATOM 133 HB2 LEU A 9 -3.218 9.972 -1.585 1.00 53.33 H ATOM 134 HB3 LEU A 9 -4.137 10.247 -3.064 1.00 62.11 H ATOM 135 HG LEU A 9 -4.483 12.105 -0.750 1.00 4.24 H ATOM 136 HD11 LEU A 9 -2.214 12.185 -2.733 1.00 21.43 H ATOM 137 HD12 LEU A 9 -2.081 11.952 -0.990 1.00 63.40 H ATOM 138 HD13 LEU A 9 -2.653 13.491 -1.632 1.00 44.21 H ATOM 139 HD21 LEU A 9 -4.387 13.465 -3.169 1.00 61.33 H ATOM 140 HD22 LEU A 9 -5.833 13.022 -2.261 1.00 64.31 H ATOM 141 HD23 LEU A 9 -5.235 11.962 -3.539 1.00 12.34 H ATOM 142 N TYR A 10 -5.344 7.675 -2.811 1.00 74.44 N ATOM 143 CA TYR A 10 -5.877 6.773 -3.826 1.00 21.20 C ATOM 144 C TYR A 10 -7.254 6.253 -3.424 1.00 41.13 C ATOM 145 O TYR A 10 -8.210 6.339 -4.194 1.00 50.43 O ATOM 146 CB TYR A 10 -4.921 5.599 -4.047 1.00 53.24 C ATOM 147 CG TYR A 10 -5.210 4.812 -5.306 1.00 13.04 C ATOM 148 CD1 TYR A 10 -4.874 5.315 -6.556 1.00 72.02 C ATOM 149 CD2 TYR A 10 -5.819 3.564 -5.243 1.00 40.42 C ATOM 150 CE1 TYR A 10 -5.137 4.599 -7.708 1.00 53.42 C ATOM 151 CE2 TYR A 10 -6.084 2.841 -6.390 1.00 15.11 C ATOM 152 CZ TYR A 10 -5.742 3.363 -7.620 1.00 12.01 C ATOM 153 OH TYR A 10 -6.005 2.647 -8.765 1.00 63.50 O ATOM 154 H TYR A 10 -4.498 7.451 -2.371 1.00 14.05 H ATOM 155 HA TYR A 10 -5.969 7.328 -4.748 1.00 10.11 H ATOM 156 HB2 TYR A 10 -3.912 5.974 -4.116 1.00 63.12 H ATOM 157 HB3 TYR A 10 -4.993 4.922 -3.209 1.00 3.55 H ATOM 158 HD1 TYR A 10 -4.400 6.284 -6.622 1.00 20.33 H ATOM 159 HD2 TYR A 10 -6.086 3.158 -4.278 1.00 41.13 H ATOM 160 HE1 TYR A 10 -4.869 5.008 -8.671 1.00 61.34 H ATOM 161 HE2 TYR A 10 -6.558 1.873 -6.321 1.00 74.14 H ATOM 162 HH TYR A 10 -5.893 3.215 -9.531 1.00 24.13 H ATOM 163 N GLN A 11 -7.345 5.714 -2.213 1.00 15.32 N ATOM 164 CA GLN A 11 -8.605 5.180 -1.708 1.00 1.40 C ATOM 165 C GLN A 11 -9.676 6.265 -1.660 1.00 41.22 C ATOM 166 O GLN A 11 -10.820 6.042 -2.057 1.00 63.43 O ATOM 167 CB GLN A 11 -8.407 4.581 -0.315 1.00 31.23 C ATOM 168 CG GLN A 11 -9.256 3.347 -0.057 1.00 74.42 C ATOM 169 CD GLN A 11 -8.618 2.078 -0.586 1.00 65.34 C ATOM 170 OE1 GLN A 11 -7.491 2.097 -1.084 1.00 75.13 O ATOM 171 NE2 GLN A 11 -9.335 0.965 -0.481 1.00 43.11 N ATOM 172 H GLN A 11 -6.548 5.674 -1.646 1.00 1.41 H ATOM 173 HA GLN A 11 -8.929 4.402 -2.382 1.00 63.00 H ATOM 174 HB2 GLN A 11 -7.369 4.308 -0.197 1.00 41.21 H ATOM 175 HB3 GLN A 11 -8.661 5.326 0.424 1.00 12.33 H ATOM 176 HG2 GLN A 11 -9.402 3.241 1.008 1.00 65.34 H ATOM 177 HG3 GLN A 11 -10.214 3.478 -0.539 1.00 12.14 H ATOM 178 HE21 GLN A 11 -10.225 1.026 -0.074 1.00 61.43 H ATOM 179 HE22 GLN A 11 -8.947 0.131 -0.816 1.00 24.14 H ATOM 180 N LYS A 12 -9.298 7.441 -1.171 1.00 51.43 N ATOM 181 CA LYS A 12 -10.225 8.563 -1.072 1.00 21.42 C ATOM 182 C LYS A 12 -10.739 8.967 -2.450 1.00 13.24 C ATOM 183 O LYS A 12 -11.933 9.206 -2.632 1.00 14.15 O ATOM 184 CB LYS A 12 -9.543 9.756 -0.399 1.00 53.44 C ATOM 185 CG LYS A 12 -10.470 10.938 -0.173 1.00 34.12 C ATOM 186 CD LYS A 12 -9.810 12.249 -0.565 1.00 64.45 C ATOM 187 CE LYS A 12 -9.759 12.417 -2.076 1.00 73.23 C ATOM 188 NZ LYS A 12 -10.109 13.803 -2.492 1.00 52.30 N ATOM 189 H LYS A 12 -8.372 7.559 -0.870 1.00 71.35 H ATOM 190 HA LYS A 12 -11.062 8.249 -0.466 1.00 64.33 H ATOM 191 HB2 LYS A 12 -9.155 9.442 0.558 1.00 63.51 H ATOM 192 HB3 LYS A 12 -8.722 10.084 -1.021 1.00 75.02 H ATOM 193 HG2 LYS A 12 -11.362 10.804 -0.768 1.00 5.21 H ATOM 194 HG3 LYS A 12 -10.737 10.979 0.874 1.00 71.01 H ATOM 195 HD2 LYS A 12 -10.373 13.067 -0.142 1.00 40.03 H ATOM 196 HD3 LYS A 12 -8.801 12.264 -0.176 1.00 53.14 H ATOM 197 HE2 LYS A 12 -8.761 12.189 -2.418 1.00 33.13 H ATOM 198 HE3 LYS A 12 -10.459 11.728 -2.525 1.00 74.23 H ATOM 199 HZ1 LYS A 12 -10.420 13.811 -3.484 1.00 53.32 H ATOM 200 HZ2 LYS A 12 -9.281 14.425 -2.394 1.00 71.02 H ATOM 201 HZ3 LYS A 12 -10.877 14.172 -1.896 1.00 33.01 H ATOM 202 N TYR A 13 -9.832 9.041 -3.417 1.00 24.24 N ATOM 203 CA TYR A 13 -10.194 9.417 -4.778 1.00 2.32 C ATOM 204 C TYR A 13 -11.068 8.347 -5.425 1.00 4.11 C ATOM 205 O TYR A 13 -11.995 8.657 -6.172 1.00 32.43 O ATOM 206 CB TYR A 13 -8.936 9.642 -5.619 1.00 71.10 C ATOM 207 CG TYR A 13 -9.224 9.913 -7.078 1.00 72.04 C ATOM 208 CD1 TYR A 13 -9.313 8.872 -7.994 1.00 61.41 C ATOM 209 CD2 TYR A 13 -9.407 11.210 -7.542 1.00 24.02 C ATOM 210 CE1 TYR A 13 -9.575 9.114 -9.329 1.00 12.34 C ATOM 211 CE2 TYR A 13 -9.671 11.462 -8.874 1.00 63.11 C ATOM 212 CZ TYR A 13 -9.754 10.411 -9.764 1.00 22.04 C ATOM 213 OH TYR A 13 -10.015 10.658 -11.092 1.00 33.02 O ATOM 214 H TYR A 13 -8.895 8.839 -3.210 1.00 72.32 H ATOM 215 HA TYR A 13 -10.752 10.341 -4.729 1.00 70.22 H ATOM 216 HB2 TYR A 13 -8.395 10.488 -5.226 1.00 3.42 H ATOM 217 HB3 TYR A 13 -8.311 8.763 -5.562 1.00 32.34 H ATOM 218 HD1 TYR A 13 -9.173 7.857 -7.650 1.00 65.14 H ATOM 219 HD2 TYR A 13 -9.340 12.031 -6.842 1.00 74.14 H ATOM 220 HE1 TYR A 13 -9.641 8.292 -10.026 1.00 24.35 H ATOM 221 HE2 TYR A 13 -9.810 12.477 -9.215 1.00 51.20 H ATOM 222 HH TYR A 13 -10.059 11.606 -11.238 1.00 75.22 H ATOM 223 N GLU A 14 -10.763 7.087 -5.131 1.00 73.22 N ATOM 224 CA GLU A 14 -11.521 5.970 -5.684 1.00 44.12 C ATOM 225 C GLU A 14 -12.882 5.847 -5.006 1.00 22.44 C ATOM 226 O GLU A 14 -13.839 5.343 -5.594 1.00 64.41 O ATOM 227 CB GLU A 14 -10.738 4.665 -5.524 1.00 11.05 C ATOM 228 CG GLU A 14 -10.879 3.721 -6.706 1.00 43.41 C ATOM 229 CD GLU A 14 -10.644 2.272 -6.327 1.00 50.12 C ATOM 230 OE1 GLU A 14 -11.486 1.705 -5.600 1.00 64.50 O ATOM 231 OE2 GLU A 14 -9.618 1.705 -6.759 1.00 0.44 O ATOM 232 H GLU A 14 -10.012 6.904 -4.529 1.00 71.22 H ATOM 233 HA GLU A 14 -11.672 6.161 -6.736 1.00 32.32 H ATOM 234 HB2 GLU A 14 -9.691 4.900 -5.399 1.00 33.12 H ATOM 235 HB3 GLU A 14 -11.091 4.155 -4.639 1.00 62.13 H ATOM 236 HG2 GLU A 14 -11.876 3.815 -7.108 1.00 53.04 H ATOM 237 HG3 GLU A 14 -10.159 4.002 -7.462 1.00 35.24 H ATOM 238 N LYS A 15 -12.961 6.310 -3.763 1.00 22.22 N ATOM 239 CA LYS A 15 -14.203 6.253 -3.002 1.00 74.01 C ATOM 240 C LYS A 15 -15.126 7.407 -3.381 1.00 33.13 C ATOM 241 O LYS A 15 -16.338 7.229 -3.510 1.00 53.23 O ATOM 242 CB LYS A 15 -13.909 6.293 -1.501 1.00 2.11 C ATOM 243 CG LYS A 15 -15.084 5.866 -0.639 1.00 30.12 C ATOM 244 CD LYS A 15 -14.663 5.633 0.802 1.00 2.15 C ATOM 245 CE LYS A 15 -14.508 6.945 1.557 1.00 75.21 C ATOM 246 NZ LYS A 15 -14.266 6.724 3.010 1.00 51.05 N ATOM 247 H LYS A 15 -12.163 6.701 -3.347 1.00 32.41 H ATOM 248 HA LYS A 15 -14.695 5.322 -3.239 1.00 72.21 H ATOM 249 HB2 LYS A 15 -13.078 5.636 -1.292 1.00 22.34 H ATOM 250 HB3 LYS A 15 -13.636 7.302 -1.227 1.00 12.14 H ATOM 251 HG2 LYS A 15 -15.836 6.640 -0.662 1.00 12.41 H ATOM 252 HG3 LYS A 15 -15.496 4.949 -1.037 1.00 10.35 H ATOM 253 HD2 LYS A 15 -15.414 5.034 1.296 1.00 65.33 H ATOM 254 HD3 LYS A 15 -13.718 5.109 0.812 1.00 64.11 H ATOM 255 HE2 LYS A 15 -13.675 7.489 1.140 1.00 23.32 H ATOM 256 HE3 LYS A 15 -15.412 7.523 1.435 1.00 14.22 H ATOM 257 HZ1 LYS A 15 -13.433 7.263 3.319 1.00 44.30 H ATOM 258 HZ2 LYS A 15 -14.101 5.714 3.194 1.00 24.23 H ATOM 259 HZ3 LYS A 15 -15.091 7.035 3.561 1.00 72.33 H ATOM 260 N LEU A 16 -14.546 8.589 -3.558 1.00 71.42 N ATOM 261 CA LEU A 16 -15.317 9.772 -3.924 1.00 4.10 C ATOM 262 C LEU A 16 -15.875 9.643 -5.338 1.00 30.15 C ATOM 263 O LEU A 16 -16.853 10.301 -5.694 1.00 33.05 O ATOM 264 CB LEU A 16 -14.445 11.025 -3.820 1.00 63.34 C ATOM 265 CG LEU A 16 -14.108 11.493 -2.404 1.00 62.32 C ATOM 266 CD1 LEU A 16 -13.144 12.668 -2.446 1.00 2.24 C ATOM 267 CD2 LEU A 16 -15.376 11.867 -1.650 1.00 63.33 C ATOM 268 H LEU A 16 -13.577 8.668 -3.441 1.00 2.30 H ATOM 269 HA LEU A 16 -16.140 9.858 -3.231 1.00 13.30 H ATOM 270 HB2 LEU A 16 -13.516 10.824 -4.332 1.00 1.13 H ATOM 271 HB3 LEU A 16 -14.963 11.830 -4.322 1.00 31.25 H ATOM 272 HG LEU A 16 -13.626 10.685 -1.870 1.00 41.31 H ATOM 273 HD11 LEU A 16 -12.535 12.603 -3.335 1.00 14.52 H ATOM 274 HD12 LEU A 16 -12.509 12.644 -1.572 1.00 60.13 H ATOM 275 HD13 LEU A 16 -13.703 13.592 -2.458 1.00 14.23 H ATOM 276 HD21 LEU A 16 -15.222 12.799 -1.129 1.00 14.54 H ATOM 277 HD22 LEU A 16 -15.613 11.090 -0.938 1.00 43.12 H ATOM 278 HD23 LEU A 16 -16.192 11.974 -2.350 1.00 41.41 H ATOM 279 N THR A 17 -15.248 8.788 -6.140 1.00 52.32 N ATOM 280 CA THR A 17 -15.683 8.571 -7.514 1.00 45.44 C ATOM 281 C THR A 17 -15.520 9.837 -8.349 1.00 31.14 C ATOM 282 O THR A 17 -16.174 10.001 -9.378 1.00 43.02 O ATOM 283 CB THR A 17 -17.153 8.116 -7.574 1.00 0.44 C ATOM 284 OG1 THR A 17 -17.446 7.262 -6.463 1.00 34.31 O ATOM 285 CG2 THR A 17 -17.440 7.382 -8.875 1.00 13.33 C ATOM 286 H THR A 17 -14.475 8.293 -5.799 1.00 3.13 H ATOM 287 HA THR A 17 -15.068 7.790 -7.939 1.00 14.50 H ATOM 288 HB THR A 17 -17.787 8.990 -7.523 1.00 3.30 H ATOM 289 HG1 THR A 17 -18.319 6.878 -6.576 1.00 55.10 H ATOM 290 HG21 THR A 17 -17.310 6.321 -8.725 1.00 44.21 H ATOM 291 HG22 THR A 17 -16.758 7.724 -9.639 1.00 55.43 H ATOM 292 HG23 THR A 17 -18.456 7.580 -9.183 1.00 10.41 H ATOM 293 N ALA A 18 -14.644 10.729 -7.898 1.00 20.22 N ATOM 294 CA ALA A 18 -14.394 11.979 -8.605 1.00 22.32 C ATOM 295 C ALA A 18 -15.697 12.716 -8.894 1.00 61.03 C ATOM 296 O ALA A 18 -16.112 13.587 -8.129 1.00 23.04 O ATOM 297 CB ALA A 18 -13.638 11.711 -9.898 1.00 1.51 C ATOM 298 H ALA A 18 -14.153 10.541 -7.071 1.00 33.01 H ATOM 299 HA ALA A 18 -13.773 12.600 -7.975 1.00 62.33 H ATOM 300 HB1 ALA A 18 -12.988 12.547 -10.113 1.00 5.02 H ATOM 301 HB2 ALA A 18 -13.048 10.814 -9.791 1.00 22.43 H ATOM 302 HB3 ALA A 18 -14.342 11.586 -10.707 1.00 20.33 H TER 303 ALA A 18 ENDMDL MODEL 19 ATOM 1 N VAL A 1 2.106 -0.037 -5.215 1.00 72.14 N ATOM 2 CA VAL A 1 2.046 0.463 -3.847 1.00 43.02 C ATOM 3 C VAL A 1 3.443 0.742 -3.303 1.00 32.33 C ATOM 4 O VAL A 1 4.369 -0.041 -3.512 1.00 42.32 O ATOM 5 CB VAL A 1 1.334 -0.535 -2.915 1.00 54.03 C ATOM 6 CG1 VAL A 1 2.109 -1.841 -2.838 1.00 62.21 C ATOM 7 CG2 VAL A 1 1.149 0.068 -1.531 1.00 24.22 C ATOM 8 H1 VAL A 1 2.692 0.408 -5.862 1.00 2.20 H ATOM 9 HA VAL A 1 1.482 1.384 -3.853 1.00 10.34 H ATOM 10 HB VAL A 1 0.357 -0.746 -3.326 1.00 41.30 H ATOM 11 HG11 VAL A 1 2.354 -2.174 -3.836 1.00 52.44 H ATOM 12 HG12 VAL A 1 3.018 -1.688 -2.275 1.00 44.34 H ATOM 13 HG13 VAL A 1 1.504 -2.590 -2.348 1.00 64.24 H ATOM 14 HG21 VAL A 1 0.105 0.036 -1.260 1.00 33.21 H ATOM 15 HG22 VAL A 1 1.725 -0.497 -0.813 1.00 65.45 H ATOM 16 HG23 VAL A 1 1.488 1.094 -1.536 1.00 63.22 H ATOM 17 N ALA A 2 3.586 1.862 -2.602 1.00 61.12 N ATOM 18 CA ALA A 2 4.869 2.243 -2.025 1.00 1.10 C ATOM 19 C ALA A 2 4.677 3.066 -0.755 1.00 62.53 C ATOM 20 O ALA A 2 4.958 2.597 0.348 1.00 3.21 O ATOM 21 CB ALA A 2 5.694 3.020 -3.040 1.00 4.22 C ATOM 22 H ALA A 2 2.810 2.445 -2.469 1.00 41.14 H ATOM 23 HA ALA A 2 5.406 1.338 -1.778 1.00 40.41 H ATOM 24 HB1 ALA A 2 6.525 3.496 -2.538 1.00 54.34 H ATOM 25 HB2 ALA A 2 6.069 2.343 -3.793 1.00 54.33 H ATOM 26 HB3 ALA A 2 5.076 3.772 -3.506 1.00 51.40 H ATOM 27 N PHE A 3 4.198 4.294 -0.918 1.00 54.15 N ATOM 28 CA PHE A 3 3.970 5.183 0.215 1.00 32.31 C ATOM 29 C PHE A 3 2.644 4.863 0.899 1.00 73.01 C ATOM 30 O PHE A 3 1.763 4.240 0.307 1.00 15.14 O ATOM 31 CB PHE A 3 3.981 6.642 -0.244 1.00 2.34 C ATOM 32 CG PHE A 3 5.128 7.436 0.312 1.00 5.53 C ATOM 33 CD1 PHE A 3 6.348 7.469 -0.344 1.00 41.44 C ATOM 34 CD2 PHE A 3 4.987 8.150 1.492 1.00 64.32 C ATOM 35 CE1 PHE A 3 7.406 8.200 0.164 1.00 32.52 C ATOM 36 CE2 PHE A 3 6.041 8.882 2.005 1.00 64.21 C ATOM 37 CZ PHE A 3 7.252 8.906 1.341 1.00 24.21 C ATOM 38 H PHE A 3 3.993 4.611 -1.823 1.00 75.24 H ATOM 39 HA PHE A 3 4.771 5.030 0.921 1.00 23.12 H ATOM 40 HB2 PHE A 3 4.048 6.673 -1.321 1.00 0.33 H ATOM 41 HB3 PHE A 3 3.064 7.118 0.070 1.00 60.41 H ATOM 42 HD1 PHE A 3 6.469 6.917 -1.266 1.00 22.45 H ATOM 43 HD2 PHE A 3 4.041 8.131 2.013 1.00 45.12 H ATOM 44 HE1 PHE A 3 8.351 8.216 -0.358 1.00 21.14 H ATOM 45 HE2 PHE A 3 5.919 9.433 2.925 1.00 30.04 H ATOM 46 HZ PHE A 3 8.077 9.477 1.740 1.00 41.32 H ATOM 47 N ALA A 4 2.511 5.294 2.149 1.00 35.20 N ATOM 48 CA ALA A 4 1.293 5.055 2.914 1.00 54.44 C ATOM 49 C ALA A 4 0.254 6.139 2.644 1.00 62.01 C ATOM 50 O ALA A 4 -0.949 5.877 2.655 1.00 73.41 O ATOM 51 CB ALA A 4 1.608 4.983 4.400 1.00 24.42 C ATOM 52 H ALA A 4 3.248 5.785 2.566 1.00 25.15 H ATOM 53 HA ALA A 4 0.889 4.100 2.609 1.00 0.31 H ATOM 54 HB1 ALA A 4 1.075 5.766 4.919 1.00 24.02 H ATOM 55 HB2 ALA A 4 1.303 4.022 4.786 1.00 32.42 H ATOM 56 HB3 ALA A 4 2.670 5.110 4.549 1.00 62.31 H ATOM 57 N LEU A 5 0.726 7.357 2.403 1.00 41.14 N ATOM 58 CA LEU A 5 -0.162 8.482 2.130 1.00 33.25 C ATOM 59 C LEU A 5 -0.864 8.309 0.787 1.00 32.44 C ATOM 60 O LEU A 5 -2.029 8.676 0.631 1.00 52.12 O ATOM 61 CB LEU A 5 0.625 9.793 2.142 1.00 11.31 C ATOM 62 CG LEU A 5 -0.186 11.065 1.890 1.00 62.02 C ATOM 63 CD1 LEU A 5 0.255 12.175 2.831 1.00 24.12 C ATOM 64 CD2 LEU A 5 -0.048 11.507 0.440 1.00 20.51 C ATOM 65 H LEU A 5 1.694 7.505 2.407 1.00 25.32 H ATOM 66 HA LEU A 5 -0.908 8.512 2.911 1.00 25.43 H ATOM 67 HB2 LEU A 5 1.095 9.888 3.109 1.00 65.24 H ATOM 68 HB3 LEU A 5 1.386 9.728 1.378 1.00 62.13 H ATOM 69 HG LEU A 5 -1.231 10.862 2.081 1.00 63.04 H ATOM 70 HD11 LEU A 5 1.063 12.730 2.379 1.00 12.52 H ATOM 71 HD12 LEU A 5 0.592 11.744 3.763 1.00 52.23 H ATOM 72 HD13 LEU A 5 -0.576 12.837 3.021 1.00 14.42 H ATOM 73 HD21 LEU A 5 -1.028 11.593 -0.004 1.00 51.25 H ATOM 74 HD22 LEU A 5 0.532 10.776 -0.105 1.00 34.14 H ATOM 75 HD23 LEU A 5 0.452 12.464 0.401 1.00 31.34 H ATOM 76 N THR A 6 -0.148 7.744 -0.180 1.00 53.45 N ATOM 77 CA THR A 6 -0.702 7.521 -1.510 1.00 12.11 C ATOM 78 C THR A 6 -1.893 6.570 -1.457 1.00 44.50 C ATOM 79 O THR A 6 -2.808 6.659 -2.277 1.00 0.15 O ATOM 80 CB THR A 6 0.356 6.947 -2.470 1.00 44.14 C ATOM 81 OG1 THR A 6 1.163 5.979 -1.789 1.00 54.52 O ATOM 82 CG2 THR A 6 1.242 8.054 -3.023 1.00 70.54 C ATOM 83 H THR A 6 0.775 7.473 0.006 1.00 73.05 H ATOM 84 HA THR A 6 -1.032 8.474 -1.898 1.00 65.03 H ATOM 85 HB THR A 6 -0.151 6.466 -3.295 1.00 4.13 H ATOM 86 HG1 THR A 6 0.598 5.394 -1.280 1.00 35.44 H ATOM 87 HG21 THR A 6 1.995 8.310 -2.294 1.00 20.24 H ATOM 88 HG22 THR A 6 0.639 8.923 -3.239 1.00 2.42 H ATOM 89 HG23 THR A 6 1.720 7.713 -3.930 1.00 32.22 H ATOM 90 N LEU A 7 -1.875 5.662 -0.488 1.00 73.44 N ATOM 91 CA LEU A 7 -2.955 4.694 -0.328 1.00 21.31 C ATOM 92 C LEU A 7 -4.262 5.391 0.036 1.00 42.01 C ATOM 93 O LEU A 7 -5.261 5.267 -0.671 1.00 44.14 O ATOM 94 CB LEU A 7 -2.593 3.670 0.749 1.00 23.05 C ATOM 95 CG LEU A 7 -2.917 2.211 0.426 1.00 53.34 C ATOM 96 CD1 LEU A 7 -1.826 1.601 -0.440 1.00 21.01 C ATOM 97 CD2 LEU A 7 -3.097 1.408 1.705 1.00 13.15 C ATOM 98 H LEU A 7 -1.119 5.640 0.134 1.00 13.02 H ATOM 99 HA LEU A 7 -3.084 4.182 -1.270 1.00 40.32 H ATOM 100 HB2 LEU A 7 -1.531 3.740 0.928 1.00 2.25 H ATOM 101 HB3 LEU A 7 -3.126 3.937 1.651 1.00 74.34 H ATOM 102 HG LEU A 7 -3.845 2.170 -0.129 1.00 44.13 H ATOM 103 HD11 LEU A 7 -2.215 1.412 -1.429 1.00 25.41 H ATOM 104 HD12 LEU A 7 -1.494 0.672 0.001 1.00 54.34 H ATOM 105 HD13 LEU A 7 -0.993 2.286 -0.505 1.00 21.35 H ATOM 106 HD21 LEU A 7 -2.130 1.121 2.089 1.00 3.35 H ATOM 107 HD22 LEU A 7 -3.679 0.522 1.495 1.00 4.53 H ATOM 108 HD23 LEU A 7 -3.613 2.011 2.439 1.00 24.03 H ATOM 109 N ASN A 8 -4.246 6.126 1.143 1.00 1.11 N ATOM 110 CA ASN A 8 -5.430 6.845 1.600 1.00 4.12 C ATOM 111 C ASN A 8 -5.964 7.765 0.506 1.00 25.13 C ATOM 112 O ASN A 8 -7.174 7.865 0.300 1.00 2.52 O ATOM 113 CB ASN A 8 -5.105 7.660 2.854 1.00 45.14 C ATOM 114 CG ASN A 8 -5.396 6.897 4.131 1.00 31.12 C ATOM 115 OD1 ASN A 8 -6.452 6.280 4.272 1.00 71.25 O ATOM 116 ND2 ASN A 8 -4.458 6.936 5.071 1.00 73.04 N ATOM 117 H ASN A 8 -3.419 6.186 1.666 1.00 50.44 H ATOM 118 HA ASN A 8 -6.187 6.115 1.843 1.00 54.54 H ATOM 119 HB2 ASN A 8 -4.056 7.921 2.844 1.00 31.43 H ATOM 120 HB3 ASN A 8 -5.696 8.563 2.852 1.00 3.43 H ATOM 121 HD21 ASN A 8 -3.642 7.448 4.890 1.00 72.24 H ATOM 122 HD22 ASN A 8 -4.621 6.451 5.906 1.00 24.34 H ATOM 123 N LEU