TITLE NMR STRUCTURE OF PW2 BOUND TO SDS MICELLES: A TRYPTOPHAN- TITLE 2 RICH ANTICOCIDIAL PEPTIDE SELECTED FROM PHAGE DISPLAY TITLE 3 LIBRARIES COMPND MOL_ID: 1; COMPND 2 MOLECULE: HIS-PRO-LEU-LYS-GLN-TYR-TRP-TRP-ARG-PRO-SER-ILE; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: PW2; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: SOLID PHASE SYNTHESIS KEYWDS ANTICOCCIDIAL PEPTIDE, EIMERIA, SDS, MICELLE, ANTIMICROBIAL, KEYWDS 2 PW2 EXPDTA NMR, 19 STRUCTURES AUTHOR L.W.TINOCO,A.DA SILVA JR.,A.LEITE,A.P.VALENTE,F.C.ALMEIDA REVDAT 1 14-AUG-02 1M02 0 JRNL AUTH L.W.TINOCO,A.DA SILVA JR.,A.LEITE,A.P.VALENTE, JRNL AUTH 2 F.C.L.ALMEIDA JRNL TITL NMR STRUCTURE OF PW2 BOUND TO SDS MICELLES: A JRNL TITL 2 TRYPTOPHAN-RICH ANTICOCCIDIAL PEPTIDE SELECTED JRNL TITL 3 FROM PHAGE DISPLAY LIBRARIES JRNL REF TO BE PUBLISHED JRNL REFN REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH A.DA SILVA JR.,U.KAWAZOE,F.F.FREITAS,M.S.GATTI, REMARK 1 AUTH 2 H.DOLDER,R.I.SCHUMACHER,M.A.JULIANO,M.J.DA SILVA, REMARK 1 AUTH 3 A.LEITE REMARK 1 TITL AVIAN ANTICOCCIDIAL ACTIVITY OF A NOVEL REMARK 1 TITL 2 MEMBRANE-INTERACTIVE PEPTIDE SELECTED FROM PHAGE REMARK 1 TITL 3 DISPLAY LIBRARIES REMARK 1 REF MOL.BIOCHEM.PARASITOL. V. 120 53 2002 REMARK 1 REFN ASTM MBIPDP NE ISSN 0166-6851 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER, A. T., ADAMS, P.D., CLORE, G.M., REMARK 3 DELANO, W.L., GROS, P., GROSSE-KUNSTLEVE, R.W., REMARK 3 JIANG, J. S., KUSZEWSKI, J., NILGES, M., PANNU, REMARK 3 N.S., READ, R.J., RICE, L.M., SIMONSON, T., REMARK 3 WARREN, G.L. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: CARTESIAN DYNAMICS REMARK 4 REMARK 4 1M02 COMPLIES WITH FORMAT V. 2.3, 09-JULY-1998 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 14-JUN-2002. REMARK 100 THE RCSB ID CODE IS RCSB016429. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 5.0 REMARK 210 IONIC STRENGTH : 100 MM SODIUM CHLORIDE REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 4 MM PW2 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY, 2D TOCSY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ, 400 MHZ REMARK 210 SPECTROMETER MODEL : DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE, NMRVIEW 4.1.2 REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 19 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST REMARK 210 ENERGY REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES: ENGH AND HUBER, 1991 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 14 TRP A 8 N - CA - C ANGL. DEV. = -2.5 DEGREES 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 M RES CSSEQI PSI PHI REMARK 500 3 TRP A 8 -95.67 -175.88 REMARK 500 5 TRP A 8 -94.41 -176.95 REMARK 500 6 TRP A 8 -94.51 -176.92 REMARK 500 12 TRP A 8 -99.51 -170.43 REMARK 500 17 TRP A 8 -98.12 -171.29 REMARK 500 18 TRP A 8 -95.56 -170.50 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1G89 RELATED DB: PDB REMARK 900 INDOLICIDIN BOUND TO DODECYLPHOSPHOCHOLINE MICELLES REMARK 900 RELATED ID: 1G8C RELATED DB: PDB REMARK 900 INDOLICIDIN BOUND TO SODIUM DODECYL SULFATE MICELLES REMARK 900 RELATED ID: 1HR1 RELATED DB: PDB REMARK 900 INDOLICIDIN PEPTIDE DERIVATIVE WITH P-->A SUBSTITUTION REMARK 900 RELATED ID: 1D6X RELATED DB: PDB REMARK 900 TRITRPTICIN BOUND TO MICELLES-A DISTINCT MEMBRANE-BOUND REMARK 900 PEPTIDE FOLD SEQRES 1 A 12 HIS PRO LEU LYS GLN TYR TRP TRP ARG PRO SER ILE 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 HIS A 1 -5.391 7.531 3.239 1.00 0.00 N ATOM 2 CA HIS A 1 -4.515 6.767 2.312 1.00 0.00 C ATOM 3 C HIS A 1 -5.086 5.380 2.030 1.00 0.00 C ATOM 4 O HIS A 1 -5.750 4.788 2.881 1.00 0.00 O ATOM 5 CB HIS A 1 -3.126 6.647 2.943 1.00 0.00 C ATOM 6 CG HIS A 1 -2.472 7.967 3.209 1.00 0.00 C ATOM 7 ND1 HIS A 1 -2.194 8.883 2.218 1.00 0.00 N ATOM 8 CD2 HIS A 1 -2.039 8.524 4.366 1.00 0.00 C ATOM 9 CE1 HIS A 1 -1.618 9.945 2.751 1.00 0.00 C ATOM 10 NE2 HIS A 1 -1.512 9.753 4.053 1.00 0.00 N ATOM 11 1H HIS A 1 -5.515 6.961 4.100 1.00 0.00 H ATOM 12 2H HIS A 1 -6.301 7.688 2.758 1.00 0.00 H ATOM 13 3H HIS A 1 -4.919 8.431 3.452 1.00 0.00 H ATOM 14 HA HIS A 1 -4.438 7.313 1.384 1.00 0.00 H ATOM 15 1HB HIS A 1 -3.209 6.123 3.883 1.00 0.00 H ATOM 16 2HB HIS A 1 -2.485 6.085 2.279 1.00 0.00 H ATOM 17 HD1 HIS A 1 -2.389 8.771 1.263 1.00 0.00 H ATOM 18 HD2 HIS A 1 -2.098 8.084 5.350 1.00 0.00 H ATOM 19 HE1 HIS A 1 -1.288 10.823 2.213 1.00 0.00 H ATOM 20 HE2 HIS A 1 -1.028 10.338 4.671 1.00 0.00 H ATOM 21 N PRO A 2 -4.833 4.840 0.825 1.00 0.00 N ATOM 22 CA PRO A 2 -5.325 3.515 0.436 1.00 0.00 C ATOM 23 C PRO A 2 -4.957 2.441 1.453 1.00 0.00 C ATOM 24 O PRO A 2 -3.801 2.329 1.863 1.00 0.00 O ATOM 25 CB PRO A 2 -4.624 3.250 -0.898 1.00 0.00 C ATOM 26 CG PRO A 2 -4.321 4.602 -1.442 1.00 0.00 C ATOM 27 CD PRO A 2 -4.049 5.477 -0.249 1.00 0.00 C ATOM 28 HA PRO A 2 -6.395 3.518 0.290 1.00 0.00 H ATOM 29 1HB PRO A 2 -3.722 2.681 -0.727 1.00 0.00 H ATOM 30 2HB PRO A 2 -5.285 2.701 -1.552 1.00 0.00 H ATOM 31 1HG PRO A 2 -3.449 4.555 -2.079 1.00 0.00 H ATOM 32 2HG PRO A 2 -5.171 4.976 -1.995 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.995 5.474 -0.012 1.00 0.00 H ATOM 34 2HD PRO A 2 -4.394 6.483 -0.433 1.00 0.00 H ATOM 35 N LEU A 3 -5.946 1.651 1.858 1.00 0.00 N ATOM 36 CA LEU A 3 -5.726 0.585 2.828 1.00 0.00 C ATOM 37 C LEU A 3 -6.336 -0.736 2.362 1.00 0.00 C ATOM 38 O LEU A 3 -6.461 -1.679 3.144 1.00 0.00 O ATOM 39 CB LEU A 3 -6.286 0.992 4.195 1.00 0.00 C ATOM 40 CG LEU A 3 -7.785 1.310 4.232 1.00 0.00 C ATOM 41 CD1 LEU A 3 -8.620 0.107 3.818 1.00 0.00 C ATOM 42 CD2 LEU A 3 -8.192 1.788 5.618 1.00 0.00 C ATOM 43 H LEU A 3 -6.846 1.789 1.496 1.00 0.00 H ATOM 44 HA LEU A 3 -4.660 0.452 2.923 1.00 0.00 H ATOM 45 1HB LEU A 3 -6.096 0.186 4.890 1.00 0.00 H ATOM 46 2HB LEU A 3 -5.750 1.866 4.533 1.00 0.00 H ATOM 47 HG LEU A 3 -7.986 2.107 3.534 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.175 -0.793 4.215 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -8.655 0.048 2.740 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -9.622 0.214 4.205 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -9.159 2.266 5.565 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -7.461 2.495 5.984 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -8.244 0.944 6.290 1.00 0.00 H ATOM 54 N LYS A 4 -6.714 -0.800 1.088 1.00 0.00 N ATOM 55 CA LYS A 4 -7.310 -2.010 0.530 1.00 0.00 C ATOM 56 C LYS A 4 -6.399 -2.646 -0.520 1.00 0.00 C ATOM 57 O LYS A 4 -6.570 -3.811 -0.875 1.00 0.00 O ATOM 58 CB LYS A 4 -8.672 -1.689 -0.090 1.00 0.00 C ATOM 59 CG LYS A 4 -9.368 -2.898 -0.696 1.00 0.00 C ATOM 60 CD LYS A 4 -10.713 -2.523 -1.294 1.00 0.00 C ATOM 61 CE LYS A 4 -11.410 -3.730 -1.901 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.730 -3.372 -2.490 1.00 0.00 N ATOM 63 H LYS A 4 -6.591 -0.019 0.511 1.00 0.00 H ATOM 64 HA LYS A 4 -7.449 -2.712 1.336 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.314 -1.280 0.676 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.537 -0.952 -0.866 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.741 -3.309 -1.473 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.520 -3.639 0.075 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.340 -2.112 -0.517 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.560 -1.783 -2.065 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.780 -4.141 -2.676 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.558 -4.471 -1.128 1.00 0.00 H ATOM 73 1HZ LYS A 4 -13.481 -3.488 -1.780 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.938 -3.988 -3.301 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.721 -2.384 -2.812 1.00 0.00 H ATOM 76 N GLN A 5 -5.433 -1.876 -1.011 1.00 0.00 N ATOM 77 CA GLN A 5 -4.501 -2.371 -2.019 1.00 0.00 C ATOM 78 C GLN A 5 -3.392 -3.200 -1.381 1.00 0.00 C ATOM 79 O GLN A 5 -2.792 -4.056 -2.032 1.00 0.00 O ATOM 80 CB GLN A 5 -3.897 -1.203 -2.802 1.00 0.00 C ATOM 81 CG GLN A 5 -2.912 -1.633 -3.877 1.00 0.00 C ATOM 82 CD GLN A 5 -2.329 -0.459 -4.637 1.00 0.00 C ATOM 83 OE1 GLN A 5 -3.054 0.312 -5.266 1.00 0.00 O ATOM 84 NE2 GLN A 5 -1.009 -0.316 -4.584 1.00 0.00 N ATOM 85 H GLN A 5 -5.346 -0.956 -0.692 1.00 0.00 H ATOM 86 HA GLN A 5 -5.055 -2.998 -2.697 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.696 -0.651 -3.277 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.382 -0.551 -2.113 1.00 0.00 H ATOM 89 1HG GLN A 5 -2.105 -2.177 -3.411 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.422 -2.279 -4.577 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.494 -0.967 -4.064 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.605 0.435 -5.065 1.00 0.00 H ATOM 93 N TYR A 6 -3.125 -2.941 -0.109 1.00 0.00 N ATOM 94 CA TYR A 6 -2.087 -3.663 0.620 1.00 0.00 C ATOM 95 C TYR A 6 -0.729 -3.496 -0.060 1.00 0.00 C ATOM 96 O TYR A 6 -0.348 -4.300 -0.910 1.00 0.00 O ATOM 97 CB TYR A 6 -2.438 -5.152 0.718 1.00 0.00 C ATOM 98 CG TYR A 6 -3.742 -5.444 1.440 1.00 0.00 C ATOM 99 CD1 TYR A 6 -4.182 -6.752 1.596 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.527 -4.423 1.968 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.365 -7.037 2.253 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.711 -4.701 2.627 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.125 -6.008 2.765 1.00 0.00 C ATOM 104 OH TYR A 6 -7.302 -6.287 3.420 1.00 0.00 O ATOM 105 H TYR A 6 -3.638 -2.247 0.353 1.00 0.00 H ATOM 106 HA TYR A 6 -2.030 -3.249 1.615 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.519 -5.558 -0.278 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.647 -5.663 1.244 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.586 -7.558 1.193 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.203 -3.400 1.860 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.688 -8.061 2.363 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.307 -3.894 3.028 1.00 0.00 H ATOM 113 HH TYR A 6 -7.245 -5.979 4.327 1.00 0.00 H ATOM 114 N TRP A 7 -0.007 -2.448 0.321 1.00 0.00 N ATOM 115 CA TRP A 7 1.307 -2.177 -0.253 1.00 0.00 C ATOM 116 C TRP A 7 2.378 -3.039 0.408 1.00 0.00 C ATOM 117 O TRP A 7 2.118 -3.717 1.402 1.00 0.00 O ATOM 118 CB TRP A 7 1.659 -0.696 -0.098 1.00 0.00 C ATOM 119 CG TRP A 7 1.702 -0.242 1.329 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.513 -0.719 2.317 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.898 0.781 1.928 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.263 -0.056 3.495 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.276 0.870 3.281 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.104 1.632 1.451 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.687 1.775 4.161 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.688 2.529 2.326 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.290 2.595 3.667 1.00 0.00 C ATOM 128 H TRP A 7 -0.364 -1.842 1.003 1.00 0.00 H ATOM 129 HA TRP A 7 1.265 -2.419 -1.304 1.00 0.00 H ATOM 130 1HB TRP A 7 2.630 -0.517 -0.534 1.00 0.00 H ATOM 131 2HB TRP A 7 0.921 -0.102 -0.616 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.240 -1.505 2.181 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.718 -0.219 4.348 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.423 1.596 0.420 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.982 1.838 5.198 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.463 3.193 1.975 1.00 0.00 H ATOM 137 HH2 TRP A 7 -0.775 3.311 4.315 1.00 0.00 H ATOM 138 N TRP A 8 3.584 -3.006 -0.150 1.00 0.00 N ATOM 139 CA TRP A 8 4.695 -3.783 0.384 1.00 0.00 C ATOM 140 C TRP A 8 5.938 -2.893 0.504 1.00 0.00 C ATOM 141 O TRP A 8 6.067 -2.127 1.458 1.00 0.00 O ATOM 142 CB TRP A 8 4.966 -4.990 -0.523 1.00 0.00 C ATOM 143 CG TRP A 8 6.076 -5.900 -0.061 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.525 -7.009 -0.720 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.818 -5.843 1.174 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.537 -7.607 -0.012 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.731 -6.920 1.155 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.825 -4.986 2.284 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.627 -7.159 2.193 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.713 -5.230 3.314 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.605 -6.306 3.261 1.00 0.00 C ATOM 152 H TRP A 8 3.729 -2.445 -0.941 1.00 0.00 H ATOM 153 HA TRP A 8 4.421 -4.130 1.365 1.00 0.00 H ATOM 154 1HB TRP A 8 4.067 -5.583 -0.585 1.00 0.00 H ATOM 155 2HB TRP A 8 5.217 -4.635 -1.512 1.00 0.00 H ATOM 156 HD1 TRP A 8 6.154 -7.335 -1.680 1.00 0.00 H ATOM 157 HE1 TRP A 8 8.033 -8.403 -0.293 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.144 -4.155 2.352 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.323 -7.985 2.169 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.727 -4.579 4.175 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.282 -6.458 4.089 1.00 0.00 H ATOM 162 N ARG A 9 6.847 -2.992 -0.461 1.00 0.00 N ATOM 163 CA ARG A 9 8.065 -2.192 -0.448 1.00 0.00 C ATOM 164 C ARG A 9 7.752 -0.701 -0.586 1.00 0.00 C ATOM 165 O ARG A 9 8.225 0.111 0.208 1.00 0.00 O ATOM 166 CB ARG A 9 9.010 -2.639 -1.566 1.00 0.00 C ATOM 167 CG ARG A 9 9.438 -4.093 -1.454 1.00 0.00 C ATOM 168 CD ARG A 9 10.168 -4.360 -0.147 1.00 0.00 C ATOM 169 NE ARG A 9 10.585 -5.755 -0.027 1.00 0.00 N ATOM 170 CZ ARG A 9 11.241 -6.244 1.022 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.561 -5.456 2.041 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.581 -7.526 1.052 1.00 0.00 N ATOM 173 H ARG A 9 6.696 -3.614 -1.198 1.00 0.00 H ATOM 174 HA ARG A 9 8.551 -2.354 0.502 1.00 0.00 H ATOM 175 1HB ARG A 9 8.517 -2.504 -2.515 1.00 0.00 H ATOM 176 2HB ARG A 9 9.896 -2.022 -1.540 1.00 0.00 H ATOM 177 1HG ARG A 9 8.561 -4.721 -1.499 1.00 0.00 H ATOM 178 2HG ARG A 9 10.095 -4.329 -2.278 1.00 0.00 H ATOM 179 1HD ARG A 9 11.042 -3.727 -0.103 1.00 0.00 H ATOM 180 2HD ARG A 9 9.509 -4.118 0.674 1.00 0.00 H ATOM 181 HE ARG A 9 10.362 -6.358 -0.766 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.308 -4.488 2.024 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.054 -5.830 2.826 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.342 -8.124 0.287 1.00 0.00 H ATOM 185 2HH2 ARG A 9 12.074 -7.894 1.840 1.00 0.00 H ATOM 186 N PRO A 10 6.949 -0.313 -1.597 1.00 0.00 N ATOM 187 CA PRO A 10 6.591 1.092 -1.816 1.00 0.00 C ATOM 188 C PRO A 10 5.613 1.609 -0.766 1.00 0.00 C ATOM 189 O PRO A 10 4.400 1.610 -0.980 1.00 0.00 O ATOM 190 CB PRO A 10 5.936 1.081 -3.197 1.00 0.00 C ATOM 191 CG PRO A 10 5.384 -0.293 -3.340 1.00 0.00 C ATOM 192 CD PRO A 10 6.331 -1.201 -2.604 1.00 0.00 C ATOM 193 HA PRO A 10 7.466 1.725 -1.833 1.00 0.00 H ATOM 194 1HB PRO A 10 5.157 1.828 -3.235 1.00 0.00 H ATOM 195 2HB PRO A 10 6.679 1.287 -3.952 1.00 0.00 H ATOM 196 1HG PRO A 10 4.399 -0.340 -2.898 1.00 0.00 H ATOM 197 2HG PRO A 10 5.340 -0.564 -4.384 1.00 0.00 H ATOM 198 1HD PRO A 10 5.787 -2.004 -2.130 1.00 0.00 H ATOM 199 2HD PRO A 10 7.075 -1.594 -3.281 1.00 0.00 H ATOM 200 N SER A 11 6.147 2.048 0.369 1.00 0.00 N ATOM 201 CA SER A 11 5.321 2.569 1.452 1.00 0.00 C ATOM 202 C SER A 11 5.710 4.005 1.789 1.00 0.00 C ATOM 203 O SER A 11 6.856 4.283 2.138 1.00 0.00 O ATOM 204 CB SER A 11 5.459 1.687 2.695 1.00 0.00 C ATOM 205 OG SER A 11 5.049 0.357 2.425 1.00 0.00 O ATOM 206 H SER A 11 7.121 2.022 0.480 1.00 0.00 H ATOM 207 HA SER A 11 4.293 2.554 1.123 1.00 0.00 H ATOM 208 1HB SER A 11 6.491 1.674 3.013 1.00 0.00 H ATOM 209 2HB SER A 11 4.843 2.086 3.487 1.00 0.00 H ATOM 210 HG SER A 11 5.563 -0.252 2.961 1.00 0.00 H ATOM 211 N ILE A 12 4.745 4.914 1.682 1.00 0.00 N ATOM 212 CA ILE A 12 4.985 6.321 1.975 1.00 0.00 C ATOM 213 C ILE A 12 4.317 6.724 3.287 1.00 0.00 C ATOM 214 O ILE A 12 4.752 7.732 3.886 1.00 0.00 O ATOM 215 CB ILE A 12 4.465 7.227 0.839 1.00 0.00 C ATOM 216 CG1 ILE A 12 5.167 6.882 -0.476 1.00 0.00 C ATOM 217 CG2 ILE A 12 4.674 8.695 1.183 1.00 0.00 C ATOM 218 CD1 ILE A 12 6.669 7.059 -0.424 1.00 0.00 C ATOM 219 OXT ILE A 12 3.366 6.031 3.705 1.00 0.00 O ATOM 220 H ILE A 12 3.851 4.630 1.399 1.00 0.00 H ATOM 221 HA ILE A 12 6.053 6.466 2.066 1.00 0.00 H ATOM 222 HB ILE A 12 3.405 7.055 0.729 1.00 0.00 H ATOM 223 1HG1 ILE A 12 4.964 5.852 -0.727 1.00 0.00 H ATOM 224 2HG1 ILE A 12 4.784 7.521 -1.258 1.00 0.00 H ATOM 225 1HG2 ILE A 12 5.689 8.845 1.520 1.00 0.00 H ATOM 226 2HG2 ILE A 12 3.989 8.982 1.967 1.00 0.00 H ATOM 227 3HG2 ILE A 12 4.494 9.300 0.308 1.00 0.00 H ATOM 228 1HD1 ILE A 12 7.124 6.163 -0.028 1.00 0.00 H ATOM 229 2HD1 ILE A 12 6.911 7.896 0.214 1.00 0.00 H ATOM 230 3HD1 ILE A 12 7.045 7.245 -1.419 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 2 ATOM 1 N HIS A 1 -3.815 6.570 -3.081 1.00 0.00 N ATOM 2 CA HIS A 1 -3.450 5.944 -1.781 1.00 0.00 C ATOM 3 C HIS A 1 -4.394 4.793 -1.436 1.00 0.00 C ATOM 4 O HIS A 1 -5.188 4.888 -0.499 1.00 0.00 O ATOM 5 CB HIS A 1 -3.504 7.015 -0.686 1.00 0.00 C ATOM 6 CG HIS A 1 -2.565 8.160 -0.915 1.00 0.00 C ATOM 7 ND1 HIS A 1 -1.198 8.005 -1.012 1.00 0.00 N ATOM 8 CD2 HIS A 1 -2.804 9.484 -1.068 1.00 0.00 C ATOM 9 CE1 HIS A 1 -0.636 9.185 -1.212 1.00 0.00 C ATOM 10 NE2 HIS A 1 -1.589 10.098 -1.251 1.00 0.00 N ATOM 11 1H HIS A 1 -4.852 6.612 -3.132 1.00 0.00 H ATOM 12 2H HIS A 1 -3.426 5.972 -3.838 1.00 0.00 H ATOM 13 3H HIS A 1 -3.401 7.522 -3.106 1.00 0.00 H ATOM 14 HA HIS A 1 -2.443 5.563 -1.854 1.00 0.00 H ATOM 15 1HB HIS A 1 -4.505 7.415 -0.633 1.00 0.00 H ATOM 16 2HB HIS A 1 -3.252 6.563 0.262 1.00 0.00 H ATOM 17 HD1 HIS A 1 -0.712 7.157 -0.941 1.00 0.00 H ATOM 18 HD2 HIS A 1 -3.771 9.969 -1.049 1.00 0.00 H ATOM 19 HE1 HIS A 1 0.421 9.370 -1.325 1.00 0.00 H ATOM 20 HE2 HIS A 1 -1.456 11.042 -1.478 1.00 0.00 H ATOM 21 N PRO A 2 -4.321 3.683 -2.191 1.00 0.00 N ATOM 22 CA PRO A 2 -5.174 2.512 -1.959 1.00 0.00 C ATOM 23 C PRO A 2 -4.808 1.775 -0.675 1.00 0.00 C ATOM 24 O PRO A 2 -3.878 0.968 -0.655 1.00 0.00 O ATOM 25 CB PRO A 2 -4.905 1.628 -3.178 1.00 0.00 C ATOM 26 CG PRO A 2 -3.539 2.013 -3.628 1.00 0.00 C ATOM 27 CD PRO A 2 -3.405 3.480 -3.330 1.00 0.00 C ATOM 28 HA PRO A 2 -6.219 2.783 -1.930 1.00 0.00 H ATOM 29 1HB PRO A 2 -4.949 0.588 -2.888 1.00 0.00 H ATOM 30 2HB PRO A 2 -5.642 1.827 -3.941 1.00 0.00 H ATOM 31 1HG PRO A 2 -2.798 1.449 -3.079 1.00 0.00 H ATOM 32 2HG PRO A 2 -3.437 1.835 -4.688 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.387 3.719 -3.053 1.00 0.00 H ATOM 34 2HD PRO A 2 -3.713 4.068 -4.181 1.00 0.00 H ATOM 35 N LEU A 3 -5.545 2.057 0.395 1.00 0.00 N ATOM 36 CA LEU A 3 -5.298 1.420 1.683 1.00 0.00 C ATOM 37 C LEU A 3 -5.766 -0.035 1.690 1.00 0.00 C ATOM 38 O LEU A 3 -5.455 -0.790 2.611 1.00 0.00 O ATOM 39 CB LEU A 3 -5.976 2.215 2.805 1.00 0.00 C ATOM 40 CG LEU A 3 -7.496 2.371 2.687 1.00 0.00 C ATOM 41 CD1 LEU A 3 -8.196 1.020 2.700 1.00 0.00 C ATOM 42 CD2 LEU A 3 -8.028 3.257 3.804 1.00 0.00 C ATOM 43 H LEU A 3 -6.273 2.708 0.316 1.00 0.00 H ATOM 44 HA LEU A 3 -4.234 1.434 1.849 1.00 0.00 H ATOM 45 1HB LEU A 3 -5.760 1.724 3.743 1.00 0.00 H ATOM 46 2HB LEU A 3 -5.539 3.202 2.829 1.00 0.00 H ATOM 47 HG LEU A 3 -7.720 2.850 1.747 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.286 0.652 1.689 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -9.180 1.128 3.131 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.620 0.321 3.289 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -9.087 3.087 3.923 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -7.854 4.293 3.554 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -7.518 3.018 4.726 1.00 0.00 H ATOM 54 N LYS A 4 -6.516 -0.424 0.662 1.00 0.00 N ATOM 55 CA LYS A 4 -7.024 -1.787 0.558 1.00 0.00 C ATOM 56 C LYS A 4 -6.120 -2.651 -0.318 1.00 0.00 C ATOM 57 O LYS A 4 -6.165 -3.879 -0.250 1.00 0.00 O ATOM 58 CB LYS A 4 -8.445 -1.778 -0.008 1.00 0.00 C ATOM 59 CG LYS A 4 -9.056 -3.164 -0.150 1.00 0.00 C ATOM 60 CD LYS A 4 -10.464 -3.095 -0.716 1.00 0.00 C ATOM 61 CE LYS A 4 -11.076 -4.480 -0.859 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.456 -4.424 -1.414 1.00 0.00 N ATOM 63 H LYS A 4 -6.734 0.220 -0.043 1.00 0.00 H ATOM 64 HA LYS A 4 -7.046 -2.206 1.550 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.077 -1.196 0.647 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.429 -1.315 -0.984 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.440 -3.752 -0.813 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.090 -3.632 0.823 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.081 -2.507 -0.053 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.429 -2.626 -1.688 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.455 -5.067 -1.520 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.106 -4.948 0.115 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.787 -5.383 -1.645 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.471 -3.847 -2.277 1.00 0.00 H ATOM 75 3HZ LYS A 4 -13.104 -4.003 -0.717 1.00 0.00 H ATOM 76 N GLN A 5 -5.303 -2.003 -1.139 1.00 0.00 N ATOM 77 CA GLN A 5 -4.391 -2.714 -2.029 1.00 0.00 C ATOM 78 C GLN A 5 -3.312 -3.447 -1.237 1.00 0.00 C ATOM 79 O GLN A 5 -2.720 -4.411 -1.722 1.00 0.00 O ATOM 80 CB GLN A 5 -3.745 -1.742 -3.017 1.00 0.00 C ATOM 81 CG GLN A 5 -2.779 -2.408 -3.983 1.00 0.00 C ATOM 82 CD GLN A 5 -2.152 -1.425 -4.951 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.848 -0.764 -5.721 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.828 -1.324 -4.918 1.00 0.00 N ATOM 85 H GLN A 5 -5.313 -1.025 -1.149 1.00 0.00 H ATOM 86 HA GLN A 5 -4.968 -3.440 -2.577 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.524 -1.262 -3.593 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.205 -0.989 -2.463 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.992 -2.881 -3.414 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.313 -3.157 -4.548 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.337 -1.882 -4.279 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.396 -0.695 -5.533 1.00 0.00 H ATOM 93 N TYR A 6 -3.058 -2.982 -0.020 1.00 0.00 N ATOM 94 CA TYR A 6 -2.048 -3.593 0.837 1.00 0.00 C ATOM 95 C TYR A 6 -0.672 -3.536 0.178 1.00 0.00 C ATOM 96 O TYR A 6 -0.164 -4.544 -0.312 1.00 0.00 O ATOM 97 CB TYR A 6 -2.419 -5.048 1.146 1.00 0.00 C ATOM 98 CG TYR A 6 -3.745 -5.218 1.866 1.00 0.00 C ATOM 99 CD1 TYR A 6 -4.205 -6.486 2.202 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.532 -4.124 2.213 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.408 -6.659 2.860 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.736 -4.290 2.871 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.169 -5.559 3.192 1.00 0.00 C ATOM 104 OH TYR A 6 -7.368 -5.727 3.848 1.00 0.00 O ATOM 105 H TYR A 6 -3.561 -2.211 0.310 1.00 0.00 H ATOM 106 HA TYR A 6 -2.015 -3.036 1.760 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.477 -5.598 0.219 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.648 -5.481 1.765 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.608 -7.347 1.942 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.192 -3.130 1.962 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.747 -7.653 3.113 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.333 -3.428 3.131 1.00 0.00 H ATOM 113 HH TYR A 6 -7.272 -6.407 4.519 1.00 0.00 H ATOM 114 N TRP A 7 -0.075 -2.349 0.170 1.00 0.00 N ATOM 115 CA TRP A 7 1.241 -2.159 -0.429 1.00 0.00 C ATOM 116 C TRP A 7 2.286 -3.027 0.265 1.00 0.00 C ATOM 117 O TRP A 7 1.987 -3.720 1.236 1.00 0.00 O ATOM 118 CB TRP A 7 1.652 -0.688 -0.353 1.00 0.00 C ATOM 119 CG TRP A 7 1.729 -0.164 1.048 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.531 -0.623 2.053 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.972 0.919 1.601 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.319 0.108 3.197 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.367 1.061 2.945 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.001 1.783 1.091 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.824 2.032 3.782 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.539 2.746 1.923 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.126 2.864 3.256 1.00 0.00 C ATOM 128 H TRP A 7 -0.531 -1.582 0.575 1.00 0.00 H ATOM 129 HA TRP A 7 1.178 -2.453 -1.466 1.00 0.00 H ATOM 130 1HB TRP A 7 2.625 -0.569 -0.807 1.00 0.00 H ATOM 131 2HB TRP A 7 0.932 -0.092 -0.895 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.225 -1.444 1.949 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.777 -0.030 4.052 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.331 1.708 0.065 1.00 0.00 H ATOM 135 HZ2 TRP A 7 1.132 2.135 4.812 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.292 3.422 1.546 1.00 0.00 H ATOM 137 HH2 TRP A 7 -0.574 3.630 3.870 1.00 0.00 H ATOM 138 N TRP A 8 3.514 -2.980 -0.241 1.00 0.00 N ATOM 139 CA TRP A 8 4.606 -3.758 0.330 1.00 0.00 C ATOM 140 C TRP A 8 5.874 -2.900 0.386 1.00 0.00 C ATOM 141 O TRP A 8 6.070 -2.134 1.329 1.00 0.00 O ATOM 142 CB TRP A 8 4.835 -5.023 -0.508 1.00 0.00 C ATOM 143 CG TRP A 8 5.920 -5.938 -0.002 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.332 -7.095 -0.600 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.669 -5.838 1.226 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.329 -7.683 0.135 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.549 -6.940 1.263 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.705 -4.923 2.287 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.444 -7.149 2.309 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.591 -5.137 3.326 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.452 -6.240 3.329 1.00 0.00 C ATOM 152 H TRP A 8 3.690 -2.407 -1.016 1.00 0.00 H ATOM 153 HA TRP A 8 4.332 -4.041 1.330 1.00 0.00 H ATOM 154 1HB TRP A 8 3.918 -5.591 -0.532 1.00 0.00 H ATOM 155 2HB TRP A 8 5.089 -4.733 -1.517 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.946 -7.463 -1.539 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.801 -8.508 -0.104 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.049 -4.070 2.313 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.115 -7.996 2.327 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.628 -4.442 4.152 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.127 -6.367 4.162 1.00 0.00 H ATOM 162 N ARG A 9 6.727 -3.023 -0.625 1.00 0.00 N ATOM 163 CA ARG A 9 7.963 -2.253 -0.679 1.00 0.00 C ATOM 164 C ARG A 9 7.682 -0.749 -0.638 1.00 0.00 C ATOM 165 O ARG A 9 8.297 -0.021 0.142 1.00 0.00 O ATOM 166 CB ARG A 9 8.760 -2.606 -1.937 1.00 0.00 C ATOM 167 CG ARG A 9 9.153 -4.071 -2.017 1.00 0.00 C ATOM 168 CD ARG A 9 10.019 -4.482 -0.837 1.00 0.00 C ATOM 169 NE ARG A 9 10.402 -5.890 -0.903 1.00 0.00 N ATOM 170 CZ ARG A 9 11.159 -6.496 0.009 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.615 -5.821 1.057 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.462 -7.779 -0.127 1.00 0.00 N ATOM 173 H ARG A 9 6.520 -3.642 -1.349 1.00 0.00 H ATOM 174 HA ARG A 9 8.550 -2.515 0.189 1.00 0.00 H ATOM 175 1HB ARG A 9 8.166 -2.367 -2.806 1.00 0.00 H ATOM 176 2HB ARG A 9 9.663 -2.013 -1.956 1.00 0.00 H ATOM 177 1HG ARG A 9 8.257 -4.675 -2.020 1.00 0.00 H ATOM 178 2HG ARG A 9 9.703 -4.237 -2.932 1.00 0.00 H ATOM 179 1HD ARG A 9 10.912 -3.875 -0.834 1.00 0.00 H ATOM 180 2HD ARG A 9 9.466 -4.312 0.075 1.00 0.00 H ATOM 181 HE ARG A 9 10.080 -6.412 -1.667 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.390 -4.852 1.166 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.183 -6.281 1.739 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.121 -8.293 -0.916 1.00 0.00 H ATOM 185 2HH2 ARG A 9 12.031 -8.235 0.557 1.00 0.00 H ATOM 186 N PRO A 10 6.749 -0.255 -1.476 1.00 0.00 N ATOM 187 CA PRO A 10 6.407 1.169 -1.515 1.00 0.00 C ATOM 188 C PRO A 10 5.494 1.578 -0.363 1.00 0.00 C ATOM 189 O PRO A 10 4.289 1.756 -0.546 1.00 0.00 O ATOM 190 CB PRO A 10 5.683 1.312 -2.851 1.00 0.00 C ATOM 191 CG PRO A 10 5.037 -0.012 -3.067 1.00 0.00 C ATOM 192 CD PRO A 10 5.956 -1.036 -2.450 1.00 0.00 C ATOM 193 HA PRO A 10 7.291 1.790 -1.512 1.00 0.00 H ATOM 194 1HB PRO A 10 4.951 2.104 -2.785 1.00 0.00 H ATOM 195 2HB PRO A 10 6.396 1.535 -3.630 1.00 0.00 H ATOM 196 1HG PRO A 10 4.073 -0.033 -2.582 1.00 0.00 H ATOM 197 2HG PRO A 10 4.929 -0.198 -4.126 1.00 0.00 H ATOM 198 1HD PRO A 10 5.379 -1.802 -1.953 1.00 0.00 H ATOM 199 2HD PRO A 10 6.591 -1.471 -3.204 1.00 0.00 H ATOM 200 N SER A 11 6.075 1.724 0.823 1.00 0.00 N ATOM 201 CA SER A 11 5.312 2.111 2.005 1.00 0.00 C ATOM 202 C SER A 11 5.203 3.629 2.108 1.00 0.00 C ATOM 203 O SER A 11 6.208 4.324 2.259 1.00 0.00 O ATOM 204 CB SER A 11 5.965 1.547 3.267 1.00 0.00 C ATOM 205 OG SER A 11 6.025 0.132 3.222 1.00 0.00 O ATOM 206 H SER A 11 7.038 1.567 0.907 1.00 0.00 H ATOM 207 HA SER A 11 4.318 1.697 1.908 1.00 0.00 H ATOM 208 1HB SER A 11 6.970 1.934 3.353 1.00 0.00 H ATOM 209 2HB SER A 11 5.390 1.844 4.131 1.00 0.00 H ATOM 210 HG SER A 11 6.830 -0.168 3.648 1.00 0.00 H ATOM 211 N ILE A 12 3.977 4.136 2.026 1.00 0.00 N ATOM 212 CA ILE A 12 3.737 5.571 2.111 1.00 0.00 C ATOM 213 C ILE A 12 2.679 5.885 3.165 1.00 0.00 C ATOM 214 O ILE A 12 3.057 6.337 4.267 1.00 0.00 O ATOM 215 CB ILE A 12 3.287 6.145 0.751 1.00 0.00 C ATOM 216 CG1 ILE A 12 4.363 5.899 -0.309 1.00 0.00 C ATOM 217 CG2 ILE A 12 2.984 7.635 0.867 1.00 0.00 C ATOM 218 CD1 ILE A 12 5.695 6.537 0.021 1.00 0.00 C ATOM 219 OXT ILE A 12 1.480 5.677 2.880 1.00 0.00 O ATOM 220 H ILE A 12 3.216 3.531 1.906 1.00 0.00 H ATOM 221 HA ILE A 12 4.664 6.049 2.392 1.00 0.00 H ATOM 222 HB ILE A 12 2.380 5.642 0.455 1.00 0.00 H ATOM 223 1HG1 ILE A 12 4.522 4.835 -0.411 1.00 0.00 H ATOM 224 2HG1 ILE A 12 4.027 6.301 -1.254 1.00 0.00 H ATOM 225 1HG2 ILE A 12 3.532 8.176 0.109 1.00 0.00 H ATOM 226 2HG2 ILE A 12 3.279 7.989 1.844 1.00 0.00 H ATOM 227 3HG2 ILE A 12 1.925 7.799 0.729 1.00 0.00 H ATOM 228 1HD1 ILE A 12 5.570 7.608 0.102 1.00 0.00 H ATOM 229 2HD1 ILE A 12 6.404 6.316 -0.762 1.00 0.00 H ATOM 230 3HD1 ILE A 12 6.059 6.145 0.959 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 3 ATOM 1 N HIS A 1 -4.796 5.609 5.288 1.00 0.00 N ATOM 2 CA HIS A 1 -4.551 4.170 5.567 1.00 0.00 C ATOM 3 C HIS A 1 -4.843 3.311 4.338 1.00 0.00 C ATOM 4 O HIS A 1 -5.878 2.647 4.267 1.00 0.00 O ATOM 5 CB HIS A 1 -5.440 3.740 6.735 1.00 0.00 C ATOM 6 CG HIS A 1 -5.180 4.503 7.998 1.00 0.00 C ATOM 7 ND1 HIS A 1 -3.958 4.512 8.633 1.00 0.00 N ATOM 8 CD2 HIS A 1 -5.996 5.287 8.742 1.00 0.00 C ATOM 9 CE1 HIS A 1 -4.031 5.268 9.716 1.00 0.00 C ATOM 10 NE2 HIS A 1 -5.257 5.749 9.803 1.00 0.00 N ATOM 11 1H HIS A 1 -5.776 5.704 4.955 1.00 0.00 H ATOM 12 2H HIS A 1 -4.119 5.910 4.558 1.00 0.00 H ATOM 13 3H HIS A 1 -4.651 6.132 6.175 1.00 0.00 H ATOM 14 HA HIS A 1 -3.515 4.045 5.845 1.00 0.00 H ATOM 15 1HB HIS A 1 -6.475 3.889 6.465 1.00 0.00 H ATOM 16 2HB HIS A 1 -5.274 2.692 6.939 1.00 0.00 H ATOM 17 HD1 HIS A 1 -3.154 4.036 8.337 1.00 0.00 H ATOM 18 HD2 HIS A 1 -7.035 5.508 8.540 1.00 0.00 H ATOM 19 HE1 HIS A 1 -3.226 5.459 10.408 1.00 0.00 H ATOM 20 HE2 HIS A 1 -5.561 6.402 10.468 1.00 0.00 H ATOM 21 N PRO A 2 -3.933 3.314 3.350 1.00 0.00 N ATOM 22 CA PRO A 2 -4.098 2.532 2.122 1.00 0.00 C ATOM 23 C PRO A 2 -3.979 1.031 2.370 1.00 0.00 C ATOM 24 O PRO A 2 -2.977 0.410 2.015 1.00 0.00 O ATOM 25 CB PRO A 2 -2.955 3.020 1.230 1.00 0.00 C ATOM 26 CG PRO A 2 -1.920 3.516 2.178 1.00 0.00 C ATOM 27 CD PRO A 2 -2.671 4.077 3.354 1.00 0.00 C ATOM 28 HA PRO A 2 -5.045 2.741 1.645 1.00 0.00 H ATOM 29 1HB PRO A 2 -2.584 2.199 0.633 1.00 0.00 H ATOM 30 2HB PRO A 2 -3.309 3.810 0.585 1.00 0.00 H ATOM 31 1HG PRO A 2 -1.287 2.698 2.493 1.00 0.00 H ATOM 32 2HG PRO A 2 -1.329 4.287 1.708 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.120 3.908 4.268 1.00 0.00 H ATOM 34 2HD PRO A 2 -2.858 5.132 3.213 1.00 0.00 H ATOM 35 N LEU A 3 -5.009 0.455 2.982 1.00 0.00 N ATOM 36 CA LEU A 3 -5.020 -0.974 3.279 1.00 0.00 C ATOM 37 C LEU A 3 -5.928 -1.741 2.318 1.00 0.00 C ATOM 38 O LEU A 3 -6.223 -2.916 2.537 1.00 0.00 O ATOM 39 CB LEU A 3 -5.447 -1.207 4.733 1.00 0.00 C ATOM 40 CG LEU A 3 -6.831 -0.672 5.113 1.00 0.00 C ATOM 41 CD1 LEU A 3 -7.925 -1.325 4.283 1.00 0.00 C ATOM 42 CD2 LEU A 3 -7.091 -0.882 6.597 1.00 0.00 C ATOM 43 H LEU A 3 -5.779 1.002 3.240 1.00 0.00 H ATOM 44 HA LEU A 3 -4.014 -1.335 3.156 1.00 0.00 H ATOM 45 1HB LEU A 3 -5.433 -2.270 4.921 1.00 0.00 H ATOM 46 2HB LEU A 3 -4.717 -0.737 5.376 1.00 0.00 H ATOM 47 HG LEU A 3 -6.857 0.388 4.919 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.004 -0.822 3.330 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -8.867 -1.252 4.807 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.684 -2.365 4.121 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -6.616 -0.094 7.161 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -6.687 -1.836 6.902 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -8.154 -0.867 6.783 1.00 0.00 H ATOM 54 N LYS A 4 -6.366 -1.076 1.252 1.00 0.00 N ATOM 55 CA LYS A 4 -7.236 -1.704 0.263 1.00 0.00 C ATOM 56 C LYS A 4 -6.427 -2.283 -0.894 1.00 0.00 C ATOM 57 O LYS A 4 -6.913 -3.136 -1.637 1.00 0.00 O ATOM 58 CB LYS A 4 -8.254 -0.692 -0.265 1.00 0.00 C ATOM 59 CG LYS A 4 -9.205 -1.267 -1.304 1.00 0.00 C ATOM 60 CD LYS A 4 -10.192 -0.222 -1.794 1.00 0.00 C ATOM 61 CE LYS A 4 -11.142 -0.796 -2.832 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.114 0.222 -3.319 1.00 0.00 N ATOM 63 H LYS A 4 -6.098 -0.143 1.125 1.00 0.00 H ATOM 64 HA LYS A 4 -7.763 -2.507 0.753 1.00 0.00 H ATOM 65 1HB LYS A 4 -8.842 -0.323 0.563 1.00 0.00 H ATOM 66 2HB LYS A 4 -7.723 0.135 -0.714 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.630 -1.627 -2.143 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.752 -2.088 -0.861 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.767 0.138 -0.954 1.00 0.00 H ATOM 70 2HD LYS A 4 -9.644 0.599 -2.235 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.564 -1.158 -3.669 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.685 -1.617 -2.388 1.00 0.00 H ATOM 73 1HZ LYS A 4 -11.773 0.644 -4.206 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.229 0.973 -2.611 1.00 0.00 H ATOM 75 3HZ LYS A 4 -13.039 -0.223 -3.491 1.00 0.00 H ATOM 76 N GLN A 5 -5.192 -1.816 -1.040 1.00 0.00 N ATOM 77 CA GLN A 5 -4.316 -2.288 -2.106 1.00 0.00 C ATOM 78 C GLN A 5 -3.210 -3.190 -1.557 1.00 0.00 C ATOM 79 O GLN A 5 -2.514 -3.863 -2.317 1.00 0.00 O ATOM 80 CB GLN A 5 -3.699 -1.100 -2.848 1.00 0.00 C ATOM 81 CG GLN A 5 -2.768 -1.503 -3.980 1.00 0.00 C ATOM 82 CD GLN A 5 -2.172 -0.306 -4.697 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.894 0.519 -5.257 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.848 -0.208 -4.685 1.00 0.00 N ATOM 85 H GLN A 5 -4.861 -1.138 -0.416 1.00 0.00 H ATOM 86 HA GLN A 5 -4.916 -2.858 -2.799 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.494 -0.496 -3.261 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.137 -0.503 -2.144 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.963 -2.096 -3.574 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.324 -2.092 -4.695 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.336 -0.903 -4.220 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.435 0.554 -5.141 1.00 0.00 H ATOM 93 N TYR A 6 -3.053 -3.200 -0.234 1.00 0.00 N ATOM 94 CA TYR A 6 -2.031 -4.020 0.408 1.00 0.00 C ATOM 95 C TYR A 6 -0.634 -3.569 -0.005 1.00 0.00 C ATOM 96 O TYR A 6 -0.068 -4.074 -0.974 1.00 0.00 O ATOM 97 CB TYR A 6 -2.229 -5.499 0.057 1.00 0.00 C ATOM 98 CG TYR A 6 -3.566 -6.074 0.487 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.880 -7.402 0.227 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.512 -5.297 1.153 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.092 -7.940 0.614 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.726 -5.830 1.542 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.011 -7.150 1.271 1.00 0.00 C ATOM 104 OH TYR A 6 -7.219 -7.684 1.657 1.00 0.00 O ATOM 105 H TYR A 6 -3.635 -2.644 0.322 1.00 0.00 H ATOM 106 HA TYR A 6 -2.133 -3.898 1.476 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.150 -5.619 -1.013 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.451 -6.078 0.533 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.159 -8.020 -0.288 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.288 -4.263 1.366 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.315 -8.976 0.402 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.446 -5.211 2.057 1.00 0.00 H ATOM 113 HH TYR A 6 -7.110 -8.160 2.484 1.00 0.00 H ATOM 114 N TRP A 7 -0.085 -2.613 0.738 1.00 0.00 N ATOM 115 CA TRP A 7 1.246 -2.089 0.450 1.00 0.00 C ATOM 116 C TRP A 7 2.310 -3.161 0.658 1.00 0.00 C ATOM 117 O TRP A 7 1.994 -4.313 0.961 1.00 0.00 O ATOM 118 CB TRP A 7 1.543 -0.882 1.341 1.00 0.00 C ATOM 119 CG TRP A 7 1.502 -1.199 2.805 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.280 -2.104 3.469 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.637 -0.616 3.786 1.00 0.00 C ATOM 122 NE1 TRP A 7 1.952 -2.117 4.803 1.00 0.00 N ATOM 123 CE2 TRP A 7 0.946 -1.213 5.022 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.368 0.354 3.739 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.286 -0.871 6.200 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -1.023 0.691 4.909 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.693 0.081 6.125 1.00 0.00 C ATOM 128 H TRP A 7 -0.587 -2.250 1.497 1.00 0.00 H ATOM 129 HA TRP A 7 1.263 -1.777 -0.583 1.00 0.00 H ATOM 130 1HB TRP A 7 2.527 -0.505 1.109 1.00 0.00 H ATOM 131 2HB TRP A 7 0.812 -0.110 1.146 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.039 -2.713 3.001 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.371 -2.682 5.486 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.637 0.836 2.811 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.529 -1.333 7.146 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.803 1.439 4.892 1.00 0.00 H ATOM 137 HH2 TRP A 7 -1.231 0.375 7.014 1.00 0.00 H ATOM 138 N TRP A 8 3.571 -2.775 0.497 1.00 0.00 N ATOM 139 CA TRP A 8 4.682 -3.702 0.669 1.00 0.00 C ATOM 140 C TRP A 8 6.007 -2.946 0.520 1.00 0.00 C ATOM 141 O TRP A 8 6.494 -2.344 1.478 1.00 0.00 O ATOM 142 CB TRP A 8 4.577 -4.836 -0.360 1.00 0.00 C ATOM 143 CG TRP A 8 5.648 -5.890 -0.262 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.787 -6.967 -1.089 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.670 -6.030 0.748 1.00 0.00 C ATOM 146 NE1 TRP A 8 6.862 -7.728 -0.705 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.414 -7.184 0.423 1.00 0.00 C ATOM 148 CE3 TRP A 8 7.046 -5.293 1.878 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.500 -7.611 1.181 1.00 0.00 C ATOM 150 CZ3 TRP A 8 8.122 -5.725 2.631 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.839 -6.872 2.278 1.00 0.00 C ATOM 152 H TRP A 8 3.758 -1.843 0.257 1.00 0.00 H ATOM 153 HA TRP A 8 4.626 -4.115 1.659 1.00 0.00 H ATOM 154 1HB TRP A 8 3.625 -5.330 -0.231 1.00 0.00 H ATOM 155 2HB TRP A 8 4.615 -4.413 -1.352 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.159 -7.158 -1.946 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.176 -8.538 -1.159 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.506 -4.410 2.176 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.065 -8.495 0.921 1.00 0.00 H ATOM 160 HZ3 TRP A 8 8.423 -5.168 3.507 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.672 -7.171 2.897 1.00 0.00 H ATOM 162 N ARG A 9 6.581 -2.969 -0.677 1.00 0.00 N ATOM 163 CA ARG A 9 7.839 -2.278 -0.934 1.00 0.00 C ATOM 164 C ARG A 9 7.639 -0.762 -0.991 1.00 0.00 C ATOM 165 O ARG A 9 8.368 -0.014 -0.340 1.00 0.00 O ATOM 166 CB ARG A 9 8.467 -2.775 -2.240 1.00 0.00 C ATOM 167 CG ARG A 9 8.785 -4.262 -2.236 1.00 0.00 C ATOM 168 CD ARG A 9 9.768 -4.616 -1.131 1.00 0.00 C ATOM 169 NE ARG A 9 10.084 -6.042 -1.117 1.00 0.00 N ATOM 170 CZ ARG A 9 10.921 -6.607 -0.248 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.525 -5.871 0.676 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.153 -7.912 -0.304 1.00 0.00 N ATOM 173 H ARG A 9 6.147 -3.455 -1.402 1.00 0.00 H ATOM 174 HA ARG A 9 8.509 -2.505 -0.119 1.00 0.00 H ATOM 175 1HB ARG A 9 7.787 -2.578 -3.053 1.00 0.00 H ATOM 176 2HB ARG A 9 9.385 -2.234 -2.412 1.00 0.00 H ATOM 177 1HG ARG A 9 7.870 -4.815 -2.082 1.00 0.00 H ATOM 178 2HG ARG A 9 9.216 -4.531 -3.189 1.00 0.00 H ATOM 179 1HD ARG A 9 10.678 -4.057 -1.284 1.00 0.00 H ATOM 180 2HD ARG A 9 9.334 -4.344 -0.181 1.00 0.00 H ATOM 181 HE ARG A 9 9.652 -6.610 -1.790 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.354 -4.887 0.724 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.152 -6.301 1.326 1.00 0.00 H ATOM 184 1HH2 ARG A 9 10.700 -8.471 -0.998 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.782 -8.335 0.348 1.00 0.00 H ATOM 186 N PRO A 10 6.651 -0.281 -1.772 1.00 0.00 N ATOM 187 CA PRO A 10 6.383 1.155 -1.894 1.00 0.00 C ATOM 188 C PRO A 10 5.664 1.724 -0.675 1.00 0.00 C ATOM 189 O PRO A 10 5.579 2.940 -0.504 1.00 0.00 O ATOM 190 CB PRO A 10 5.488 1.237 -3.130 1.00 0.00 C ATOM 191 CG PRO A 10 4.768 -0.066 -3.156 1.00 0.00 C ATOM 192 CD PRO A 10 5.724 -1.085 -2.595 1.00 0.00 C ATOM 193 HA PRO A 10 7.289 1.713 -2.066 1.00 0.00 H ATOM 194 1HB PRO A 10 4.803 2.067 -3.027 1.00 0.00 H ATOM 195 2HB PRO A 10 6.096 1.371 -4.012 1.00 0.00 H ATOM 196 1HG PRO A 10 3.881 -0.007 -2.544 1.00 0.00 H ATOM 197 2HG PRO A 10 4.506 -0.319 -4.173 1.00 0.00 H ATOM 198 1HD PRO A 10 5.191 -1.802 -1.987 1.00 0.00 H ATOM 199 2HD PRO A 10 6.251 -1.584 -3.394 1.00 0.00 H ATOM 200 N SER A 11 5.147 0.839 0.171 1.00 0.00 N ATOM 201 CA SER A 11 4.437 1.255 1.375 1.00 0.00 C ATOM 202 C SER A 11 3.193 2.064 1.023 1.00 0.00 C ATOM 203 O SER A 11 2.785 2.952 1.771 1.00 0.00 O ATOM 204 CB SER A 11 5.357 2.080 2.278 1.00 0.00 C ATOM 205 OG SER A 11 6.493 1.329 2.672 1.00 0.00 O ATOM 206 H SER A 11 5.247 -0.116 -0.018 1.00 0.00 H ATOM 207 HA SER A 11 4.133 0.365 1.905 1.00 0.00 H ATOM 208 1HB SER A 11 5.689 2.958 1.743 1.00 0.00 H ATOM 209 2HB SER A 11 4.815 2.381 3.162 1.00 0.00 H ATOM 210 HG SER A 11 7.290 1.782 2.387 1.00 0.00 H ATOM 211 N ILE A 12 2.594 1.753 -0.123 1.00 0.00 N ATOM 212 CA ILE A 12 1.396 2.451 -0.574 1.00 0.00 C ATOM 213 C ILE A 12 0.330 1.460 -1.032 1.00 0.00 C ATOM 214 O ILE A 12 -0.847 1.865 -1.137 1.00 0.00 O ATOM 215 CB ILE A 12 1.716 3.426 -1.726 1.00 0.00 C ATOM 216 CG1 ILE A 12 2.736 4.470 -1.269 1.00 0.00 C ATOM 217 CG2 ILE A 12 0.447 4.108 -2.221 1.00 0.00 C ATOM 218 CD1 ILE A 12 2.263 5.307 -0.101 1.00 0.00 C ATOM 219 OXT ILE A 12 0.681 0.288 -1.283 1.00 0.00 O ATOM 220 H ILE A 12 2.966 1.035 -0.677 1.00 0.00 H ATOM 221 HA ILE A 12 1.010 3.021 0.259 1.00 0.00 H ATOM 222 HB ILE A 12 2.133 2.859 -2.543 1.00 0.00 H ATOM 223 1HG1 ILE A 12 3.645 3.969 -0.971 1.00 0.00 H ATOM 224 2HG1 ILE A 12 2.952 5.137 -2.091 1.00 0.00 H ATOM 225 1HG2 ILE A 12 -0.283 4.130 -1.425 1.00 0.00 H ATOM 226 2HG2 ILE A 12 0.047 3.558 -3.060 1.00 0.00 H ATOM 227 3HG2 ILE A 12 0.675 5.117 -2.528 1.00 0.00 H ATOM 228 1HD1 ILE A 12 1.195 5.197 0.012 1.00 0.00 H ATOM 229 2HD1 ILE A 12 2.502 6.345 -0.281 1.00 0.00 H ATOM 230 3HD1 ILE A 12 2.755 4.976 0.802 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 4 ATOM 1 N HIS A 1 -6.044 6.788 3.079 1.00 0.00 N ATOM 2 CA HIS A 1 -5.450 5.566 3.680 1.00 0.00 C ATOM 3 C HIS A 1 -6.137 4.305 3.162 1.00 0.00 C ATOM 4 O HIS A 1 -6.959 3.705 3.856 1.00 0.00 O ATOM 5 CB HIS A 1 -5.586 5.655 5.201 1.00 0.00 C ATOM 6 CG HIS A 1 -4.893 6.842 5.796 1.00 0.00 C ATOM 7 ND1 HIS A 1 -3.538 7.062 5.675 1.00 0.00 N ATOM 8 CD2 HIS A 1 -5.377 7.879 6.520 1.00 0.00 C ATOM 9 CE1 HIS A 1 -3.217 8.182 6.299 1.00 0.00 C ATOM 10 NE2 HIS A 1 -4.315 8.697 6.819 1.00 0.00 N ATOM 11 1H HIS A 1 -7.064 6.776 3.280 1.00 0.00 H ATOM 12 2H HIS A 1 -5.863 6.758 2.055 1.00 0.00 H ATOM 13 3H HIS A 1 -5.586 7.612 3.518 1.00 0.00 H ATOM 14 HA HIS A 1 -4.403 5.529 3.418 1.00 0.00 H ATOM 15 1HB HIS A 1 -6.632 5.717 5.459 1.00 0.00 H ATOM 16 2HB HIS A 1 -5.163 4.765 5.646 1.00 0.00 H ATOM 17 HD1 HIS A 1 -2.903 6.483 5.201 1.00 0.00 H ATOM 18 HD2 HIS A 1 -6.408 8.034 6.809 1.00 0.00 H ATOM 19 HE1 HIS A 1 -2.226 8.604 6.370 1.00 0.00 H ATOM 20 HE2 HIS A 1 -4.348 9.479 7.408 1.00 0.00 H ATOM 21 N PRO A 2 -5.809 3.884 1.929 1.00 0.00 N ATOM 22 CA PRO A 2 -6.399 2.688 1.319 1.00 0.00 C ATOM 23 C PRO A 2 -5.900 1.402 1.970 1.00 0.00 C ATOM 24 O PRO A 2 -4.717 1.075 1.894 1.00 0.00 O ATOM 25 CB PRO A 2 -5.935 2.766 -0.136 1.00 0.00 C ATOM 26 CG PRO A 2 -4.670 3.549 -0.088 1.00 0.00 C ATOM 27 CD PRO A 2 -4.837 4.540 1.032 1.00 0.00 C ATOM 28 HA PRO A 2 -7.478 2.716 1.359 1.00 0.00 H ATOM 29 1HB PRO A 2 -5.769 1.769 -0.518 1.00 0.00 H ATOM 30 2HB PRO A 2 -6.685 3.265 -0.731 1.00 0.00 H ATOM 31 1HG PRO A 2 -3.837 2.892 0.116 1.00 0.00 H ATOM 32 2HG PRO A 2 -4.521 4.065 -1.024 1.00 0.00 H ATOM 33 1HD PRO A 2 -3.896 4.703 1.536 1.00 0.00 H ATOM 34 2HD PRO A 2 -5.231 5.472 0.655 1.00 0.00 H ATOM 35 N LEU A 3 -6.813 0.675 2.607 1.00 0.00 N ATOM 36 CA LEU A 3 -6.466 -0.577 3.271 1.00 0.00 C ATOM 37 C LEU A 3 -6.713 -1.781 2.364 1.00 0.00 C ATOM 38 O LEU A 3 -6.701 -2.924 2.822 1.00 0.00 O ATOM 39 CB LEU A 3 -7.248 -0.712 4.583 1.00 0.00 C ATOM 40 CG LEU A 3 -8.774 -0.696 4.452 1.00 0.00 C ATOM 41 CD1 LEU A 3 -9.271 -1.846 3.588 1.00 0.00 C ATOM 42 CD2 LEU A 3 -9.424 -0.742 5.827 1.00 0.00 C ATOM 43 H LEU A 3 -7.741 0.988 2.631 1.00 0.00 H ATOM 44 HA LEU A 3 -5.415 -0.536 3.502 1.00 0.00 H ATOM 45 1HB LEU A 3 -6.960 -1.641 5.050 1.00 0.00 H ATOM 46 2HB LEU A 3 -6.958 0.101 5.232 1.00 0.00 H ATOM 47 HG LEU A 3 -9.071 0.225 3.975 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -9.177 -1.581 2.546 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -10.308 -2.046 3.816 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -8.683 -2.729 3.790 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -9.030 -1.578 6.384 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -10.493 -0.856 5.715 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -9.214 0.176 6.356 1.00 0.00 H ATOM 54 N LYS A 4 -6.935 -1.524 1.078 1.00 0.00 N ATOM 55 CA LYS A 4 -7.183 -2.593 0.116 1.00 0.00 C ATOM 56 C LYS A 4 -6.028 -2.727 -0.874 1.00 0.00 C ATOM 57 O LYS A 4 -5.889 -3.751 -1.542 1.00 0.00 O ATOM 58 CB LYS A 4 -8.489 -2.334 -0.637 1.00 0.00 C ATOM 59 CG LYS A 4 -8.825 -3.405 -1.662 1.00 0.00 C ATOM 60 CD LYS A 4 -10.129 -3.099 -2.380 1.00 0.00 C ATOM 61 CE LYS A 4 -10.465 -4.172 -3.405 1.00 0.00 C ATOM 62 NZ LYS A 4 -11.741 -3.881 -4.115 1.00 0.00 N ATOM 63 H LYS A 4 -6.932 -0.595 0.767 1.00 0.00 H ATOM 64 HA LYS A 4 -7.274 -3.515 0.666 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.298 -2.282 0.076 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.413 -1.387 -1.151 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.028 -3.456 -2.389 1.00 0.00 H ATOM 68 2HG LYS A 4 -8.916 -4.356 -1.157 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.926 -3.049 -1.654 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.037 -2.149 -2.884 1.00 0.00 H ATOM 71 1HE LYS A 4 -9.665 -4.222 -4.128 1.00 0.00 H ATOM 72 2HE LYS A 4 -10.552 -5.121 -2.898 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.228 -4.770 -4.351 1.00 0.00 H ATOM 74 2HZ LYS A 4 -11.551 -3.360 -4.994 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.363 -3.307 -3.512 1.00 0.00 H ATOM 76 N GLN A 5 -5.203 -1.689 -0.966 1.00 0.00 N ATOM 77 CA GLN A 5 -4.064 -1.696 -1.876 1.00 0.00 C ATOM 78 C GLN A 5 -3.004 -2.692 -1.420 1.00 0.00 C ATOM 79 O GLN A 5 -2.247 -3.225 -2.230 1.00 0.00 O ATOM 80 CB GLN A 5 -3.458 -0.295 -1.981 1.00 0.00 C ATOM 81 CG GLN A 5 -2.261 -0.216 -2.915 1.00 0.00 C ATOM 82 CD GLN A 5 -1.679 1.181 -3.000 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.361 2.127 -3.396 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.411 1.318 -2.628 1.00 0.00 N ATOM 85 H GLN A 5 -5.364 -0.900 -0.409 1.00 0.00 H ATOM 86 HA GLN A 5 -4.422 -1.996 -2.846 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.214 0.386 -2.341 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.141 0.021 -0.997 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.494 -0.887 -2.554 1.00 0.00 H ATOM 90 2HG GLN A 5 -2.571 -0.523 -3.903 1.00 0.00 H ATOM 91 1HE2 GLN A 5 0.070 0.521 -2.324 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.010 2.212 -2.673 1.00 0.00 H ATOM 93 N TYR A 6 -2.958 -2.935 -0.117 1.00 0.00 N ATOM 94 CA TYR A 6 -1.992 -3.868 0.456 1.00 0.00 C ATOM 95 C TYR A 6 -0.564 -3.459 0.102 1.00 0.00 C ATOM 96 O TYR A 6 0.147 -4.186 -0.593 1.00 0.00 O ATOM 97 CB TYR A 6 -2.266 -5.292 -0.039 1.00 0.00 C ATOM 98 CG TYR A 6 -3.639 -5.831 0.321 1.00 0.00 C ATOM 99 CD1 TYR A 6 -4.019 -7.109 -0.072 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.550 -5.074 1.053 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.264 -7.616 0.251 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.797 -5.577 1.379 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.148 -6.846 0.975 1.00 0.00 C ATOM 104 OH TYR A 6 -7.388 -7.348 1.298 1.00 0.00 O ATOM 105 H TYR A 6 -3.589 -2.477 0.473 1.00 0.00 H ATOM 106 HA TYR A 6 -2.104 -3.842 1.529 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.181 -5.311 -1.115 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.528 -5.957 0.383 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.326 -7.712 -0.640 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.275 -4.081 1.369 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.539 -8.612 -0.064 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.489 -4.972 1.945 1.00 0.00 H ATOM 113 HH TYR A 6 -7.918 -7.429 0.501 1.00 0.00 H ATOM 114 N TRP A 7 -0.150 -2.291 0.582 1.00 0.00 N ATOM 115 CA TRP A 7 1.192 -1.789 0.314 1.00 0.00 C ATOM 116 C TRP A 7 2.250 -2.731 0.879 1.00 0.00 C ATOM 117 O TRP A 7 1.994 -3.473 1.826 1.00 0.00 O ATOM 118 CB TRP A 7 1.368 -0.391 0.909 1.00 0.00 C ATOM 119 CG TRP A 7 1.172 -0.347 2.394 1.00 0.00 C ATOM 120 CD1 TRP A 7 1.887 -1.030 3.335 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.198 0.422 3.107 1.00 0.00 C ATOM 122 NE1 TRP A 7 1.415 -0.734 4.591 1.00 0.00 N ATOM 123 CE2 TRP A 7 0.379 0.156 4.478 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.808 1.311 2.721 1.00 0.00 C ATOM 125 CZ2 TRP A 7 -0.410 0.746 5.462 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -1.591 1.896 3.699 1.00 0.00 C ATOM 127 CH2 TRP A 7 -1.388 1.612 5.054 1.00 0.00 C ATOM 128 H TRP A 7 -0.762 -1.755 1.128 1.00 0.00 H ATOM 129 HA TRP A 7 1.315 -1.731 -0.758 1.00 0.00 H ATOM 130 1HB TRP A 7 2.364 -0.037 0.694 1.00 0.00 H ATOM 131 2HB TRP A 7 0.649 0.278 0.457 1.00 0.00 H ATOM 132 HD1 TRP A 7 2.701 -1.704 3.111 1.00 0.00 H ATOM 133 HE1 TRP A 7 1.764 -1.100 5.431 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.980 1.542 1.681 1.00 0.00 H ATOM 135 HZ2 TRP A 7 -0.266 0.538 6.511 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -2.375 2.585 3.419 1.00 0.00 H ATOM 137 HH2 TRP A 7 -2.024 2.092 5.784 1.00 0.00 H ATOM 138 N TRP A 8 3.441 -2.693 0.290 1.00 0.00 N ATOM 139 CA TRP A 8 4.541 -3.541 0.732 1.00 0.00 C ATOM 140 C TRP A 8 5.876 -2.833 0.471 1.00 0.00 C ATOM 141 O TRP A 8 6.306 -2.000 1.268 1.00 0.00 O ATOM 142 CB TRP A 8 4.482 -4.890 0.003 1.00 0.00 C ATOM 143 CG TRP A 8 5.550 -5.878 0.398 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.725 -7.120 -0.139 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.527 -5.760 1.453 1.00 0.00 C ATOM 146 NE1 TRP A 8 6.784 -7.755 0.461 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.287 -6.948 1.445 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.855 -4.767 2.387 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.341 -7.169 2.327 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.899 -4.992 3.264 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.632 -6.182 3.227 1.00 0.00 C ATOM 152 H TRP A 8 3.583 -2.079 -0.459 1.00 0.00 H ATOM 153 HA TRP A 8 4.436 -3.704 1.789 1.00 0.00 H ATOM 154 1HB TRP A 8 3.526 -5.349 0.205 1.00 0.00 H ATOM 155 2HB TRP A 8 4.565 -4.717 -1.059 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.132 -7.519 -0.949 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.118 -8.646 0.228 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.303 -3.845 2.441 1.00 0.00 H ATOM 159 HZ2 TRP A 8 8.917 -8.082 2.311 1.00 0.00 H ATOM 160 HZ3 TRP A 8 8.161 -4.238 3.991 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.439 -6.315 3.932 1.00 0.00 H ATOM 162 N ARG A 9 6.523 -3.161 -0.642 1.00 0.00 N ATOM 163 CA ARG A 9 7.801 -2.547 -0.991 1.00 0.00 C ATOM 164 C ARG A 9 7.681 -1.024 -1.072 1.00 0.00 C ATOM 165 O ARG A 9 8.505 -0.304 -0.509 1.00 0.00 O ATOM 166 CB ARG A 9 8.320 -3.106 -2.319 1.00 0.00 C ATOM 167 CG ARG A 9 8.544 -4.609 -2.300 1.00 0.00 C ATOM 168 CD ARG A 9 9.563 -5.007 -1.245 1.00 0.00 C ATOM 169 NE ARG A 9 9.788 -6.451 -1.218 1.00 0.00 N ATOM 170 CZ ARG A 9 10.632 -7.055 -0.385 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.334 -6.345 0.489 1.00 0.00 N ATOM 172 NH2 ARG A 9 10.775 -8.373 -0.427 1.00 0.00 N ATOM 173 H ARG A 9 6.136 -3.826 -1.241 1.00 0.00 H ATOM 174 HA ARG A 9 8.506 -2.795 -0.211 1.00 0.00 H ATOM 175 1HB ARG A 9 7.607 -2.882 -3.096 1.00 0.00 H ATOM 176 2HB ARG A 9 9.258 -2.627 -2.554 1.00 0.00 H ATOM 177 1HG ARG A 9 7.608 -5.100 -2.084 1.00 0.00 H ATOM 178 2HG ARG A 9 8.902 -4.922 -3.270 1.00 0.00 H ATOM 179 1HD ARG A 9 10.498 -4.512 -1.461 1.00 0.00 H ATOM 180 2HD ARG A 9 9.204 -4.690 -0.277 1.00 0.00 H ATOM 181 HE ARG A 9 9.281 -6.999 -1.854 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.231 -5.352 0.526 1.00 0.00 H ATOM 183 2HH1 ARG A 9 11.966 -6.805 1.112 1.00 0.00 H ATOM 184 1HH2 ARG A 9 10.248 -8.913 -1.085 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.410 -8.827 0.198 1.00 0.00 H ATOM 186 N PRO A 10 6.651 -0.507 -1.770 1.00 0.00 N ATOM 187 CA PRO A 10 6.442 0.932 -1.907 1.00 0.00 C ATOM 188 C PRO A 10 5.707 1.522 -0.708 1.00 0.00 C ATOM 189 O PRO A 10 5.612 0.893 0.346 1.00 0.00 O ATOM 190 CB PRO A 10 5.586 1.026 -3.167 1.00 0.00 C ATOM 191 CG PRO A 10 4.770 -0.220 -3.157 1.00 0.00 C ATOM 192 CD PRO A 10 5.606 -1.277 -2.477 1.00 0.00 C ATOM 193 HA PRO A 10 7.373 1.459 -2.056 1.00 0.00 H ATOM 194 1HB PRO A 10 4.963 1.908 -3.120 1.00 0.00 H ATOM 195 2HB PRO A 10 6.224 1.073 -4.037 1.00 0.00 H ATOM 196 1HG PRO A 10 3.857 -0.055 -2.605 1.00 0.00 H ATOM 197 2HG PRO A 10 4.545 -0.517 -4.170 1.00 0.00 H ATOM 198 1HD PRO A 10 5.005 -1.835 -1.777 1.00 0.00 H ATOM 199 2HD PRO A 10 6.043 -1.937 -3.209 1.00 0.00 H ATOM 200 N SER A 11 5.187 2.732 -0.875 1.00 0.00 N ATOM 201 CA