A 9 -5.053 8.434 -0.193 1.00 33.13 N ATOM 124 CA LEU A 9 -5.432 9.346 -1.267 1.00 23.41 C ATOM 125 C LEU A 9 -6.042 8.583 -2.438 1.00 53.15 C ATOM 126 O LEU A 9 -7.005 9.040 -3.055 1.00 72.32 O ATOM 127 CB LEU A 9 -4.214 10.141 -1.740 1.00 63.34 C ATOM 128 CG LEU A 9 -4.499 11.303 -2.692 1.00 15.22 C ATOM 129 CD1 LEU A 9 -3.776 12.559 -2.232 1.00 40.31 C ATOM 130 CD2 LEU A 9 -4.093 10.941 -4.113 1.00 53.40 C ATOM 131 H LEU A 9 -4.104 8.313 0.017 1.00 33.35 H ATOM 132 HA LEU A 9 -6.169 10.031 -0.876 1.00 21.34 H ATOM 133 HB2 LEU A 9 -3.721 10.541 -0.868 1.00 1.30 H ATOM 134 HB3 LEU A 9 -3.548 9.455 -2.245 1.00 21.11 H ATOM 135 HG LEU A 9 -5.561 11.510 -2.689 1.00 1.03 H ATOM 136 HD11 LEU A 9 -4.201 13.420 -2.725 1.00 41.33 H ATOM 137 HD12 LEU A 9 -2.728 12.482 -2.481 1.00 41.51 H ATOM 138 HD13 LEU A 9 -3.885 12.666 -1.163 1.00 5.14 H ATOM 139 HD21 LEU A 9 -4.893 11.197 -4.792 1.00 31.00 H ATOM 140 HD22 LEU A 9 -3.896 9.881 -4.172 1.00 2.25 H ATOM 141 HD23 LEU A 9 -3.202 11.489 -4.383 1.00 22.01 H ATOM 142 N TYR A 10 -5.478 7.419 -2.738 1.00 65.14 N ATOM 143 CA TYR A 10 -5.966 6.593 -3.836 1.00 71.30 C ATOM 144 C TYR A 10 -7.384 6.103 -3.560 1.00 32.43 C ATOM 145 O TYR A 10 -8.286 6.286 -4.377 1.00 44.41 O ATOM 146 CB TYR A 10 -5.036 5.399 -4.057 1.00 22.45 C ATOM 147 CG TYR A 10 -5.364 4.596 -5.295 1.00 44.35 C ATOM 148 CD1 TYR A 10 -4.880 4.977 -6.541 1.00 63.33 C ATOM 149 CD2 TYR A 10 -6.158 3.459 -5.221 1.00 22.22 C ATOM 150 CE1 TYR A 10 -5.177 4.247 -7.676 1.00 51.32 C ATOM 151 CE2 TYR A 10 -6.459 2.723 -6.350 1.00 70.51 C ATOM 152 CZ TYR A 10 -5.967 3.121 -7.575 1.00 64.24 C ATOM 153 OH TYR A 10 -6.266 2.391 -8.703 1.00 23.11 O ATOM 154 H TYR A 10 -4.713 7.108 -2.210 1.00 62.04 H ATOM 155 HA TYR A 10 -5.975 7.200 -4.730 1.00 23.54 H ATOM 156 HB2 TYR A 10 -4.021 5.754 -4.151 1.00 74.12 H ATOM 157 HB3 TYR A 10 -5.103 4.737 -3.205 1.00 44.12 H ATOM 158 HD1 TYR A 10 -4.261 5.860 -6.617 1.00 75.41 H ATOM 159 HD2 TYR A 10 -6.542 3.150 -4.259 1.00 72.14 H ATOM 160 HE1 TYR A 10 -4.792 4.559 -8.636 1.00 24.40 H ATOM 161 HE2 TYR A 10 -7.078 1.841 -6.271 1.00 63.35 H ATOM 162 HH TYR A 10 -5.665 1.644 -8.769 1.00 55.41 H ATOM 163 N GLN A 11 -7.572 5.479 -2.401 1.00 75.13 N ATOM 164 CA GLN A 11 -8.880 4.962 -2.016 1.00 54.12 C ATOM 165 C GLN A 11 -9.892 6.094 -1.873 1.00 55.02 C ATOM 166 O GLN A 11 -11.058 5.950 -2.244 1.00 44.34 O ATOM 167 CB GLN A 11 -8.778 4.184 -0.703 1.00 55.21 C ATOM 168 CG GLN A 11 -8.300 5.027 0.468 1.00 55.50 C ATOM 169 CD GLN A 11 -8.046 4.204 1.715 1.00 72.30 C ATOM 170 OE1 GLN A 11 -7.051 3.484 1.805 1.00 34.32 O ATOM 171 NE2 GLN A 11 -8.947 4.305 2.686 1.00 45.42 N ATOM 172 H GLN A 11 -6.814 5.363 -1.792 1.00 15.31 H ATOM 173 HA GLN A 11 -9.215 4.293 -2.795 1.00 3.41 H ATOM 174 HB2 GLN A 11 -9.751 3.785 -0.458 1.00 54.14 H ATOM 175 HB3 GLN A 11 -8.086 3.366 -0.836 1.00 3.42 H ATOM 176 HG2 GLN A 11 -7.382 5.521 0.188 1.00 4.24 H ATOM 177 HG3 GLN A 11 -9.053 5.769 0.691 1.00 1.42 H ATOM 178 HE21 GLN A 11 -9.715 4.898 2.544 1.00 61.25 H ATOM 179 HE22 GLN A 11 -8.808 3.784 3.502 1.00 24.54 H ATOM 180 N LYS A 12 -9.440 7.220 -1.332 1.00 54.33 N ATOM 181 CA LYS A 12 -10.305 8.378 -1.140 1.00 52.44 C ATOM 182 C LYS A 12 -10.770 8.938 -2.481 1.00 12.41 C ATOM 183 O LYS A 12 -11.945 9.265 -2.654 1.00 64.24 O ATOM 184 CB LYS A 12 -9.571 9.463 -0.349 1.00 50.54 C ATOM 185 CG LYS A 12 -10.437 10.666 -0.019 1.00 13.52 C ATOM 186 CD LYS A 12 -9.670 11.968 -0.180 1.00 65.21 C ATOM 187 CE LYS A 12 -9.362 12.256 -1.642 1.00 22.24 C ATOM 188 NZ LYS A 12 -9.593 13.686 -1.986 1.00 0.14 N ATOM 189 H LYS A 12 -8.501 7.274 -1.056 1.00 50.20 H ATOM 190 HA LYS A 12 -11.169 8.058 -0.579 1.00 33.24 H ATOM 191 HB2 LYS A 12 -9.214 9.038 0.577 1.00 61.43 H ATOM 192 HB3 LYS A 12 -8.725 9.804 -0.929 1.00 1.02 H ATOM 193 HG2 LYS A 12 -11.289 10.679 -0.683 1.00 21.04 H ATOM 194 HG3 LYS A 12 -10.777 10.584 1.004 1.00 61.20 H ATOM 195 HD2 LYS A 12 -10.263 12.778 0.217 1.00 20.33 H ATOM 196 HD3 LYS A 12 -8.740 11.898 0.367 1.00 32.55 H ATOM 197 HE2 LYS A 12 -8.328 12.011 -1.833 1.00 74.14 H ATOM 198 HE3 LYS A 12 -9.998 11.638 -2.258 1.00 54.51 H ATOM 199 HZ1 LYS A 12 -10.221 14.126 -1.283 1.00 23.01 H ATOM 200 HZ2 LYS A 12 -10.035 13.761 -2.924 1.00 64.44 H ATOM 201 HZ3 LYS A 12 -8.690 14.201 -1.998 1.00 43.04 H ATOM 202 N TYR A 13 -9.843 9.045 -3.426 1.00 3.43 N ATOM 203 CA TYR A 13 -10.158 9.567 -4.750 1.00 62.24 C ATOM 204 C TYR A 13 -11.082 8.616 -5.505 1.00 20.45 C ATOM 205 O TYR A 13 -11.996 9.048 -6.206 1.00 61.30 O ATOM 206 CB TYR A 13 -8.874 9.791 -5.552 1.00 33.12 C ATOM 207 CG TYR A 13 -9.050 10.726 -6.727 1.00 23.00 C ATOM 208 CD1 TYR A 13 -9.495 12.029 -6.542 1.00 44.32 C ATOM 209 CD2 TYR A 13 -8.772 10.306 -8.022 1.00 3.21 C ATOM 210 CE1 TYR A 13 -9.657 12.887 -7.613 1.00 11.21 C ATOM 211 CE2 TYR A 13 -8.930 11.158 -9.098 1.00 62.52 C ATOM 212 CZ TYR A 13 -9.373 12.447 -8.889 1.00 21.23 C ATOM 213 OH TYR A 13 -9.533 13.297 -9.958 1.00 51.54 O ATOM 214 H TYR A 13 -8.924 8.769 -3.227 1.00 63.05 H ATOM 215 HA TYR A 13 -10.661 10.514 -4.623 1.00 41.01 H ATOM 216 HB2 TYR A 13 -8.122 10.212 -4.903 1.00 41.12 H ATOM 217 HB3 TYR A 13 -8.525 8.842 -5.932 1.00 30.12 H ATOM 218 HD1 TYR A 13 -9.716 12.371 -5.542 1.00 14.44 H ATOM 219 HD2 TYR