SER A 11 4.459 3.406 0.195 1.00 0.00 C ATOM 202 C SER A 11 3.656 4.583 -0.351 1.00 0.00 C ATOM 203 O SER A 11 4.212 5.639 -0.653 1.00 0.00 O ATOM 204 CB SER A 11 5.430 3.892 1.273 1.00 0.00 C ATOM 205 OG SER A 11 6.147 2.809 1.839 1.00 0.00 O ATOM 206 H SER A 11 5.294 3.182 -1.737 1.00 0.00 H ATOM 207 HA SER A 11 3.777 2.692 0.632 1.00 0.00 H ATOM 208 1HB SER A 11 6.134 4.584 0.835 1.00 0.00 H ATOM 209 2HB SER A 11 4.876 4.389 2.055 1.00 0.00 H ATOM 210 HG SER A 11 5.891 2.702 2.758 1.00 0.00 H ATOM 211 N ILE A 12 2.347 4.393 -0.474 1.00 0.00 N ATOM 212 CA ILE A 12 1.469 5.439 -0.983 1.00 0.00 C ATOM 213 C ILE A 12 1.852 5.827 -2.408 1.00 0.00 C ATOM 214 O ILE A 12 1.114 5.450 -3.342 1.00 0.00 O ATOM 215 CB ILE A 12 1.512 6.693 -0.083 1.00 0.00 C ATOM 216 CG1 ILE A 12 1.070 6.340 1.337 1.00 0.00 C ATOM 217 CG2 ILE A 12 0.632 7.796 -0.655 1.00 0.00 C ATOM 218 CD1 ILE A 12 -0.339 5.792 1.414 1.00 0.00 C ATOM 219 OXT ILE A 12 2.887 6.505 -2.578 1.00 0.00 O ATOM 220 H ILE A 12 1.963 3.529 -0.216 1.00 0.00 H ATOM 221 HA ILE A 12 0.459 5.056 -0.983 1.00 0.00 H ATOM 222 HB ILE A 12 2.529 7.055 -0.057 1.00 0.00 H ATOM 223 1HG1 ILE A 12 1.738 5.594 1.741 1.00 0.00 H ATOM 224 2HG1 ILE A 12 1.114 7.228 1.952 1.00 0.00 H ATOM 225 1HG2 ILE A 12 -0.350 7.398 -0.868 1.00 0.00 H ATOM 226 2HG2 ILE A 12 1.072 8.172 -1.567 1.00 0.00 H ATOM 227 3HG2 ILE A 12 0.548 8.599 0.062 1.00 0.00 H ATOM 228 1HD1 ILE A 12 -0.685 5.829 2.436 1.00 0.00 H ATOM 229 2HD1 ILE A 12 -0.344 4.768 1.068 1.00 0.00 H ATOM 230 3HD1 ILE A 12 -0.990 6.385 0.789 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 5 ATOM 1 N HIS A 1 -6.133 5.037 6.817 1.00 0.00 N ATOM 2 CA HIS A 1 -5.108 4.093 6.295 1.00 0.00 C ATOM 3 C HIS A 1 -5.744 3.021 5.412 1.00 0.00 C ATOM 4 O HIS A 1 -6.200 1.991 5.906 1.00 0.00 O ATOM 5 CB HIS A 1 -4.395 3.442 7.482 1.00 0.00 C ATOM 6 CG HIS A 1 -3.703 4.424 8.375 1.00 0.00 C ATOM 7 ND1 HIS A 1 -2.700 5.264 7.937 1.00 0.00 N ATOM 8 CD2 HIS A 1 -3.872 4.698 9.691 1.00 0.00 C ATOM 9 CE1 HIS A 1 -2.283 6.011 8.945 1.00 0.00 C ATOM 10 NE2 HIS A 1 -2.978 5.688 10.019 1.00 0.00 N ATOM 11 1H HIS A 1 -6.702 5.364 6.012 1.00 0.00 H ATOM 12 2H HIS A 1 -5.632 5.828 7.270 1.00 0.00 H ATOM 13 3H HIS A 1 -6.719 4.520 7.504 1.00 0.00 H ATOM 14 HA HIS A 1 -4.392 4.652 5.714 1.00 0.00 H ATOM 15 1HB HIS A 1 -5.118 2.905 8.078 1.00 0.00 H ATOM 16 2HB HIS A 1 -3.655 2.749 7.111 1.00 0.00 H ATOM 17 HD1 HIS A 1 -2.346 5.306 7.025 1.00 0.00 H ATOM 18 HD2 HIS A 1 -4.579 4.226 10.359 1.00 0.00 H ATOM 19 HE1 HIS A 1 -1.506 6.760 8.896 1.00 0.00 H ATOM 20 HE2 HIS A 1 -2.800 6.015 10.925 1.00 0.00 H ATOM 21 N PRO A 2 -5.782 3.250 4.088 1.00 0.00 N ATOM 22 CA PRO A 2 -6.366 2.295 3.140 1.00 0.00 C ATOM 23 C PRO A 2 -5.550 1.012 3.037 1.00 0.00 C ATOM 24 O PRO A 2 -4.418 1.022 2.553 1.00 0.00 O ATOM 25 CB PRO A 2 -6.348 3.052 1.809 1.00 0.00 C ATOM 26 CG PRO A 2 -5.263 4.060 1.960 1.00 0.00 C ATOM 27 CD PRO A 2 -5.262 4.453 3.410 1.00 0.00 C ATOM 28 HA PRO A 2 -7.386 2.051 3.404 1.00 0.00 H ATOM 29 1HB PRO A 2 -6.137 2.362 1.004 1.00 0.00 H ATOM 30 2HB PRO A 2 -7.304 3.522 1.645 1.00 0.00 H ATOM 31 1HG PRO A 2 -4.313 3.623 1.688 1.00 0.00 H ATOM 32 2HG PRO A 2 -5.472 4.920 1.340 1.00 0.00 H ATOM 33 1HD PRO A 2 -4.257 4.677 3.740 1.00 0.00 H ATOM 34 2HD PRO A 2 -5.911 5.300 3.574 1.00 0.00 H ATOM 35 N LEU A 3 -6.132 -0.091 3.494 1.00 0.00 N ATOM 36 CA LEU A 3 -5.461 -1.384 3.455 1.00 0.00 C ATOM 37 C LEU A 3 -6.000 -2.267 2.330 1.00 0.00 C ATOM 38 O LEU A 3 -5.767 -3.476 2.314 1.00 0.00 O ATOM 39 CB LEU A 3 -5.590 -2.087 4.812 1.00 0.00 C ATOM 40 CG LEU A 3 -7.021 -2.352 5.291 1.00 0.00 C ATOM 41 CD1 LEU A 3 -7.777 -3.250 4.323 1.00 0.00 C ATOM 42 CD2 LEU A 3 -7.008 -2.960 6.685 1.00 0.00 C ATOM 43 H LEU A 3 -7.037 -0.034 3.868 1.00 0.00 H ATOM 44 HA LEU A 3 -4.416 -1.197 3.266 1.00 0.00 H ATOM 45 1HB LEU A 3 -5.075 -3.034 4.751 1.00 0.00 H ATOM 46 2HB LEU A 3 -5.096 -1.478 5.553 1.00 0.00 H ATOM 47 HG LEU A 3 -7.546 -1.411 5.345 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.614 -3.703 4.833 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -7.117 -4.023 3.958 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -8.138 -2.662 3.493 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -6.492 -2.296 7.363 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -6.499 -3.912 6.658 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -8.023 -3.104 7.025 1.00 0.00 H ATOM 54 N LYS A 4 -6.719 -1.658 1.390 1.00 0.00 N ATOM 55 CA LYS A 4 -7.286 -2.396 0.266 1.00 0.00 C ATOM 56 C LYS A 4 -6.291 -2.494 -0.888 1.00 0.00 C ATOM 57 O LYS A 4 -6.431 -3.340 -1.770 1.00 0.00 O ATOM 58 CB LYS A 4 -8.575 -1.726 -0.213 1.00 0.00 C ATOM 59 CG LYS A 4 -9.232 -2.435 -1.386 1.00 0.00 C ATOM 60 CD LYS A 4 -10.506 -1.727 -1.822 1.00 0.00 C ATOM 61 CE LYS A 4 -11.162 -2.436 -2.995 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.410 -1.750 -3.430 1.00 0.00 N ATOM 63 H LYS A 4 -6.872 -0.693 1.452 1.00 0.00 H ATOM 64 HA LYS A 4 -7.515 -3.391 0.608 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.279 -1.701 0.605 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.350 -0.713 -0.513 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.541 -2.453 -2.216 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.474 -3.446 -1.093 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.197 -1.708 -0.994 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.262 -0.717 -2.114 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.468 -2.456 -3.822 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.401 -3.448 -2.701 1.00 0.00 H ATOM 73 1HZ LYS A 4 -13.117 -2.452 -3.734 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.209 -1.112 -4.225 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.805 -1.194 -2.645 1.00 0.00 H ATOM 76 N GLN A 5 -5.287 -1.623 -0.876 1.00 0.00 N ATOM 77 CA GLN A 5 -4.271 -1.611 -1.922 1.00 0.00 C ATOM 78 C GLN A 5 -3.165 -2.621 -1.628 1.00 0.00 C ATOM 79 O GLN A 5 -2.445 -3.048 -2.531 1.00 0.00 O ATOM 80 CB GLN A 5 -3.674 -0.211 -2.068 1.00 0.00 C ATOM 81 CG GLN A 5 -2.605 -0.112 -3.145 1.00 0.00 C ATOM 82 CD GLN A 5 -2.029 1.285 -3.269 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.749 2.243 -3.550 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.724 1.407 -3.062 1.00 0.00 N ATOM 85 H GLN A 5 -5.229 -0.971 -0.147 1.00 0.00 H ATOM 86 HA GLN A 5 -4.751 -1.885 -2.848 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.466 0.483 -2.313 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.233 0.080 -1.125 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.804 -0.795 -2.902 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.041 -0.392 -4.093 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.212 0.600 -2.844 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.324 2.299 -3.136 1.00 0.00 H ATOM 93 N TYR A 6 -3.034 -2.998 -0.361 1.00 0.00 N ATOM 94 CA TYR A 6 -2.014 -3.957 0.049 1.00 0.00 C ATOM 95 C TYR A 6 -0.617 -3.429 -0.260 1.00 0.00 C ATOM 96 O TYR A 6 -0.042 -3.740 -1.302 1.00 0.00 O ATOM 97 CB TYR A 6 -2.231 -5.301 -0.653 1.00 0.00 C ATOM 98 CG TYR A 6 -3.569 -5.955 -0.361 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.898 -7.176 -0.936 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.500 -5.359 0.488 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.113 -7.784 -0.678 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.714 -5.964 0.750 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.017 -7.173 0.164 1.00 0.00 C ATOM 104 OH TYR A 6 -7.226 -7.777 0.424 1.00 0.00 O ATOM 105 H TYR A 6 -3.636 -2.623 0.313 1.00 0.00 H ATOM 106 HA TYR A 6 -2.104 -4.099 1.116 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.165 -5.152 -1.721 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.454 -5.986 -0.344 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.190 -7.651 -1.597 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.263 -4.412 0.947 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.349 -8.733 -1.136 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.423 -5.484 1.411 1.00 0.00 H ATOM 113 HH TYR A 6 -7.095 -8.721 0.537 1.00 0.00 H ATOM 114 N TRP A 7 -0.075 -2.630 0.654 1.00 0.00 N ATOM 115 CA TRP A 7 1.255 -2.061 0.477 1.00 0.00 C ATOM 116 C TRP A 7 2.334 -3.063 0.876 1.00 0.00 C ATOM 117 O TRP A 7 2.035 -4.149 1.371 1.00 0.00 O ATOM 118 CB TRP A 7 1.403 -0.783 1.304 1.00 0.00 C ATOM 119 CG TRP A 7 1.211 -1.001 2.774 1.00 0.00 C ATOM 120 CD1 TRP A 7 1.941 -1.821 3.585 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.225 -0.384 3.609 1.00 0.00 C ATOM 122 NE1 TRP A 7 1.466 -1.756 4.873 1.00 0.00 N ATOM 123 CE2 TRP A 7 0.413 -0.880 4.913 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.799 0.538 3.380 1.00 0.00 C ATOM 125 CZ2 TRP A 7 -0.386 -0.483 5.982 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -1.592 0.931 4.442 1.00 0.00 C ATOM 127 CH2 TRP A 7 -1.381 0.421 5.730 1.00 0.00 C ATOM 128 H TRP A 7 -0.582 -2.419 1.465 1.00 0.00 H ATOM 129 HA TRP A 7 1.375 -1.818 -0.568 1.00 0.00 H ATOM 130 1HB TRP A 7 2.392 -0.377 1.154 1.00 0.00 H ATOM 131 2HB TRP A 7 0.669 -0.062 0.974 1.00 0.00 H ATOM 132 HD1 TRP A 7 2.768 -2.430 3.248 1.00 0.00 H ATOM 133 HE1 TRP A 7 1.823 -2.254 5.637 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.975 0.943 2.394 1.00 0.00 H ATOM 135 HZ2 TRP A 7 -0.237 -0.867 6.981 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -2.388 1.643 4.284 1.00 0.00 H ATOM 137 HH2 TRP A 7 -2.025 0.756 6.529 1.00 0.00 H ATOM 138 N TRP A 8 3.591 -2.687 0.657 1.00 0.00 N ATOM 139 CA TRP A 8 4.717 -3.550 0.994 1.00 0.00 C ATOM 140 C TRP A 8 6.031 -2.819 0.699 1.00 0.00 C ATOM 141 O TRP A 8 6.528 -2.063 1.533 1.00 0.00 O ATOM 142 CB TRP A 8 4.626 -4.858 0.195 1.00 0.00 C ATOM 143 CG TRP A 8 5.715 -5.858 0.479 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.869 -7.068 -0.135 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.744 -5.794 1.489 1.00 0.00 C ATOM 146 NE1 TRP A 8 6.959 -7.727 0.373 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.507 -6.976 1.376 1.00 0.00 C ATOM 148 CE3 TRP A 8 7.113 -4.855 2.462 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.604 -7.238 2.192 1.00 0.00 C ATOM 150 CZ3 TRP A 8 8.200 -5.123 3.272 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.935 -6.303 3.131 1.00 0.00 C ATOM 152 H TRP A 8 3.765 -1.808 0.260 1.00 0.00 H ATOM 153 HA TRP A 8 4.669 -3.772 2.044 1.00 0.00 H ATOM 154 1HB TRP A 8 3.684 -5.334 0.420 1.00 0.00 H ATOM 155 2HB TRP A 8 4.653 -4.627 -0.859 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.239 -7.425 -0.937 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.286 -8.602 0.074 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.559 -3.942 2.596 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.184 -8.144 2.095 1.00 0.00 H ATOM 160 HZ3 TRP A 8 8.494 -4.409 4.028 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.777 -6.470 3.788 1.00 0.00 H ATOM 162 N ARG A 9 6.585 -3.042 -0.486 1.00 0.00 N ATOM 163 CA ARG A 9 7.833 -2.401 -0.880 1.00 0.00 C ATOM 164 C ARG A 9 7.646 -0.898 -1.097 1.00 0.00 C ATOM 165 O ARG A 9 8.410 -0.093 -0.566 1.00 0.00 O ATOM 166 CB ARG A 9 8.389 -3.050 -2.149 1.00 0.00 C ATOM 167 CG ARG A 9 8.684 -4.533 -1.994 1.00 0.00 C ATOM 168 CD ARG A 9 9.711 -4.787 -0.903 1.00 0.00 C ATOM 169 NE ARG A 9 10.002 -6.209 -0.745 1.00 0.00 N ATOM 170 CZ ARG A 9 10.868 -6.696 0.142 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.527 -5.878 0.954 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.073 -8.003 0.219 1.00 0.00 N ATOM 173 H ARG A 9 6.144 -3.648 -1.110 1.00 0.00 H ATOM 174 HA ARG A 9 8.542 -2.546 -0.078 1.00 0.00 H ATOM 175 1HB ARG A 9 7.671 -2.930 -2.946 1.00 0.00 H ATOM 176 2HB ARG A 9 9.306 -2.550 -2.425 1.00 0.00 H ATOM 177 1HG ARG A 9 7.769 -5.048 -1.740 1.00 0.00 H ATOM 178 2HG ARG A 9 9.065 -4.914 -2.931 1.00 0.00 H ATOM 179 1HD ARG A 9 10.624 -4.268 -1.159 1.00 0.00 H ATOM 180 2HD ARG A 9 9.329 -4.401 0.029 1.00 0.00 H ATOM 181 HE ARG A 9 9.530 -6.836 -1.331 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.377 -4.892 0.902 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.175 -6.250 1.619 1.00 0.00 H ATOM 184 1HH2 ARG A 9 10.579 -8.624 -0.390 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.723 -8.370 0.885 1.00 0.00 H ATOM 186 N PRO A 10 6.629 -0.491 -1.884 1.00 0.00 N ATOM 187 CA PRO A 10 6.371 0.927 -2.155 1.00 0.00 C ATOM 188 C PRO A 10 5.791 1.658 -0.951 1.00 0.00 C ATOM 189 O PRO A 10 5.911 2.878 -0.835 1.00 0.00 O ATOM 190 CB PRO A 10 5.359 0.890 -3.300 1.00 0.00 C ATOM 191 CG PRO A 10 4.647 -0.406 -3.132 1.00 0.00 C ATOM 192 CD PRO A 10 5.658 -1.369 -2.570 1.00 0.00 C ATOM 193 HA PRO A 10 7.264 1.431 -2.477 1.00 0.00 H ATOM 194 1HB PRO A 10 4.683 1.728 -3.213 1.00 0.00 H ATOM 195 2HB PRO A 10 5.879 0.935 -4.245 1.00 0.00 H ATOM 196 1HG PRO A 10 3.823 -0.285 -2.444 1.00 0.00 H ATOM 197 2HG PRO A 10 4.290 -0.755 -4.089 1.00 0.00 H ATOM 198 1HD PRO A 10 5.185 -2.043 -1.874 1.00 0.00 H ATOM 199 2HD PRO A 10 6.134 -1.920 -3.367 1.00 0.00 H ATOM 200 N SER A 11 5.164 0.905 -0.057 1.00 0.00 N ATOM 201 CA SER A 11 4.563 1.476 1.145 1.00 0.00 C ATOM 202 C SER A 11 3.652 2.652 0.801 1.00 0.00 C ATOM 203 O SER A 11 3.478 3.570 1.604 1.00 0.00 O ATOM 204 CB SER A 11 5.653 1.929 2.118 1.00 0.00 C ATOM 205 OG SER A 11 6.475 0.842 2.506 1.00 0.00 O ATOM 206 H SER A 11 5.107 -0.060 -0.210 1.00 0.00 H ATOM 207 HA SER A 11 3.971 0.705 1.617 1.00 0.00 H ATOM 208 1HB SER A 11 6.269 2.677 1.642 1.00 0.00 H ATOM 209 2HB SER A 11 5.193 2.350 2.999 1.00 0.00 H ATOM 210 HG SER A 11 6.707 0.931 3.434 1.00 0.00 H ATOM 211 N ILE A 12 3.074 2.618 -0.395 1.00 0.00 N ATOM 212 CA ILE A 12 2.183 3.681 -0.843 1.00 0.00 C ATOM 213 C ILE A 12 0.729 3.343 -0.523 1.00 0.00 C ATOM 214 O ILE A 12 -0.043 4.278 -0.224 1.00 0.00 O ATOM 215 CB ILE A 12 2.328 3.931 -2.358 1.00 0.00 C ATOM 216 CG1 ILE A 12 3.764 4.334 -2.695 1.00 0.00 C ATOM 217 CG2 ILE A 12 1.354 5.006 -2.821 1.00 0.00 C ATOM 218 CD1 ILE A 12 4.217 5.597 -1.994 1.00 0.00 C ATOM 219 OXT ILE A 12 0.377 2.146 -0.574 1.00 0.00 O ATOM 220 H ILE A 12 3.251 1.861 -0.991 1.00 0.00 H ATOM 221 HA ILE A 12 2.456 4.587 -0.321 1.00 0.00 H ATOM 222 HB ILE A 12 2.088 3.015 -2.877 1.00 0.00 H ATOM 223 1HG1 ILE A 12 4.433 3.537 -2.405 1.00 0.00 H ATOM 224 2HG1 ILE A 12 3.846 4.497 -3.760 1.00 0.00 H ATOM 225 1HG2 ILE A 12 0.404 4.552 -3.064 1.00 0.00 H ATOM 226 2HG2 ILE A 12 1.750 5.500 -3.696 1.00 0.00 H ATOM 227 3HG2 ILE A 12 1.214 5.730 -2.032 1.00 0.00 H ATOM 228 1HD1 ILE A 12 4.805 6.195 -2.674 1.00 0.00 H ATOM 229 2HD1 ILE A 12 4.817 5.335 -1.134 1.00 0.00 H ATOM 230 3HD1 ILE A 12 3.353 6.160 -1.673 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 6 ATOM 1 N HIS A 1 -4.730 7.507 3.333 1.00 0.00 N ATOM 2 CA HIS A 1 -4.024 6.240 3.660 1.00 0.00 C ATOM 3 C HIS A 1 -4.909 5.027 3.386 1.00 0.00 C ATOM 4 O HIS A 1 -5.645 4.575 4.262 1.00 0.00 O ATOM 5 CB HIS A 1 -3.619 6.275 5.135 1.00 0.00 C ATOM 6 CG HIS A 1 -2.707 7.411 5.479 1.00 0.00 C ATOM 7 ND1 HIS A 1 -1.469 7.585 4.898 1.00 0.00 N ATOM 8 CD2 HIS A 1 -2.860 8.436 6.351 1.00 0.00 C ATOM 9 CE1 HIS A 1 -0.899 8.668 5.397 1.00 0.00 C ATOM 10 NE2 HIS A 1 -1.721 9.203 6.280 1.00 0.00 N ATOM 11 1H HIS A 1 -4.022 8.267 3.308 1.00 0.00 H ATOM 12 2H HIS A 1 -5.436 7.676 4.079 1.00 0.00 H ATOM 13 3H HIS A 1 -5.184 7.387 2.407 1.00 0.00 H ATOM 14 HA HIS A 1 -3.135 6.174 3.050 1.00 0.00 H ATOM 15 1HB HIS A 1 -4.506 6.366 5.742 1.00 0.00 H ATOM 16 2HB HIS A 1 -3.112 5.353 5.383 1.00 0.00 H ATOM 17 HD1 HIS A 1 -1.067 7.003 4.221 1.00 0.00 H ATOM 18 HD2 HIS A 1 -3.716 8.619 6.983 1.00 0.00 H ATOM 19 HE1 HIS A 1 0.075 9.050 5.128 1.00 0.00 H ATOM 20 HE2 HIS A 1 -1.512 9.964 6.859 1.00 0.00 H ATOM 21 N PRO A 2 -4.850 4.483 2.157 1.00 0.00 N ATOM 22 CA PRO A 2 -5.652 3.317 1.771 1.00 0.00 C ATOM 23 C PRO A 2 -5.210 2.048 2.492 1.00 0.00 C ATOM 24 O PRO A 2 -4.103 1.978 3.027 1.00 0.00 O ATOM 25 CB PRO A 2 -5.400 3.192 0.266 1.00 0.00 C ATOM 26 CG PRO A 2 -4.081 3.847 0.045 1.00 0.00 C ATOM 27 CD PRO A 2 -3.999 4.960 1.051 1.00 0.00 C ATOM 28 HA PRO A 2 -6.703 3.483 1.951 1.00 0.00 H ATOM 29 1HB PRO A 2 -5.377 2.148 -0.012 1.00 0.00 H ATOM 30 2HB PRO A 2 -6.186 3.696 -0.276 1.00 0.00 H ATOM 31 1HG PRO A 2 -3.286 3.134 0.207 1.00 0.00 H ATOM 32 2HG PRO A 2 -4.031 4.244 -0.958 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.979 5.097 1.380 1.00 0.00 H ATOM 34 2HD PRO A 2 -4.388 5.876 0.634 1.00 0.00 H ATOM 35 N LEU A 3 -6.082 1.045 2.502 1.00 0.00 N ATOM 36 CA LEU A 3 -5.782 -0.222 3.158 1.00 0.00 C ATOM 37 C LEU A 3 -6.309 -1.412 2.357 1.00 0.00 C ATOM 38 O LEU A 3 -6.405 -2.524 2.874 1.00 0.00 O ATOM 39 CB LEU A 3 -6.353 -0.227 4.582 1.00 0.00 C ATOM 40 CG LEU A 3 -7.867 -0.026 4.694 1.00 0.00 C ATOM 41 CD1 LEU A 3 -8.633 -1.127 3.974 1.00 0.00 C ATOM 42 CD2 LEU A 3 -8.286 0.046 6.155 1.00 0.00 C ATOM 43 H LEU A 3 -6.949 1.161 2.059 1.00 0.00 H ATOM 44 HA LEU A 3 -4.709 -0.304 3.221 1.00 0.00 H ATOM 45 1HB LEU A 3 -6.104 -1.172 5.040 1.00 0.00 H ATOM 46 2HB LEU A 3 -5.867 0.560 5.140 1.00 0.00 H ATOM 47 HG LEU A 3 -8.125 0.913 4.229 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.654 -0.917 2.915 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -9.643 -1.170 4.352 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -8.144 -2.074 4.144 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -9.283 -0.353 6.264 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -8.271 1.074 6.484 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -7.600 -0.533 6.755 1.00 0.00 H ATOM 54 N LYS A 4 -6.644 -1.174 1.091 1.00 0.00 N ATOM 55 CA LYS A 4 -7.156 -2.231 0.226 1.00 0.00 C ATOM 56 C LYS A 4 -6.141 -2.606 -0.850 1.00 0.00 C ATOM 57 O LYS A 4 -6.230 -3.675 -1.455 1.00 0.00 O ATOM 58 CB LYS A 4 -8.469 -1.791 -0.427 1.00 0.00 C ATOM 59 CG LYS A 4 -9.074 -2.840 -1.347 1.00 0.00 C ATOM 60 CD LYS A 4 -10.373 -2.354 -1.968 1.00 0.00 C ATOM 61 CE LYS A 4 -10.976 -3.402 -2.889 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.251 -2.937 -3.502 1.00 0.00 N ATOM 63 H LYS A 4 -6.543 -0.269 0.730 1.00 0.00 H ATOM 64 HA LYS A 4 -7.345 -3.096 0.840 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.187 -1.569 0.349 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.288 -0.897 -1.005 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.370 -3.060 -2.136 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.270 -3.736 -0.777 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.077 -2.134 -1.180 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.175 -1.458 -2.538 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.270 -3.623 -3.674 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.168 -4.297 -2.316 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.070 -2.547 -4.450 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.682 -2.197 -2.913 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.918 -3.730 -3.586 1.00 0.00 H ATOM 76 N GLN A 5 -5.175 -1.724 -1.083 1.00 0.00 N ATOM 77 CA GLN A 5 -4.143 -1.967 -2.087 1.00 0.00 C ATOM 78 C GLN A 5 -3.077 -2.925 -1.560 1.00 0.00 C ATOM 79 O GLN A 5 -2.334 -3.526 -2.336 1.00 0.00 O ATOM 80 CB GLN A 5 -3.496 -0.648 -2.513 1.00 0.00 C ATOM 81 CG GLN A 5 -2.408 -0.813 -3.561 1.00 0.00 C ATOM 82 CD GLN A 5 -1.783 0.507 -3.966 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.465 1.404 -4.463 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.478 0.632 -3.757 1.00 0.00 N ATOM 85 H GLN A 5 -5.154 -0.891 -0.571 1.00 0.00 H ATOM 86 HA GLN A 5 -4.618 -2.417 -2.943 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.260 0.000 -2.918 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.061 -0.177 -1.644 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.634 -1.452 -3.161 1.00 0.00 H ATOM 90 2HG GLN A 5 -2.838 -1.277 -4.438 1.00 0.00 H ATOM 91 1HE2 GLN A 5 0.003 -0.123 -3.358 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.047 1.476 -4.010 1.00 0.00 H ATOM 93 N TYR A 6 -3.004 -3.062 -0.240 1.00 0.00 N ATOM 94 CA TYR A 6 -2.026 -3.945 0.385 1.00 0.00 C ATOM 95 C TYR A 6 -0.605 -3.493 0.065 1.00 0.00 C ATOM 96 O TYR A 6 0.046 -4.040 -0.825 1.00 0.00 O ATOM 97 CB TYR A 6 -2.233 -5.388 -0.087 1.00 0.00 C ATOM 98 CG TYR A 6 -3.598 -5.966 0.242 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.922 -7.266 -0.131 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.559 -5.224 0.925 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.160 -7.806 0.163 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.798 -5.760 1.221 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.093 -7.050 0.838 1.00 0.00 C ATOM 104 OH TYR A 6 -7.325 -7.586 1.132 1.00 0.00 O ATOM 105 H TYR A 6 -3.622 -2.556 0.327 1.00 0.00 H ATOM 106 HA TYR A 6 -2.174 -3.899 1.453 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.111 -5.428 -1.158 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.487 -6.018 0.377 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.190 -7.856 -0.660 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.328 -4.213 1.224 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.390 -8.819 -0.136 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.530 -5.167 1.749 1.00 0.00 H ATOM 113 HH TYR A 6 -7.630 -8.115 0.391 1.00 0.00 H ATOM 114 N TRP A 7 -0.130 -2.490 0.796 1.00 0.00 N ATOM 115 CA TRP A 7 1.213 -1.964 0.591 1.00 0.00 C ATOM 116 C TRP A 7 2.267 -3.038 0.842 1.00 0.00 C ATOM 117 O TRP A 7 1.946 -4.152 1.255 1.00 0.00 O ATOM 118 CB TRP A 7 1.462 -0.768 1.509 1.00 0.00 C ATOM 119 CG TRP A 7 1.340 -1.099 2.966 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.077 -2.013 3.663 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.426 -0.520 3.903 1.00 0.00 C ATOM 122 NE1 TRP A 7 1.676 -2.038 4.977 1.00 0.00 N ATOM 123 CE2 TRP A 7 0.663 -1.130 5.149 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.571 0.455 3.810 1.00 0.00 C ATOM 125 CZ2 TRP A 7 -0.058 -0.796 6.292 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -1.287 0.786 4.946 1.00 0.00 C ATOM 127 CH2 TRP A 7 -1.027 0.162 6.172 1.00 0.00 C ATOM 128 H TRP A 7 -0.697 -2.095 1.491 1.00 0.00 H ATOM 129 HA TRP A 7 1.287 -1.638 -0.436 1.00 0.00 H ATOM 130 1HB TRP A 7 2.459 -0.390 1.337 1.00 0.00 H ATOM 131 2HB TRP A 7 0.745 0.008 1.282 1.00 0.00 H ATOM 132 HD1 TRP A 7 2.857 -2.622 3.232 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.054 -2.612 5.676 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.785 0.947 2.873 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.130 -1.267 7.246 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -2.061 1.538 4.892 1.00 0.00 H ATOM 137 HH2 TRP A 7 -1.612 0.451 7.033 1.00 0.00 H ATOM 138 N TRP A 8 3.526 -2.693 0.589 1.00 0.00 N ATOM 139 CA TRP A 8 4.629 -3.625 0.788 1.00 0.00 C ATOM 140 C TRP A 8 5.957 -2.922 0.488 1.00 0.00 C ATOM 141 O TRP A 8 6.528 -2.263 1.358 1.00 0.00 O ATOM 142 CB TRP A 8 4.441 -4.852 -0.116 1.00 0.00 C ATOM 143 CG TRP A 8 5.501 -5.915 0.020 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.569 -7.070 -0.705 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.580 -5.980 0.974 1.00 0.00 C ATOM 146 NE1 TRP A 8 6.655 -7.813 -0.316 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.286 -7.174 0.717 1.00 0.00 C ATOM 148 CE3 TRP A 8 7.039 -5.146 2.003 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.412 -7.551 1.444 1.00 0.00 C ATOM 150 CZ3 TRP A 8 8.155 -5.527 2.726 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.830 -6.717 2.442 1.00 0.00 C ATOM 152 H TRP A 8 3.717 -1.790 0.262 1.00 0.00 H ATOM 153 HA TRP A 8 4.624 -3.938 1.816 1.00 0.00 H ATOM 154 1HB TRP A 8 3.493 -5.310 0.119 1.00 0.00 H ATOM 155 2HB TRP A 8 4.424 -4.528 -1.145 1.00 0.00 H ATOM 156 HD1 TRP A 8 4.884 -7.329 -1.498 1.00 0.00 H ATOM 157 HE1 TRP A 8 6.928 -8.669 -0.708 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.533 -4.228 2.247 1.00 0.00 H ATOM 159 HZ2 TRP A 8 8.945 -8.467 1.237 1.00 0.00 H ATOM 160 HZ3 TRP A 8 8.518 -4.895 3.523 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.697 -6.973 3.034 1.00 0.00 H ATOM 162 N ARG A 9 6.442 -3.061 -0.740 1.00 0.00 N ATOM 163 CA ARG A 9 7.697 -2.438 -1.142 1.00 0.00 C ATOM 164 C ARG A 9 7.583 -0.912 -1.162 1.00 0.00 C ATOM 165 O ARG A 9 8.421 -0.219 -0.586 1.00 0.00 O ATOM 166 CB ARG A 9 8.129 -2.951 -2.518 1.00 0.00 C ATOM 167 CG ARG A 9 8.349 -4.453 -2.564 1.00 0.00 C ATOM 168 CD ARG A 9 9.432 -4.888 -1.589 1.00 0.00 C ATOM 169 NE ARG A 9 9.653 -6.332 -1.625 1.00 0.00 N ATOM 170 CZ ARG A 9 10.547 -6.964 -0.868 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.306 -6.284 -0.017 1.00 0.00 N ATOM 172 NH2 ARG A 9 10.682 -8.280 -0.960 1.00 0.00 N ATOM 173 H ARG A 9 5.945 -3.593 -1.389 1.00 0.00 H ATOM 174 HA ARG A 9 8.446 -2.716 -0.417 1.00 0.00 H ATOM 175 1HB ARG A 9 7.368 -2.698 -3.240 1.00 0.00 H ATOM 176 2HB ARG A 9 9.053 -2.465 -2.796 1.00 0.00 H ATOM 177 1HG ARG A 9 7.427 -4.952 -2.307 1.00 0.00 H ATOM 178 2HG ARG A 9 8.645 -4.733 -3.565 1.00 0.00 H ATOM 179 1HD ARG A 9 10.353 -4.387 -1.847 1.00 0.00 H ATOM 180 2HD ARG A 9 9.134 -4.603 -0.591 1.00 0.00 H ATOM 181 HE ARG A 9 9.106 -6.859 -2.245 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.210 -5.291 0.057 1.00 0.00 H ATOM 183 2HH1 ARG A 9 11.976 -6.764 0.549 1.00 0.00 H ATOM 184 1HH2 ARG A 9 10.112 -8.798 -1.599 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.354 -8.755 -0.391 1.00 0.00 H ATOM 186 N PRO A 10 6.550 -0.361 -1.828 1.00 0.00 N ATOM 187 CA PRO A 10 6.358 1.091 -1.908 1.00 0.00 C ATOM 188 C PRO A 10 5.904 1.696 -0.586 1.00 0.00 C ATOM 189 O PRO A 10 6.145 2.872 -0.312 1.00 0.00 O ATOM 190 CB PRO A 10 5.270 1.248 -2.971 1.00 0.00 C ATOM 191 CG PRO A 10 4.500 -0.024 -2.913 1.00 0.00 C ATOM 192 CD PRO A 10 5.494 -1.097 -2.555 1.00 0.00 C ATOM 193 HA PRO A 10 7.254 1.587 -2.233 1.00 0.00 H ATOM 194 1HB PRO A 10 4.648 2.099 -2.732 1.00 0.00 H ATOM 195 2HB PRO A 10 5.726 1.389 -3.940 1.00 0.00 H ATOM 196 1HG PRO A 10 3.735 0.044 -2.154 1.00 0.00 H ATOM 197 2HG PRO A 10 4.058 -0.230 -3.876 1.00 0.00 H ATOM 198 1HD PRO A 10 5.032 -1.838 -1.923 1.00 0.00 H ATOM 199 2HD PRO A 10 5.889 -1.554 -3.449 1.00 0.00 H ATOM 200 N SER A 11 5.249 0.882 0.228 1.00 0.00 N ATOM 201 CA SER A 11 4.756 1.326 1.531 1.00 0.00 C ATOM 202 C SER A 11 3.952 2.618 1.405 1.00 0.00 C ATOM 203 O SER A 11 4.517 3.712 1.373 1.00 0.00 O ATOM 204 CB SER A 11 5.925 1.532 2.495 1.00 0.00 C ATOM 205 OG SER A 11 6.651 0.329 2.683 1.00 0.00 O ATOM 206 H SER A 11 5.094 -0.041 -0.052 1.00 0.00 H ATOM 207 HA SER A 11 4.112 0.553 1.921 1.00 0.00 H ATOM 208 1HB SER A 11 6.592 2.281 2.096 1.00 0.00 H ATOM 209 2HB SER A 11 5.545 1.862 3.452 1.00 0.00 H ATOM 210 HG SER A 11 6.171 -0.244 3.285 1.00 0.00 H ATOM 211 N ILE A 12 2.632 2.484 1.335 1.00 0.00 N ATOM 212 CA ILE A 12 1.752 3.639 1.214 1.00 0.00 C ATOM 213 C ILE A 12 1.812 4.503 2.470 1.00 0.00 C ATOM 214 O ILE A 12 1.648 5.736 2.349 1.00 0.00 O ATOM 215 CB ILE A 12 0.292 3.207 0.962 1.00 0.00 C ATOM 216 CG1 ILE A 12 0.196 2.392 -0.329 1.00 0.00 C ATOM 217 CG2 ILE A 12 -0.625 4.422 0.892 1.00 0.00 C ATOM 218 CD1 ILE A 12 0.650 3.150 -1.557 1.00 0.00 C ATOM 219 OXT ILE A 12 2.023 3.941 3.565 1.00 0.00 O ATOM 220 H ILE A 12 2.241 1.587 1.366 1.00 0.00 H ATOM 221 HA ILE A 12 2.084 4.225 0.370 