A 13 -8.425 9.295 -8.182 1.00 52.44 H ATOM 220 HE1 TYR A 13 -10.004 13.897 -7.449 1.00 62.04 H ATOM 221 HE2 TYR A 13 -8.708 10.813 -10.097 1.00 61.33 H ATOM 222 HH TYR A 13 -8.957 14.058 -9.851 1.00 50.03 H ATOM 223 N GLU A 14 -10.836 7.318 -5.353 1.00 72.11 N ATOM 224 CA GLU A 14 -11.646 6.305 -6.020 1.00 21.13 C ATOM 225 C GLU A 14 -13.010 6.170 -5.348 1.00 43.14 C ATOM 226 O GLU A 14 -13.994 5.797 -5.986 1.00 74.41 O ATOM 227 CB GLU A 14 -10.925 4.956 -6.009 1.00 65.54 C ATOM 228 CG GLU A 14 -11.017 4.206 -7.328 1.00 23.01 C ATOM 229 CD GLU A 14 -10.320 2.860 -7.284 1.00 22.13 C ATOM 230 OE1 GLU A 14 -10.933 1.889 -6.793 1.00 12.41 O ATOM 231 OE2 GLU A 14 -9.160 2.778 -7.741 1.00 34.44 O ATOM 232 H GLU A 14 -10.093 7.035 -4.780 1.00 41.44 H ATOM 233 HA GLU A 14 -11.791 6.617 -7.043 1.00 32.12 H ATOM 234 HB2 GLU A 14 -9.881 5.120 -5.784 1.00 51.33 H ATOM 235 HB3 GLU A 14 -11.356 4.336 -5.237 1.00 14.51 H ATOM 236 HG2 GLU A 14 -12.058 4.047 -7.565 1.00 41.11 H ATOM 237 HG3 GLU A 14 -10.560 4.806 -8.101 1.00 50.12 H ATOM 238 N LYS A 15 -13.059 6.476 -4.056 1.00 53.45 N ATOM 239 CA LYS A 15 -14.301 6.391 -3.297 1.00 22.14 C ATOM 240 C LYS A 15 -15.180 7.611 -3.552 1.00 72.20 C ATOM 241 O LYS A 15 -16.401 7.495 -3.672 1.00 4.03 O ATOM 242 CB LYS A 15 -14.000 6.270 -1.801 1.00 11.01 C ATOM 243 CG LYS A 15 -15.233 6.019 -0.951 1.00 35.11 C ATOM 244 CD LYS A 15 -14.869 5.793 0.507 1.00 74.31 C ATOM 245 CE LYS A 15 -16.091 5.887 1.408 1.00 54.03 C ATOM 246 NZ LYS A 15 -15.718 6.171 2.821 1.00 20.21 N ATOM 247 H LYS A 15 -12.240 6.768 -3.603 1.00 14.22 H ATOM 248 HA LYS A 15 -14.829 5.507 -3.622 1.00 4.24 H ATOM 249 HB2 LYS A 15 -13.311 5.452 -1.649 1.00 52.04 H ATOM 250 HB3 LYS A 15 -13.537 7.186 -1.464 1.00 1.31 H ATOM 251 HG2 LYS A 15 -15.887 6.876 -1.019 1.00 30.14 H ATOM 252 HG3 LYS A 15 -15.745 5.143 -1.325 1.00 0.31 H ATOM 253 HD2 LYS A 15 -14.434 4.810 0.612 1.00 1.22 H ATOM 254 HD3 LYS A 15 -14.151 6.541 0.810 1.00 41.32 H ATOM 255 HE2 LYS A 15 -16.728 6.680 1.047 1.00 72.24 H ATOM 256 HE3 LYS A 15 -16.626 4.949 1.367 1.00 44.34 H ATOM 257 HZ1 LYS A 15 -15.754 7.194 3.002 1.00 43.22 H ATOM 258 HZ2 LYS A 15 -14.754 5.829 3.011 1.00 11.11 H ATOM 259 HZ3 LYS A 15 -16.377 5.692 3.468 1.00 42.03 H ATOM 260 N LEU A 16 -14.553 8.779 -3.636 1.00 13.00 N ATOM 261 CA LEU A 16 -15.279 10.021 -3.879 1.00 60.02 C ATOM 262 C LEU A 16 -15.865 10.042 -5.287 1.00 54.21 C ATOM 263 O LEU A 16 -16.817 10.773 -5.565 1.00 34.44 O ATOM 264 CB LEU A 16 -14.353 11.223 -3.682 1.00 33.42 C ATOM 265 CG LEU A 16 -13.979 11.551 -2.236 1.00 41.11 C ATOM 266 CD1 LEU A 16 -12.842 12.561 -2.195 1.00 75.13 C ATOM 267 CD2 LEU A 16 -15.189 12.077 -1.478 1.00 32.41 C ATOM 268 H LEU A 16 -13.580 8.808 -3.532 1.00 43.32 H ATOM 269 HA LEU A 16 -16.087 10.078 -3.165 1.00 22.11 H ATOM 270 HB2 LEU A 16 -13.440 11.029 -4.224 1.00 14.23 H ATOM 271 HB3 LEU A 16 -14.843 12.089 -4.103 1.00 12.11 H ATOM 272 HG LEU A 16 -13.641 10.649 -1.745 1.00 1.15 H ATOM 273 HD11 LEU A 16 -13.243 13.558 -2.293 1.00 55.24 H ATOM 274 HD12 LEU A 16 -12.159 12.366 -3.008 1.00 44.11 H ATOM 275 HD13 LEU A 16 -12.318 12.474 -1.255 1.00 45.01 H ATOM 276 HD21 LEU A 16 -16.006 12.231 -2.167 1.00 11.31 H ATOM 277 HD22 LEU A 16 -14.937 13.013 -1.002 1.00 63.32 H ATOM 278 HD23 LEU A 16 -15.482 11.358 -0.726 1.00 14.42 H ATOM 279 N THR A 17 -15.292 9.234 -6.174 1.00 11.32 N ATOM 280 CA THR A 17 -15.758 9.159 -7.553 1.00 11.33 C ATOM 281 C THR A 17 -15.550 10.485 -8.276 1.00 75.11 C ATOM 282 O THR A 17 -16.211 10.768 -9.275 1.00 35.12 O ATOM 283 CB THR A 17 -17.249 8.778 -7.622 1.00 22.41 C ATOM 284 OG1 THR A 17 -17.596 7.954 -6.503 1.00 13.40 O ATOM 285 CG2 THR A 17 -17.559 8.041 -8.916 1.00 32.40 C ATOM 286 H THR A 17 -14.537 8.677 -5.892 1.00 72.54 H ATOM 287 HA THR A 17 -15.188 8.392 -8.056 1.00 42.11 H ATOM 288 HB THR A 17 -17.838 9.683 -7.590 1.00 73.21 H ATOM 289 HG1 THR A 17 -18.552 7.912 -6.421 1.00 72.13 H ATOM 290 HG21 THR A 17 -18.608 7.788 -8.943 1.00 54.11 H ATOM 291 HG22 THR A 17 -16.970 7.137 -8.966 1.00 34.44 H ATOM 292 HG23 THR A 17 -17.319 8.674 -9.757 1.00 70.42 H ATOM 293 N ALA A 18 -14.628 11.294 -7.766 1.00 63.10 N ATOM 294 CA ALA A 18 -14.331 12.589 -8.366 1.00 33.12 C ATOM 295 C ALA A 18 -15.603 13.406 -8.564 1.00 13.21 C ATOM 296 O ALA A 18 -15.564 14.637 -8.591 1.00 62.10 O ATOM 297 CB ALA A 18 -13.609 12.403 -9.692 1.00 41.30 C ATOM 298 H ALA A 18 -14.134 11.012 -6.968 1.00 44.32 H ATOM 299 HA ALA A 18 -13.672 13.124 -7.697 1.00 33.42 H ATOM 300 HB1 ALA A 18 -13.510 11.348 -9.903 1.00 14.23 H ATOM 301 HB2 ALA A 18 -14.176 12.877 -10.480 1.00 23.23 H ATOM 302 HB3 ALA A 18 -12.629 12.852 -9.633 1.00 64.04 H TER 303 ALA A 18 ENDMDL MODEL 20 ATOM 1 N VAL A 1 3.761 -1.013 -3.644 1.00 70.00 N ATOM 2 CA VAL A 1 3.609 0.292 -3.013 1.00 12.42 C ATOM 3 C VAL A 1 4.243 0.310 -1.627 1.00 30.25 C ATOM 4 O VAL A 1 4.085 -0.631 -0.849 1.00 3.22 O ATOM 5 CB VAL A 1 2.125 0.688 -2.891 1.00 61.44 C ATOM 6 CG1 VAL A 1 1.390 -0.274 -1.970 1.00 53.04 C ATOM 7 CG2 VAL A 1 1.994 2.120 -2.395 1.00 25.52 C ATOM 8 H1 VAL A 1 4.100 -1.063 -4.562 1.00 70.31 H ATOM 9 HA VAL A 1 4.105 1.024 -3.634 1.00 72.23 H ATOM 10 HB VAL A 1 1.676 0.627 -3.872 1.00 32.52 H ATOM 11 HG11 VAL A 1 0.427 -0.516 -2.397 1.00 43.33 H ATOM 12 HG12 VAL A 1 1.971 -1.177 -1.854 1.00 73.24 H ATOM 13 HG13 VAL A 1 1.248 0.190 -1.005 1.00 61.13 H ATOM 14 HG21 VAL A 1 1.081 2.551 -2.776 1.00 43.40 H ATOM 15 HG22 VAL A 1 1.973 2.125 -1.315 1.00 73.42 H ATOM 16 HG23 VAL A 1 2.838 2.699 -2.740 1.00 42.43 H ATOM 17 N ALA A 2 4.961 1.386 -1.324 1.00 12.53 N ATOM 18 CA ALA A 2 5.617 1.528 -0.030 1.00 21.01 C ATOM 19 C ALA A 2 5.082 2.738 0.728 1.00 50.43 C ATOM 20 O ALA A 2 5.051 2.749 1.958 1.00 1.14 O ATOM 21 CB ALA A 2 7.124 1.640 -0.212 1.00 15.42 C ATOM 22 H ALA A 2 5.050 2.103 -1.986 1.00 13.23 H ATOM 23 HA ALA A 2 5.414 0.637 0.546 1.00 24.35 H ATOM 24 HB1 ALA A 2 7.344 1.872 -1.244 1.00 2.33 H ATOM 25 HB2 ALA A 2 7.505 2.426 0.424 1.00 70.44 H ATOM 26 HB3 ALA A 2 7.589 0.703 0.054 1.00 12.23 H ATOM 27 N PHE A 3 4.662 3.757 -0.015 1.00 52.10 N ATOM 28 CA PHE A 3 4.129 4.974 0.587 1.00 23.22 C ATOM 29 C PHE A 3 2.665 4.792 0.976 1.00 51.44 C ATOM 30 O PHE A 3 1.867 4.266 0.201 1.00 53.54 O ATOM 31 CB PHE A 3 4.270 6.151 -0.380 1.00 61.23 C ATOM 32 CG PHE A 3 5.394 7.084 -0.030 1.00 32.22 C ATOM 33 CD1 PHE A 3 6.676 6.599 0.174 1.00 51.41 C ATOM 34 CD2 PHE A 3 5.168 8.445 0.096 1.00 42.05 C ATOM 35 CE1 PHE A 3 7.711 7.456 0.497 1.00 24.33 C ATOM 36 CE2 PHE A 3 6.200 9.306 0.418 1.00 11.34 C ATOM 37 CZ PHE A 3 7.473 8.811 0.618 1.00 25.15 C ATOM 38 H PHE A 3 4.712 3.689 -0.992 1.00 13.12 H ATOM 39 HA PHE A 3 4.703 5.180 1.478 1.00 54.24 H ATOM 40 HB2 PHE A 3 4.453 5.771 -1.374 1.00 71.21 H ATOM 41 HB3 PHE A 3 3.352 6.719 -0.380 1.00 4.43 H ATOM 42 HD1 PHE A 3 6.864 5.540 0.078 1.00 11.15 H ATOM 43 HD2 PHE A 3 4.172 8.834 -0.061 1.00 74.22 H ATOM 44 HE1 PHE A 3 8.706 7.066 0.653 1.00 23.00 H ATOM 45 HE2 PHE A 3 6.010 10.365 0.512 1.00 1.32 H ATOM 46 HZ PHE A 3 8.281 9.482 0.871 1.00 33.24 H ATOM 47 N ALA A 4 2.320 5.232 2.182 1.00 61.44 N ATOM 48 CA ALA A 4 0.952 5.120 2.673 1.00 24.42 C ATOM 49 C ALA A 4 0.114 6.317 2.240 1.00 14.23 C ATOM 50 O ALA A 4 -1.095 6.200 2.035 1.00 13.03 O ATOM 51 CB ALA A 4 0.946 4.988 4.189 1.00 55.20 C ATOM 52 H ALA A 4 3.001 5.642 2.754 1.00 65.14 H ATOM 53 HA ALA A 4 0.521 4.221 2.257 1.00 75.15 H ATOM 54 HB1 ALA A 4 1.930 5.211 4.573 1.00 5.02 H ATOM 55 HB2 ALA A 4 0.230 5.681 4.607 1.00 64.21 H ATOM 56 HB3 ALA A 4 0.672 3.980 4.461 1.00 24.33 H ATOM 57 N LEU A 5 0.762 7.469 2.104 1.00 74.25 N ATOM 58 CA LEU A 5 0.075 8.689 1.695 1.00 12.43 C ATOM 59 C LEU A 5 -0.704 8.470 0.402 1.00 20.53 C ATOM 60 O LEU A 5 -1.892 8.782 0.319 1.00 52.30 O ATOM 61 CB LEU A 5 1.081 9.827 1.511 1.00 32.20 C ATOM 62 CG LEU A 5 1.301 10.731 2.724 1.00 3.03 C ATOM 63 CD1 LEU A 5 2.748 10.659 3.188 1.00 31.20 C ATOM 64 CD2 LEU A 5 0.915 12.166 2.397 1.00 2.11 C ATOM 65 H LEU A 5 1.724 7.500 2.281 1.00 45.11 H ATOM 66 HA LEU A 5 -0.619 8.957 2.478 1.00 31.43 H ATOM 67 HB2 LEU A 5 2.031 9.388 1.249 1.00 43.22 H ATOM 68 HB3 LEU A 5 0.734 10.445 0.695 1.00 20.10 H ATOM 69 HG LEU A 5 0.674 10.392 3.537 1.00 74.11 H ATOM 70 HD11 LEU A 5 2.845 11.153 4.143 1.00 71.03 H ATOM 71 HD12 LEU A 5 3.383 11.147 2.464 1.00 72.04 H ATOM 72 HD13 LEU A 5 3.043 9.624 3.286 1.00 42.24 H ATOM 73 HD21 LEU A 5 0.924 12.756 3.301 1.00 12.23 H ATOM 74 HD22 LEU A 5 -0.075 12.183 1.965 1.00 24.53 H ATOM 75 HD23 LEU A 5 1.623 12.577 1.691 1.00 15.11 H ATOM 76 N THR A 6 -0.027 7.927 -0.605 1.00 52.13 N ATOM 77 CA THR A 6 -0.655 7.664 -1.894 1.00 12.01 C ATOM 78 C THR A 6 -1.857 6.739 -1.741 1.00 60.22 C ATOM 79 O THR A 6 -2.791 6.780 -2.543 1.00 14.53 O ATOM 80 CB THR A 6 0.341 7.034 -2.886 1.00 34.01 C ATOM 81 OG1 THR A 6 -0.319 6.742 -4.123 1.00 44.52 O ATOM 82 CG2 THR A 6 0.942 5.759 -2.313 1.00 52.31 C ATOM 83 H THR A 6 0.917 7.700 -0.478 1.00 24.34 H ATOM 84 HA THR A 6 -0.989 8.607 -2.301 1.00 43.52 H ATOM 85 HB THR A 6 1.138 7.740 -3.069 1.00 62.11 H ATOM 86 HG1 THR A 6 0.305 6.836 -4.848 1.00 14.12 H ATOM 87 HG21 THR A 6 1.598 5.311 -3.044 1.00 55.12 H ATOM 88 HG22 THR A 6 0.150 5.067 -2.067 1.00 63.34 H ATOM 89 HG23 THR A 6 1.504 5.995 -1.422 1.00 13.32 H ATOM 90 N LEU A 7 -1.828 5.905 -0.708 1.00 22.42 N ATOM 91 CA LEU A 7 -2.916 4.968 -0.449 1.00 54.52 C ATOM 92 C LEU A 7 -4.193 5.710 -0.065 1.00 43.23 C ATOM 93 O LEU A 7 -5.251 5.489 -0.652 1.00 32.42 O ATOM 94 CB LEU A 7 -2.524 3.995 0.664 1.00 74.24 C ATOM 95 CG LEU A 7 -2.619 2.508 0.319 1.00 42.14 C ATOM 96 CD1 LEU A 7 -1.737 1.688 1.247 1.00 35.45 C ATOM 97 CD2 LEU A 7 -4.063 2.034 0.394 1.00 61.14 C ATOM 98 H LEU A 7 -1.057 5.918 -0.104 1.00 23.32 H ATOM 99 HA LEU A 7 -3.097 4.412 -1.357 1.00 21.34 H ATOM 100 HB2 LEU A 7 -1.503 4.205 0.942 1.00 14.14 H ATOM 101 HB3 LEU A 7 -3.172 4.181 1.508 1.00 13.44 H ATOM 102 HG LEU A 7 -2.268 2.357 -0.693 1.00 73.21 H ATOM 103 HD11 LEU A 7 -1.628 0.690 0.851 1.00 22.41 H ATOM 104 HD12 LEU A 7 -2.193 1.639 2.226 1.00 61.45 H ATOM 105 HD13 LEU A 7 -0.766 2.153 1.326 1.00 0.42 H ATOM 106 HD21 LEU A 7 -4.686 2.680 -0.206 1.00 44.34 H ATOM 107 HD22 LEU A 7 -4.398 2.062 1.420 1.00 4.11 H ATOM 108 HD23 LEU A 7 -4.129 1.022 0.021 1.00 30.33 H ATOM 109 N ASN A 8 -4.084 6.593 0.922 1.00 3.11 N ATOM 110 CA ASN A 8 -5.229 7.369 1.383 1.00 11.33 C ATOM 111 C ASN A 8 -5.789 8.234 0.258 1.00 44.30 C ATOM 112 O ASN A 8 -7.004 8.366 0.107 1.00 0.52 O ATOM 113 CB ASN A 8 -4.830 8.250 2.569 