1.00 0.00 H ATOM 222 HB ILE A 12 -0.027 2.593 1.791 1.00 0.00 H ATOM 223 1HG1 ILE A 12 0.813 1.511 -0.237 1.00 0.00 H ATOM 224 2HG1 ILE A 12 -0.830 2.093 -0.483 1.00 0.00 H ATOM 225 1HG2 ILE A 12 -0.054 5.286 0.584 1.00 0.00 H ATOM 226 2HG2 ILE A 12 -1.057 4.603 1.864 1.00 0.00 H ATOM 227 3HG2 ILE A 12 -1.412 4.238 0.175 1.00 0.00 H ATOM 228 1HD1 ILE A 12 1.533 2.679 -1.965 1.00 0.00 H ATOM 229 2HD1 ILE A 12 0.880 4.170 -1.286 1.00 0.00 H ATOM 230 3HD1 ILE A 12 -0.136 3.142 -2.297 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 7 ATOM 1 N HIS A 1 -6.698 6.468 -1.205 1.00 0.00 N ATOM 2 CA HIS A 1 -5.438 5.934 -0.624 1.00 0.00 C ATOM 3 C HIS A 1 -5.358 4.418 -0.780 1.00 0.00 C ATOM 4 O HIS A 1 -6.380 3.730 -0.773 1.00 0.00 O ATOM 5 CB HIS A 1 -5.384 6.315 0.856 1.00 0.00 C ATOM 6 CG HIS A 1 -5.410 7.794 1.095 1.00 0.00 C ATOM 7 ND1 HIS A 1 -4.450 8.653 0.602 1.00 0.00 N ATOM 8 CD2 HIS A 1 -6.287 8.565 1.779 1.00 0.00 C ATOM 9 CE1 HIS A 1 -4.735 9.888 0.974 1.00 0.00 C ATOM 10 NE2 HIS A 1 -5.845 9.862 1.689 1.00 0.00 N ATOM 11 1H HIS A 1 -6.731 7.488 -1.007 1.00 0.00 H ATOM 12 2H HIS A 1 -7.491 5.971 -0.750 1.00 0.00 H ATOM 13 3H HIS A 1 -6.677 6.287 -2.228 1.00 0.00 H ATOM 14 HA HIS A 1 -4.603 6.386 -1.139 1.00 0.00 H ATOM 15 1HB HIS A 1 -6.233 5.883 1.364 1.00 0.00 H ATOM 16 2HB HIS A 1 -4.475 5.924 1.289 1.00 0.00 H ATOM 17 HD1 HIS A 1 -3.675 8.395 0.060 1.00 0.00 H ATOM 18 HD2 HIS A 1 -7.172 8.224 2.299 1.00 0.00 H ATOM 19 HE1 HIS A 1 -4.159 10.769 0.733 1.00 0.00 H ATOM 20 HE2 HIS A 1 -6.223 10.627 2.171 1.00 0.00 H ATOM 21 N PRO A 2 -4.137 3.874 -0.926 1.00 0.00 N ATOM 22 CA PRO A 2 -3.928 2.435 -1.085 1.00 0.00 C ATOM 23 C PRO A 2 -3.963 1.687 0.245 1.00 0.00 C ATOM 24 O PRO A 2 -3.034 0.951 0.579 1.00 0.00 O ATOM 25 CB PRO A 2 -2.533 2.364 -1.700 1.00 0.00 C ATOM 26 CG PRO A 2 -1.820 3.547 -1.141 1.00 0.00 C ATOM 27 CD PRO A 2 -2.863 4.621 -0.949 1.00 0.00 C ATOM 28 HA PRO A 2 -4.647 2.001 -1.764 1.00 0.00 H ATOM 29 1HB PRO A 2 -2.055 1.439 -1.411 1.00 0.00 H ATOM 30 2HB PRO A 2 -2.605 2.420 -2.776 1.00 0.00 H ATOM 31 1HG PRO A 2 -1.371 3.290 -0.193 1.00 0.00 H ATOM 32 2HG PRO A 2 -1.064 3.883 -1.836 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.703 5.137 -0.014 1.00 0.00 H ATOM 34 2HD PRO A 2 -2.842 5.318 -1.773 1.00 0.00 H ATOM 35 N LEU A 3 -5.042 1.875 0.998 1.00 0.00 N ATOM 36 CA LEU A 3 -5.196 1.213 2.288 1.00 0.00 C ATOM 37 C LEU A 3 -5.848 -0.160 2.140 1.00 0.00 C ATOM 38 O LEU A 3 -5.878 -0.947 3.085 1.00 0.00 O ATOM 39 CB LEU A 3 -6.001 2.100 3.246 1.00 0.00 C ATOM 40 CG LEU A 3 -7.414 2.470 2.781 1.00 0.00 C ATOM 41 CD1 LEU A 3 -8.278 1.232 2.588 1.00 0.00 C ATOM 42 CD2 LEU A 3 -8.065 3.424 3.771 1.00 0.00 C ATOM 43 H LEU A 3 -5.751 2.470 0.679 1.00 0.00 H ATOM 44 HA LEU A 3 -4.209 1.077 2.698 1.00 0.00 H ATOM 45 1HB LEU A 3 -6.083 1.585 4.192 1.00 0.00 H ATOM 46 2HB LEU A 3 -5.450 3.015 3.402 1.00 0.00 H ATOM 47 HG LEU A 3 -7.343 2.974 1.830 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.173 0.875 1.573 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -9.311 1.481 2.775 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.963 0.461 3.275 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -7.358 4.194 4.047 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -8.366 2.879 4.653 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -8.932 3.879 3.315 1.00 0.00 H ATOM 54 N LYS A 4 -6.372 -0.442 0.948 1.00 0.00 N ATOM 55 CA LYS A 4 -7.023 -1.720 0.683 1.00 0.00 C ATOM 56 C LYS A 4 -6.222 -2.550 -0.317 1.00 0.00 C ATOM 57 O LYS A 4 -6.396 -3.764 -0.411 1.00 0.00 O ATOM 58 CB LYS A 4 -8.441 -1.489 0.156 1.00 0.00 C ATOM 59 CG LYS A 4 -9.197 -2.772 -0.148 1.00 0.00 C ATOM 60 CD LYS A 4 -10.596 -2.482 -0.666 1.00 0.00 C ATOM 61 CE LYS A 4 -11.355 -3.764 -0.969 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.728 -3.489 -1.478 1.00 0.00 N ATOM 63 H LYS A 4 -6.321 0.224 0.232 1.00 0.00 H ATOM 64 HA LYS A 4 -7.079 -2.260 1.613 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.000 -0.934 0.895 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.384 -0.906 -0.751 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.654 -3.329 -0.897 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.271 -3.357 0.757 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.138 -1.925 0.084 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.521 -1.896 -1.569 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.810 -4.321 -1.716 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.426 -4.349 -0.065 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.987 -4.188 -2.204 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.771 -2.539 -1.897 1.00 0.00 H ATOM 75 3HZ LYS A 4 -13.415 -3.544 -0.699 1.00 0.00 H ATOM 76 N GLN A 5 -5.341 -1.887 -1.061 1.00 0.00 N ATOM 77 CA GLN A 5 -4.513 -2.564 -2.052 1.00 0.00 C ATOM 78 C GLN A 5 -3.418 -3.391 -1.381 1.00 0.00 C ATOM 79 O GLN A 5 -2.864 -4.309 -1.985 1.00 0.00 O ATOM 80 CB GLN A 5 -3.886 -1.543 -3.004 1.00 0.00 C ATOM 81 CG GLN A 5 -3.003 -2.167 -4.072 1.00 0.00 C ATOM 82 CD GLN A 5 -2.394 -1.134 -5.000 1.00 0.00 C ATOM 83 OE1 GLN A 5 -3.107 -0.393 -5.676 1.00 0.00 O ATOM 84 NE2 GLN A 5 -1.067 -1.079 -5.036 1.00 0.00 N ATOM 85 H GLN A 5 -5.247 -0.922 -0.940 1.00 0.00 H ATOM 86 HA GLN A 5 -5.149 -3.226 -2.617 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.676 -0.995 -3.496 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.286 -0.854 -2.429 1.00 0.00 H ATOM 89 1HG GLN A 5 -2.204 -2.709 -3.589 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.598 -2.851 -4.659 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.564 -1.701 -4.469 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.647 -0.421 -5.626 1.00 0.00 H ATOM 93 N TYR A 6 -3.112 -3.058 -0.132 1.00 0.00 N ATOM 94 CA TYR A 6 -2.082 -3.771 0.618 1.00 0.00 C ATOM 95 C TYR A 6 -0.721 -3.625 -0.054 1.00 0.00 C ATOM 96 O TYR A 6 -0.294 -4.498 -0.808 1.00 0.00 O ATOM 97 CB TYR A 6 -2.446 -5.254 0.747 1.00 0.00 C ATOM 98 CG TYR A 6 -3.757 -5.519 1.466 1.00 0.00 C ATOM 99 CD1 TYR A 6 -4.208 -6.821 1.650 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.539 -4.480 1.962 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.398 -7.079 2.303 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.729 -4.732 2.617 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.155 -6.032 2.784 1.00 0.00 C ATOM 104 OH TYR A 6 -7.340 -6.287 3.435 1.00 0.00 O ATOM 105 H TYR A 6 -3.587 -2.318 0.295 1.00 0.00 H ATOM 106 HA TYR A 6 -2.032 -3.334 1.605 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.522 -5.682 -0.240 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.662 -5.760 1.291 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.615 -7.640 1.271 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.206 -3.461 1.832 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.731 -8.098 2.435 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.322 -3.911 2.994 1.00 0.00 H ATOM 113 HH TYR A 6 -7.208 -6.983 4.082 1.00 0.00 H ATOM 114 N TRP A 7 -0.045 -2.515 0.226 1.00 0.00 N ATOM 115 CA TRP A 7 1.268 -2.255 -0.352 1.00 0.00 C ATOM 116 C TRP A 7 2.310 -3.217 0.210 1.00 0.00 C ATOM 117 O TRP A 7 1.983 -4.122 0.979 1.00 0.00 O ATOM 118 CB TRP A 7 1.692 -0.811 -0.078 1.00 0.00 C ATOM 119 CG TRP A 7 1.783 -0.485 1.381 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.590 -1.081 2.306 1.00 0.00 C ATOM 121 CD2 TRP A 7 1.038 0.517 2.084 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.394 -0.513 3.541 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.445 0.472 3.431 1.00 0.00 C ATOM 124 CE3 TRP A 7 0.067 1.448 1.706 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.916 1.321 4.399 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.459 2.291 2.668 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.033 2.223 4.000 1.00 0.00 C ATOM 128 H TRP A 7 -0.438 -1.856 0.834 1.00 0.00 H ATOM 129 HA TRP A 7 1.197 -2.404 -1.419 1.00 0.00 H ATOM 130 1HB TRP A 7 2.662 -0.637 -0.520 1.00 0.00 H ATOM 131 2HB TRP A 7 0.972 -0.141 -0.527 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.279 -1.884 2.086 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.857 -0.769 4.366 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.273 1.516 0.682 1.00 0.00 H ATOM 135 HZ2 TRP A 7 1.234 1.281 5.430 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.210 3.017 2.394 1.00 0.00 H ATOM 137 HH2 TRP A 7 -0.471 2.900 4.718 1.00 0.00 H ATOM 138 N TRP A 8 3.565 -3.016 -0.177 1.00 0.00 N ATOM 139 CA TRP A 8 4.654 -3.865 0.290 1.00 0.00 C ATOM 140 C TRP A 8 5.897 -3.007 0.547 1.00 0.00 C ATOM 141 O TRP A 8 6.061 -2.451 1.633 1.00 0.00 O ATOM 142 CB TRP A 8 4.942 -4.955 -0.750 1.00 0.00 C ATOM 143 CG TRP A 8 6.021 -5.934 -0.369 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.482 -6.958 -1.146 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.713 -6.051 0.891 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.456 -7.659 -0.482 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.610 -7.131 0.771 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.683 -5.342 2.101 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.460 -7.518 1.804 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.525 -5.732 3.125 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.404 -6.809 2.971 1.00 0.00 C ATOM 152 H TRP A 8 3.764 -2.278 -0.791 1.00 0.00 H ATOM 153 HA TRP A 8 4.350 -4.325 1.212 1.00 0.00 H ATOM 154 1HB TRP A 8 4.038 -5.521 -0.917 1.00 0.00 H ATOM 155 2HB TRP A 8 5.232 -4.485 -1.678 1.00 0.00 H ATOM 156 HD1 TRP A 8 6.146 -7.152 -2.154 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.953 -8.424 -0.844 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.011 -4.515 2.248 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.145 -8.347 1.700 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.511 -5.198 4.063 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.042 -7.078 3.798 1.00 0.00 H ATOM 162 N ARG A 9 6.760 -2.894 -0.454 1.00 0.00 N ATOM 163 CA ARG A 9 7.975 -2.095 -0.331 1.00 0.00 C ATOM 164 C ARG A 9 7.678 -0.601 -0.479 1.00 0.00 C ATOM 165 O ARG A 9 8.165 0.210 0.309 1.00 0.00 O ATOM 166 CB ARG A 9 9.011 -2.529 -1.372 1.00 0.00 C ATOM 167 CG ARG A 9 9.437 -3.982 -1.242 1.00 0.00 C ATOM 168 CD ARG A 9 10.066 -4.257 0.114 1.00 0.00 C ATOM 169 NE ARG A 9 10.484 -5.648 0.253 1.00 0.00 N ATOM 170 CZ ARG A 9 11.064 -6.143 1.345 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.294 -5.362 2.393 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.412 -7.421 1.390 1.00 0.00 N ATOM 173 H ARG A 9 6.573 -3.350 -1.295 1.00 0.00 H ATOM 174 HA ARG A 9 8.381 -2.269 0.654 1.00 0.00 H ATOM 175 1HB ARG A 9 8.596 -2.387 -2.358 1.00 0.00 H ATOM 176 2HB ARG A 9 9.889 -1.909 -1.269 1.00 0.00 H ATOM 177 1HG ARG A 9 8.570 -4.614 -1.361 1.00 0.00 H ATOM 178 2HG ARG A 9 10.157 -4.207 -2.016 1.00 0.00 H ATOM 179 1HD ARG A 9 10.928 -3.618 0.233 1.00 0.00 H ATOM 180 2HD ARG A 9 9.343 -4.029 0.884 1.00 0.00 H ATOM 181 HE ARG A 9 10.326 -6.247 -0.506 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.033 -4.396 2.367 1.00 0.00 H ATOM 183 2HH1 ARG A 9 11.730 -5.739 3.210 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.240 -8.013 0.602 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.848 -7.792 2.210 1.00 0.00 H ATOM 186 N PRO A 10 6.875 -0.210 -1.487 1.00 0.00 N ATOM 187 CA PRO A 10 6.531 1.191 -1.717 1.00 0.00 C ATOM 188 C PRO A 10 5.359 1.649 -0.853 1.00 0.00 C ATOM 189 O PRO A 10 4.996 0.986 0.119 1.00 0.00 O ATOM 190 CB PRO A 10 6.150 1.204 -3.194 1.00 0.00 C ATOM 191 CG PRO A 10 5.565 -0.145 -3.443 1.00 0.00 C ATOM 192 CD PRO A 10 6.240 -1.095 -2.485 1.00 0.00 C ATOM 193 HA PRO A 10 7.377 1.841 -1.552 1.00 0.00 H ATOM 194 1HB PRO A 10 5.432 1.988 -3.379 1.00 0.00 H ATOM 195 2HB PRO A 10 7.032 1.367 -3.795 1.00 0.00 H ATOM 196 1HG PRO A 10 4.502 -0.121 -3.257 1.00 0.00 H ATOM 197 2HG PRO A 10 5.760 -0.443 -4.463 1.00 0.00 H ATOM 198 1HD PRO A 10 5.508 -1.735 -2.017 1.00 0.00 H ATOM 199 2HD PRO A 10 6.981 -1.686 -3.003 1.00 0.00 H ATOM 200 N SER A 11 4.772 2.785 -1.214 1.00 0.00 N ATOM 201 CA SER A 11 3.641 3.334 -0.474 1.00 0.00 C ATOM 202 C SER A 11 4.046 3.688 0.953 1.00 0.00 C ATOM 203 O SER A 11 3.912 2.875 1.867 1.00 0.00 O ATOM 204 CB SER A 11 2.481 2.338 -0.455 1.00 0.00 C ATOM 205 OG SER A 11 2.044 2.038 -1.769 1.00 0.00 O ATOM 206 H SER A 11 5.109 3.267 -1.997 1.00 0.00 H ATOM 207 HA SER A 11 3.323 4.235 -0.978 1.00 0.00 H ATOM 208 1HB SER A 11 2.801 1.424 0.021 1.00 0.00 H ATOM 209 2HB SER A 11 1.656 2.761 0.098 1.00 0.00 H ATOM 210 HG SER A 11 1.914 2.854 -2.258 1.00 0.00 H ATOM 211 N ILE A 12 4.540 4.909 1.136 1.00 0.00 N ATOM 212 CA ILE A 12 4.962 5.373 2.453 1.00 0.00 C ATOM 213 C ILE A 12 6.123 4.531 2.980 1.00 0.00 C ATOM 214 O ILE A 12 6.877 5.037 3.836 1.00 0.00 O ATOM 215 CB ILE A 12 3.797 5.326 3.464 1.00 0.00 C ATOM 216 CG1 ILE A 12 2.647 6.214 2.986 1.00 0.00 C ATOM 217 CG2 ILE A 12 4.266 5.763 4.845 1.00 0.00 C ATOM 218 CD1 ILE A 12 3.033 7.668 2.824 1.00 0.00 C ATOM 219 OXT ILE A 12 6.264 3.374 2.532 1.00 0.00 O ATOM 220 H ILE A 12 4.621 5.512 0.369 1.00 0.00 H ATOM 221 HA ILE A 12 5.289 6.398 2.356 1.00 0.00 H ATOM 222 HB ILE A 12 3.450 4.306 3.534 1.00 0.00 H ATOM 223 1HG1 ILE A 12 2.297 5.856 2.029 1.00 0.00 H ATOM 224 2HG1 ILE A 12 1.839 6.162 3.702 1.00 0.00 H ATOM 225 1HG2 ILE A 12 3.467 6.288 5.347 1.00 0.00 H ATOM 226 2HG2 ILE A 12 5.119 6.417 4.746 1.00 0.00 H ATOM 227 3HG2 ILE A 12 4.544 4.893 5.423 1.00 0.00 H ATOM 228 1HD1 ILE A 12 2.369 8.285 3.411 1.00 0.00 H ATOM 229 2HD1 ILE A 12 2.956 7.947 1.783 1.00 0.00 H ATOM 230 3HD1 ILE A 12 4.049 7.811 3.160 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 8 ATOM 1 N HIS A 1 -5.594 7.928 1.291 1.00 0.00 N ATOM 2 CA HIS A 1 -5.335 6.790 2.211 1.00 0.00 C ATOM 3 C HIS A 1 -5.613 5.454 1.526 1.00 0.00 C ATOM 4 O HIS A 1 -6.640 4.822 1.772 1.00 0.00 O ATOM 5 CB HIS A 1 -6.227 6.947 3.443 1.00 0.00 C ATOM 6 CG HIS A 1 -5.986 8.216 4.200 1.00 0.00 C ATOM 7 ND1 HIS A 1 -4.767 8.540 4.758 1.00 0.00 N ATOM 8 CD2 HIS A 1 -6.816 9.247 4.489 1.00 0.00 C ATOM 9 CE1 HIS A 1 -4.858 9.714 5.358 1.00 0.00 C ATOM 10 NE2 HIS A 1 -6.090 10.164 5.208 1.00 0.00 N ATOM 11 1H HIS A 1 -6.623 8.071 1.245 1.00 0.00 H ATOM 12 2H HIS A 1 -5.207 7.676 0.358 1.00 0.00 H ATOM 13 3H HIS A 1 -5.118 8.766 1.681 1.00 0.00 H ATOM 14 HA HIS A 1 -4.299 6.821 2.515 1.00 0.00 H ATOM 15 1HB HIS A 1 -7.262 6.937 3.134 1.00 0.00 H ATOM 16 2HB HIS A 1 -6.050 6.120 4.115 1.00 0.00 H ATOM 17 HD1 HIS A 1 -3.957 7.991 4.721 1.00 0.00 H ATOM 18 HD2 HIS A 1 -7.856 9.332 4.206 1.00 0.00 H ATOM 19 HE1 HIS A 1 -4.059 10.221 5.879 1.00 0.00 H ATOM 20 HE2 HIS A 1 -6.401 11.055 5.472 1.00 0.00 H ATOM 21 N PRO A 2 -4.697 5.005 0.649 1.00 0.00 N ATOM 22 CA PRO A 2 -4.851 3.739 -0.072 1.00 0.00 C ATOM 23 C PRO A 2 -4.580 2.529 0.816 1.00 0.00 C ATOM 24 O PRO A 2 -3.496 1.945 0.775 1.00 0.00 O ATOM 25 CB PRO A 2 -3.801 3.839 -1.178 1.00 0.00 C ATOM 26 CG PRO A 2 -2.740 4.714 -0.610 1.00 0.00 C ATOM 27 CD PRO A 2 -3.442 5.695 0.293 1.00 0.00 C ATOM 28 HA PRO A 2 -5.834 3.650 -0.510 1.00 0.00 H ATOM 29 1HB PRO A 2 -3.423 2.853 -1.409 1.00 0.00 H ATOM 30 2HB PRO A 2 -4.244 4.276 -2.060 1.00 0.00 H ATOM 31 1HG PRO A 2 -2.038 4.120 -0.044 1.00 0.00 H ATOM 32 2HG PRO A 2 -2.232 5.238 -1.406 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.846 5.889 1.173 1.00 0.00 H ATOM 34 2HD PRO A 2 -3.645 6.615 -0.235 1.00 0.00 H ATOM 35 N LEU A 3 -5.572 2.156 1.618 1.00 0.00 N ATOM 36 CA LEU A 3 -5.441 1.014 2.517 1.00 0.00 C ATOM 37 C LEU A 3 -6.016 -0.258 1.896 1.00 0.00 C ATOM 38 O LEU A 3 -5.800 -1.358 2.406 1.00 0.00 O ATOM 39 CB LEU A 3 -6.110 1.319 3.862 1.00 0.00 C ATOM 40 CG LEU A 3 -7.605 1.650 3.805 1.00 0.00 C ATOM 41 CD1 LEU A 3 -8.409 0.494 3.232 1.00 0.00 C ATOM 42 CD2 LEU A 3 -8.118 2.025 5.187 1.00 0.00 C ATOM 43 H LEU A 3 -6.412 2.660 1.606 1.00 0.00 H ATOM 44 HA LEU A 3 -4.388 0.861 2.687 1.00 0.00 H ATOM 45 1HB LEU A 3 -5.980 0.460 4.504 1.00 0.00 H ATOM 46 2HB LEU A 3 -5.597 2.157 4.311 1.00 0.00 H ATOM 47 HG LEU A 3 -7.743 2.501 3.157 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.484 0.602 2.160 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -9.399 0.495 3.663 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.917 -0.439 3.466 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -9.180 2.214 5.137 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -7.610 2.914 5.530 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -7.928 1.213 5.874 1.00 0.00 H ATOM 54 N LYS A 4 -6.747 -0.107 0.795 1.00 0.00 N ATOM 55 CA LYS A 4 -7.346 -1.248 0.112 1.00 0.00 C ATOM 56 C LYS A 4 -6.472 -1.700 -1.054 1.00 0.00 C ATOM 57 O LYS A 4 -6.762 -1.400 -2.212 1.00 0.00 O ATOM 58 CB LYS A 4 -8.747 -0.889 -0.392 1.00 0.00 C ATOM 59 CG LYS A 4 -9.444 -2.028 -1.118 1.00 0.00 C ATOM 60 CD LYS A 4 -10.828 -1.618 -1.596 1.00 0.00 C ATOM 61 CE LYS A 4 -11.526 -2.757 -2.322 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.882 -2.365 -2.795 1.00 0.00 N ATOM 63 H LYS A 4 -6.886 0.793 0.432 1.00 0.00 H ATOM 64 HA LYS A 4 -7.425 -2.056 0.823 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.357 -0.600 0.451 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.668 -0.052 -1.071 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.850 -2.315 -1.971 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.540 -2.866 -0.443 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.424 -1.331 -0.742 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.732 -0.779 -2.269 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.928 -3.045 -3.173 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.617 -3.595 -1.646 1.00 0.00 H ATOM 73 1HZ LYS A 4 -13.153 -2.939 -3.619 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.892 -1.363 -3.067 1.00 0.00 H ATOM 75 3HZ LYS A 4 -13.582 -2.513 -2.038 1.00 0.00 H ATOM 76 N GLN A 5 -5.403 -2.424 -0.737 1.00 0.00 N ATOM 77 CA GLN A 5 -4.482 -2.921 -1.757 1.00 0.00 C ATOM 78 C GLN A 5 -3.341 -3.717 -1.133 1.00 0.00 C ATOM 79 O GLN A 5 -2.789 -4.622 -1.758 1.00 0.00 O ATOM 80 CB GLN A 5 -3.916 -1.759 -2.579 1.00 0.00 C ATOM 81 CG GLN A 5 -2.946 -2.196 -3.666 1.00 0.00 C ATOM 82 CD GLN A 5 -2.402 -1.027 -4.464 1.00 0.00 C ATOM 83 OE1 GLN A 5 -3.156 -0.284 -5.092 1.00 0.00 O ATOM 84 NE2 GLN A 5 -1.084 -0.860 -4.443 1.00 0.00 N ATOM 85 H GLN A 5 -5.230 -2.631 0.204 1.00 0.00 H ATOM 86 HA GLN A 5 -5.037 -3.572 -2.409 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.734 -1.232 -3.048 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.398 -1.083 -1.915 1.00 0.00 H ATOM 89 1HG GLN A 5 -2.119 -2.714 -3.206 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.460 -2.865 -4.340 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.546 -1.491 -3.921 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.705 -0.112 -4.950 1.00 0.00 H ATOM 93 N TYR A 6 -2.991 -3.369 0.099 1.00 0.00 N ATOM 94 CA TYR A 6 -1.913 -4.042 0.817 1.00 0.00 C ATOM 95 C TYR A 6 -0.566 -3.765 0.157 1.00 0.00 C ATOM 96 O TYR A 6 -0.073 -4.568 -0.634 1.00 0.00 O ATOM 97 CB TYR A 6 -2.164 -5.554 0.880 1.00 0.00 C ATOM 98 CG TYR A 6 -3.448 -5.949 1.586 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.801 -7.287 1.712 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.305 -4.994 2.128 1.00 0.00 C ATOM 101 CE1 TYR A 6 -4.966 -7.663 2.354 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.471 -5.364 2.771 1.00 0.00 C ATOM 103 CZ TYR A 6 -5.797 -6.698 2.880 1.00 0.00 C ATOM 104 OH TYR A 6 -6.957 -7.069 3.521 1.00 0.00 O ATOM 105 H TYR A 6 -3.469 -2.637 0.536 1.00 0.00 H ATOM 106 HA TYR A 6 -1.892 -3.649 1.822 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.208 -5.945 -0.124 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.342 -6.022 1.403 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.148 -8.042 1.298 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.049 -3.949 2.043 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.220 -8.709 2.440 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.122 -4.607 3.185 1.00 0.00 H ATOM 113 HH TYR A 6 -7.714 -6.742 3.028 1.00 0.00 H ATOM 114 N TRP A 7 0.021 -2.619 0.490 1.00 0.00 N ATOM 115 CA TRP A 7 1.311 -2.230 -0.069 1.00 0.00 C ATOM 116 C TRP A 7 2.405 -3.206 0.350 1.00 0.00 C ATOM 117 O TRP A 7 2.167 -4.121 1.137 1.00 0.00 O ATOM 118 CB TRP A 7 1.676 -0.814 0.383 1.00 0.00 C ATOM 119 CG TRP A 7 1.779 -0.675 1.871 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.627 -1.350 2.701 1.00 0.00 C ATOM 121 CD2 TRP A 7 1.005 0.194 2.707 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.430 -0.955 4.002 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.439 -0.008 4.032 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.011 1.123 2.467 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.892 0.685 5.108 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.553 1.810 3.536 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.100 1.588 4.843 1.00 0.00 C ATOM 128 H TRP A 7 -0.424 -2.022 1.125 1.00 0.00 H ATOM 129 HA TRP A 7 1.224 -2.244 -1.144 1.00 0.00 H ATOM 130 1HB TRP A 7 2.629 -0.542 -0.044 1.00 0.00 H ATOM 131 2HB TRP A 7 0.919 -0.126 0.033 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.345 -2.085 2.369 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.917 -1.294 4.781 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.374 1.308 1.466 1.00 0.00 H ATOM 135 HZ2 TRP A 7 1.230 0.527 6.122 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.340 2.531 3.369 1.00 0.00 H ATOM 137 HH2 TRP A 7 -0.554 2.147 5.648 1.00 0.00 H ATOM 138 N TRP A 8 3.606 -3.002 -0.182 1.00 0.00 N ATOM 139 CA TRP A 8 4.740 -3.862 0.136 1.00 0.00 C ATOM 140 C TRP A 8 5.998 -3.005 0.307 1.00 0.00 C ATOM 141 O TRP A 8 6.242 -2.459 1.384 1.00 0.00 O ATOM 142 CB TRP A 8 4.929 -4.904 -0.975 1.00 0.00 C ATOM 143 CG TRP A 8 6.052 -5.881 -0.750 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.437 -6.868 -1.613 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.876 -6.038 0.424 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.484 -7.580 -1.087 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.767 -7.100 0.163 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.969 -5.380 1.658 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.727 -7.515 1.083 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.921 -5.798 2.569 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.790 -6.853 2.277 1.00 0.00 C ATOM 152 H TRP A 8 3.733 -2.255 -0.802 1.00 0.00 H ATOM 153 HA TRP A 8 4.532 -4.364 1.062 1.00 0.00 H ATOM 154 1HB TRP A 8 4.018 -5.473 -1.072 1.00 0.00 H ATOM 155 2HB TRP A 8 5.117 -4.390 -1.907 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.997 -7.027 -2.586 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.947 -8.322 -1.530 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.308 -4.569 1.911 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.405 -8.328 0.873 1.00 0.00 H ATOM 160 HZ3 TRP A 8 8.003 -5.301 3.525 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.516 -7.146 3.020 1.00 0.00 H ATOM 162 N ARG A 9 6.790 -2.882 -0.753 1.00 0.00 N ATOM 163 CA ARG A 9 8.010 -2.085 -0.705 1.00 0.00 C ATOM 164 C ARG A 9 7.695 -0.589 -0.646 1.00 0.00 C ATOM 165 O ARG A 9 8.239 0.129 0.192 1.00 0.00 O ATOM 166 CB ARG A 9 8.897 -2.389 -1.915 1.00 0.00 C ATOM 167 CG ARG A 9 9.331 -3.842 -2.003 1.00 0.00 C ATOM 168 CD ARG A 9 10.128 -4.260 -0.777 1.00 0.00 C ATOM 169 NE ARG A 9 10.553 -5.656 -0.850 1.00 0.00 N ATOM 170 CZ ARG A 9 11.264 -6.265 0.097 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.623 -5.608 1.192 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.612 -7.536 -0.050 1.00 0.00 N ATOM 173 H ARG A 9 6.546 -3.330 -1.583 1.00 0.00 H ATOM 174 HA ARG A 9 8.543 -2.358 0.194 1.00 0.00 H ATOM 175 1HB ARG A 9 8.357 -2.143 -2.816 1.00 0.00 H ATOM 176 2HB ARG A 9 9.784 -1.775 -1.859 1.00 0.00 H ATOM 177 1HG ARG A 9 8.453 -4.466 -2.079 1.00 0.00 H ATOM 178 2HG ARG A 9 9.945 -3.972 -2.882 1.00 0.00 H ATOM 179 1HD ARG A 9 11.002 -3.631 -0.701 1.00 0.00 H ATOM 180 2HD ARG A 9 9.511 -4.127 0.099 1.00 0.00 H ATOM 181 HE ARG A 9 10.297 -6.166 -1.648 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.363 -4.650 1.310 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.157 -6.071 1.900 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.343 -8.036 -0.873 1.00 0.00 H ATOM 185 2HH2 ARG A 9 12.147 -7.993 0.661 1.00 0.00 H ATOM 186 N PRO A 10 6.811 -0.090 -1.534 1.00 0.00 N ATOM 187 CA PRO A 10 6.444 1.327 -1.560 1.00 0.00 C ATOM 188 C PRO A 10 5.455 1.691 -0.457 1.00 0.00 C ATOM 189 O PRO A 10 4.242 1.609 -0.646 1.00 0.00 O ATOM 190 CB PRO A 10 5.797 1.492 -2.933 1.00 0.00 C ATOM 191 CG PRO A 10 5.199 0.159 -3.225 1.00 0.00 C ATOM 192 CD PRO A 10 6.103 -0.860 -2.579 1.00 0.00 C ATOM 193 HA PRO A 10 7.314 1.964 -1.489 1.00 0.00 H ATOM 194 1HB PRO A 10 5.044 2.265 -2.890 1.00 0.00 H ATOM 195 2HB PRO A 10 6.550 1.753 -3.661 1.00 0.00 H ATOM 196 1HG PRO A 10 4.208 0.102 -2.799 1.00 0.00 H ATOM 197 2HG PRO A 10 5.160 0.001 -4.292 1.00 0.00 H ATOM 198 1HD PRO A 10 5.518 -1.655 -2.143 1.00 0.00 H ATOM 199 2HD PRO A 10 6.797 -1.255 -3.305 1.00 0.00 H ATOM 200 N SER A 11 5.983 2.095 0.694 1.00 0.00 N ATOM 201 CA SER A 11 5.146 2.471 1.827 1.00 0.00 C ATOM 202 C SER A 11 4.240 3.645 1.468 1.00 0.00 C ATOM 203 O SER A 11 4.586 4.803 1.698 1.00 0.00 O ATOM 204 CB SER A 11 6.017 2.835 3.032 1.00 0.00 C ATOM 205 OG SER A 11 6.827 1.741 3.424 1.00 0.00 O ATOM 206 H SER A 11 6.957 2.140 0.783 1.00 0.00 H ATOM 207 HA SER A 11 4.531 1.621 2.082 1.00 0.00 H ATOM 208 1HB SER A 11 6.656 3.666 2.773 1.00 0.00 H ATOM 209 2HB SER A 11 5.382 3.114 3.860 1.00 0.00 H ATOM 210 HG SER A 11 7.143 1.883 4.321 1.00 0.00 H ATOM 211 N ILE A 12 3.078 3.336 0.902 1.00 0.00 N ATOM 212 CA ILE A 12 2.120 4.364 0.510 1.00 0.00 C ATOM 213 C ILE A 12 0.759 4.114 1.153 1.00 0.00 C ATOM 214 O ILE A 12 -0.031 3.335 0.579 1.00 0.00 O ATOM 215 CB ILE A 12 1.959 4.422 -1.024 1.00 0.00 C ATOM 216 CG1 ILE A 12 3.301 4.737 -1.687 1.00 0.00 C ATOM 217 CG2 ILE A 12 0.915 5.462 -1.416 1.00 0.00 C ATOM 218 CD1 ILE A 12 3.894 6.060 -1.253 1.00 0.00 C ATOM 219 OXT ILE A 12 0.495 4.698 2.225 1.00 0.00 O ATOM 220 H ILE A 12 2.858 2.394 0.743 1.00 0.00 H ATOM 221 HA ILE A 12 2.499 5.317 0.849 1.00 0.00 H ATOM 222 HB ILE A 12 1.615 3.458 -1.364 1.00 0.00 H ATOM 223 1HG1 ILE A 12 4.008 3.960 -1.437 1.00 0.00 H ATOM 224 2HG1 ILE A 12 3.168 4.766 -2.758 1.00 0.00 H ATOM 225 1HG2 ILE A 12 0.006 4.963 -1.721 1.00 0.00 H ATOM 226 2HG2 ILE A 12 1.289 6.059 -2.234 1.00 0.00 H ATOM 227 3HG2 ILE A 12 0.708 6.101 -0.570 1.00 0.00 H ATOM 228 1HD1 ILE A 12 4.047 6.687 -2.120 1.00 0.00 H ATOM 229 2HD1 ILE A 12 4.840 5.887 -0.763 1.00 0.00 H ATOM 230 3HD1 ILE A 12 3.218 6.550 -0.569 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 9 ATOM 1 N HIS A 1 -0.866 4.182 5.601 1.00 0.00 N ATOM 2 CA HIS A 1 -0.973 2.702 5.675 1.00 0.00 C ATOM 3 C HIS A 1 -2.008 2.174 4.684 1.00 0.00 C ATOM 4 O HIS A 1 -3.023 2.824 4.431 1.00 0.00 O ATOM 5 CB HIS A 1 -1.362 2.313 7.103 1.00 0.00 C ATOM 6 CG HIS A 1 -0.371 2.756 8.134 1.00 0.00 C ATOM 7 ND1 HIS A 1 0.946 2.348 8.137 1.00 0.00 N