1.00 54.41 C ATOM 114 CG ASN A 8 -5.033 7.554 3.901 1.00 51.03 C ATOM 115 OD1 ASN A 8 -5.918 7.918 4.676 1.00 44.11 O ATOM 116 ND2 ASN A 8 -4.212 6.546 4.172 1.00 1.44 N ATOM 117 H ASN A 8 -3.213 6.726 1.351 1.00 23.22 H ATOM 118 HA ASN A 8 -5.992 6.676 1.702 1.00 34.23 H ATOM 119 HB2 ASN A 8 -3.787 8.515 2.478 1.00 22.32 H ATOM 120 HB3 ASN A 8 -5.428 9.150 2.559 1.00 65.33 H ATOM 121 HD21 ASN A 8 -3.531 6.312 3.508 1.00 64.12 H ATOM 122 HD22 ASN A 8 -4.321 6.078 5.026 1.00 12.12 H ATOM 123 N LEU A 9 -4.895 8.821 -0.530 1.00 44.01 N ATOM 124 CA LEU A 9 -5.298 9.673 -1.643 1.00 51.41 C ATOM 125 C LEU A 9 -6.026 8.865 -2.712 1.00 61.32 C ATOM 126 O LEU A 9 -7.059 9.289 -3.230 1.00 34.12 O ATOM 127 CB LEU A 9 -4.076 10.363 -2.252 1.00 71.35 C ATOM 128 CG LEU A 9 -3.958 11.866 -1.999 1.00 43.03 C ATOM 129 CD1 LEU A 9 -2.509 12.252 -1.743 1.00 71.25 C ATOM 130 CD2 LEU A 9 -4.521 12.651 -3.175 1.00 61.12 C ATOM 131 H LEU A 9 -3.940 8.678 -0.361 1.00 14.35 H ATOM 132 HA LEU A 9 -5.971 10.425 -1.258 1.00 4.24 H ATOM 133 HB2 LEU A 9 -3.194 9.889 -1.849 1.00 52.32 H ATOM 134 HB3 LEU A 9 -4.109 10.208 -3.322 1.00 21.34 H ATOM 135 HG LEU A 9 -4.531 12.123 -1.119 1.00 73.23 H ATOM 136 HD11 LEU A 9 -2.295 12.166 -0.689 1.00 64.31 H ATOM 137 HD12 LEU A 9 -2.346 13.271 -2.062 1.00 74.20 H ATOM 138 HD13 LEU A 9 -1.858 11.593 -2.299 1.00 42.01 H ATOM 139 HD21 LEU A 9 -3.983 12.389 -4.074 1.00 24.33 H ATOM 140 HD22 LEU A 9 -4.413 13.709 -2.986 1.00 21.30 H ATOM 141 HD23 LEU A 9 -5.567 12.412 -3.299 1.00 15.42 H ATOM 142 N TYR A 10 -5.481 7.698 -3.037 1.00 21.42 N ATOM 143 CA TYR A 10 -6.078 6.829 -4.044 1.00 40.14 C ATOM 144 C TYR A 10 -7.456 6.348 -3.601 1.00 71.41 C ATOM 145 O TYR A 10 -8.443 6.515 -4.317 1.00 31.31 O ATOM 146 CB TYR A 10 -5.169 5.629 -4.317 1.00 14.13 C ATOM 147 CG TYR A 10 -5.638 4.763 -5.464 1.00 70.10 C ATOM 148 CD1 TYR A 10 -5.476 5.174 -6.781 1.00 60.25 C ATOM 149 CD2 TYR A 10 -6.243 3.534 -5.231 1.00 15.42 C ATOM 150 CE1 TYR A 10 -5.903 4.386 -7.833 1.00 51.10 C ATOM 151 CE2 TYR A 10 -6.672 2.740 -6.276 1.00 73.51 C ATOM 152 CZ TYR A 10 -6.500 3.170 -7.575 1.00 71.32 C ATOM 153 OH TYR A 10 -6.927 2.381 -8.619 1.00 53.52 O ATOM 154 H TYR A 10 -4.657 7.414 -2.590 1.00 25.44 H ATOM 155 HA TYR A 10 -6.185 7.401 -4.954 1.00 44.34 H ATOM 156 HB2 TYR A 10 -4.178 5.983 -4.553 1.00 1.11 H ATOM 157 HB3 TYR A 10 -5.125 5.012 -3.431 1.00 62.13 H ATOM 158 HD1 TYR A 10 -5.008 6.127 -6.980 1.00 41.13 H ATOM 159 HD2 TYR A 10 -6.377 3.201 -4.212 1.00 32.41 H ATOM 160 HE1 TYR A 10 -5.768 4.722 -8.851 1.00 14.44 H ATOM 161 HE2 TYR A 10 -7.140 1.787 -6.074 1.00 53.35 H ATOM 162 HH TYR A 10 -7.452 2.910 -9.225 1.00 40.02 H ATOM 163 N GLN A 11 -7.514 5.750 -2.415 1.00 63.14 N ATOM 164 CA GLN A 11 -8.770 5.244 -1.876 1.00 32.22 C ATOM 165 C GLN A 11 -9.808 6.357 -1.779 1.00 35.32 C ATOM 166 O GLN A 11 -10.974 6.166 -2.127 1.00 62.53 O ATOM 167 CB GLN A 11 -8.543 4.620 -0.498 1.00 13.25 C ATOM 168 CG GLN A 11 -9.584 3.577 -0.123 1.00 1.31 C ATOM 169 CD GLN A 11 -9.068 2.159 -0.269 1.00 51.43 C ATOM 170 OE1 GLN A 11 -8.074 1.781 0.351 1.00 43.12 O ATOM 171 NE2 GLN A 11 -9.743 1.366 -1.092 1.00 70.45 N ATOM 172 H GLN A 11 -6.692 5.646 -1.892 1.00 14.51 H ATOM 173 HA GLN A 11 -9.137 4.484 -2.548 1.00 74.35 H ATOM 174 HB2 GLN A 11 -7.572 4.150 -0.484 1.00 23.50 H ATOM 175 HB3 GLN A 11 -8.566 5.403 0.247 1.00 61.25 H ATOM 176 HG2 GLN A 11 -9.877 3.733 0.905 1.00 70.41 H ATOM 177 HG3 GLN A 11 -10.444 3.700 -0.764 1.00 14.11 H ATOM 178 HE21 GLN A 11 -10.525 1.736 -1.554 1.00 31.30 H ATOM 179 HE22 GLN A 11 -9.431 0.445 -1.207 1.00 33.54 H ATOM 180 N LYS A 12 -9.379 7.520 -1.303 1.00 5.33 N ATOM 181 CA LYS A 12 -10.270 8.665 -1.160 1.00 42.41 C ATOM 182 C LYS A 12 -10.821 9.098 -2.515 1.00 30.10 C ATOM 183 O LYS A 12 -12.028 9.279 -2.676 1.00 12.14 O ATOM 184 CB LYS A 12 -9.532 9.833 -0.502 1.00 2.25 C ATOM 185 CG LYS A 12 -10.417 11.038 -0.233 1.00 2.11 C ATOM 186 CD LYS A 12 -9.652 12.340 -0.401 1.00 0.32 C ATOM 187 CE LYS A 12 -9.397 12.652 -1.868 1.00 33.14 C ATOM 188 NZ LYS A 12 -9.889 14.007 -2.240 1.00 52.22 N ATOM 189 H LYS A 12 -8.438 7.611 -1.041 1.00 43.45 H ATOM 190 HA LYS A 12 -11.093 8.369 -0.528 1.00 61.41 H ATOM 191 HB2 LYS A 12 -9.120 9.498 0.439 1.00 44.50 H ATOM 192 HB3 LYS A 12 -8.724 10.144 -1.149 1.00 21.44 H ATOM 193 HG2 LYS A 12 -11.244 11.027 -0.926 1.00 55.43 H ATOM 194 HG3 LYS A 12 -10.792 10.979 0.779 1.00 3.21 H ATOM 195 HD2 LYS A 12 -10.228 13.145 0.031 1.00 33.35 H ATOM 196 HD3 LYS A 12 -8.703 12.259 0.111 1.00 14.11 H ATOM 197 HE2 LYS A 12 -8.336 12.600 -2.054 1.00 63.11 H ATOM 198 HE3 LYS A 12 -9.905 11.915 -2.472 1.00 34.01 H ATOM 199 HZ1 LYS A 12 -10.299 13.989 -3.196 1.00 31.34 H ATOM 200 HZ2 LYS A 12 -9.104 14.689 -2.224 1.00 64.25 H ATOM 201 HZ3 LYS A 12 -10.618 14.320 -1.568 1.00 1.23 H ATOM 202 N TYR A 13 -9.930 9.260 -3.487 1.00 1.15 N ATOM 203 CA TYR A 13 -10.328 9.672 -4.827 1.00 45.15 C ATOM 204 C TYR A 13 -11.295 8.665 -5.442 1.00 43.24 C ATOM 205 O TYR A 13 -12.249 9.041 -6.122 1.00 60.03 O ATOM 206 CB TYR A 13 -9.097 9.826 -5.722 1.00 63.05 C ATOM 207 CG TYR A 13 -9.344 10.671 -6.951 1.00 44.45 C ATOM 208 CD1 TYR A 13 -9.830 10.105 -8.123 1.00 35.53 C ATOM 209 CD2 TYR A 13 -9.091 12.038 -6.941 1.00 23.31 C