ATOM 8 CD2 HIS A 1 -0.511 3.578 9.202 1.00 0.00 C ATOM 9 CE1 HIS A 1 1.574 2.898 9.162 1.00 0.00 C ATOM 10 NE2 HIS A 1 0.711 3.648 9.823 1.00 0.00 N ATOM 11 1H HIS A 1 -1.704 4.584 6.065 1.00 0.00 H ATOM 12 2H HIS A 1 -0.830 4.447 4.595 1.00 0.00 H ATOM 13 3H HIS A 1 0.005 4.463 6.094 1.00 0.00 H ATOM 14 HA HIS A 1 -0.009 2.277 5.440 1.00 0.00 H ATOM 15 1HB HIS A 1 -2.314 2.761 7.343 1.00 0.00 H ATOM 16 2HB HIS A 1 -1.449 1.238 7.163 1.00 0.00 H ATOM 17 HD1 HIS A 1 1.361 1.745 7.485 1.00 0.00 H ATOM 18 HD2 HIS A 1 -1.416 4.084 9.507 1.00 0.00 H ATOM 19 HE1 HIS A 1 2.614 2.759 9.415 1.00 0.00 H ATOM 20 HE2 HIS A 1 0.892 4.101 10.674 1.00 0.00 H ATOM 21 N PRO A 2 -1.767 0.982 4.108 1.00 0.00 N ATOM 22 CA PRO A 2 -2.688 0.374 3.143 1.00 0.00 C ATOM 23 C PRO A 2 -4.103 0.243 3.698 1.00 0.00 C ATOM 24 O PRO A 2 -4.291 -0.020 4.885 1.00 0.00 O ATOM 25 CB PRO A 2 -2.089 -1.011 2.889 1.00 0.00 C ATOM 26 CG PRO A 2 -0.650 -0.884 3.252 1.00 0.00 C ATOM 27 CD PRO A 2 -0.584 0.137 4.353 1.00 0.00 C ATOM 28 HA PRO A 2 -2.718 0.932 2.218 1.00 0.00 H ATOM 29 1HB PRO A 2 -2.589 -1.742 3.509 1.00 0.00 H ATOM 30 2HB PRO A 2 -2.211 -1.272 1.848 1.00 0.00 H ATOM 31 1HG PRO A 2 -0.274 -1.834 3.600 1.00 0.00 H ATOM 32 2HG PRO A 2 -0.085 -0.548 2.395 1.00 0.00 H ATOM 33 1HD PRO A 2 -0.646 -0.344 5.318 1.00 0.00 H ATOM 34 2HD PRO A 2 0.324 0.716 4.274 1.00 0.00 H ATOM 35 N LEU A 3 -5.094 0.428 2.833 1.00 0.00 N ATOM 36 CA LEU A 3 -6.490 0.328 3.241 1.00 0.00 C ATOM 37 C LEU A 3 -7.308 -0.518 2.265 1.00 0.00 C ATOM 38 O LEU A 3 -8.529 -0.613 2.393 1.00 0.00 O ATOM 39 CB LEU A 3 -7.100 1.728 3.383 1.00 0.00 C ATOM 40 CG LEU A 3 -7.078 2.592 2.118 1.00 0.00 C ATOM 41 CD1 LEU A 3 -7.864 1.940 0.990 1.00 0.00 C ATOM 42 CD2 LEU A 3 -7.623 3.980 2.414 1.00 0.00 C ATOM 43 H LEU A 3 -4.881 0.636 1.899 1.00 0.00 H ATOM 44 HA LEU A 3 -6.510 -0.151 4.205 1.00 0.00 H ATOM 45 1HB LEU A 3 -8.125 1.618 3.699 1.00 0.00 H ATOM 46 2HB LEU A 3 -6.559 2.253 4.156 1.00 0.00 H ATOM 47 HG LEU A 3 -6.057 2.698 1.789 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.186 2.698 0.291 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -8.729 1.437 1.398 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.237 1.223 0.482 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -7.351 4.653 1.614 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -7.205 4.340 3.344 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -8.699 3.937 2.497 1.00 0.00 H ATOM 54 N LYS A 4 -6.635 -1.136 1.293 1.00 0.00 N ATOM 55 CA LYS A 4 -7.313 -1.973 0.306 1.00 0.00 C ATOM 56 C LYS A 4 -6.329 -2.532 -0.715 1.00 0.00 C ATOM 57 O LYS A 4 -6.512 -3.633 -1.234 1.00 0.00 O ATOM 58 CB LYS A 4 -8.408 -1.177 -0.412 1.00 0.00 C ATOM 59 CG LYS A 4 -9.160 -1.982 -1.459 1.00 0.00 C ATOM 60 CD LYS A 4 -10.232 -1.146 -2.139 1.00 0.00 C ATOM 61 CE LYS A 4 -10.985 -1.949 -3.188 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.037 -1.138 -3.858 1.00 0.00 N ATOM 63 H LYS A 4 -5.664 -1.030 1.242 1.00 0.00 H ATOM 64 HA LYS A 4 -7.762 -2.792 0.829 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.121 -0.827 0.318 1.00 0.00 H ATOM 66 2HB LYS A 4 -7.957 -0.326 -0.899 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.460 -2.328 -2.206 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.627 -2.831 -0.981 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.932 -0.801 -1.393 1.00 0.00 H ATOM 70 2HD LYS A 4 -9.763 -0.297 -2.615 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.282 -2.296 -3.931 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.448 -2.798 -2.708 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.346 -1.605 -4.734 1.00 0.00 H ATOM 74 2HZ LYS A 4 -11.666 -0.196 -4.095 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.858 -1.026 -3.230 1.00 0.00 H ATOM 76 N GLN A 5 -5.293 -1.762 -0.999 1.00 0.00 N ATOM 77 CA GLN A 5 -4.277 -2.168 -1.963 1.00 0.00 C ATOM 78 C GLN A 5 -3.228 -3.063 -1.314 1.00 0.00 C ATOM 79 O GLN A 5 -2.659 -3.942 -1.961 1.00 0.00 O ATOM 80 CB GLN A 5 -3.608 -0.938 -2.581 1.00 0.00 C ATOM 81 CG GLN A 5 -2.533 -1.277 -3.601 1.00 0.00 C ATOM 82 CD GLN A 5 -1.887 -0.042 -4.199 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.556 0.787 -4.815 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.577 0.086 -4.019 1.00 0.00 N ATOM 85 H GLN A 5 -5.214 -0.898 -0.553 1.00 0.00 H ATOM 86 HA GLN A 5 -4.768 -2.726 -2.739 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.362 -0.341 -3.070 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.155 -0.355 -1.793 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.768 -1.865 -3.117 1.00 0.00 H ATOM 90 2HG GLN A 5 -2.979 -1.854 -4.398 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.108 -0.613 -3.518 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.134 0.876 -4.396 1.00 0.00 H ATOM 93 N TYR A 6 -2.979 -2.832 -0.034 1.00 0.00 N ATOM 94 CA TYR A 6 -1.998 -3.617 0.710 1.00 0.00 C ATOM 95 C TYR A 6 -0.632 -3.568 0.028 1.00 0.00 C ATOM 96 O TYR A 6 -0.212 -4.534 -0.610 1.00 0.00 O ATOM 97 CB TYR A 6 -2.466 -5.071 0.837 1.00 0.00 C ATOM 98 CG TYR A 6 -3.787 -5.245 1.565 1.00 0.00 C ATOM 99 CD1 TYR A 6 -4.330 -6.513 1.745 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.489 -4.156 2.075 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.530 -6.690 2.407 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.689 -4.328 2.738 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.205 -5.595 2.901 1.00 0.00 C ATOM 104 OH TYR A 6 -7.400 -5.769 3.561 1.00 0.00 O ATOM 105 H TYR A 6 -3.468 -2.118 0.421 1.00 0.00 H ATOM 106 HA TYR A 6 -1.909 -3.189 1.697 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.578 -5.490 -0.151 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.715 -5.632 1.374 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.799 -7.370 1.356 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.085 -3.164 1.949 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.933 -7.684 2.536 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.218 -3.469 3.125 1.00 0.00 H ATOM 113 HH TYR A 6 -7.373 -5.301 4.399 1.00 0.00 H ATOM 114 N TRP A 7 0.054 -2.437 0.162 1.00 0.00 N ATOM 115 CA TRP A 7 1.369 -2.268 -0.448 1.00 0.00 C ATOM 116 C TRP A 7 2.460 -2.866 0.434 1.00 0.00 C ATOM 117 O TRP A 7 2.293 -2.991 1.647 1.00 0.00 O ATOM 118 CB TRP A 7 1.657 -0.786 -0.696 1.00 0.00 C ATOM 119 CG TRP A 7 1.652 0.041 0.553 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.465 -0.112 1.640 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.798 1.154 0.844 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.167 0.836 2.589 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.148 1.625 2.124 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.228 1.798 0.147 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.507 2.709 2.719 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.862 2.874 0.739 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.493 3.320 2.013 1.00 0.00 C ATOM 128 H TRP A 7 -0.333 -1.700 0.678 1.00 0.00 H ATOM 129 HA TRP A 7 1.364 -2.787 -1.395 1.00 0.00 H ATOM 130 1HB TRP A 7 2.628 -0.687 -1.157 1.00 0.00 H ATOM 131 2HB TRP A 7 0.905 -0.388 -1.362 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.224 -0.874 1.729 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.612 0.932 3.457 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.527 1.467 -0.836 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.781 3.066 3.701 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.658 3.383 0.214 1.00 0.00 H ATOM 137 HH2 TRP A 7 -1.017 4.164 2.437 1.00 0.00 H ATOM 138 N TRP A 8 3.578 -3.233 -0.185 1.00 0.00 N ATOM 139 CA TRP A 8 4.698 -3.817 0.542 1.00 0.00 C ATOM 140 C TRP A 8 5.873 -2.832 0.550 1.00 0.00 C ATOM 141 O TRP A 8 5.918 -1.919 1.374 1.00 0.00 O ATOM 142 CB TRP A 8 5.100 -5.148 -0.105 1.00 0.00 C ATOM 143 CG TRP A 8 6.231 -5.873 0.578 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.790 -7.049 0.165 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.887 -5.537 1.818 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.789 -7.430 1.024 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.863 -6.528 2.051 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.766 -4.492 2.745 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.704 -6.505 3.161 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.599 -4.476 3.848 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.557 -5.474 4.046 1.00 0.00 C ATOM 152 H TRP A 8 3.650 -3.107 -1.154 1.00 0.00 H ATOM 153 HA TRP A 8 4.386 -3.994 1.556 1.00 0.00 H ATOM 154 1HB TRP A 8 4.246 -5.806 -0.099 1.00 0.00 H ATOM 155 2HB TRP A 8 5.391 -4.966 -1.128 1.00 0.00 H ATOM 156 HD1 TRP A 8 6.503 -7.574 -0.735 1.00 0.00 H ATOM 157 HE1 TRP A 8 8.351 -8.227 0.925 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.031 -3.714 2.620 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.449 -7.268 3.328 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.516 -3.678 4.572 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.187 -5.421 4.923 1.00 0.00 H ATOM 162 N ARG A 9 6.817 -3.015 -0.367 1.00 0.00 N ATOM 163 CA ARG A 9 7.978 -2.137 -0.454 1.00 0.00 C ATOM 164 C ARG A 9 7.559 -0.685 -0.689 1.00 0.00 C ATOM 165 O ARG A 9 8.086 0.227 -0.051 1.00 0.00 O ATOM 166 CB ARG A 9 8.918 -2.600 -1.571 1.00 0.00 C ATOM 167 CG ARG A 9 9.448 -4.011 -1.373 1.00 0.00 C ATOM 168 CD ARG A 9 10.233 -4.136 -0.079 1.00 0.00 C ATOM 169 NE ARG A 9 10.748 -5.489 0.121 1.00 0.00 N ATOM 170 CZ ARG A 9 11.468 -5.860 1.177 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.763 -4.984 2.128 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.894 -7.112 1.282 1.00 0.00 N ATOM 173 H ARG A 9 6.730 -3.753 -0.999 1.00 0.00 H ATOM 174 HA ARG A 9 8.502 -2.195 0.488 1.00 0.00 H ATOM 175 1HB ARG A 9 8.390 -2.566 -2.510 1.00 0.00 H ATOM 176 2HB ARG A 9 9.761 -1.927 -1.617 1.00 0.00 H ATOM 177 1HG ARG A 9 8.615 -4.698 -1.345 1.00 0.00 H ATOM 178 2HG ARG A 9 10.094 -4.261 -2.203 1.00 0.00 H ATOM 179 1HD ARG A 9 11.064 -3.447 -0.108 1.00 0.00 H ATOM 180 2HD ARG A 9 9.584 -3.882 0.747 1.00 0.00 H ATOM 181 HE ARG A 9 10.545 -6.156 -0.568 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.445 -4.039 2.055 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.305 -5.269 2.919 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.674 -7.776 0.567 1.00 0.00 H ATOM 185 2HH2 ARG A 9 12.436 -7.391 2.074 1.00 0.00 H ATOM 186 N PRO A 10 6.602 -0.441 -1.607 1.00 0.00 N ATOM 187 CA PRO A 10 6.129 0.916 -1.907 1.00 0.00 C ATOM 188 C PRO A 10 5.591 1.624 -0.668 1.00 0.00 C ATOM 189 O PRO A 10 5.835 1.197 0.460 1.00 0.00 O ATOM 190 CB PRO A 10 5.004 0.695 -2.923 1.00 0.00 C ATOM 191 CG PRO A 10 5.278 -0.643 -3.516 1.00 0.00 C ATOM 192 CD PRO A 10 5.908 -1.457 -2.422 1.00 0.00 C ATOM 193 HA PRO A 10 6.908 1.516 -2.352 1.00 0.00 H ATOM 194 1HB PRO A 10 4.049 0.714 -2.418 1.00 0.00 H ATOM 195 2HB PRO A 10 5.035 1.471 -3.673 1.00 0.00 H ATOM 196 1HG PRO A 10 4.353 -1.100 -3.838 1.00 0.00 H ATOM 197 2HG PRO A 10 5.959 -0.544 -4.348 1.00 0.00 H ATOM 198 1HD PRO A 10 5.150 -1.964 -1.844 1.00 0.00 H ATOM 199 2HD PRO A 10 6.607 -2.166 -2.835 1.00 0.00 H ATOM 200 N SER A 11 4.857 2.711 -0.888 1.00 0.00 N ATOM 201 CA SER A 11 4.282 3.480 0.210 1.00 0.00 C ATOM 202 C SER A 11 3.189 4.417 -0.296 1.00 0.00 C ATOM 203 O SER A 11 2.975 5.494 0.260 1.00 0.00 O ATOM 204 CB SER A 11 5.372 4.287 0.920 1.00 0.00 C ATOM 205 OG SER A 11 6.372 3.435 1.452 1.00 0.00 O ATOM 206 H SER A 11 4.698 3.002 -1.810 1.00 0.00 H ATOM 207 HA SER A 11 3.848 2.784 0.911 1.00 0.00 H ATOM 208 1HB SER A 11 5.831 4.965 0.217 1.00 0.00 H ATOM 209 2HB SER A 11 4.929 4.850 1.728 1.00 0.00 H ATOM 210 HG SER A 11 5.959 2.742 1.972 1.00 0.00 H ATOM 211 N ILE A 12 2.500 3.998 -1.352 1.00 0.00 N ATOM 212 CA ILE A 12 1.428 4.798 -1.933 1.00 0.00 C ATOM 213 C ILE A 12 0.255 3.916 -2.348 1.00 0.00 C ATOM 214 O ILE A 12 0.460 3.017 -3.190 1.00 0.00 O ATOM 215 CB ILE A 12 1.925 5.596 -3.158 1.00 0.00 C ATOM 216 CG1 ILE A 12 3.062 6.536 -2.752 1.00 0.00 C ATOM 217 CG2 ILE A 12 0.784 6.384 -3.785 1.00 0.00 C ATOM 218 CD1 ILE A 12 2.664 7.548 -1.701 1.00 0.00 C ATOM 219 OXT ILE A 12 -0.859 4.131 -1.827 1.00 0.00 O ATOM 220 H ILE A 12 2.717 3.129 -1.751 1.00 0.00 H ATOM 221 HA ILE A 12 1.092 5.500 -1.183 1.00 0.00 H ATOM 222 HB ILE A 12 2.293 4.894 -3.891 1.00 0.00 H ATOM 223 1HG1 ILE A 12 3.880 5.951 -2.357 1.00 0.00 H ATOM 224 2HG1 ILE A 12 3.401 7.077 -3.624 1.00 0.00 H ATOM 225 1HG2 ILE A 12 0.248 6.918 -3.015 1.00 0.00 H ATOM 226 2HG2 ILE A 12 0.110 5.705 -4.287 1.00 0.00 H ATOM 227 3HG2 ILE A 12 1.183 7.088 -4.501 1.00 0.00 H ATOM 228 1HD1 ILE A 12 1.630 7.397 -1.428 1.00 0.00 H ATOM 229 2HD1 ILE A 12 2.791 8.546 -2.095 1.00 0.00 H ATOM 230 3HD1 ILE A 12 3.289 7.424 -0.828 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 10 ATOM 1 N HIS A 1 -3.398 6.342 2.987 1.00 0.00 N ATOM 2 CA HIS A 1 -4.755 6.349 2.375 1.00 0.00 C ATOM 3 C HIS A 1 -5.045 5.053 1.612 1.00 0.00 C ATOM 4 O HIS A 1 -6.109 4.458 1.783 1.00 0.00 O ATOM 5 CB HIS A 1 -4.872 7.555 1.439 1.00 0.00 C ATOM 6 CG HIS A 1 -4.679 8.869 2.130 1.00 0.00 C ATOM 7 ND1 HIS A 1 -5.483 9.302 3.163 1.00 0.00 N ATOM 8 CD2 HIS A 1 -3.764 9.848 1.933 1.00 0.00 C ATOM 9 CE1 HIS A 1 -5.074 10.490 3.570 1.00 0.00 C ATOM 10 NE2 HIS A 1 -4.031 10.843 2.841 1.00 0.00 N ATOM 11 1H HIS A 1 -3.106 5.351 3.104 1.00 0.00 H ATOM 12 2H HIS A 1 -3.465 6.822 3.908 1.00 0.00 H ATOM 13 3H HIS A 1 -2.754 6.848 2.347 1.00 0.00 H ATOM 14 HA HIS A 1 -5.481 6.451 3.168 1.00 0.00 H ATOM 15 1HB HIS A 1 -4.126 7.477 0.664 1.00 0.00 H ATOM 16 2HB HIS A 1 -5.854 7.557 0.987 1.00 0.00 H ATOM 17 HD1 HIS A 1 -6.244 8.811 3.541 1.00 0.00 H ATOM 18 HD2 HIS A 1 -2.971 9.847 1.199 1.00 0.00 H ATOM 19 HE1 HIS A 1 -5.515 11.072 4.366 1.00 0.00 H ATOM 20 HE2 HIS A 1 -3.579 11.711 2.885 1.00 0.00 H ATOM 21 N PRO A 2 -4.108 4.589 0.760 1.00 0.00 N ATOM 22 CA PRO A 2 -4.297 3.361 -0.012 1.00 0.00 C ATOM 23 C PRO A 2 -4.026 2.109 0.814 1.00 0.00 C ATOM 24 O PRO A 2 -2.944 1.527 0.743 1.00 0.00 O ATOM 25 CB PRO A 2 -3.270 3.498 -1.132 1.00 0.00 C ATOM 26 CG PRO A 2 -2.163 4.291 -0.528 1.00 0.00 C ATOM 27 CD PRO A 2 -2.800 5.218 0.477 1.00 0.00 C ATOM 28 HA PRO A 2 -5.290 3.306 -0.435 1.00 0.00 H ATOM 29 1HB PRO A 2 -2.933 2.518 -1.439 1.00 0.00 H ATOM 30 2HB PRO A 2 -3.711 4.014 -1.971 1.00 0.00 H ATOM 31 1HG PRO A 2 -1.465 3.631 -0.036 1.00 0.00 H ATOM 32 2HG PRO A 2 -1.661 4.862 -1.296 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.197 5.270 1.369 1.00 0.00 H ATOM 34 2HD PRO A 2 -2.928 6.201 0.050 1.00 0.00 H ATOM 35 N LEU A 3 -5.018 1.697 1.599 1.00 0.00 N ATOM 36 CA LEU A 3 -4.888 0.514 2.440 1.00 0.00 C ATOM 37 C LEU A 3 -5.803 -0.616 1.970 1.00 0.00 C ATOM 38 O LEU A 3 -6.040 -1.577 2.701 1.00 0.00 O ATOM 39 CB LEU A 3 -5.173 0.874 3.904 1.00 0.00 C ATOM 40 CG LEU A 3 -6.560 1.461 4.189 1.00 0.00 C ATOM 41 CD1 LEU A 3 -7.666 0.487 3.814 1.00 0.00 C ATOM 42 CD2 LEU A 3 -6.675 1.862 5.651 1.00 0.00 C ATOM 43 H LEU A 3 -5.858 2.203 1.612 1.00 0.00 H ATOM 44 HA LEU A 3 -3.868 0.177 2.366 1.00 0.00 H ATOM 45 1HB LEU A 3 -5.058 -0.020 4.498 1.00 0.00 H ATOM 46 2HB LEU A 3 -4.433 1.593 4.222 1.00 0.00 H ATOM 47 HG LEU A 3 -6.687 2.350 3.590 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.572 0.752 4.340 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -7.373 -0.515 4.087 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.843 0.534 2.749 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -5.733 2.267 5.990 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -6.928 0.994 6.243 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -7.448 2.609 5.761 1.00 0.00 H ATOM 54 N LYS A 4 -6.312 -0.497 0.747 1.00 0.00 N ATOM 55 CA LYS A 4 -7.198 -1.513 0.186 1.00 0.00 C ATOM 56 C LYS A 4 -6.424 -2.503 -0.682 1.00 0.00 C ATOM 57 O LYS A 4 -6.910 -3.595 -0.975 1.00 0.00 O ATOM 58 CB LYS A 4 -8.307 -0.853 -0.635 1.00 0.00 C ATOM 59 CG LYS A 4 -9.278 -1.844 -1.256 1.00 0.00 C ATOM 60 CD LYS A 4 -10.357 -1.136 -2.060 1.00 0.00 C ATOM 61 CE LYS A 4 -11.328 -2.126 -2.681 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.389 -1.443 -3.470 1.00 0.00 N ATOM 63 H LYS A 4 -6.087 0.288 0.207 1.00 0.00 H ATOM 64 HA LYS A 4 -7.644 -2.049 1.008 1.00 0.00 H ATOM 65 1HB LYS A 4 -8.866 -0.187 0.006 1.00 0.00 H ATOM 66 2HB LYS A 4 -7.856 -0.278 -1.430 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.732 -2.506 -1.911 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.745 -2.416 -0.469 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.904 -0.473 -1.406 1.00 0.00 H ATOM 70 2HD LYS A 4 -9.888 -0.562 -2.847 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.779 -2.789 -3.332 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.791 -2.700 -1.892 1.00 0.00 H ATOM 73 1HZ LYS A 4 -13.097 -2.134 -3.793 1.00 0.00 H ATOM 74 2HZ LYS A 4 -11.973 -0.977 -4.302 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.863 -0.723 -2.887 1.00 0.00 H ATOM 76 N GLN A 5 -5.221 -2.115 -1.092 1.00 0.00 N ATOM 77 CA GLN A 5 -4.386 -2.969 -1.928 1.00 0.00 C ATOM 78 C GLN A 5 -3.261 -3.611 -1.115 1.00 0.00 C ATOM 79 O GLN A 5 -2.628 -4.566 -1.567 1.00 0.00 O ATOM 80 CB GLN A 5 -3.798 -2.163 -3.088 1.00 0.00 C ATOM 81 CG GLN A 5 -2.912 -2.982 -4.013 1.00 0.00 C ATOM 82 CD GLN A 5 -2.342 -2.160 -5.153 1.00 0.00 C ATOM 83 OE1 GLN A 5 -3.084 -1.599 -5.959 1.00 0.00 O ATOM 84 NE2 GLN A 5 -1.018 -2.086 -5.226 1.00 0.00 N ATOM 85 H GLN A 5 -4.887 -1.233 -0.828 1.00 0.00 H ATOM 86 HA GLN A 5 -5.013 -3.752 -2.329 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.608 -1.752 -3.672 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.209 -1.353 -2.685 1.00 0.00 H ATOM 89 1HG GLN A 5 -2.092 -3.388 -3.438 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.496 -3.791 -4.427 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.490 -2.560 -4.550 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.624 -1.562 -5.954 1.00 0.00 H ATOM 93 N TYR A 6 -3.014 -3.082 0.080 1.00 0.00 N ATOM 94 CA TYR A 6 -1.963 -3.608 0.945 1.00 0.00 C ATOM 95 C TYR A 6 -0.595 -3.458 0.287 1.00 0.00 C ATOM 96 O TYR A 6 -0.072 -4.402 -0.304 1.00 0.00 O ATOM 97 CB TYR A 6 -2.226 -5.082 1.272 1.00 0.00 C ATOM 98 CG TYR A 6 -3.537 -5.344 1.992 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.902 -6.638 2.344 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.405 -4.307 2.322 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.090 -6.892 3.001 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.596 -4.555 2.979 1.00 0.00 C ATOM 103 CZ TYR A 6 -5.934 -5.848 3.316 1.00 0.00 C ATOM 104 OH TYR A 6 -7.117 -6.098 3.970 1.00 0.00 O ATOM 105 H TYR A 6 -3.547 -2.320 0.388 1.00 0.00 H ATOM 106 HA TYR A 6 -1.973 -3.038 1.862 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.239 -5.648 0.353 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.426 -5.449 1.899 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.240 -7.454 2.097 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.141 -3.294 2.058 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.354 -7.905 3.266 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.257 -3.738 3.226 1.00 0.00 H ATOM 113 HH TYR A 6 -6.944 -6.608 4.765 1.00 0.00 H ATOM 114 N TRP A 7 -0.022 -2.264 0.393 1.00 0.00 N ATOM 115 CA TRP A 7 1.286 -1.989 -0.193 1.00 0.00 C ATOM 116 C TRP A 7 2.350 -2.916 0.382 1.00 0.00 C ATOM 117 O TRP A 7 2.149 -3.535 1.428 1.00 0.00 O ATOM 118 CB TRP A 7 1.681 -0.531 0.049 1.00 0.00 C ATOM 119 CG TRP A 7 1.769 -0.172 1.500 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.589 -0.736 2.436 1.00 0.00 C ATOM 121 CD2 TRP A 7 1.009 0.832 2.184 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.384 -0.144 3.659 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.420 0.821 3.531 1.00 0.00 C ATOM 124 CE3 TRP A 7 0.022 1.739 1.788 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.877 1.682 4.482 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.516 2.592 2.734 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.087 2.559 4.066 1.00 0.00 C ATOM 128 H TRP A 7 -0.489 -1.550 0.875 1.00 0.00 H ATOM 129 HA TRP A 7 1.213 -2.160 -1.257 1.00 0.00 H ATOM 130 1HB TRP A 7 2.646 -0.348 -0.398 1.00 0.00 H ATOM 131 2HB TRP A 7 0.947 0.115 -0.411 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.290 -1.530 2.230 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.854 -0.375 4.488 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.321 1.779 0.766 1.00 0.00 H ATOM 135 HZ2 TRP A 7 1.198 1.669 5.513 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.280 3.299 2.446 1.00 0.00 H ATOM 137 HH2 TRP A 7 -0.535 3.244 4.771 1.00 0.00 H ATOM 138 N TRP A 8 3.482 -3.006 -0.306 1.00 0.00 N ATOM 139 CA TRP A 8 4.582 -3.854 0.135 1.00 0.00 C ATOM 140 C TRP A 8 5.858 -3.016 0.261 1.00 0.00 C ATOM 141 O TRP A 8 6.083 -2.369 1.284 1.00 0.00 O ATOM 142 CB TRP A 8 4.778 -5.008 -0.858 1.00 0.00 C ATOM 143 CG TRP A 8 5.868 -5.984 -0.497 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.253 -7.061 -1.243 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.651 -6.039 0.713 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.266 -7.739 -0.613 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.522 -7.141 0.590 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.722 -5.260 1.877 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.442 -7.481 1.579 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.634 -5.604 2.857 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.485 -6.703 2.701 1.00 0.00 C ATOM 152 H TRP A 8 3.581 -2.487 -1.132 1.00 0.00 H ATOM 153 HA TRP A 8 4.332 -4.255 1.100 1.00 0.00 H ATOM 154 1HB TRP A 8 3.856 -5.564 -0.926 1.00 0.00 H ATOM 155 2HB TRP A 8 5.007 -4.598 -1.830 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.841 -7.308 -2.210 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.724 -8.532 -0.964 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.074 -4.413 2.024 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.106 -8.327 1.474 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.699 -5.016 3.760 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.180 -6.934 3.495 1.00 0.00 H ATOM 162 N ARG A 9 6.683 -3.019 -0.779 1.00 0.00 N ATOM 163 CA ARG A 9 7.923 -2.253 -0.774 1.00 0.00 C ATOM 164 C ARG A 9 7.646 -0.753 -0.655 1.00 0.00 C ATOM 165 O ARG A 9 8.249 -0.073 0.176 1.00 0.00 O ATOM 166 CB ARG A 9 8.738 -2.541 -2.037 1.00 0.00 C ATOM 167 CG ARG A 9 9.126 -4.002 -2.190 1.00 0.00 C ATOM 168 CD ARG A 9 9.973 -4.479 -1.020 1.00 0.00 C ATOM 169 NE ARG A 9 10.352 -5.883 -1.157 1.00 0.00 N ATOM 170 CZ ARG A 9 11.093 -6.540 -0.266 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.536 -5.924 0.822 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.392 -7.816 -0.467 1.00 0.00 N ATOM 173 H ARG A 9 6.452 -3.544 -1.568 1.00 0.00 H ATOM 174 HA ARG A 9 8.496 -2.565 0.088 1.00 0.00 H ATOM 175 1HB ARG A 9 8.158 -2.254 -2.900 1.00 0.00 H ATOM 176 2HB ARG A 9 9.642 -1.952 -2.010 1.00 0.00 H ATOM 177 1HG ARG A 9 8.228 -4.600 -2.239 1.00 0.00 H ATOM 178 2HG ARG A 9 9.689 -4.122 -3.103 1.00 0.00 H ATOM 179 1HD ARG A 9 10.867 -3.877 -0.972 1.00 0.00 H ATOM 180 2HD ARG A 9 9.407 -4.355 -0.109 1.00 0.00 H ATOM 181 HE ARG A 9 10.039 -6.362 -1.952 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.313 -4.962 0.979 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.091 -6.424 1.487 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.062 -8.285 -1.286 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.949 -8.310 0.201 1.00 0.00 H ATOM 186 N PRO A 10 6.732 -0.208 -1.484 1.00 0.00 N ATOM 187 CA PRO A 10 6.397 1.218 -1.449 1.00 0.00 C ATOM 188 C PRO A 10 5.480 1.570 -0.282 1.00 0.00 C ATOM 189 O PRO A 10 4.256 1.553 -0.415 1.00 0.00 O ATOM 190 CB PRO A 10 5.679 1.435 -2.778 1.00 0.00 C ATOM 191 CG PRO A 10 5.038 0.124 -3.074 1.00 0.00 C ATOM 192 CD PRO A 10 5.957 -0.930 -2.514 1.00 0.00 C ATOM 193 HA PRO A 10 7.284 1.833 -1.409 1.00 0.00 H ATOM 194 1HB PRO A 10 4.946 2.221 -2.671 1.00 0.00 H ATOM 195 2HB PRO A 10 6.396 1.704 -3.541 1.00 0.00 H ATOM 196 1HG PRO A 10 4.071 0.073 -2.594 1.00 0.00 H ATOM 197 2HG PRO A 10 4.933 0.000 -4.142 1.00 0.00 H ATOM 198 1HD PRO A 10 5.381 -1.730 -2.074 1.00 0.00 H ATOM 199 2HD PRO A 10 6.604 -1.312 -3.288 1.00 0.00 H ATOM 200 N SER A 11 6.081 1.889 0.859 1.00 0.00 N ATOM 201 CA SER A 11 5.317 2.246 2.051 1.00 0.00 C ATOM 202 C SER A 11 4.769 3.667 1.951 1.00 0.00 C ATOM 203 O SER A 11 3.835 4.033 2.665 1.00 0.00 O ATOM 204 CB SER A 11 6.189 2.110 3.300 1.00 0.00 C ATOM 205 OG SER A 11 6.657 0.781 3.454 1.00 0.00 O ATOM 206 H SER A 11 7.059 1.884 0.902 1.00 0.00 H ATOM 207 HA SER A 11 4.488 1.560 2.127 1.00 0.00 H ATOM 208 1HB SER A 11 7.040 2.769 3.215 1.00 0.00 H ATOM 209 2HB SER A 11 5.611 2.379 4.171 1.00 0.00 H ATOM 210 HG SER A 11 6.618 0.533 4.381 1.00 0.00 H ATOM 211 N ILE A 12 5.354 4.465 1.063 1.00 0.00 N ATOM 212 CA ILE A 12 4.921 5.845 0.875 1.00 0.00 C ATOM 213 C ILE A 12 5.137 6.661 2.146 1.00 0.00 C ATOM 214 O ILE A 12 5.061 7.905 2.070 1.00 0.00 O ATOM 215 CB ILE A 12 3.433 5.915 0.469 1.00 0.00 C ATOM 216 CG1 ILE A 12 3.204 5.156 -0.839 1.00 0.00 C ATOM 217 CG2 ILE A 12 2.983 7.363 0.328 1.00 0.00 C ATOM 218 CD1 ILE A 12 4.005 5.700 -2.002 1.00 0.00 C ATOM 219 OXT ILE A 12 5.379 6.049 3.207 1.00 0.00 O ATOM 220 H ILE A 12 6.093 4.119 0.523 1.00 0.00 H ATOM 221 HA ILE A 12 5.512 6.273 0.077 1.00 0.00 H ATOM 222 HB ILE A 12 2.847 5.456 1.251 1.00 0.00 H ATOM 223 1HG1 ILE A 12 3.483 4.122 -0.702 1.00 0.00 H ATOM 224 2HG1 ILE A 12 2.158 5.211 -1.101 1.00 0.00 H ATOM 225 1HG2 ILE A 12 2.227 7.432 -0.441 1.00 0.00 H ATOM 226 2HG2 ILE A 12 3.827 7.979 0.057 1.00 0.00 H ATOM 227 3HG2 ILE A 12 2.574 7.706 1.266 1.00 0.00 H ATOM 228 1HD1 ILE A 12 3.838 6.763 -2.088 1.00 0.00 H ATOM 229 2HD1 ILE A 12 3.694 5.212 -2.913 1.00 0.00 H ATOM 230 3HD1 ILE A 12 5.055 5.514 -1.834 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 11 ATOM 1 N HIS A 1 -3.508 5.447 3.853 1.00 0.00 N ATOM 2 CA HIS A 1 -4.997 5.455 3.894 1.00 0.00 C ATOM 3 C HIS A 1 -5.594 4.261 3.145 1.00 0.00 C ATOM 4 O HIS A 1 -6.479 3.581 3.665 1.00 0.00 O ATOM 5 CB HIS A 1 -5.505 6.769 3.295 1.00 0.00 C ATOM 6 CG HIS A 1 -5.023 7.985 4.025 1.00 0.00 C ATOM 7 ND1 HIS A 1 -5.294 8.220 5.357 1.00 0.00 N ATOM 8 CD2 HIS A 1 -4.282 9.037 3.602 1.00 0.00 C ATOM 9 CE1 HIS A 1 -4.742 9.364 5.721 1.00 0.00 C ATOM 10 NE2 HIS A 1 -4.121 9.878 4.675 1.00 0.00 N ATOM 11 1H HIS A 1 -3.206 6.078 3.084 1.00 0.00 H ATOM 12 2H HIS A 1 -3.200 4.468 3.678 1.00 0.00 H ATOM 13 3H HIS A 1 -3.164 5.788 4.772 1.00 0.00 H ATOM 14 HA HIS A 1 -5.304 5.400 4.929 1.00 0.00 H ATOM 15 1HB HIS A 1 -5.173 6.845 2.273 1.00 0.00 H ATOM 16 2HB HIS A 1 -6.585 6.774 3.319 1.00 0.00 H ATOM 17 HD1 HIS A 1 -5.814 7.636 5.947 1.00 0.00 H ATOM 18 HD2 HIS A 1 -3.890 9.186 2.606 1.00 0.00 H ATOM 19 HE1 HIS A 1 -4.788 9.803 6.707 1.00 0.00 H ATOM 20 HE2 HIS A 1 -3.560 10.682 4.689 1.00 0.00 H ATOM 21 N PRO A 2 -5.128 3.984 1.910 1.00 0.00 N ATOM 22 CA PRO A 2 -5.641 2.865 1.117 1.00 0.00 C ATOM 23 C PRO A 2 -5.036 1.530 1.538 1.00 0.00 C ATOM 24 O PRO A 2 -4.075 1.054 0.933 1.00 0.00 O ATOM 25 CB PRO A 2 -5.208 3.226 -0.301 