ATOM 210 CE1 TYR A 13 -10.057 10.873 -9.248 1.00 43.20 C ATOM 211 CE2 TYR A 13 -9.315 12.814 -8.061 1.00 53.41 C ATOM 212 CZ TYR A 13 -9.798 12.227 -9.212 1.00 42.52 C ATOM 213 OH TYR A 13 -10.023 12.997 -10.331 1.00 32.23 O ATOM 214 H TYR A 13 -8.982 9.101 -3.297 1.00 63.35 H ATOM 215 HA TYR A 13 -10.824 10.628 -4.747 1.00 42.22 H ATOM 216 HB2 TYR A 13 -8.304 10.289 -5.156 1.00 43.20 H ATOM 217 HB3 TYR A 13 -8.775 8.849 -6.051 1.00 24.40 H ATOM 218 HD1 TYR A 13 -10.033 9.043 -8.147 1.00 44.41 H ATOM 219 HD2 TYR A 13 -8.713 12.495 -6.038 1.00 23.43 H ATOM 220 HE1 TYR A 13 -10.435 10.414 -10.149 1.00 60.13 H ATOM 221 HE2 TYR A 13 -9.113 13.875 -8.034 1.00 25.03 H ATOM 222 HH TYR A 13 -10.230 13.896 -10.064 1.00 63.22 H ATOM 223 N GLU A 14 -11.040 7.384 -5.197 1.00 21.31 N ATOM 224 CA GLU A 14 -11.888 6.322 -5.726 1.00 64.04 C ATOM 225 C GLU A 14 -13.211 6.253 -4.969 1.00 5.22 C ATOM 226 O GLU A 14 -14.231 5.832 -5.514 1.00 42.35 O ATOM 227 CB GLU A 14 -11.168 4.974 -5.641 1.00 50.35 C ATOM 228 CG GLU A 14 -10.884 4.349 -6.997 1.00 53.41 C ATOM 229 CD GLU A 14 -11.029 2.840 -6.986 1.00 34.05 C ATOM 230 OE1 GLU A 14 -12.142 2.354 -6.691 1.00 64.14 O ATOM 231 OE2 GLU A 14 -10.032 2.145 -7.270 1.00 43.20 O ATOM 232 H GLU A 14 -10.264 7.147 -4.648 1.00 22.04 H ATOM 233 HA GLU A 14 -12.091 6.546 -6.762 1.00 74.15 H ATOM 234 HB2 GLU A 14 -10.228 5.113 -5.128 1.00 12.32 H ATOM 235 HB3 GLU A 14 -11.780 4.289 -5.074 1.00 21.22 H ATOM 236 HG2 GLU A 14 -11.576 4.756 -7.719 1.00 13.41 H ATOM 237 HG3 GLU A 14 -9.874 4.597 -7.289 1.00 53.01 H ATOM 238 N LYS A 15 -13.185 6.669 -3.707 1.00 53.22 N ATOM 239 CA LYS A 15 -14.381 6.656 -2.873 1.00 1.52 C ATOM 240 C LYS A 15 -15.286 7.840 -3.201 1.00 21.24 C ATOM 241 O LYS A 15 -16.512 7.729 -3.152 1.00 43.20 O ATOM 242 CB LYS A 15 -13.995 6.691 -1.392 1.00 70.23 C ATOM 243 CG LYS A 15 -15.159 6.425 -0.454 1.00 14.21 C ATOM 244 CD LYS A 15 -14.762 5.491 0.677 1.00 75.12 C ATOM 245 CE LYS A 15 -15.530 5.802 1.952 1.00 12.04 C ATOM 246 NZ LYS A 15 -16.800 5.029 2.038 1.00 53.32 N ATOM 247 H LYS A 15 -12.341 6.994 -3.328 1.00 32.00 H ATOM 248 HA LYS A 15 -14.917 5.742 -3.075 1.00 71.22 H ATOM 249 HB2 LYS A 15 -13.237 5.943 -1.213 1.00 31.43 H ATOM 250 HB3 LYS A 15 -13.589 7.665 -1.161 1.00 42.01 H ATOM 251 HG2 LYS A 15 -15.491 7.362 -0.032 1.00 54.22 H ATOM 252 HG3 LYS A 15 -15.966 5.975 -1.015 1.00 32.44 H ATOM 253 HD2 LYS A 15 -14.973 4.473 0.383 1.00 51.54 H ATOM 254 HD3 LYS A 15 -13.704 5.601 0.868 1.00 72.40 H ATOM 255 HE2 LYS A 15 -14.910 5.554 2.800 1.00 72.50 H ATOM 256 HE3 LYS A 15 -15.759 6.857 1.971 1.00 42.41 H ATOM 257 HZ1 LYS A 15 -16.686 4.102 1.582 1.00 22.42 H ATOM 258 HZ2 LYS A 15 -17.566 5.547 1.560 1.00 63.53 H ATOM 259 HZ3 LYS A 15 -17.064 4.885 3.033 1.00 34.31 H ATOM 260 N LEU A 16 -14.675 8.971 -3.536 1.00 21.23 N ATOM 261 CA LEU A 16 -15.426 10.175 -3.874 1.00 1.05 C ATOM 262 C LEU A 16 -16.188 9.992 -5.182 1.00 51.20 C ATOM 263 O LEU A 16 -17.173 10.685 -5.442 1.00 64.13 O ATOM 264 CB LEU A 16 -14.483 11.374 -3.983 1.00 5.21 C ATOM 265 CG LEU A 16 -13.920 11.908 -2.665 1.00 64.30 C ATOM 266 CD1 LEU A 16 -12.870 12.977 -2.927 1.00 14.03 C ATOM 267 CD2 LEU A 16 -15.038 12.457 -1.791 1.00 44.42 C ATOM 268 H LEU A 16 -13.696 8.998 -3.557 1.00 21.12 H ATOM 269 HA LEU A 16 -16.135 10.357 -3.080 1.00 33.51 H ATOM 270 HB2 LEU A 16 -13.650 11.084 -4.605 1.00 24.05 H ATOM 271 HB3 LEU A 16 -15.024 12.177 -4.462 1.00 13.52 H ATOM 272 HG LEU A 16 -13.443 11.098 -2.130 1.00 73.51 H ATOM 273 HD11 LEU A 16 -13.154 13.555 -3.793 1.00 13.53 H ATOM 274 HD12 LEU A 16 -11.914 12.507 -3.105 1.00 14.30 H ATOM 275 HD13 LEU A 16 -12.797 13.627 -2.067 1.00 41.00 H ATOM 276 HD21 LEU A 16 -15.159 11.827 -0.923 1.00 5.22 H ATOM 277 HD22 LEU A 16 -15.959 12.475 -2.355 1.00 3.12 H ATOM 278 HD23 LEU A 16 -14.789 13.461 -1.477 1.00 64.22 H ATOM 279 N THR A 17 -15.728 9.053 -6.003 1.00 0.11 N ATOM 280 CA THR A 17 -16.366 8.778 -7.284 1.00 34.12 C ATOM 281 C THR A 17 -16.262 9.977 -8.219 1.00 50.11 C ATOM 282 O THR A 17 -17.049 10.117 -9.155 1.00 63.50 O ATOM 283 CB THR A 17 -17.851 8.409 -7.104 1.00 12.42 C ATOM 284 OG1 THR A 17 -18.017 7.599 -5.935 1.00 25.11 O ATOM 285 CG2 THR A 17 -18.375 7.664 -8.322 1.00 53.20 C ATOM 286 H THR A 17 -14.940 8.534 -5.740 1.00 5.24 H ATOM 287 HA THR A 17 -15.860 7.937 -7.735 1.00 34.42 H ATOM 288 HB THR A 17 -18.421 9.320 -6.985 1.00 5.13 H ATOM 289 HG1 THR A 17 -17.516 6.785 -6.036 1.00 13.40 H ATOM 290 HG21 THR A 17 -17.544 7.330 -8.924 1.00 40.12 H ATOM 291 HG22 THR A 17 -19.000 8.323 -8.906 1.00 14.40 H ATOM 292 HG23 THR A 17 -18.953 6.811 -8.001 1.00 33.44 H ATOM 293 N ALA A 18 -15.285 10.840 -7.960 1.00 14.40 N ATOM 294 CA ALA A 18 -15.077 12.027 -8.781 1.00 22.31 C ATOM 295 C ALA A 18 -16.369 12.823 -8.934 1.00 25.50 C ATOM 296 O ALA A 18 -16.685 13.676 -8.104 1.00 41.14 O ATOM 297 CB ALA A 18 -14.531 11.635 -10.146 1.00 73.51 C ATOM 298 H ALA A 18 -14.690 10.675 -7.200 1.00 33.35 H ATOM 299 HA ALA A 18 -14.340 12.647 -8.291 1.00 22.44 H ATOM 300 HB1 ALA A 18 -13.455 11.561 -10.095 1.00 24.22 H ATOM 301 HB2 ALA A 18 -14.944 10.681 -10.438 1.00 75.31 H ATOM 302 HB3 ALA A 18 -14.807 12.384 -10.872 1.00 42.44 H TER 303 ALA A 18 ENDMDL MASTER 109 0 0 1 0 0 0 6 147 1 0 2 END