1.00 0.00 C ATOM 26 CG PRO A 2 -3.946 3.995 -0.122 1.00 0.00 C ATOM 27 CD PRO A 2 -4.075 4.730 1.190 1.00 0.00 C ATOM 28 HA PRO A 2 -6.718 2.805 1.165 1.00 0.00 H ATOM 29 1HB PRO A 2 -5.046 2.324 -0.872 1.00 0.00 H ATOM 30 2HB PRO A 2 -5.972 3.826 -0.773 1.00 0.00 H ATOM 31 1HG PRO A 2 -3.106 3.317 -0.088 1.00 0.00 H ATOM 32 2HG PRO A 2 -3.827 4.699 -0.933 1.00 0.00 H ATOM 33 1HD PRO A 2 -3.141 4.695 1.728 1.00 0.00 H ATOM 34 2HD PRO A 2 -4.374 5.751 1.017 1.00 0.00 H ATOM 35 N LEU A 3 -5.606 0.931 2.578 1.00 0.00 N ATOM 36 CA LEU A 3 -5.122 -0.351 3.080 1.00 0.00 C ATOM 37 C LEU A 3 -5.631 -1.516 2.232 1.00 0.00 C ATOM 38 O LEU A 3 -5.186 -2.652 2.398 1.00 0.00 O ATOM 39 CB LEU A 3 -5.524 -0.529 4.549 1.00 0.00 C ATOM 40 CG LEU A 3 -7.028 -0.493 4.837 1.00 0.00 C ATOM 41 CD1 LEU A 3 -7.760 -1.604 4.099 1.00 0.00 C ATOM 42 CD2 LEU A 3 -7.285 -0.586 6.333 1.00 0.00 C ATOM 43 H LEU A 3 -6.368 1.360 3.019 1.00 0.00 H ATOM 44 HA LEU A 3 -4.047 -0.332 3.021 1.00 0.00 H ATOM 45 1HB LEU A 3 -5.139 -1.479 4.889 1.00 0.00 H ATOM 46 2HB LEU A 3 -5.054 0.255 5.124 1.00 0.00 H ATOM 47 HG LEU A 3 -7.423 0.449 4.489 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -7.108 -2.459 3.997 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -8.054 -1.255 3.121 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -8.640 -1.888 4.658 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -6.685 -1.381 6.752 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -8.330 -0.793 6.507 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -7.020 0.350 6.802 1.00 0.00 H ATOM 54 N LYS A 4 -6.564 -1.232 1.326 1.00 0.00 N ATOM 55 CA LYS A 4 -7.124 -2.264 0.460 1.00 0.00 C ATOM 56 C LYS A 4 -6.175 -2.594 -0.690 1.00 0.00 C ATOM 57 O LYS A 4 -6.291 -3.645 -1.320 1.00 0.00 O ATOM 58 CB LYS A 4 -8.478 -1.816 -0.092 1.00 0.00 C ATOM 59 CG LYS A 4 -9.132 -2.838 -1.008 1.00 0.00 C ATOM 60 CD LYS A 4 -10.472 -2.345 -1.528 1.00 0.00 C ATOM 61 CE LYS A 4 -11.125 -3.369 -2.443 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.439 -2.895 -2.960 1.00 0.00 N ATOM 63 H LYS A 4 -6.882 -0.311 1.237 1.00 0.00 H ATOM 64 HA LYS A 4 -7.265 -3.151 1.055 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.146 -1.625 0.735 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.341 -0.900 -0.650 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.478 -3.026 -1.846 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.285 -3.755 -0.456 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.126 -2.158 -0.690 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.318 -1.429 -2.079 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.468 -3.557 -3.278 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.274 -4.284 -1.889 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.463 -1.855 -2.973 1.00 0.00 H ATOM 74 2HZ LYS A 4 -13.208 -3.241 -2.350 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.592 -3.248 -3.925 1.00 0.00 H ATOM 76 N GLN A 5 -5.239 -1.691 -0.960 1.00 0.00 N ATOM 77 CA GLN A 5 -4.272 -1.890 -2.035 1.00 0.00 C ATOM 78 C GLN A 5 -3.188 -2.883 -1.624 1.00 0.00 C ATOM 79 O GLN A 5 -2.505 -3.457 -2.474 1.00 0.00 O ATOM 80 CB GLN A 5 -3.636 -0.556 -2.431 1.00 0.00 C ATOM 81 CG GLN A 5 -2.615 -0.677 -3.551 1.00 0.00 C ATOM 82 CD GLN A 5 -1.999 0.658 -3.924 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.699 1.586 -4.330 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.682 0.760 -3.789 1.00 0.00 N ATOM 85 H GLN A 5 -5.195 -0.873 -0.424 1.00 0.00 H ATOM 86 HA GLN A 5 -4.803 -2.290 -2.884 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.415 0.119 -2.754 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.143 -0.136 -1.567 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.827 -1.342 -3.232 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.102 -1.088 -4.422 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.188 -0.020 -3.461 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.257 1.611 -4.024 1.00 0.00 H ATOM 93 N TYR A 6 -3.035 -3.083 -0.319 1.00 0.00 N ATOM 94 CA TYR A 6 -2.033 -4.008 0.201 1.00 0.00 C ATOM 95 C TYR A 6 -0.627 -3.557 -0.182 1.00 0.00 C ATOM 96 O TYR A 6 0.013 -4.151 -1.050 1.00 0.00 O ATOM 97 CB TYR A 6 -2.290 -5.423 -0.327 1.00 0.00 C ATOM 98 CG TYR A 6 -3.641 -6.002 0.056 1.00 0.00 C ATOM 99 CD1 TYR A 6 -4.006 -7.276 -0.359 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.547 -5.282 0.831 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.230 -7.817 -0.018 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.774 -5.817 1.175 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.110 -7.085 0.749 1.00 0.00 C ATOM 104 OH TYR A 6 -7.331 -7.620 1.091 1.00 0.00 O ATOM 105 H TYR A 6 -3.608 -2.597 0.309 1.00 0.00 H ATOM 106 HA TYR A 6 -2.116 -4.013 1.277 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.232 -5.411 -1.404 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.527 -6.084 0.059 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.315 -7.850 -0.961 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.283 -4.291 1.164 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.494 -8.810 -0.351 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.463 -5.244 1.777 1.00 0.00 H ATOM 113 HH TYR A 6 -7.443 -7.580 2.043 1.00 0.00 H ATOM 114 N TRP A 7 -0.150 -2.504 0.475 1.00 0.00 N ATOM 115 CA TRP A 7 1.182 -1.975 0.203 1.00 0.00 C ATOM 116 C TRP A 7 2.258 -2.882 0.792 1.00 0.00 C ATOM 117 O TRP A 7 1.969 -3.747 1.619 1.00 0.00 O ATOM 118 CB TRP A 7 1.321 -0.563 0.775 1.00 0.00 C ATOM 119 CG TRP A 7 1.116 -0.498 2.258 1.00 0.00 C ATOM 120 CD1 TRP A 7 1.842 -1.147 3.215 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.118 0.257 2.953 1.00 0.00 C ATOM 122 NE1 TRP A 7 1.357 -0.841 4.463 1.00 0.00 N ATOM 123 CE2 TRP A 7 0.298 0.019 4.329 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.909 1.114 2.547 1.00 0.00 C ATOM 125 CZ2 TRP A 7 -0.511 0.606 5.299 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -1.712 1.695 3.510 1.00 0.00 C ATOM 127 CH2 TRP A 7 -1.509 1.439 4.872 1.00 0.00 C ATOM 128 H TRP A 7 -0.705 -2.073 1.156 1.00 0.00 H ATOM 129 HA TRP A 7 1.311 -1.934 -0.867 1.00 0.00 H ATOM 130 1HB TRP A 7 2.311 -0.190 0.559 1.00 0.00 H ATOM 131 2HB TRP A 7 0.589 0.080 0.308 1.00 0.00 H ATOM 132 HD1 TRP A 7 2.674 -1.803 3.006 1.00 0.00 H ATOM 133 HE1 TRP A 7 1.710 -1.183 5.311 1.00 0.00 H ATOM 134 HE3 TRP A 7 -1.081 1.322 1.501 1.00 0.00 H ATOM 135 HZ2 TRP A 7 -0.368 0.419 6.352 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -2.512 2.358 3.214 1.00 0.00 H ATOM 137 HH2 TRP A 7 -2.161 1.915 5.589 1.00 0.00 H ATOM 138 N TRP A 8 3.498 -2.679 0.360 1.00 0.00 N ATOM 139 CA TRP A 8 4.616 -3.479 0.844 1.00 0.00 C ATOM 140 C TRP A 8 5.931 -2.731 0.597 1.00 0.00 C ATOM 141 O TRP A 8 6.307 -1.855 1.377 1.00 0.00 O ATOM 142 CB TRP A 8 4.619 -4.844 0.145 1.00 0.00 C ATOM 143 CG TRP A 8 5.710 -5.785 0.583 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.939 -7.034 0.077 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.661 -5.610 1.654 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.005 -7.617 0.713 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.459 -6.772 1.689 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.934 -4.588 2.572 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.502 -6.937 2.598 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.967 -4.758 3.475 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.741 -5.923 3.481 1.00 0.00 C ATOM 152 H TRP A 8 3.665 -1.974 -0.300 1.00 0.00 H ATOM 153 HA TRP A 8 4.492 -3.623 1.903 1.00 0.00 H ATOM 154 1HB TRP A 8 3.674 -5.330 0.337 1.00 0.00 H ATOM 155 2HB TRP A 8 4.719 -4.690 -0.920 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.378 -7.470 -0.735 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.374 -8.501 0.508 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.350 -3.684 2.595 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.109 -7.831 2.615 1.00 0.00 H ATOM 160 HZ3 TRP A 8 8.188 -3.978 4.190 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.537 -6.011 4.205 1.00 0.00 H ATOM 162 N ARG A 9 6.626 -3.074 -0.482 1.00 0.00 N ATOM 163 CA ARG A 9 7.891 -2.428 -0.813 1.00 0.00 C ATOM 164 C ARG A 9 7.716 -0.917 -0.980 1.00 0.00 C ATOM 165 O ARG A 9 8.501 -0.136 -0.443 1.00 0.00 O ATOM 166 CB ARG A 9 8.485 -3.033 -2.088 1.00 0.00 C ATOM 167 CG ARG A 9 8.768 -4.522 -1.979 1.00 0.00 C ATOM 168 CD ARG A 9 9.758 -4.821 -0.865 1.00 0.00 C ATOM 169 NE ARG A 9 10.037 -6.251 -0.751 1.00 0.00 N ATOM 170 CZ ARG A 9 10.870 -6.774 0.147 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.507 -5.990 1.007 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.066 -8.085 0.183 1.00 0.00 N ATOM 173 H ARG A 9 6.283 -3.774 -1.067 1.00 0.00 H ATOM 174 HA ARG A 9 8.572 -2.606 0.005 1.00 0.00 H ATOM 175 1HB ARG A 9 7.796 -2.879 -2.903 1.00 0.00 H ATOM 176 2HB ARG A 9 9.414 -2.529 -2.312 1.00 0.00 H ATOM 177 1HG ARG A 9 7.844 -5.040 -1.773 1.00 0.00 H ATOM 178 2HG ARG A 9 9.178 -4.871 -2.916 1.00 0.00 H ATOM 179 1HD ARG A 9 10.681 -4.300 -1.071 1.00 0.00 H ATOM 180 2HD ARG A 9 9.346 -4.469 0.070 1.00 0.00 H ATOM 181 HE ARG A 9 9.580 -6.853 -1.375 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.364 -5.001 0.985 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.131 -6.390 1.679 1.00 0.00 H ATOM 184 1HH2 ARG A 9 10.589 -8.680 -0.463 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.692 -8.478 0.856 1.00 0.00 H ATOM 186 N PRO A 10 6.684 -0.478 -1.725 1.00 0.00 N ATOM 187 CA PRO A 10 6.425 0.941 -1.947 1.00 0.00 C ATOM 188 C PRO A 10 5.602 1.562 -0.823 1.00 0.00 C ATOM 189 O PRO A 10 5.437 0.965 0.241 1.00 0.00 O ATOM 190 CB PRO A 10 5.634 0.935 -3.251 1.00 0.00 C ATOM 191 CG PRO A 10 4.863 -0.341 -3.213 1.00 0.00 C ATOM 192 CD PRO A 10 5.684 -1.322 -2.411 1.00 0.00 C ATOM 193 HA PRO A 10 7.341 1.499 -2.077 1.00 0.00 H ATOM 194 1HB PRO A 10 4.980 1.793 -3.285 1.00 0.00 H ATOM 195 2HB PRO A 10 6.314 0.958 -4.089 1.00 0.00 H ATOM 196 1HG PRO A 10 3.909 -0.175 -2.734 1.00 0.00 H ATOM 197 2HG PRO A 10 4.717 -0.710 -4.217 1.00 0.00 H ATOM 198 1HD PRO A 10 5.061 -1.832 -1.693 1.00 0.00 H ATOM 199 2HD PRO A 10 6.164 -2.032 -3.065 1.00 0.00 H ATOM 200 N SER A 11 5.088 2.762 -1.067 1.00 0.00 N ATOM 201 CA SER A 11 4.280 3.466 -0.077 1.00 0.00 C ATOM 202 C SER A 11 3.532 4.632 -0.716 1.00 0.00 C ATOM 203 O SER A 11 3.292 5.654 -0.074 1.00 0.00 O ATOM 204 CB SER A 11 5.163 3.978 1.063 1.00 0.00 C ATOM 205 OG SER A 11 5.827 2.910 1.715 1.00 0.00 O ATOM 206 H SER A 11 5.256 3.183 -1.934 1.00 0.00 H ATOM 207 HA SER A 11 3.561 2.767 0.322 1.00 0.00 H ATOM 208 1HB SER A 11 5.904 4.655 0.666 1.00 0.00 H ATOM 209 2HB SER A 11 4.550 4.498 1.784 1.00 0.00 H ATOM 210 HG SER A 11 5.209 2.189 1.861 1.00 0.00 H ATOM 211 N ILE A 12 3.166 4.471 -1.984 1.00 0.00 N ATOM 212 CA ILE A 12 2.446 5.510 -2.709 1.00 0.00 C ATOM 213 C ILE A 12 3.279 6.786 -2.802 1.00 0.00 C ATOM 214 O ILE A 12 2.899 7.684 -3.583 1.00 0.00 O ATOM 215 CB ILE A 12 1.095 5.831 -2.033 1.00 0.00 C ATOM 216 CG1 ILE A 12 0.216 4.581 -1.987 1.00 0.00 C ATOM 217 CG2 ILE A 12 0.380 6.956 -2.770 1.00 0.00 C ATOM 218 CD1 ILE A 12 -0.098 4.012 -3.353 1.00 0.00 C ATOM 219 OXT ILE A 12 4.304 6.875 -2.093 1.00 0.00 O ATOM 220 H ILE A 12 3.386 3.633 -2.443 1.00 0.00 H ATOM 221 HA ILE A 12 2.249 5.146 -3.707 1.00 0.00 H ATOM 222 HB ILE A 12 1.292 6.162 -1.025 1.00 0.00 H ATOM 223 1HG1 ILE A 12 0.721 3.815 -1.417 1.00 0.00 H ATOM 224 2HG1 ILE A 12 -0.720 4.824 -1.504 1.00 0.00 H ATOM 225 1HG2 ILE A 12 0.672 7.906 -2.348 1.00 0.00 H ATOM 226 2HG2 ILE A 12 -0.688 6.830 -2.669 1.00 0.00 H ATOM 227 3HG2 ILE A 12 0.647 6.928 -3.816 1.00 0.00 H ATOM 228 1HD1 ILE A 12 -1.034 3.473 -3.312 1.00 0.00 H ATOM 229 2HD1 ILE A 12 0.692 3.339 -3.653 1.00 0.00 H ATOM 230 3HD1 ILE A 12 -0.177 4.816 -4.069 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 12 ATOM 1 N HIS A 1 -3.835 7.306 0.603 1.00 0.00 N ATOM 2 CA HIS A 1 -3.452 6.218 1.542 1.00 0.00 C ATOM 3 C HIS A 1 -4.127 4.902 1.168 1.00 0.00 C ATOM 4 O HIS A 1 -5.219 4.597 1.649 1.00 0.00 O ATOM 5 CB HIS A 1 -3.854 6.635 2.959 1.00 0.00 C ATOM 6 CG HIS A 1 -3.194 7.896 3.422 1.00 0.00 C ATOM 7 ND1 HIS A 1 -1.825 8.037 3.522 1.00 0.00 N ATOM 8 CD2 HIS A 1 -3.722 9.080 3.815 1.00 0.00 C ATOM 9 CE1 HIS A 1 -1.542 9.252 3.956 1.00 0.00 C ATOM 10 NE2 HIS A 1 -2.674 9.905 4.140 1.00 0.00 N ATOM 11 1H HIS A 1 -4.805 7.597 0.836 1.00 0.00 H ATOM 12 2H HIS A 1 -3.777 6.924 -0.362 1.00 0.00 H ATOM 13 3H HIS A 1 -3.166 8.091 0.738 1.00 0.00 H ATOM 14 HA HIS A 1 -2.380 6.090 1.500 1.00 0.00 H ATOM 15 1HB HIS A 1 -4.922 6.787 2.992 1.00 0.00 H ATOM 16 2HB HIS A 1 -3.586 5.846 3.647 1.00 0.00 H ATOM 17 HD1 HIS A 1 -1.162 7.349 3.308 1.00 0.00 H ATOM 18 HD2 HIS A 1 -4.773 9.329 3.861 1.00 0.00 H ATOM 19 HE1 HIS A 1 -0.551 9.647 4.130 1.00 0.00 H ATOM 20 HE2 HIS A 1 -2.754 10.796 4.541 1.00 0.00 H ATOM 21 N PRO A 2 -3.483 4.100 0.302 1.00 0.00 N ATOM 22 CA PRO A 2 -4.028 2.811 -0.135 1.00 0.00 C ATOM 23 C PRO A 2 -4.428 1.925 1.040 1.00 0.00 C ATOM 24 O PRO A 2 -3.622 1.659 1.932 1.00 0.00 O ATOM 25 CB PRO A 2 -2.870 2.180 -0.913 1.00 0.00 C ATOM 26 CG PRO A 2 -2.057 3.334 -1.385 1.00 0.00 C ATOM 27 CD PRO A 2 -2.177 4.388 -0.318 1.00 0.00 C ATOM 28 HA PRO A 2 -4.877 2.942 -0.791 1.00 0.00 H ATOM 29 1HB PRO A 2 -2.303 1.536 -0.257 1.00 0.00 H ATOM 30 2HB PRO A 2 -3.259 1.607 -1.741 1.00 0.00 H ATOM 31 1HG PRO A 2 -1.026 3.034 -1.501 1.00 0.00 H ATOM 32 2HG PRO A 2 -2.451 3.702 -2.320 1.00 0.00 H ATOM 33 1HD PRO A 2 -1.378 4.288 0.402 1.00 0.00 H ATOM 34 2HD PRO A 2 -2.168 5.374 -0.759 1.00 0.00 H ATOM 35 N LEU A 3 -5.677 1.469 1.034 1.00 0.00 N ATOM 36 CA LEU A 3 -6.184 0.613 2.101 1.00 0.00 C ATOM 37 C LEU A 3 -6.759 -0.694 1.553 1.00 0.00 C ATOM 38 O LEU A 3 -7.260 -1.524 2.312 1.00 0.00 O ATOM 39 CB LEU A 3 -7.235 1.364 2.924 1.00 0.00 C ATOM 40 CG LEU A 3 -8.459 1.857 2.146 1.00 0.00 C ATOM 41 CD1 LEU A 3 -9.216 0.698 1.514 1.00 0.00 C ATOM 42 CD2 LEU A 3 -9.376 2.663 3.054 1.00 0.00 C ATOM 43 H LEU A 3 -6.272 1.716 0.295 1.00 0.00 H ATOM 44 HA LEU A 3 -5.354 0.374 2.744 1.00 0.00 H ATOM 45 1HB LEU A 3 -7.579 0.708 3.711 1.00 0.00 H ATOM 46 2HB LEU A 3 -6.760 2.220 3.378 1.00 0.00 H ATOM 47 HG LEU A 3 -8.124 2.505 1.351 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.765 0.449 0.566 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -10.246 0.983 1.359 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -9.174 -0.159 2.170 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -9.117 3.709 2.990 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -9.262 2.325 4.073 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -10.402 2.526 2.743 1.00 0.00 H ATOM 54 N LYS A 4 -6.688 -0.873 0.236 1.00 0.00 N ATOM 55 CA LYS A 4 -7.206 -2.081 -0.399 1.00 0.00 C ATOM 56 C LYS A 4 -6.077 -2.927 -0.985 1.00 0.00 C ATOM 57 O LYS A 4 -6.255 -4.114 -1.255 1.00 0.00 O ATOM 58 CB LYS A 4 -8.209 -1.715 -1.494 1.00 0.00 C ATOM 59 CG LYS A 4 -8.801 -2.920 -2.208 1.00 0.00 C ATOM 60 CD LYS A 4 -9.789 -2.500 -3.284 1.00 0.00 C ATOM 61 CE LYS A 4 -10.381 -3.704 -3.998 1.00 0.00 C ATOM 62 NZ LYS A 4 -11.350 -3.301 -5.054 1.00 0.00 N ATOM 63 H LYS A 4 -6.280 -0.180 -0.323 1.00 0.00 H ATOM 64 HA LYS A 4 -7.711 -2.659 0.359 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.019 -1.153 -1.052 1.00 0.00 H ATOM 66 2HB LYS A 4 -7.714 -1.097 -2.228 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.001 -3.483 -2.667 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.311 -3.540 -1.484 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.588 -1.938 -2.825 1.00 0.00 H ATOM 70 2HD LYS A 4 -9.277 -1.879 -4.005 1.00 0.00 H ATOM 71 1HE LYS A 4 -9.579 -4.266 -4.454 1.00 0.00 H ATOM 72 2HE LYS A 4 -10.887 -4.323 -3.273 1.00 0.00 H ATOM 73 1HZ LYS A 4 -11.096 -2.367 -5.436 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.310 -3.252 -4.659 1.00 0.00 H ATOM 75 3HZ LYS A 4 -11.342 -3.993 -5.830 1.00 0.00 H ATOM 76 N GLN A 5 -4.918 -2.308 -1.180 1.00 0.00 N ATOM 77 CA GLN A 5 -3.763 -3.007 -1.736 1.00 0.00 C ATOM 78 C GLN A 5 -2.803 -3.446 -0.633 1.00 0.00 C ATOM 79 O GLN A 5 -1.985 -4.344 -0.832 1.00 0.00 O ATOM 80 CB GLN A 5 -3.034 -2.109 -2.738 1.00 0.00 C ATOM 81 CG GLN A 5 -1.813 -2.762 -3.366 1.00 0.00 C ATOM 82 CD GLN A 5 -1.109 -1.852 -4.354 1.00 0.00 C ATOM 83 OE1 GLN A 5 -1.697 -1.422 -5.347 1.00 0.00 O ATOM 84 NE2 GLN A 5 0.157 -1.552 -4.084 1.00 0.00 N ATOM 85 H GLN A 5 -4.835 -1.362 -0.947 1.00 0.00 H ATOM 86 HA GLN A 5 -4.124 -3.883 -2.249 1.00 0.00 H ATOM 87 1HB GLN A 5 -3.719 -1.840 -3.528 1.00 0.00 H ATOM 88 2HB GLN A 5 -2.713 -1.210 -2.231 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.117 -3.024 -2.583 1.00 0.00 H ATOM 90 2HG GLN A 5 -2.126 -3.657 -3.884 1.00 0.00 H ATOM 91 1HE2 GLN A 5 0.559 -1.930 -3.275 1.00 0.00 H ATOM 92 2HE2 GLN A 5 0.635 -0.965 -4.706 1.00 0.00 H ATOM 93 N TYR A 6 -2.907 -2.807 0.528 1.00 0.00 N ATOM 94 CA TYR A 6 -2.049 -3.133 1.662 1.00 0.00 C ATOM 95 C TYR A 6 -0.579 -2.863 1.339 1.00 0.00 C ATOM 96 O TYR A 6 0.311 -3.372 2.017 1.00 0.00 O ATOM 97 CB TYR A 6 -2.231 -4.599 2.066 1.00 0.00 C ATOM 98 CG TYR A 6 -3.643 -4.967 2.484 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.949 -6.266 2.870 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.667 -4.023 2.496 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.229 -6.616 3.255 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.950 -4.367 2.880 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.225 -5.664 3.257 1.00 0.00 C ATOM 104 OH TYR A 6 -7.502 -6.009 3.640 1.00 0.00 O ATOM 105 H TYR A 6 -3.577 -2.101 0.625 1.00 0.00 H ATOM 106 HA TYR A 6 -2.342 -2.504 2.488 1.00 0.00 H ATOM 107 1HB TYR A 6 -1.963 -5.228 1.230 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.573 -4.818 2.895 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.167 -7.011 2.867 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.451 -3.008 2.201 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.444 -7.632 3.551 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.730 -3.621 2.882 1.00 0.00 H ATOM 113 HH TYR A 6 -8.107 -5.853 2.911 1.00 0.00 H ATOM 114 N TRP A 7 -0.338 -2.060 0.299 1.00 0.00 N ATOM 115 CA TRP A 7 1.019 -1.711 -0.128 1.00 0.00 C ATOM 116 C TRP A 7 1.948 -2.927 -0.097 1.00 0.00 C ATOM 117 O TRP A 7 1.494 -4.065 0.020 1.00 0.00 O ATOM 118 CB TRP A 7 1.582 -0.587 0.750 1.00 0.00 C ATOM 119 CG TRP A 7 1.679 -0.941 2.203 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.411 -1.955 2.754 1.00 0.00 C ATOM 121 CD2 TRP A 7 1.022 -0.283 3.292 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.249 -1.966 4.118 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.401 -0.949 4.473 1.00 0.00 C ATOM 124 CE3 TRP A 7 0.150 0.807 3.382 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.937 -0.562 5.728 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.310 1.189 4.628 1.00 0.00 C ATOM 127 CH2 TRP A 7 0.086 0.507 5.786 1.00 0.00 C ATOM 128 H TRP A 7 -1.097 -1.689 -0.197 1.00 0.00 H ATOM 129 HA TRP A 7 0.956 -1.356 -1.146 1.00 0.00 H ATOM 130 1HB TRP A 7 2.571 -0.330 0.404 1.00 0.00 H ATOM 131 2HB TRP A 7 0.942 0.279 0.661 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.024 -2.640 2.187 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.672 -2.598 4.736 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.165 1.345 2.501 1.00 0.00 H ATOM 135 HZ2 TRP A 7 1.232 -1.076 6.629 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -0.984 2.028 4.718 1.00 0.00 H ATOM 137 HH2 TRP A 7 -0.299 0.841 6.738 1.00 0.00 H ATOM 138 N TRP A 8 3.250 -2.679 -0.207 1.00 0.00 N ATOM 139 CA TRP A 8 4.236 -3.752 -0.193 1.00 0.00 C ATOM 140 C TRP A 8 5.645 -3.156 -0.096 1.00 0.00 C ATOM 141 O TRP A 8 6.091 -2.786 0.991 1.00 0.00 O ATOM 142 CB TRP A 8 4.087 -4.612 -1.456 1.00 0.00 C ATOM 143 CG TRP A 8 5.030 -5.784 -1.544 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.113 -6.664 -2.585 1.00 0.00 C ATOM 145 CD2 TRP A 8 5.957 -6.259 -0.546 1.00 0.00 C ATOM 146 NE1 TRP A 8 6.070 -7.614 -2.331 1.00 0.00 N ATOM 147 CE2 TRP A 8 6.596 -7.395 -1.086 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.329 -5.834 0.737 1.00 0.00 C ATOM 149 CZ2 TRP A 8 7.576 -8.103 -0.394 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.299 -6.542 1.421 1.00 0.00 C ATOM 151 CH2 TRP A 8 7.913 -7.664 0.855 1.00 0.00 C ATOM 152 H TRP A 8 3.554 -1.753 -0.303 1.00 0.00 H ATOM 153 HA TRP A 8 4.056 -4.363 0.675 1.00 0.00 H ATOM 154 1HB TRP A 8 3.082 -5.003 -1.489 1.00 0.00 H ATOM 155 2HB TRP A 8 4.246 -3.990 -2.324 1.00 0.00 H ATOM 156 HD1 TRP A 8 4.530 -6.590 -3.490 1.00 0.00 H ATOM 157 HE1 TRP A 8 6.329 -8.337 -2.938 1.00 0.00 H ATOM 158 HE3 TRP A 8 5.867 -4.978 1.199 1.00 0.00 H ATOM 159 HZ2 TRP A 8 8.060 -8.970 -0.818 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.594 -6.228 2.411 1.00 0.00 H ATOM 161 HH2 TRP A 8 8.665 -8.185 1.428 1.00 0.00 H ATOM 162 N ARG A 9 6.341 -3.058 -1.224 1.00 0.00 N ATOM 163 CA ARG A 9 7.689 -2.502 -1.242 1.00 0.00 C ATOM 164 C ARG A 9 7.679 -1.016 -0.880 1.00 0.00 C ATOM 165 O ARG A 9 8.507 -0.562 -0.091 1.00 0.00 O ATOM 166 CB ARG A 9 8.336 -2.703 -2.616 1.00 0.00 C ATOM 167 CG ARG A 9 8.458 -4.162 -3.025 1.00 0.00 C ATOM 168 CD ARG A 9 9.306 -4.949 -2.038 1.00 0.00 C ATOM 169 NE ARG A 9 9.432 -6.352 -2.422 1.00 0.00 N ATOM 170 CZ ARG A 9 10.121 -7.253 -1.726 1.00 0.00 C ATOM 171 NH1 ARG A 9 10.745 -6.902 -0.608 1.00 0.00 N ATOM 172 NH2 ARG A 9 10.187 -8.508 -2.148 1.00 0.00 N ATOM 173 H ARG A 9 5.940 -3.363 -2.060 1.00 0.00 H ATOM 174 HA ARG A 9 8.270 -3.033 -0.503 1.00 0.00 H ATOM 175 1HB ARG A 9 7.745 -2.192 -3.361 1.00 0.00 H ATOM 176 2HB ARG A 9 9.326 -2.274 -2.599 1.00 0.00 H ATOM 177 1HG ARG A 9 7.471 -4.599 -3.063 1.00 0.00 H ATOM 178 2HG ARG A 9 8.916 -4.215 -4.002 1.00 0.00 H ATOM 179 1HD ARG A 9 10.290 -4.507 -1.997 1.00 0.00 H ATOM 180 2HD ARG A 9 8.846 -4.891 -1.062 1.00 0.00 H ATOM 181 HE ARG A 9 8.979 -6.639 -3.243 1.00 0.00 H ATOM 182 1HH1 ARG A 9 10.698 -5.958 -0.283 1.00 0.00 H ATOM 183 2HH1 ARG A 9 11.262 -7.583 -0.089 1.00 0.00 H ATOM 184 1HH2 ARG A 9 9.718 -8.778 -2.989 1.00 0.00 H ATOM 185 2HH2 ARG A 9 10.706 -9.185 -1.626 1.00 0.00 H ATOM 186 N PRO A 10 6.743 -0.232 -1.451 1.00 0.00 N ATOM 187 CA PRO A 10 6.645 1.205 -1.176 1.00 0.00 C ATOM 188 C PRO A 10 6.157 1.490 0.240 1.00 0.00 C ATOM 189 O PRO A 10 6.198 0.618 1.109 1.00 0.00 O ATOM 190 CB PRO A 10 5.620 1.713 -2.205 1.00 0.00 C ATOM 191 CG PRO A 10 5.428 0.590 -3.169 1.00 0.00 C ATOM 192 CD PRO A 10 5.713 -0.667 -2.403 1.00 0.00 C ATOM 193 HA PRO A 10 7.592 1.702 -1.333 1.00 0.00 H ATOM 194 1HB PRO A 10 4.697 1.961 -1.701 1.00 0.00 H ATOM 195 2HB PRO A 10 6.011 2.591 -2.698 1.00 0.00 H ATOM 196 1HG PRO A 10 4.409 0.586 -3.530 1.00 0.00 H ATOM 197 2HG PRO A 10 6.117 0.692 -3.994 1.00 0.00 H ATOM 198 1HD PRO A 10 4.827 -1.007 -1.888 1.00 0.00 H ATOM 199 2HD PRO A 10 6.091 -1.434 -3.060 1.00 0.00 H ATOM 200 N SER A 11 5.693 2.714 0.465 1.00 0.00 N ATOM 201 CA SER A 11 5.194 3.116 1.776 1.00 0.00 C ATOM 202 C SER A 11 4.392 4.409 1.678 1.00 0.00 C ATOM 203 O SER A 11 4.378 5.215 2.610 1.00 0.00 O ATOM 204 CB SER A 11 6.355 3.294 2.756 1.00 0.00 C ATOM 205 OG SER A 11 7.083 2.088 2.911 1.00 0.00 O ATOM 206 H SER A 11 5.685 3.364 -0.268 1.00 0.00 H ATOM 207 HA SER A 11 4.546 2.331 2.138 1.00 0.00 H ATOM 208 1HB SER A 11 7.022 4.057 2.385 1.00 0.00 H ATOM 209 2HB SER A 11 5.967 3.593 3.719 1.00 0.00 H ATOM 210 HG SER A 11 6.475 1.370 3.101 1.00 0.00 H ATOM 211 N ILE A 12 3.725 4.602 0.545 1.00 0.00 N ATOM 212 CA ILE A 12 2.921 5.798 0.325 1.00 0.00 C ATOM 213 C ILE A 12 1.671 5.781 1.200 1.00 0.00 C ATOM 214 O ILE A 12 1.537 6.681 2.056 1.00 0.00 O ATOM 215 CB ILE A 12 2.506 5.929 -1.155 1.00 0.00 C ATOM 216 CG1 ILE A 12 3.746 6.011 -2.048 1.00 0.00 C ATOM 217 CG2 ILE A 12 1.624 7.153 -1.361 1.00 0.00 C ATOM 218 CD1 ILE A 12 4.640 7.191 -1.734 1.00 0.00 C ATOM 219 OXT ILE A 12 0.836 4.869 1.020 1.00 0.00 O ATOM 220 H ILE A 12 3.776 3.924 -0.161 1.00 0.00 H ATOM 221 HA ILE A 12 3.521 6.657 0.587 1.00 0.00 H ATOM 222 HB ILE A 12 1.935 5.054 -1.426 1.00 0.00 H ATOM 223 1HG1 ILE A 12 4.330 5.111 -1.926 1.00 0.00 H ATOM 224 2HG1 ILE A 12 3.434 6.095 -3.080 1.00 0.00 H ATOM 225 1HG2 ILE A 12 1.428 7.284 -2.415 1.00 0.00 H ATOM 226 2HG2 ILE A 12 2.127 8.029 -0.977 1.00 0.00 H ATOM 227 3HG2 ILE A 12 0.689 7.016 -0.835 1.00 0.00 H ATOM 228 1HD1 ILE A 12 5.541 6.841 -1.251 1.00 0.00 H ATOM 229 2HD1 ILE A 12 4.120 7.871 -1.076 1.00 0.00 H ATOM 230 3HD1 ILE A 12 4.897 7.702 -2.650 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 13 ATOM 1 N HIS A 1 -5.210 6.418 2.600 1.00 0.00 N ATOM 2 CA HIS A 1 -4.951 5.096 3.226 1.00 0.00 C ATOM 3 C HIS A 1 -5.989 4.064 2.787 1.00 0.00 C ATOM 4 O HIS A 1 -6.894 3.719 3.546 1.00 0.00 O ATOM 5 CB HIS A 1 -4.983 5.263 4.747 1.00 0.00 C ATOM 6 CG HIS A 1 -3.960 6.225 5.265 1.00 0.00 C ATOM 7 ND1 HIS A 1 -2.604 6.053 5.083 1.00 0.00 N ATOM 8 CD2 HIS A 1 -4.101 7.377 5.964 1.00 0.00 C ATOM 9 CE1 HIS A 1 -1.955 7.057 5.649 1.00 0.00 C ATOM 10 NE2 HIS A 1 -2.841 7.873 6.189 1.00 0.00 N ATOM 11 1H HIS A 1 -5.448 6.255 1.601 1.00 0.00 H ATOM 12 2H HIS A 1 -4.342 6.986 2.690 1.00 0.00 H ATOM 13 3H HIS A 1 -6.002 6.859 3.106 1.00 0.00 H ATOM 14 HA HIS A 1 -3.970 4.758 2.927 1.00 0.00 H ATOM 15 1HB HIS A 1 -5.957 5.624 5.041 1.00 0.00 H ATOM 16 2HB HIS A 1 -4.805 4.304 5.211 1.00 0.00 H ATOM 17 HD1 HIS A 1 -2.180 5.307 4.610 1.00 0.00 H ATOM 18 HD2 HIS A 1 -5.033 7.822 6.284 1.00 0.00 H ATOM 19 HE1 HIS A 1 -0.883 7.186 5.665 1.00 0.00 H ATOM 20 HE2 HIS A 1 -2.626 8.645 6.753 1.00 0.00 H ATOM 21 N PRO A 2 -5.869 3.556 1.547 1.00 0.00 N ATOM 22 CA PRO A 2 -6.801 2.560 1.009 1.00 0.00 C ATOM 23 C PRO A 2 -6.619 1.190 1.653 1.00 0.00 C ATOM 24 O PRO A 2 -5.495 0.713 1.815 1.00 0.00 O ATOM 25 CB PRO A 2 -6.438 2.505 -0.476 1.00 0.00 C ATOM 26 CG PRO A 2 -5.007 2.909 -0.529 1.00 0.00 C ATOM 27 CD PRO A 2 -4.817 3.912 0.576 1.00 0.00 C ATOM 28 HA PRO A 2 -7.827 2.877 1.121 1.00 0.00 H ATOM 29 1HB PRO A 2 -6.581 1.499 -0.846 1.00 0.00 H ATOM 30 2HB PRO A 2 -7.063 3.190 -1.029 1.00 0.00 H ATOM 31 1HG PRO A 2 -4.375 2.049 -0.367 1.00 0.00 H ATOM 32 2HG PRO A 2 -4.787 3.361 -1.485 1.00 0.00 H ATOM 33 1HD PRO A 2 -3.836 3.809 1.015 1.00 0.00 H ATOM 34 2HD PRO A 2 -4.961 4.915 0.204 1.00 0.00 H ATOM 35 N LEU A 3 -7.730 0.560 2.023 1.00 0.00 N ATOM 36 CA LEU A 3 -7.688 -0.756 2.649 1.00 0.00 C ATOM 37 C LEU A 3 -7.756 -1.876 1.611 1.00 0.00 C ATOM 38 O LEU A 3 -7.778 -3.056 1.961 1.00 0.00 O ATOM 39 CB LEU A 3 -8.826 -0.896 3.666 1.00 0.00 C ATOM 40 CG LEU A 3 -10.240 -0.737 3.100 1.00 0.00 C ATOM 41 CD1 LEU A 3 -10.527 -1.789 2.040 1.00 0.00 C ATOM 42 CD2 LEU A 3 -11.270 -0.808 4.218 1.00 0.00 C ATOM 43 H LEU A 3 -8.598 0.990 1.869 1.00 0.00 H ATOM 44 HA LEU A 3 -6.750 -0.832 3.173 1.00 0.00 H ATOM 45 1HB LEU A 3 -8.753 -1.873 4.121 1.00 0.00 H ATOM 46 2HB LEU A 3 -8.686 -0.150 4.434 1.00 0.00 H ATOM 47 HG LEU A 3 -10.318 0.232 2.633 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -10.184 -1.435 1.079 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -11.589 -1.978 1.997 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -10.009 -2.704 2.291 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -10.802 -0.547 5.155 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -11.666 -1.811 4.279 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -12.072 -0.115 4.011 1.00 0.00 H ATOM 54 N LYS A 4 -7.793 -1.506 0.334 1.00 0.00 N ATOM 55 CA LYS A 4 -7.857 -2.488 -0.741 1.00 0.00 C ATOM 56 C LYS A 4 -6.458 -2.885 -1.203 1.00 0.00 C ATOM 57 O LYS A 4 -6.280 -3.902 -1.874 1.00 0.00 O ATOM 58 CB LYS A 4 -8.663 -1.935 -1.919 1.00 0.00 C ATOM 59 CG LYS A 4 -8.780 -2.903 -3.085 1.00 0.00 C ATOM 60 CD LYS A 4 -9.590 -2.307 -4.225 1.00 0.00 C ATOM 61 CE LYS A 4 -9.706 -3.276 -5.391 1.00 0.00 C ATOM 62 NZ LYS A 4 -10.498 -2.701 -6.514 1.00 0.00 N ATOM 63 H LYS A 4 -7.775 -0.553 0.109 1.00 0.00 H ATOM 64 HA LYS A 4 -8.356 -3.365 -0.357 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.659 -1.695 -1.577 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.186 -1.033 -2.273 1.00 0.00 H ATOM 67 1HG LYS A 4 -7.790 -3.139 -3.445 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.265 -3.806 -2.743 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.580 -2.072 -3.866 1.00 0.00 H ATOM 70 2HD LYS A 4 -9.103 -1.405 -4.565 1.00 0.00 H ATOM 71 1HE LYS A 4 -8.715 -3.512 -5.747 1.00 0.00 H ATOM 72 2HE LYS A 4 -10.188 -4.178 -5.045 1.00 0.00 H ATOM 73 1HZ LYS A 4 -10.461 -3.334 -7.338 1.00 0.00 H ATOM 74 2HZ LYS A 4 -10.114 -1.774 -6.784 1.00 0.00 H ATOM 75 3HZ LYS A 4 -11.490 -2.581 -6.226 1.00 0.00 H ATOM 76 N GLN A 5 -5.466 -2.075 -0.843 1.00 0.00 N ATOM 77 CA GLN A 5 -4.085 -2.344 -1.222 1.00 0.00 C ATOM 78 C GLN A 5 -3.127 -1.951 -0.100 1.00 0.00 C ATOM 79 O GLN A 5 -2.885 -0.768 0.135 1.00 0.00 O ATOM 80 CB GLN A 5 -3.732 -1.586 -2.504 1.00 0.00 C ATOM 81 CG GLN A 5 -2.303 -1.811 -2.971 1.00 0.00 C ATOM 82 CD GLN A 5 -1.980 -1.050 -4.242 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.611 -1.254 -5.279 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.989 -0.168 -4.167 1.00 0.00 N ATOM 85 H GLN A 5 -5.666 -1.280 -0.309 1.00 0.00 H ATOM 86 HA GLN A 5 -3.991 -3.404 -1.404 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.399 -1.903 -3.291 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.869 -0.528 -2.332 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.629 -1.484 -2.195 1.00 0.00 H ATOM 90 2HG GLN A 5 -2.159 -2.866 -3.154 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.530 -0.060 -3.309 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.759 0.338 -4.974 1.00 0.00 H ATOM 93 N TYR A 6 -2.581 -2.953 0.585 1.00 0.00 N ATOM 94 CA TYR A 6 -1.645 -2.713 1.679 1.00 0.00 C ATOM 95 C TYR A 6 -0.210 -2.573 1.169 1.00 0.00 C ATOM 96 O TYR A 6 0.731 -2.547 1.959 1.00 0.00 O ATOM 97 CB TYR A 6 -1.718 -3.848 2.705 1.00 0.00 C ATOM 98 CG TYR A 6 -3.077 -4.026 3.358 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.278 -5.026 4.301 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.152 -3.197 3.046 1.00 0.00 C ATOM 101 CE1 TYR A 6 -4.505 -5.198 4.913 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.382 -3.364 3.654 1.00 0.00 C ATOM 103 CZ TYR A 6 -5.553 -4.364 4.587 1.00 0.00 C ATOM 104 OH TYR A 6 -6.776 -4.532 5.194 1.00 0.00 O ATOM 105 H TYR A 6 -2.812 -3.875 0.347 1.00 0.00 H ATOM 106 HA TYR A 6 -1.932 -1.790 2.160 1.00 0.00 H ATOM 107 1HB TYR A 6 -1.467 -4.778 2.216 1.00 0.00 H ATOM 108 2HB TYR A 6 -0.999 -3.658 3.488 1.00 0.00 H ATOM 109 HD1 TYR A 6 -2.457 -5.679 4.556 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.021 -2.413 2.316 1.00 0.00 H ATOM 111 HE1 TYR A 6 -4.639 -5.981 5.645 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.201 -2.712 3.400 1.00 0.00 H ATOM 113 HH TYR A 6 -6.855 -3.920 5.930 1.00 0.00 H ATOM 114 N TRP A 7 -0.051 -2.485 -0.153 1.00 0.00 N ATOM 115 CA TRP A 7 1.265 -2.345 -0.782 1.00 0.00 C ATOM 116 C TRP A 7 2.288 -3.295 -0.161 1.00 0.00 C ATOM 117 O TRP A 7 1.937 -4.178 0.622 1.00 0.00 O ATOM 118 CB TRP A 7 1.758 -0.896 -0.682 1.00 0.00 C ATOM 119 CG TRP A 7 1.919 -0.400 0.724 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.743 -0.912 1.685 1.00 0.00 C ATOM 121 CD2 TRP A 7 1.238 0.707 1.326 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.616 -0.191 2.847 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.698 0.808 2.653 1.00 0.00 C ATOM 124 CE3 TRP A 7 0.284 1.624 0.873 1.00 0.00 C ATOM 125 CZ2 TRP A 7 1.237 1.787 3.529 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.173 2.595 1.745 1.00 0.00 C ATOM 127 CH2 TRP A 7 0.303 2.670 3.060 1.00 0.00 C ATOM 128 H TRP A 7 -0.843 -2.513 -0.727 1.00 0.00 H ATOM 129 HA TRP A 7 1.154 -2.601 -1.826 1.00 0.00 H ATOM 130 1HB TRP A 7 2.715 -0.814 -1.173 1.00 0.00 H ATOM 131 2HB TRP A 7 1.050 -0.251 -1.184 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.395 -1.761 1.537 1.00 0.00 H ATOM 133 HE1 TRP A 7 3.103 -0.364 3.680 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.095 1.581 -0.137 1.00 0.00 H ATOM 135 HZ2 TRP A 7 1.594 1.858 4.546 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -0.911 3.310 1.412 1.00 0.00 H ATOM 137 HH2 TRP A 7 -0.083 3.444 3.705 1.00 0.00 H ATOM 138 N TRP A 8 3.555 -3.111 -0.519 1.00 0.00 N ATOM 139 CA TRP A 8 4.627 -3.950 -0.001 1.00 0.00 C ATOM 140 C TRP A 8 5.888 -3.104 0.207 1.00 0.00 C ATOM 141 O TRP A 8 6.031 -2.439 1.233 1.00 0.00 O ATOM 142 CB TRP A 8 4.896 -5.108 -0.973 1.00 0.00 C ATOM 143 CG TRP A 8 5.964 -6.075 -0.535 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.405 -7.153 -1.248 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.665 -6.118 0.725 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.378 -7.822 -0.547 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.549 -7.216 0.667 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.654 -5.334 1.886 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.403 -7.546 1.716 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.500 -5.667 2.928 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.366 -6.762 2.835 1.00 0.00 C ATOM 152 H TRP A 8 3.774 -2.395 -1.151 1.00 0.00 H ATOM 153 HA TRP A 8 4.314 -4.349 0.947 1.00 0.00 H ATOM 154 1HB TRP A 8 3.984 -5.670 -1.100 1.00 0.00 H ATOM 155 2HB TRP A 8 5.187 -4.701 -1.930 1.00 0.00 H ATOM 156 HD1 TRP A 8 6.059 -7.408 -2.239 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.863 -8.613 -0.863 1.00 0.00 H ATOM 158 HE3 TRP A 8 5.993 -4.490 1.986 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.078 -8.387 1.662 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.501 -5.073 3.829 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.009 -6.985 3.674 1.00 0.00 H ATOM 162 N ARG A 9 6.792 -3.125 -0.765 1.00 0.00 N ATOM 163 CA ARG A 9 8.027 -2.356 -0.676 1.00 0.00 C ATOM 164 C ARG A 9 7.743 -0.854 -0.611 1.00 0.00 C ATOM 165 O ARG A 9 8.261 -0.160 0.264 1.00 0.00 O ATOM 166 CB ARG A 9 8.939 -2.668 -1.865 1.00 0.00 C ATOM 167 CG ARG A 9 9.338 -4.133 -1.955 1.00 0.00 C ATOM 168 CD ARG A 9 10.091 -4.584 -0.714 1.00 0.00 C ATOM 169 NE ARG A 9 10.480 -5.989 -0.790 1.00 0.00 N ATOM 170 CZ ARG A 9 11.148 -6.627 0.168 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.508 -5.987 1.274 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.459 -7.907 0.021 1.00 0.00 N ATOM 173 H ARG A 9 6.626 -3.667 -1.559 1.00 0.00 H ATOM 174 HA ARG A 9 8.531 -2.649 0.233 1.00 0.00 H ATOM 175 1HB ARG A 9 8.429 -2.401 -2.778 1.00 0.00 H ATOM 176 2HB ARG A 9 9.838 -2.077 -1.780 1.00 0.00 H ATOM 177 1HG ARG A 9 8.447 -4.733 -2.062 1.00 0.00 H ATOM 178 2HG ARG A 9 9.971 -4.270 -2.820 1.00 0.00 H ATOM 179 1HD ARG A 9 10.979 -3.980 -0.608 1.00 0.00 H ATOM 180 2HD ARG A 9 9.455 -4.441 0.148 1.00 0.00 H ATOM 181 HE ARG A 9 10.228 -6.485 -1.597 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.277 -5.021 1.392 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.010 -6.471 1.991 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.191 -8.394 -0.811 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.961 -8.387 0.740 1.00 0.00 H ATOM 186 N PRO A 10 6.914 -0.323 -1.532 1.00 0.00 N ATOM 187 CA PRO A 10 6.579 1.104 -1.553 1.00 0.00 C ATOM 188 C PRO A 10 5.618 1.489 -0.434 1.00 0.00 C ATOM 189 O PRO A 10 4.402 1.494 -0.620 1.00 0.00 O ATOM 190 CB PRO A 10 5.914 1.290 -2.916 1.00 0.00 C ATOM 191 CG PRO A 10 5.318 -0.038 -3.226 1.00 0.00 C ATOM 192 CD PRO A 10 6.241 -1.062 -2.621 1.00 0.00 C ATOM 193 HA PRO A 10 7.465 1.719 -1.493 1.00 0.00 H ATOM 194 1HB PRO A 10 5.158 2.059 -2.850 1.00 0.00 H ATOM 195 2HB PRO A 10 6.658 1.569 -3.648 1.00 0.00 H ATOM 196 1HG PRO A 10 4.336 -0.111 -2.783 1.00 0.00 H ATOM 197 2HG PRO A 10 5.259 -0.174 -4.296 1.00 0.00 H ATOM 198 1HD PRO A 10 5.673 -1.893 -2.232 1.00 0.00 H ATOM 199 2HD PRO A 10 6.955 -1.403 -3.355 1.00 0.00 H ATOM 200 N SER A 11 6.173 1.811 0.730 1.00 0.00 N ATOM 201 CA SER A 11 5.365 2.198 1.881 1.00 0.00 C ATOM 202 C SER A 11 5.057 3.694 1.863 1.00 0.00 C ATOM 203 O SER A 11 4.134 4.154 2.535 1.00 0.00 O ATOM 204 CB SER A 11 6.083 1.829 3.180 1.00 0.00 C ATOM 205 OG SER A 11 6.321 0.434 3.254 1.00 0.00 O ATOM 206 H SER A 11 7.148 1.788 0.817 1.00 0.00 H ATOM 207 HA SER A 11 4.435 1.653 1.829 1.00 0.00 H ATOM 208 1HB SER A 11 7.030 2.345 3.225 1.00 0.00 H ATOM 209 2HB SER A 11 5.474 2.123 4.022 1.00 0.00 H ATOM 210 HG SER A 11 7.150 0.274 3.710 1.00 0.00 H ATOM 211 N ILE A 12 5.835 4.448 1.092 1.00 0.00 N ATOM 212 CA ILE A 12 5.642 5.890 0.991 1.00 0.00 C ATOM 213 C ILE A 12 5.882 6.567 2.337 1.00 0.00 C ATOM 214 O ILE A 12 5.697 5.899 3.376 1.00 0.00 O ATOM 215 CB ILE A 12 4.221 6.233 0.494 1.00 0.00 C ATOM 216 CG1 ILE A 12 3.980 5.617 -0.885 1.00 0.00 C ATOM 217 CG2 ILE A 12 4.020 7.742 0.441 1.00 0.00 C ATOM 218 CD1 ILE A 12 4.946 6.103 -1.944 1.00 0.00 C ATOM 219 OXT ILE A 12 6.253 7.760 2.341 1.00 0.00 O ATOM 220 H ILE A 12 6.555 4.027 0.581 1.00 0.00 H ATOM 221 HA ILE A 12 6.355 6.271 0.274 1.00 0.00 H ATOM 222 HB ILE A 12 3.509 5.823 1.193 1.00 0.00 H ATOM 223 1HG1 ILE A 12 4.078 4.544 -0.816 1.00 0.00 H ATOM 224 2HG1 ILE A 12 2.979 5.862 -1.212 1.00 0.00 H ATOM 225 1HG2 ILE A 12 4.191 8.162 1.423 1.00 0.00 H ATOM 226 2HG2 ILE A 12 3.010 7.960 0.128 1.00 0.00 H ATOM 227 3HG2 ILE A 12 4.717 8.174 -0.262 1.00 0.00 H ATOM 228 1HD1 ILE A 12 5.505 5.265 -2.333 1.00 0.00 H ATOM 229 2HD1 ILE A 12 5.627 6.818 -1.507 1.00 0.00 H ATOM 230 3HD1 ILE A 12 4.396 6.573 -2.745 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 14 ATOM 1 N HIS A 1 -4.421 4.246 7.405 1.00 0.00 N ATOM 2 CA HIS A 1 -3.694 3.957 6.142 1.00 0.00 C ATOM 3 C HIS A 1 -4.531 3.081 5.212 1.00 0.00 C ATOM 4 O HIS A 1 -5.422 2.360 5.661 1.00 0.00 O ATOM 5 CB HIS A 1 -2.380 3.253 6.486 1.00 0.00 C ATOM 6 CG HIS A 1 -1.476 4.066 7.361 1.00 0.00 C ATOM 7 ND1 HIS A 1 -0.985 5.301 6.994 1.00 0.00 N ATOM 8 CD2 HIS A 1 -0.973 3.813 8.593 1.00 0.00 C ATOM 9 CE1 HIS A 1 -0.218 5.773 7.961 1.00 0.00 C ATOM 10 NE2 HIS A 1 -0.195 4.890 8.941 1.00 0.00 N ATOM 11 1H HIS A 1 -4.356 3.402 8.009 1.00 0.00 H ATOM 12 2H HIS A 1 -5.410 4.458 7.160 1.00 0.00 H ATOM 13 3H HIS A 1 -3.962 5.063 7.855 1.00 0.00 H ATOM 14 HA HIS A 1 -3.478 4.891 5.647 1.00 0.00 H ATOM 15 1HB HIS A 1 -2.599 2.331 7.003 1.00 0.00 H ATOM 16 2HB HIS A 1 -1.848 3.031 5.573 1.00 0.00 H ATOM 17 HD1 HIS A 1 -1.171 5.765 6.150 1.00 0.00 H ATOM 18 HD2 HIS A 1 -1.151 2.930 9.189 1.00 0.00 H ATOM 19 HE1 HIS A 1 0.301 6.719 7.951 1.00 0.00 H ATOM 20 HE2 HIS A 1 0.230 5.026 9.815 1.00 0.00 H ATOM 21 N PRO A 2 -4.253 3.131 3.898 1.00 0.00 N ATOM 22 CA PRO A 2 -4.985 2.339 2.906 1.00 0.00 C ATOM 23 C PRO A 2 -4.670 0.850 3.007 1.00 0.00 C ATOM 24 O PRO A 2 -3.612 0.399 2.569 1.00 0.00 O ATOM 25 CB PRO A 2 -4.497 2.900 1.569 1.00 0.00 C ATOM 26 CG PRO A 2 -3.146 3.455 1.863 1.00 0.00 C ATOM 27 CD PRO A 2 -3.205 3.964 3.277 1.00 0.00 C ATOM 28 HA PRO A 2 -6.053 2.485 2.992 1.00 0.00 H ATOM 29 1HB PRO A 2 -4.448 2.105 0.839 1.00 0.00 H ATOM 30 2HB PRO A 2 -5.173 3.669 1.229 1.00 0.00 H ATOM 31 1HG PRO A 2 -2.402 2.676 1.776 1.00 0.00 H ATOM 32 2HG PRO A 2 -2.924 4.263 1.183 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.256 3.818 3.771 1.00 0.00 H ATOM 34 2HD PRO A 2 -3.483 5.007 3.292 1.00 0.00 H ATOM 35 N LEU A 3 -5.593 0.093 3.588 1.00 0.00 N ATOM 36 CA LEU A 3 -5.414 -1.345 3.748 1.00 0.00 C ATOM 37 C LEU A 3 -6.173 -2.127 2.677 1.00 0.00 C ATOM 38 O LEU A 3 -6.398 -3.330 2.818 1.00 0.00 O ATOM 39 CB LEU A 3 -5.850 -1.777 5.154 1.00 0.00 C ATOM 40 CG LEU A 3 -7.306 -1.472 5.526 1.00 0.00 C ATOM 41 CD1 LEU A 3 -8.280 -2.177 4.592 1.00 0.00 C ATOM 42 CD2 LEU A 3 -7.577 -1.861 6.971 1.00 0.00 C ATOM 43 H LEU A 3 -6.416 0.512 3.918 1.00 0.00 H ATOM 44 HA LEU A 3 -4.363 -1.551 3.638 1.00 0.00 H ATOM 45 1HB LEU A 3 -5.697 -2.842 5.241 1.00 0.00 H ATOM 46 2HB LEU A 3 -5.211 -1.281 5.870 1.00 0.00 H ATOM 47 HG LEU A 3 -7.471 -0.410 5.431 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.370 -1.617 3.674 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -9.247 -2.245 5.068 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.916 -3.170 4.375 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -7.703 -2.931 7.038 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -8.476 -1.370 7.313 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -6.745 -1.557 7.587 1.00 0.00 H ATOM 54 N LYS A 4 -6.562 -1.442 1.605 1.00 0.00 N ATOM 55 CA LYS A 4 -7.294 -2.079 0.516 1.00 0.00 C ATOM 56 C LYS A 4 -6.400 -2.289 -0.706 1.00 0.00 C ATOM 57 O LYS A 4 -6.730 -3.069 -1.599 1.00 0.00 O ATOM 58 CB LYS A 4 -8.508 -1.232 0.131 1.00 0.00 C ATOM 59 CG LYS A 4 -9.334 -1.823 -0.999 1.00 0.00 C ATOM 60 CD LYS A 4 -10.524 -0.939 -1.338 1.00 0.00 C ATOM 61 CE LYS A 4 -11.353 -1.529 -2.468 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.520 -0.669 -2.809 1.00 0.00 N ATOM 63 H LYS A 4 -6.353 -0.487 1.544 1.00 0.00 H ATOM 64 HA LYS A 4 -7.634 -3.041 0.865 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.145 -1.124 0.996 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.167 -0.253 -0.175 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.711 -1.923 -1.875 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.695 -2.796 -0.697 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.149 -0.840 -0.462 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.164 0.033 -1.638 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.727 -1.632 -3.342 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.709 -2.503 -2.166 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.815 -0.121 -1.975 1.00 0.00 H ATOM 74 2HZ LYS A 4 -13.319 -1.258 -3.122 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.269 -0.011 -3.573 1.00 0.00 H ATOM 76 N GLN A 5 -5.271 -1.588 -0.740 1.00 0.00 N ATOM 77 CA GLN A 5 -4.336 -1.699 -1.856 1.00 0.00 C ATOM 78 C GLN A 5 -3.278 -2.767 -1.589 1.00 0.00 C ATOM 79 O GLN A 5 -2.643 -3.268 -2.516 1.00 0.00 O ATOM 80 CB GLN A 5 -3.663 -0.351 -2.117 1.00 0.00 C ATOM 81 CG GLN A 5 -2.670 -0.377 -3.269 1.00 0.00 C ATOM 82 CD GLN A 5 -2.018 0.971 -3.506 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.693 1.960 -3.788 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.695 1.016 -3.392 1.00 0.00 N ATOM 85 H GLN A 5 -5.061 -0.981 -0.002 1.00 0.00 H ATOM 86 HA GLN A 5 -4.901 -1.984 -2.729 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.424 0.380 -2.345 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.138 -0.045 -1.225 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.899 -1.098 -3.046 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.190 -0.672 -4.169 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.222 0.188 -3.165 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.246 1.874 -3.540 1.00 0.00 H ATOM 93 N TYR A 6 -3.092 -3.111 -0.320 1.00 0.00 N ATOM 94 CA TYR A 6 -2.108 -4.117 0.062 1.00 0.00 C ATOM 95 C TYR A 6 -0.706 -3.691 -0.365 1.00 0.00 C ATOM 96 O TYR A 6 -0.164 -4.200 -1.347 1.00 0.00 O ATOM 97 CB TYR A 6 -2.457 -5.471 -0.564 1.00 0.00 C ATOM 98 CG TYR A 6 -3.809 -6.025 -0.154 1.00 0.00 C ATOM 99 CD1 TYR A 6 -4.253 -7.245 -0.653 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.641 -5.339 0.728 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.481 -7.764 -0.287 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.870 -5.854 1.096 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.284 -7.064 0.586 1.00 0.00 C ATOM 104 OH TYR A 6 -7.507 -7.579 0.952 1.00 0.00 O ATOM 105 H TYR A 6 -3.626 -2.676 0.376 1.00 0.00 H ATOM 106 HA TYR A 6 -2.130 -4.211 1.138 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.458 -5.370 -1.638 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.705 -6.192 -0.280 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.621 -7.791 -1.339 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.316 -4.391 1.128 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.804 -8.714 -0.687 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.500 -5.306 1.781 1.00 0.00 H ATOM 113 HH TYR A 6 -7.419 -8.057 1.780 1.00 0.00 H ATOM 114 N TRP A 7 -0.127 -2.753 0.376 1.00 0.00 N ATOM 115 CA TRP A 7 1.210 -2.255 0.074 1.00 0.00 C ATOM 116 C TRP A 7 2.272 -3.289 0.434 1.00 0.00 C ATOM 117 O TRP A 7 1.954 -4.402 0.852 1.00 0.00 O ATOM 118 CB TRP A 7 1.473 -0.956 0.838 1.00 0.00 C ATOM 119 CG TRP A 7 1.390 -1.115 2.324 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.152 -1.936 3.106 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.491 -0.438 3.211 1.00 0.00 C ATOM 122 NE1 TRP A 7 1.784 -1.810 4.423 1.00 0.00 N ATOM 123 CE2 TRP A 7 0.766 -0.897 4.514 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.519 0.511 3.030 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.068 -0.438 5.627 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -1.211 0.966 4.138 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.915 0.492 5.421 1.00 0.00 C ATOM 128 H TRP A 7 -0.612 -2.385 1.144 1.00 0.00 H ATOM 129 HA TRP A 7 1.259 -2.057 -0.986 1.00 0.00 H ATOM 130 1HB TRP A 7 2.463 -0.597 0.595 1.00 0.00 H ATOM 131 2HB TRP A 7 0.745 -0.216 0.539 1.00 0.00 H ATOM 132 HD1 TRP A 7 2.929 -2.584 2.729 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.184 -2.294 5.175 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.761 0.889 2.049 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.285 -0.793 6.624 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.995 1.699 4.017 1.00 0.00 H ATOM 137 HH2 TRP A 7 -1.482 0.873 6.257 1.00 0.00 H ATOM 138 N TRP A 8 3.536 -2.908 0.273 1.00 0.00 N ATOM 139 CA TRP A 8 4.648 -3.797 0.585 1.00 0.00 C ATOM 140 C TRP A 8 5.904 -2.948 0.823 1.00 0.00 C ATOM 141 O TRP A 8 6.101 -2.416 1.916 1.00 0.00 O ATOM 142 CB TRP A 8 4.858 -4.787 -0.568 1.00 0.00 C ATOM 143 CG TRP A 8 5.944 -5.802 -0.342 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.350 -6.754 -1.233 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.688 -6.047 0.867 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.341 -7.528 -0.685 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.560 -7.124 0.604 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.724 -5.456 2.138 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.447 -7.618 1.556 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.603 -5.953 3.082 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.453 -7.023 2.786 1.00 0.00 C ATOM 152 H TRP A 8 3.724 -2.006 -0.060 1.00 0.00 H ATOM 153 HA TRP A 8 4.411 -4.337 1.484 1.00 0.00 H ATOM 154 1HB TRP A 8 3.938 -5.327 -0.731 1.00 0.00 H ATOM 155 2HB TRP A 8 5.100 -4.234 -1.464 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.966 -6.846 -2.239 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.809 -8.260 -1.140 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.076 -4.634 2.392 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.111 -8.443 1.344 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.638 -5.511 4.067 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.122 -7.378 3.556 1.00 0.00 H ATOM 162 N ARG A 9 6.733 -2.800 -0.207 1.00 0.00 N ATOM 163 CA ARG A 9 7.945 -1.988 -0.111 1.00 0.00 C ATOM 164 C ARG A 9 7.690 -0.545 -0.554 1.00 0.00 C ATOM 165 O ARG A 9 8.069 0.396 0.143 1.00 0.00 O ATOM 166 CB ARG A 9 9.082 -2.597 -0.938 1.00 0.00 C ATOM 167 CG ARG A 9 9.507 -3.982 -0.483 1.00 0.00 C ATOM 168 CD ARG A 9 10.015 -3.952 0.950 1.00 0.00 C ATOM 169 NE ARG A 9 10.444 -5.268 1.415 1.00 0.00 N ATOM 170 CZ ARG A 9 10.934 -5.498 2.632 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.064 -4.504 3.503 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.298 -6.725 2.979 1.00 0.00 N ATOM 173 H ARG A 9 6.518 -3.230 -1.054 1.00 0.00 H ATOM 174 HA ARG A 9 8.243 -1.975 0.927 1.00 0.00 H ATOM 175 1HB ARG A 9 8.768 -2.665 -1.968 1.00 0.00 H ATOM 176 2HB ARG A 9 9.941 -1.945 -0.878 1.00 0.00 H ATOM 177 1HG ARG A 9 8.658 -4.647 -0.542 1.00 0.00 H ATOM 178 2HG ARG A 9 10.295 -4.340 -1.129 1.00 0.00 H ATOM 179 1HD ARG A 9 10.852 -3.273 1.006 1.00 0.00 H ATOM 180 2HD ARG A 9 9.221 -3.595 1.592 1.00 0.00 H ATOM 181 HE ARG A 9 10.361 -6.019 0.791 1.00 0.00 H ATOM 182 1HH1 ARG A 9 10.792 -3.576 3.248 1.00 0.00 H ATOM 183 2HH1 ARG A 9 11.432 -4.684 4.415 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.203 -7.478 2.327 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.665 -6.898 3.892 1.00 0.00 H ATOM 186 N PRO A 10 7.045 -0.341 -1.721 1.00 0.00 N ATOM 187 CA PRO A 10 6.755 0.997 -2.233 1.00 0.00 C ATOM 188 C PRO A 10 5.459 1.567 -1.669 1.00 0.00 C ATOM 189 O PRO A 10 4.384 1.367 -2.234 1.00 0.00 O ATOM 190 CB PRO A 10 6.625 0.755 -3.733 1.00 0.00 C ATOM 191 CG PRO A 10 6.054 -0.618 -3.840 1.00 0.00 C ATOM 192 CD PRO A 10 6.548 -1.388 -2.637 1.00 0.00 C ATOM 193 HA PRO A 10 7.568 1.682 -2.043 1.00 0.00 H ATOM 194 1HB PRO A 10 5.966 1.494 -4.164 1.00 0.00 H ATOM 195 2HB PRO A 10 7.598 0.815 -4.198 1.00 0.00 H ATOM 196 1HG PRO A 10 4.976 -0.567 -3.832 1.00 0.00 H ATOM 197 2HG PRO A 10 6.399 -1.087 -4.749 1.00 0.00 H ATOM 198 1HD PRO A 10 5.735 -1.937 -2.187 1.00 0.00 H ATOM 199 2HD PRO A 10 7.342 -2.059 -2.924 1.00 0.00 H ATOM 200 N SER A 11 5.567 2.278 -0.552 1.00 0.00 N ATOM 201 CA SER A 11 4.402 2.878 0.088 1.00 0.00 C ATOM 202 C SER A 11 3.994 4.165 -0.624 1.00 0.00 C ATOM 203 O SER A 11 4.095 5.257 -0.063 1.00 0.00 O ATOM 204 CB SER A 11 4.694 3.163 1.562 1.00 0.00 C ATOM 205 OG SER A 11 5.016 1.972 2.259 1.00 0.00 O ATOM 206 H SER A 11 6.451 2.403 -0.148 1.00 0.00 H ATOM 207 HA SER A 11 3.588 2.171 0.021 1.00 0.00 H ATOM 208 1HB SER A 11 5.527 3.845 1.637 1.00 0.00 H ATOM 209 2HB SER A 11 3.822 3.608 2.020 1.00 0.00 H ATOM 210 HG SER A 11 5.621 1.445 1.731 1.00 0.00 H ATOM 211 N ILE A 12 3.533 4.029 -1.863 1.00 0.00 N ATOM 212 CA ILE A 12 3.109 5.179 -2.654 1.00 0.00 C ATOM 213 C ILE A 12 1.611 5.120 -2.943 1.00 0.00 C ATOM 214 O ILE A 12 0.903 6.087 -2.593 1.00 0.00 O ATOM 215 CB ILE A 12 3.883 5.258 -3.986 1.00 0.00 C ATOM 216 CG1 ILE A 12 5.384 5.382 -3.720 1.00 0.00 C ATOM 217 CG2 ILE A 12 3.393 6.432 -4.825 1.00 0.00 C ATOM 218 CD1 ILE A 12 5.756 6.612 -2.920 1.00 0.00 C ATOM 219 OXT ILE A 12 1.161 4.106 -3.517 1.00 0.00 O ATOM 220 H ILE A 12 3.476 3.133 -2.256 1.00 0.00 H ATOM 221 HA ILE A 12 3.320 6.073 -2.084 1.00 0.00 H ATOM 222 HB ILE A 12 3.697 4.350 -4.540 1.00 0.00 H ATOM 223 1HG1 ILE A 12 5.719 4.517 -3.170 1.00 0.00 H ATOM 224 2HG1 ILE A 12 5.909 5.429 -4.664 1.00 0.00 H ATOM 225 1HG2 ILE A 12 4.222 6.850 -5.377 1.00 0.00 H ATOM 226 2HG2 ILE A 12 2.975 7.188 -4.176 1.00 0.00 H ATOM 227 3HG2 ILE A 12 2.637 6.090 -5.516 1.00 0.00 H ATOM 228 1HD1 ILE A 12 6.175 6.311 -1.971 1.00 0.00 H ATOM 229 2HD1 ILE A 12 4.874 7.212 -2.750 1.00 0.00 H ATOM 230 3HD1 ILE A 12 6.485 7.191 -3.467 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 15 ATOM 1 N HIS A 1 -5.051 6.104 -2.107 1.00 0.00 N ATOM 2 CA HIS A 1 -4.623 5.613 -0.770 1.00 0.00 C ATOM 3 C HIS A 1 -4.770 4.097 -0.665 1.00 0.00 C ATOM 4 O HIS A 1 -5.640 3.504 -1.304 1.00 0.00 O ATOM 5 CB HIS A 1 -5.476 6.301 0.298 1.00 0.00 C ATOM 6 CG HIS A 1 -5.350 7.793 0.296 1.00 0.00 C ATOM 7 ND1 HIS A 1 -4.154 8.448 0.501 1.00 0.00 N ATOM 8 CD2 HIS A 1 -6.279 8.761 0.109 1.00 0.00 C ATOM 9 CE1 HIS A 1 -4.352 9.752 0.443 1.00 0.00 C ATOM 10 NE2 HIS A 1 -5.634 9.969 0.205 1.00 0.00 N ATOM 11 1H HIS A 1 -4.729 7.088 -2.200 1.00 0.00 H ATOM 12 2H HIS A 1 -6.089 6.043 -2.149 1.00 0.00 H ATOM 13 3H HIS A 1 -4.609 5.497 -2.825 1.00 0.00 H ATOM 14 HA HIS A 1 -3.587 5.878 -0.623 1.00 0.00 H ATOM 15 1HB HIS A 1 -6.513 6.056 0.133 1.00 0.00 H ATOM 16 2HB HIS A 1 -5.177 5.943 1.272 1.00 0.00 H ATOM 17 HD1 HIS A 1 -3.288 8.020 0.668 1.00 0.00 H ATOM 18 HD2 HIS A 1 -7.332 8.610 -0.081 1.00 0.00 H ATOM 19 HE1 HIS A 1 -3.596 10.513 0.567 1.00 0.00 H ATOM 20 HE2 HIS A 1 -6.032 10.843 0.015 1.00 0.00 H ATOM 21 N PRO A 2 -3.916 3.449 0.144 1.00 0.00 N ATOM 22 CA PRO A 2 -3.952 1.995 0.331 1.00 0.00 C ATOM 23 C PRO A 2 -5.104 1.554 1.225 1.00 0.00 C ATOM 24 O PRO A 2 -5.001 1.596 2.451 1.00 0.00 O ATOM 25 CB PRO A 2 -2.612 1.700 1.003 1.00 0.00 C ATOM 26 CG PRO A 2 -2.295 2.944 1.759 1.00 0.00 C ATOM 27 CD PRO A 2 -2.846 4.082 0.942 1.00 0.00 C ATOM 28 HA PRO A 2 -4.008 1.475 -0.614 1.00 0.00 H ATOM 29 1HB PRO A 2 -2.715 0.850 1.662 1.00 0.00 H ATOM 30 2HB PRO A 2 -1.865 1.494 0.251 1.00 0.00 H ATOM 31 1HG PRO A 2 -2.770 2.915 2.730 1.00 0.00 H ATOM 32 2HG PRO A 2 -1.226 3.045 1.867 1.00 0.00 H ATOM 33 1HD PRO A 2 -3.250 4.848 1.587 1.00 0.00 H ATOM 34 2HD PRO A 2 -2.080 4.492 0.301 1.00 0.00 H ATOM 35 N LEU A 3 -6.203 1.133 0.606 1.00 0.00 N ATOM 36 CA LEU A 3 -7.374 0.686 1.352 1.00 0.00 C ATOM 37 C LEU A 3 -7.680 -0.789 1.098 1.00 0.00 C ATOM 38 O LEU A 3 -8.419 -1.416 1.858 1.00 0.00 O ATOM 39 CB LEU A 3 -8.586 1.564 1.011 1.00 0.00 C ATOM 40 CG LEU A 3 -9.000 1.593 -0.465 1.00 0.00 C ATOM 41 CD1 LEU A 3 -9.389 0.210 -0.966 1.00 0.00 C ATOM 42 CD2 LEU A 3 -10.143 2.575 -0.675 1.00 0.00 C ATOM 43 H LEU A 3 -6.226 1.124 -0.373 1.00 0.00 H ATOM 44 HA LEU A 3 -7.151 0.807 2.398 1.00 0.00 H ATOM 45 1HB LEU A 3 -9.427 1.212 1.588 1.00 0.00 H ATOM 46 2HB LEU A 3 -8.362 2.576 1.316 1.00 0.00 H ATOM 47 HG LEU A 3 -8.160 1.931 -1.052 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.529 -0.266 -1.413 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -10.171 0.301 -1.704 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -9.742 -0.388 -0.139 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -9.742 3.568 -0.813 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -10.790 2.564 0.189 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -10.707 2.289 -1.551 1.00 0.00 H ATOM 54 N LYS A 4 -7.116 -1.341 0.027 1.00 0.00 N ATOM 55 CA LYS A 4 -7.345 -2.743 -0.313 1.00 0.00 C ATOM 56 C LYS A 4 -6.057 -3.447 -0.745 1.00 0.00 C ATOM 57 O LYS A 4 -6.011 -4.675 -0.812 1.00 0.00 O ATOM 58 CB LYS A 4 -8.392 -2.848 -1.424 1.00 0.00 C ATOM 59 CG LYS A 4 -8.696 -4.279 -1.841 1.00 0.00 C ATOM 60 CD LYS A 4 -9.740 -4.326 -2.945 1.00 0.00 C ATOM 61 CE LYS A 4 -10.044 -5.755 -3.364 1.00 0.00 C ATOM 62 NZ LYS A 4 -11.066 -5.812 -4.444 1.00 0.00 N ATOM 63 H LYS A 4 -6.542 -0.796 -0.547 1.00 0.00 H ATOM 64 HA LYS A 4 -7.725 -3.234 0.568 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.311 -2.394 -1.081 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.037 -2.310 -2.290 1.00 0.00 H ATOM 67 1HG LYS A 4 -7.788 -4.739 -2.201 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.065 -4.823 -0.985 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.649 -3.865 -2.587 1.00 0.00 H ATOM 70 2HD LYS A 4 -9.370 -3.780 -3.801 1.00 0.00 H ATOM 71 1HE LYS A 4 -9.134 -6.215 -3.717 1.00 0.00 H ATOM 72 2HE LYS A 4 -10.410 -6.298 -2.504 1.00 0.00 H ATOM 73 1HZ LYS A 4 -11.078 -4.916 -4.973 1.00 0.00 H ATOM 74 2HZ LYS A 4 -12.009 -5.971 -4.036 1.00 0.00 H ATOM 75 3HZ LYS A 4 -10.849 -6.588 -5.101 1.00 0.00 H ATOM 76 N GLN A 5 -5.015 -2.675 -1.042 1.00 0.00 N ATOM 77 CA GLN A 5 -3.743 -3.250 -1.469 1.00 0.00 C ATOM 78 C GLN A 5 -2.733 -3.258 -0.327 1.00 0.00 C ATOM 79 O GLN A 5 -1.866 -4.129 -0.256 1.00 0.00 O ATOM 80 CB GLN A 5 -3.181 -2.471 -2.661 1.00 0.00 C ATOM 81 CG GLN A 5 -1.852 -3.010 -3.168 1.00 0.00 C ATOM 82 CD GLN A 5 -1.316 -2.224 -4.349 1.00 0.00 C ATOM 83 OE1 GLN A 5 -1.961 -2.137 -5.395 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.131 -1.649 -4.189 1.00 0.00 N ATOM 85 H GLN A 5 -5.101 -1.704 -0.976 1.00 0.00 H ATOM 86 HA GLN A 5 -3.928 -4.264 -1.769 1.00 0.00 H ATOM 87 1HB GLN A 5 -3.894 -2.513 -3.471 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.040 -1.441 -2.370 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.129 -2.961 -2.368 1.00 0.00 H ATOM 90 2HG GLN A 5 -1.986 -4.038 -3.469 1.00 0.00 H ATOM 91 1HE2 GLN A 5 0.326 -1.761 -3.330 1.00 0.00 H ATOM 92 2HE2 GLN A 5 0.238 -1.134 -4.938 1.00 0.00 H ATOM 93 N TYR A 6 -2.854 -2.284 0.562 1.00 0.00 N ATOM 94 CA TYR A 6 -1.954 -2.172 1.706 1.00 0.00 C ATOM 95 C TYR A 6 -0.498 -2.122 1.253 1.00 0.00 C ATOM 96 O TYR A 6 0.390 -2.619 1.943 1.00 0.00 O ATOM 97 CB TYR A 6 -2.161 -3.350 2.664 1.00 0.00 C ATOM 98 CG TYR A 6 -3.562 -3.459 3.239 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.886 -4.486 4.117 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.557 -2.540 2.913 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.155 -4.597 4.651 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.828 -2.645 3.444 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.122 -3.676 4.311 1.00 0.00 C ATOM 104 OH TYR A 6 -7.387 -3.783 4.842 1.00 0.00 O ATOM 105 H TYR A 6 -3.567 -1.624 0.445 1.00 0.00 H ATOM 106 HA TYR A 6 -2.190 -1.254 2.224 1.00 0.00 H ATOM 107 1HB TYR A 6 -1.951 -4.269 2.138 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.472 -3.253 3.491 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.127 -5.208 4.381 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.326 -1.733 2.235 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.386 -5.404 5.331 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.586 -1.923 3.178 1.00 0.00 H ATOM 113 HH TYR A 6 -7.654 -4.705 4.850 1.00 0.00 H ATOM 114 N TRP A 7 -0.269 -1.520 0.086 1.00 0.00 N ATOM 115 CA TRP A 7 1.074 -1.392 -0.486 1.00 0.00 C ATOM 116 C TRP A 7 1.867 -2.692 -0.351 1.00 0.00 C ATOM 117 O TRP A 7 1.315 -3.736 -0.005 1.00 0.00 O ATOM 118 CB TRP A 7 1.835 -0.237 0.177 1.00 0.00 C ATOM 119 CG TRP A 7 2.031 -0.405 1.654 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.698 -1.416 2.284 1.00 0.00 C ATOM 121 CD2 TRP A 7 1.558 0.469 2.685 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.664 -1.226 3.645 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.972 -0.075 3.916 1.00 0.00 C ATOM 124 CE3 TRP A 7 0.826 1.658 2.687 1.00 0.00 C ATOM 125 CZ2 TRP A 7 1.675 0.529 5.134 1.00 0.00 C ATOM 126 CZ3 TRP A 7 0.533 2.259 3.897 1.00 0.00 C ATOM 127 CH2 TRP A 7 0.957 1.693 5.106 1.00 0.00 C ATOM 128 H TRP A 7 -1.029 -1.149 -0.410 1.00 0.00 H ATOM 129 HA TRP A 7 0.959 -1.171 -1.537 1.00 0.00 H ATOM 130 1HB TRP A 7 2.810 -0.149 -0.278 1.00 0.00 H ATOM 131 2HB TRP A 7 1.288 0.680 0.016 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.174 -2.241 1.775 1.00 0.00 H ATOM 133 HE1 TRP A 7 3.072 -1.817 4.312 1.00 0.00 H ATOM 134 HE3 TRP A 7 0.491 2.109 1.764 1.00 0.00 H ATOM 135 HZ2 TRP A 7 1.996 0.107 6.075 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -0.033 3.178 3.918 1.00 0.00 H ATOM 137 HH2 TRP A 7 0.705 2.197 6.028 1.00 0.00 H ATOM 138 N TRP A 8 3.165 -2.622 -0.630 1.00 0.00 N ATOM 139 CA TRP A 8 4.032 -3.791 -0.542 1.00 0.00 C ATOM 140 C TRP A 8 5.453 -3.348 -0.183 1.00 0.00 C ATOM 141 O TRP A 8 5.768 -3.145 0.989 1.00 0.00 O ATOM 142 CB TRP A 8 4.012 -4.554 -1.873 1.00 0.00 C ATOM 143 CG TRP A 8 4.841 -5.811 -1.899 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.014 -6.632 -2.977 1.00 0.00 C ATOM 145 CD2 TRP A 8 5.536 -6.445 -0.805 1.00 0.00 C ATOM 146 NE1 TRP A 8 5.820 -7.692 -2.647 1.00 0.00 N ATOM 147 CE2 TRP A 8 6.146 -7.607 -1.321 1.00 0.00 C ATOM 148 CE3 TRP A 8 5.726 -6.139 0.550 1.00 0.00 C ATOM 149 CZ2 TRP A 8 6.922 -8.457 -0.536 1.00 0.00 C ATOM 150 CZ3 TRP A 8 6.492 -6.989 1.326 1.00 0.00 C ATOM 151 CH2 TRP A 8 7.084 -8.132 0.782 1.00 0.00 C ATOM 152 H TRP A 8 3.550 -1.764 -0.905 1.00 0.00 H ATOM 153 HA TRP A 8 3.658 -4.429 0.240 1.00 0.00 H ATOM 154 1HB TRP A 8 2.993 -4.835 -2.094 1.00 0.00 H ATOM 155 2HB TRP A 8 4.370 -3.903 -2.655 1.00 0.00 H ATOM 156 HD1 TRP A 8 4.600 -6.441 -3.957 1.00 0.00 H ATOM 157 HE1 TRP A 8 6.107 -8.401 -3.259 1.00 0.00 H ATOM 158 HE3 TRP A 8 5.275 -5.269 0.996 1.00 0.00 H ATOM 159 HZ2 TRP A 8 7.386 -9.343 -0.941 1.00 0.00 H ATOM 160 HZ3 TRP A 8 6.644 -6.767 2.373 1.00 0.00 H ATOM 161 HH2 TRP A 8 7.675 -8.766 1.427 1.00 0.00 H ATOM 162 N ARG A 9 6.304 -3.186 -1.190 1.00 0.00 N ATOM 163 CA ARG A 9 7.680 -2.758 -0.966 1.00 0.00 C ATOM 164 C ARG A 9 7.742 -1.284 -0.561 1.00 0.00 C ATOM 165 O ARG A 9 8.393 -0.938 0.425 1.00 0.00 O ATOM 166 CB ARG A 9 8.527 -2.997 -2.219 1.00 0.00 C ATOM 167 CG ARG A 9 8.589 -4.457 -2.643 1.00 0.00 C ATOM 168 CD ARG A 9 9.190 -5.328 -1.552 1.00 0.00 C ATOM 169 NE ARG A 9 9.257 -6.732 -1.948 1.00 0.00 N ATOM 170 CZ ARG A 9 9.743 -7.698 -1.173 1.00 0.00 C ATOM 171 NH1 ARG A 9 10.207 -7.417 0.038 1.00 0.00 N ATOM 172 NH2 ARG A 9 9.765 -8.950 -1.610 1.00 0.00 N ATOM 173 H ARG A 9 5.999 -3.352 -2.102 1.00 0.00 H ATOM 174 HA ARG A 9 8.078 -3.353 -0.159 1.00 0.00 H ATOM 175 1HB ARG A 9 8.113 -2.427 -3.035 1.00 0.00 H ATOM 176 2HB ARG A 9 9.534 -2.658 -2.028 1.00 0.00 H ATOM 177 1HG ARG A 9 7.589 -4.802 -2.856 1.00 0.00 H ATOM 178 2HG ARG A 9 9.196 -4.537 -3.533 1.00 0.00 H ATOM 179 1HD ARG A 9 10.189 -4.977 -1.338 1.00 0.00 H ATOM 180 2HD ARG A 9 8.581 -5.242 -0.664 1.00 0.00 H ATOM 181 HE ARG A 9 8.921 -6.969 -2.839 1.00 0.00 H ATOM 182 1HH1 ARG A 9 10.194 -6.476 0.373 1.00 0.00 H ATOM 183 2HH1 ARG A 9 10.571 -8.148 0.616 1.00 0.00 H ATOM 184 1HH2 ARG A 9 9.417 -9.168 -2.522 1.00 0.00 H ATOM 185 2HH2 ARG A 9 10.132 -9.677 -1.028 1.00 0.00 H ATOM 186 N PRO A 10 7.070 -0.389 -1.312 1.00 0.00 N ATOM 187 CA PRO A 10 7.068 1.043 -1.007 1.00 0.00 C ATOM 188 C PRO A 10 6.154 1.387 0.165 1.00 0.00 C ATOM 189 O PRO A 10 5.004 1.780 -0.027 1.00 0.00 O ATOM 190 CB PRO A 10 6.544 1.673 -2.296 1.00 0.00 C ATOM 191 CG PRO A 10 5.655 0.633 -2.883 1.00 0.00 C ATOM 192 CD PRO A 10 6.261 -0.696 -2.512 1.00 0.00 C ATOM 193 HA PRO A 10 8.065 1.407 -0.804 1.00 0.00 H ATOM 194 1HB PRO A 10 5.998 2.575 -2.063 1.00 0.00 H ATOM 195 2HB PRO A 10 7.370 1.902 -2.952 1.00 0.00 H ATOM 196 1HG PRO A 10 4.663 0.720 -2.468 1.00 0.00 H ATOM 197 2HG PRO A 10 5.623 0.742 -3.957 1.00 0.00 H ATOM 198 1HD PRO A 10 5.485 -1.410 -2.282 1.00 0.00 H ATOM 199 2HD PRO A 10 6.884 -1.060 -3.314 1.00 0.00 H ATOM 200 N SER A 11 6.674 1.235 1.379 1.00 0.00 N ATOM 201 CA SER A 11 5.904 1.528 2.582 1.00 0.00 C ATOM 202 C SER A 11 6.332 2.860 3.192 1.00 0.00 C ATOM 203 O SER A 11 7.521 3.172 3.254 1.00 0.00 O ATOM 204 CB SER A 11 6.075 0.407 3.608 1.00 0.00 C ATOM 205 OG SER A 11 5.627 -0.833 3.088 1.00 0.00 O ATOM 206 H SER A 11 7.598 0.918 1.467 1.00 0.00 H ATOM 207 HA SER A 11 4.863 1.592 2.301 1.00 0.00 H ATOM 208 1HB SER A 11 7.118 0.317 3.870 1.00 0.00 H ATOM 209 2HB SER A 11 5.501 0.640 4.493 1.00 0.00 H ATOM 210 HG SER A 11 5.418 -1.428 3.811 1.00 0.00 H ATOM 211 N ILE A 12 5.354 3.640 3.640 1.00 0.00 N ATOM 212 CA ILE A 12 5.628 4.938 4.245 1.00 0.00 C ATOM 213 C ILE A 12 6.423 4.777 5.538 1.00 0.00 C ATOM 214 O ILE A 12 6.120 3.840 6.306 1.00 0.00 O ATOM 215 CB ILE A 12 4.323 5.706 4.541 1.00 0.00 C ATOM 216 CG1 ILE A 12 3.539 5.933 3.247 1.00 0.00 C ATOM 217 CG2 ILE A 12 4.621 7.035 5.222 1.00 0.00 C ATOM 218 CD1 ILE A 12 4.298 6.736 2.213 1.00 0.00 C ATOM 219 OXT ILE A 12 7.342 5.592 5.772 1.00 0.00 O ATOM 220 H ILE A 12 4.426 3.336 3.563 1.00 0.00 H ATOM 221 HA ILE A 12 6.213 5.516 3.544 1.00 0.00 H ATOM 222 HB ILE A 12 3.726 5.110 5.214 1.00 0.00 H ATOM 223 1HG1 ILE A 12 3.294 4.977 2.809 1.00 0.00 H ATOM 224 2HG1 ILE A 12 2.626 6.464 3.476 1.00 0.00 H ATOM 225 1HG2 ILE A 12 3.901 7.773 4.901 1.00 0.00 H ATOM 226 2HG2 ILE A 12 5.616 7.360 4.954 1.00 0.00 H ATOM 227 3HG2 ILE A 12 4.559 6.913 6.293 1.00 0.00 H ATOM 228 1HD1 ILE A 12 4.747 6.065 1.496 1.00 0.00 H ATOM 229 2HD1 ILE A 12 5.072 7.311 2.702 1.00 0.00 H ATOM 230 3HD1 ILE A 12 3.618 7.403 1.706 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 16 ATOM 1 N HIS A 1 -4.104 6.398 5.326 1.00 0.00 N ATOM 2 CA HIS A 1 -3.427 5.085 5.162 1.00 0.00 C ATOM 3 C HIS A 1 -4.400 4.021 4.661 1.00 0.00 C ATOM 4 O HIS A 1 -5.102 3.391 5.452 1.00 0.00 O ATOM 5 CB HIS A 1 -2.839 4.668 6.511 1.00 0.00 C ATOM 6 CG HIS A 1 -1.836 5.638 7.054 1.00 0.00 C ATOM 7 ND1 HIS A 1 -0.673 5.968 6.391 1.00 0.00 N ATOM 8 CD2 HIS A 1 -1.826 6.352 8.205 1.00 0.00 C ATOM 9 CE1 HIS A 1 0.009 6.842 7.110 1.00 0.00 C ATOM 10 NE2 HIS A 1 -0.669 7.092 8.214 1.00 0.00 N ATOM 11 1H HIS A 1 -4.729 6.538 4.506 1.00 0.00 H ATOM 12 2H HIS A 1 -3.367 7.132 5.365 1.00 0.00 H ATOM 13 3H HIS A 1 -4.650 6.366 6.209 1.00 0.00 H ATOM 14 HA HIS A 1 -2.627 5.198 4.446 1.00 0.00 H ATOM 15 1HB HIS A 1 -3.638 4.579 7.232 1.00 0.00 H ATOM 16 2HB HIS A 1 -2.352 3.710 6.402 1.00 0.00 H ATOM 17 HD1 HIS A 1 -0.388 5.613 5.523 1.00 0.00 H ATOM 18 HD2 HIS A 1 -2.587 6.340 8.973 1.00 0.00 H ATOM 19 HE1 HIS A 1 0.959 7.280 6.839 1.00 0.00 H ATOM 20 HE2 HIS A 1 -0.430 7.766 8.885 1.00 0.00 H ATOM 21 N PRO A 2 -4.456 3.803 3.334 1.00 0.00 N ATOM 22 CA PRO A 2 -5.349 2.807 2.734 1.00 0.00 C ATOM 23 C PRO A 2 -5.277 1.460 3.446 1.00 0.00 C ATOM 24 O PRO A 2 -4.308 1.170 4.148 1.00 0.00 O ATOM 25 CB PRO A 2 -4.827 2.684 1.304 1.00 0.00 C ATOM 26 CG PRO A 2 -4.217 4.012 1.012 1.00 0.00 C ATOM 27 CD PRO A 2 -3.653 4.509 2.316 1.00 0.00 C ATOM 28 HA PRO A 2 -6.373 3.151 2.720 1.00 0.00 H ATOM 29 1HB PRO A 2 -4.095 1.892 1.252 1.00 0.00 H ATOM 30 2HB PRO A 2 -5.647 2.472 0.635 1.00 0.00 H ATOM 31 1HG PRO A 2 -3.430 3.901 0.281 1.00 0.00 H ATOM 32 2HG PRO A 2 -4.974 4.691 0.648 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.609 4.247 2.400 1.00 0.00 H ATOM 34 2HD PRO A 2 -3.783 5.578 2.399 1.00 0.00 H ATOM 35 N LEU A 3 -6.307 0.641 3.262 1.00 0.00 N ATOM 36 CA LEU A 3 -6.357 -0.674 3.890 1.00 0.00 C ATOM 37 C LEU A 3 -6.792 -1.758 2.903 1.00 0.00 C ATOM 38 O LEU A 3 -7.066 -2.890 3.299 1.00 0.00 O ATOM 39 CB LEU A 3 -7.295 -0.640 5.102 1.00 0.00 C ATOM 40 CG LEU A 3 -8.745 -0.242 4.808 1.00 0.00 C ATOM 41 CD1 LEU A 3 -9.402 -1.213 3.839 1.00 0.00 C ATOM 42 CD2 LEU A 3 -9.543 -0.155 6.100 1.00 0.00 C ATOM 43 H LEU A 3 -7.051 0.929 2.693 1.00 0.00 H ATOM 44 HA LEU A 3 -5.363 -0.906 4.233 1.00 0.00 H ATOM 45 1HB LEU A 3 -7.299 -1.622 5.551 1.00 0.00 H ATOM 46 2HB LEU A 3 -6.892 0.060 5.818 1.00 0.00 H ATOM 47 HG LEU A 3 -8.747 0.735 4.349 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -10.475 -1.162 3.951 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -9.065 -2.217 4.052 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -9.133 -0.950 2.827 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -9.125 -0.834 6.828 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -10.571 -0.423 5.905 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -9.501 0.855 6.482 1.00 0.00 H ATOM 54 N LYS A 4 -6.861 -1.407 1.621 1.00 0.00 N ATOM 55 CA LYS A 4 -7.269 -2.358 0.592 1.00 0.00 C ATOM 56 C LYS A 4 -6.259 -2.419 -0.556 1.00 0.00 C ATOM 57 O LYS A 4 -6.310 -3.328 -1.385 1.00 0.00 O ATOM 58 CB LYS A 4 -8.652 -1.988 0.052 1.00 0.00 C ATOM 59 CG LYS A 4 -9.159 -2.932 -1.028 1.00 0.00 C ATOM 60 CD LYS A 4 -10.536 -2.523 -1.525 1.00 0.00 C ATOM 61 CE LYS A 4 -11.043 -3.467 -2.603 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.392 -3.076 -3.095 1.00 0.00 N ATOM 63 H LYS A 4 -6.638 -0.490 1.361 1.00 0.00 H ATOM 64 HA LYS A 4 -7.326 -3.333 1.052 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.360 -1.997 0.869 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.609 -0.993 -0.363 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.470 -2.918 -1.858 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.215 -3.931 -0.621 1.00 0.00 H ATOM 69 1HD LYS A 4 -11.227 -2.537 -0.694 1.00 0.00 H ATOM 70 2HD LYS A 4 -10.479 -1.523 -1.930 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.350 -3.451 -3.431 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.093 -4.466 -2.195 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.422 -2.054 -3.284 1.00 0.00 H ATOM 74 2HZ LYS A 4 -13.113 -3.305 -2.381 1.00 0.00 H ATOM 75 3HZ LYS A 4 -12.615 -3.588 -3.973 1.00 0.00 H ATOM 76 N GLN A 5 -5.346 -1.453 -0.606 1.00 0.00 N ATOM 77 CA GLN A 5 -4.338 -1.412 -1.660 1.00 0.00 C ATOM 78 C GLN A 5 -3.321 -2.535 -1.492 1.00 0.00 C ATOM 79 O GLN A 5 -2.775 -3.046 -2.471 1.00 0.00 O ATOM 80 CB GLN A 5 -3.628 -0.057 -1.663 1.00 0.00 C ATOM 81 CG GLN A 5 -2.558 0.069 -2.736 1.00 0.00 C ATOM 82 CD GLN A 5 -1.871 1.420 -2.716 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.512 2.457 -2.887 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.560 1.414 -2.508 1.00 0.00 N ATOM 85 H GLN A 5 -5.349 -0.751 0.076 1.00 0.00 H ATOM 86 HA GLN A 5 -4.842 -1.545 -2.599 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.360 0.720 -1.823 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.161 0.094 -0.701 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.814 -0.697 -2.576 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.017 -0.072 -3.703 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.114 0.550 -2.380 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.090 2.274 -2.490 1.00 0.00 H ATOM 93 N TYR A 6 -3.074 -2.912 -0.247 1.00 0.00 N ATOM 94 CA TYR A 6 -2.123 -3.978 0.060 1.00 0.00 C ATOM 95 C TYR A 6 -0.758 -3.691 -0.562 1.00 0.00 C ATOM 96 O TYR A 6 -0.422 -4.230 -1.616 1.00 0.00 O ATOM 97 CB TYR A 6 -2.648 -5.325 -0.446 1.00 0.00 C ATOM 98 CG TYR A 6 -3.970 -5.757 0.164 1.00 0.00 C ATOM 99 CD1 TYR A 6 -4.562 -6.956 -0.215 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.622 -4.979 1.117 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.762 -7.366 0.333 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.822 -5.384 1.669 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.388 -6.576 1.273 1.00 0.00 C ATOM 104 OH TYR A 6 -7.583 -6.982 1.821 1.00 0.00 O ATOM 105 H TYR A 6 -3.544 -2.464 0.485 1.00 0.00 H ATOM 106 HA TYR A 6 -2.012 -4.024 1.133 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.785 -5.268 -1.514 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.917 -6.090 -0.226 1.00 0.00 H ATOM 109 HD1 TYR A 6 -4.070 -7.572 -0.954 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.178 -4.045 1.427 1.00 0.00 H ATOM 111 HE1 TYR A 6 -6.204 -8.301 0.024 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.312 -4.766 2.406 1.00 0.00 H ATOM 113 HH TYR A 6 -8.150 -6.219 1.953 1.00 0.00 H ATOM 114 N TRP A 7 0.024 -2.843 0.097 1.00 0.00 N ATOM 115 CA TRP A 7 1.351 -2.489 -0.397 1.00 0.00 C ATOM 116 C TRP A 7 2.433 -3.202 0.408 1.00 0.00 C ATOM 117 O TRP A 7 2.184 -3.680 1.515 1.00 0.00 O ATOM 118 CB TRP A 7 1.558 -0.976 -0.325 1.00 0.00 C ATOM 119 CG TRP A 7 1.447 -0.425 1.063 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.218 -0.757 2.140 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.506 0.549 1.527 1.00 0.00 C ATOM 122 NE1 TRP A 7 1.816 -0.046 3.244 1.00 0.00 N ATOM 123 CE2 TRP A 7 0.767 0.763 2.894 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.530 1.265 0.920 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.029 1.660 3.662 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -1.262 2.155 1.684 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.978 2.346 3.042 1.00 0.00 C ATOM 128 H TRP A 7 -0.297 -2.445 0.933 1.00 0.00 H ATOM 129 HA TRP A 7 1.418 -2.806 -1.426 1.00 0.00 H ATOM 130 1HB TRP A 7 2.542 -0.736 -0.701 1.00 0.00 H ATOM 131 2HB TRP A 7 0.815 -0.489 -0.940 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.024 -1.475 2.112 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.216 -0.107 4.137 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.763 1.131 -0.126 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.235 1.820 4.710 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -2.066 2.716 1.231 1.00 0.00 H ATOM 137 HH2 TRP A 7 -1.576 3.052 3.600 1.00 0.00 H ATOM 138 N TRP A 8 3.636 -3.272 -0.153 1.00 0.00 N ATOM 139 CA TRP A 8 4.751 -3.929 0.518 1.00 0.00 C ATOM 140 C TRP A 8 5.796 -2.871 0.898 1.00 0.00 C ATOM 141 O TRP A 8 5.650 -2.185 1.909 1.00 0.00 O ATOM 142 CB TRP A 8 5.353 -4.993 -0.408 1.00 0.00 C ATOM 143 CG TRP A 8 6.478 -5.792 0.192 1.00 0.00 C ATOM 144 CD1 TRP A 8 7.201 -6.759 -0.445 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.938 -5.783 1.557 1.00 0.00 C ATOM 146 NE1 TRP A 8 8.125 -7.302 0.411 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.979 -6.730 1.646 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.595 -5.058 2.707 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.670 -6.971 2.829 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.282 -5.305 3.880 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.309 -6.252 3.933 1.00 0.00 C ATOM 152 H TRP A 8 3.777 -2.874 -1.038 1.00 0.00 H ATOM 153 HA TRP A 8 4.381 -4.399 1.411 1.00 0.00 H ATOM 154 1HB TRP A 8 4.575 -5.688 -0.687 1.00 0.00 H ATOM 155 2HB TRP A 8 5.725 -4.512 -1.300 1.00 0.00 H ATOM 156 HD1 TRP A 8 7.081 -7.021 -1.485 1.00 0.00 H ATOM 157 HE1 TRP A 8 8.778 -7.996 0.179 1.00 0.00 H ATOM 158 HE3 TRP A 8 5.806 -4.325 2.693 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.466 -7.699 2.888 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.027 -4.758 4.776 1.00 0.00 H ATOM 161 HH2 TRP A 8 8.817 -6.411 4.873 1.00 0.00 H ATOM 162 N ARG A 9 6.833 -2.725 0.075 1.00 0.00 N ATOM 163 CA ARG A 9 7.876 -1.731 0.318 1.00 0.00 C ATOM 164 C ARG A 9 7.520 -0.384 -0.319 1.00 0.00 C ATOM 165 O ARG A 9 7.626 0.657 0.328 1.00 0.00 O ATOM 166 CB ARG A 9 9.229 -2.215 -0.212 1.00 0.00 C ATOM 167 CG ARG A 9 9.737 -3.488 0.446 1.00 0.00 C ATOM 168 CD ARG A 9 9.935 -3.294 1.941 1.00 0.00 C ATOM 169 NE ARG A 9 10.435 -4.503 2.590 1.00 0.00 N ATOM 170 CZ ARG A 9 10.698 -4.591 3.892 1.00 0.00 C ATOM 171 NH1 ARG A 9 10.515 -3.544 4.687 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.147 -5.731 4.401 1.00 0.00 N ATOM 173 H ARG A 9 6.889 -3.286 -0.720 1.00 0.00 H ATOM 174 HA ARG A 9 7.951 -1.593 1.387 1.00 0.00 H ATOM 175 1HB ARG A 9 9.143 -2.397 -1.271 1.00 0.00 H ATOM 176 2HB ARG A 9 9.961 -1.437 -0.051 1.00 0.00 H ATOM 177 1HG ARG A 9 9.017 -4.276 0.286 1.00 0.00 H ATOM 178 2HG ARG A 9 10.681 -3.761 -0.002 1.00 0.00 H ATOM 179 1HD ARG A 9 10.643 -2.494 2.097 1.00 0.00 H ATOM 180 2HD ARG A 9 8.987 -3.025 2.384 1.00 0.00 H ATOM 181 HE ARG A 9 10.581 -5.291 2.026 1.00 0.00 H ATOM 182 1HH1 ARG A 9 10.177 -2.682 4.309 1.00 0.00 H ATOM 183 2HH1 ARG A 9 10.715 -3.618 5.663 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.286 -6.522 3.806 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.345 -5.799 5.378 1.00 0.00 H ATOM 186 N PRO A 10 7.099 -0.378 -1.601 1.00 0.00 N ATOM 187 CA PRO A 10 6.741 0.854 -2.302 1.00 0.00 C ATOM 188 C PRO A 10 5.310 1.294 -2.015 1.00 0.00 C ATOM 189 O PRO A 10 4.365 0.808 -2.635 1.00 0.00 O ATOM 190 CB PRO A 10 6.896 0.464 -3.767 1.00 0.00 C ATOM 191 CG PRO A 10 6.537 -0.983 -3.805 1.00 0.00 C ATOM 192 CD PRO A 10 6.939 -1.561 -2.471 1.00 0.00 C ATOM 193 HA PRO A 10 7.421 1.658 -2.066 1.00 0.00 H ATOM 194 1HB PRO A 10 6.225 1.055 -4.374 1.00 0.00 H ATOM 195 2HB PRO A 10 7.915 0.625 -4.082 1.00 0.00 H ATOM 196 1HG PRO A 10 5.472 -1.090 -3.953 1.00 0.00 H ATOM 197 2HG PRO A 10 7.077 -1.471 -4.603 1.00 0.00 H ATOM 198 1HD PRO A 10 6.161 -2.210 -2.096 1.00 0.00 H ATOM 199 2HD PRO A 10 7.867 -2.102 -2.563 1.00 0.00 H ATOM 200 N SER A 11 5.160 2.220 -1.075 1.00 0.00 N ATOM 201 CA SER A 11 3.844 2.728 -0.708 1.00 0.00 C ATOM 202 C SER A 11 3.368 3.773 -1.711 1.00 0.00 C ATOM 203 O SER A 11 4.154 4.587 -2.195 1.00 0.00 O ATOM 204 CB SER A 11 3.883 3.333 0.697 1.00 0.00 C ATOM 205 OG SER A 11 4.269 2.367 1.657 1.00 0.00 O ATOM 206 H SER A 11 5.953 2.569 -0.619 1.00 0.00 H ATOM 207 HA SER A 11 3.154 1.899 -0.714 1.00 0.00 H ATOM 208 1HB SER A 11 4.593 4.146 0.717 1.00 0.00 H ATOM 209 2HB SER A 11 2.902 3.706 0.952 1.00 0.00 H ATOM 210 HG SER A 11 3.738 1.575 1.548 1.00 0.00 H ATOM 211 N ILE A 12 2.075 3.744 -2.020 1.00 0.00 N ATOM 212 CA ILE A 12 1.493 4.688 -2.967 1.00 0.00 C ATOM 213 C ILE A 12 2.088 4.501 -4.361 1.00 0.00 C ATOM 214 O ILE A 12 1.496 3.746 -5.160 1.00 0.00 O ATOM 215 CB ILE A 12 1.713 6.146 -2.511 1.00 0.00 C ATOM 216 CG1 ILE A 12 1.066 6.376 -1.145 1.00 0.00 C ATOM 217 CG2 ILE A 12 1.150 7.122 -3.536 1.00 0.00 C ATOM 218 CD1 ILE A 12 -0.428 6.130 -1.135 1.00 0.00 C ATOM 219 OXT ILE A 12 3.140 5.113 -4.641 1.00 0.00 O ATOM 220 H ILE A 12 1.498 3.071 -1.603 1.00 0.00 H ATOM 221 HA ILE A 12 0.429 4.503 -3.013 1.00 0.00 H ATOM 222 HB ILE A 12 2.775 6.320 -2.432 1.00 0.00 H ATOM 223 1HG1 ILE A 12 1.516 5.710 -0.424 1.00 0.00 H ATOM 224 2HG1 ILE A 12 1.236 7.399 -0.840 1.00 0.00 H ATOM 225 1HG2 ILE A 12 1.652 6.980 -4.481 1.00 0.00 H ATOM 226 2HG2 ILE A 12 1.307 8.134 -3.193 1.00 0.00 H ATOM 227 3HG2 ILE A 12 0.093 6.945 -3.660 1.00 0.00 H ATOM 228 1HD1 ILE A 12 -0.843 6.396 -2.095 1.00 0.00 H ATOM 229 2HD1 ILE A 12 -0.886 6.732 -0.364 1.00 0.00 H ATOM 230 3HD1 ILE A 12 -0.619 5.085 -0.936 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 17 ATOM 1 N HIS A 1 -4.116 4.413 5.687 1.00 0.00 N ATOM 2 CA HIS A 1 -5.336 4.637 4.861 1.00 0.00 C ATOM 3 C HIS A 1 -5.291 3.850 3.549 1.00 0.00 C ATOM 4 O HIS A 1 -6.268 3.197 3.184 1.00 0.00 O ATOM 5 CB HIS A 1 -5.480 6.136 4.580 1.00 0.00 C ATOM 6 CG HIS A 1 -5.612 6.967 5.819 1.00 0.00 C ATOM 7 ND1 HIS A 1 -6.636 6.804 6.728 1.00 0.00 N ATOM 8 CD2 HIS A 1 -4.843 7.973 6.298 1.00 0.00 C ATOM 9 CE1 HIS A 1 -6.493 7.675 7.711 1.00 0.00 C ATOM 10 NE2 HIS A 1 -5.412 8.394 7.475 1.00 0.00 N ATOM 11 1H HIS A 1 -3.457 5.197 5.503 1.00 0.00 H ATOM 12 2H HIS A 1 -3.704 3.500 5.403 1.00 0.00 H ATOM 13 3H HIS A 1 -4.408 4.399 6.684 1.00 0.00 H ATOM 14 HA HIS A 1 -6.191 4.306 5.432 1.00 0.00 H ATOM 15 1HB HIS A 1 -4.611 6.481 4.043 1.00 0.00 H ATOM 16 2HB HIS A 1 -6.359 6.299 3.975 1.00 0.00 H ATOM 17 HD1 HIS A 1 -7.362 6.148 6.662 1.00 0.00 H ATOM 18 HD2 HIS A 1 -3.947 8.370 5.841 1.00 0.00 H ATOM 19 HE1 HIS A 1 -7.147 7.779 8.564 1.00 0.00 H ATOM 20 HE2 HIS A 1 -5.125 9.172 7.999 1.00 0.00 H ATOM 21 N PRO A 2 -4.161 3.896 2.813 1.00 0.00 N ATOM 22 CA PRO A 2 -4.027 3.178 1.545 1.00 0.00 C ATOM 23 C PRO A 2 -3.703 1.700 1.746 1.00 0.00 C ATOM 24 O PRO A 2 -2.688 1.204 1.255 1.00 0.00 O ATOM 25 CB PRO A 2 -2.864 3.898 0.868 1.00 0.00 C ATOM 26 CG PRO A 2 -2.006 4.363 1.993 1.00 0.00 C ATOM 27 CD PRO A 2 -2.933 4.644 3.150 1.00 0.00 C ATOM 28 HA PRO A 2 -4.916 3.272 0.940 1.00 0.00 H ATOM 29 1HB PRO A 2 -2.336 3.208 0.225 1.00 0.00 H ATOM 30 2HB PRO A 2 -3.238 4.727 0.288 1.00 0.00 H ATOM 31 1HG PRO A 2 -1.301 3.590 2.259 1.00 0.00 H ATOM 32 2HG PRO A 2 -1.483 5.263 1.705 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.499 4.281 4.070 1.00 0.00 H ATOM 34 2HD PRO A 2 -3.132 5.703 3.220 1.00 0.00 H ATOM 35 N LEU A 3 -4.572 1.002 2.470 1.00 0.00 N ATOM 36 CA LEU A 3 -4.378 -0.419 2.736 1.00 0.00 C ATOM 37 C LEU A 3 -5.399 -1.277 1.989 1.00 0.00 C ATOM 38 O LEU A 3 -5.542 -2.467 2.269 1.00 0.00 O ATOM 39 CB LEU A 3 -4.441 -0.686 4.245 1.00 0.00 C ATOM 40 CG LEU A 3 -5.748 -0.288 4.938 1.00 0.00 C ATOM 41 CD1 LEU A 3 -6.935 -1.047 4.364 1.00 0.00 C ATOM 42 CD2 LEU A 3 -5.643 -0.516 6.439 1.00 0.00 C ATOM 43 H LEU A 3 -5.361 1.454 2.835 1.00 0.00 H ATOM 44 HA LEU A 3 -3.394 -0.680 2.385 1.00 0.00 H ATOM 45 1HB LEU A 3 -4.283 -1.742 4.406 1.00 0.00 H ATOM 46 2HB LEU A 3 -3.634 -0.146 4.716 1.00 0.00 H ATOM 47 HG LEU A 3 -5.920 0.764 4.773 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -6.644 -2.064 4.150 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -7.265 -0.568 3.455 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.742 -1.049 5.083 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -5.429 -1.558 6.631 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -6.578 -0.249 6.909 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -4.849 0.094 6.841 1.00 0.00 H ATOM 54 N LYS A 4 -6.104 -0.671 1.038 1.00 0.00 N ATOM 55 CA LYS A 4 -7.106 -1.388 0.256 1.00 0.00 C ATOM 56 C LYS A 4 -6.450 -2.268 -0.805 1.00 0.00 C ATOM 57 O LYS A 4 -7.071 -3.194 -1.327 1.00 0.00 O ATOM 58 CB LYS A 4 -8.068 -0.400 -0.406 1.00 0.00 C ATOM 59 CG LYS A 4 -9.148 -1.068 -1.243 1.00 0.00 C ATOM 60 CD LYS A 4 -10.075 -0.044 -1.877 1.00 0.00 C ATOM 61 CE LYS A 4 -11.155 -0.711 -2.713 1.00 0.00 C ATOM 62 NZ LYS A 4 -12.067 0.286 -3.339 1.00 0.00 N ATOM 63 H LYS A 4 -5.947 0.278 0.854 1.00 0.00 H ATOM 64 HA LYS A 4 -7.660 -2.018 0.932 1.00 0.00 H ATOM 65 1HB LYS A 4 -8.550 0.186 0.362 1.00 0.00 H ATOM 66 2HB LYS A 4 -7.503 0.259 -1.048 1.00 0.00 H ATOM 67 1HG LYS A 4 -8.678 -1.647 -2.024 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.728 -1.722 -0.608 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.545 0.535 -1.096 1.00 0.00 H ATOM 70 2HD LYS A 4 -9.492 0.609 -2.510 1.00 0.00 H ATOM 71 1HE LYS A 4 -10.681 -1.291 -3.492 1.00 0.00 H ATOM 72 2HE LYS A 4 -11.732 -1.366 -2.077 1.00 0.00 H ATOM 73 1HZ LYS A 4 -12.055 1.173 -2.794 1.00 0.00 H ATOM 74 2HZ LYS A 4 -13.040 -0.082 -3.358 1.00 0.00 H ATOM 75 3HZ LYS A 4 -11.765 0.486 -4.313 1.00 0.00 H ATOM 76 N GLN A 5 -5.193 -1.975 -1.119 1.00 0.00 N ATOM 77 CA GLN A 5 -4.452 -2.739 -2.117 1.00 0.00 C ATOM 78 C GLN A 5 -3.316 -3.537 -1.474 1.00 0.00 C ATOM 79 O GLN A 5 -2.629 -4.304 -2.147 1.00 0.00 O ATOM 80 CB GLN A 5 -3.895 -1.799 -3.190 1.00 0.00 C ATOM 81 CG GLN A 5 -3.107 -2.506 -4.281 1.00 0.00 C ATOM 82 CD GLN A 5 -2.573 -1.547 -5.328 1.00 0.00 C ATOM 83 OE1 GLN A 5 -3.338 -0.848 -5.993 1.00 0.00 O ATOM 84 NE2 GLN A 5 -1.256 -1.511 -5.481 1.00 0.00 N ATOM 85 H GLN A 5 -4.751 -1.226 -0.669 1.00 0.00 H ATOM 86 HA GLN A 5 -5.141 -3.430 -2.581 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.718 -1.275 -3.655 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.245 -1.078 -2.717 1.00 0.00 H ATOM 89 1HG GLN A 5 -2.271 -3.019 -3.830 1.00 0.00 H ATOM 90 2HG GLN A 5 -3.751 -3.224 -4.766 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.707 -2.097 -4.917 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.883 -0.901 -6.151 1.00 0.00 H ATOM 93 N TYR A 6 -3.123 -3.354 -0.167 1.00 0.00 N ATOM 94 CA TYR A 6 -2.071 -4.058 0.558 1.00 0.00 C ATOM 95 C TYR A 6 -0.693 -3.623 0.071 1.00 0.00 C ATOM 96 O TYR A 6 -0.151 -4.190 -0.878 1.00 0.00 O ATOM 97 CB TYR A 6 -2.227 -5.575 0.402 1.00 0.00 C ATOM 98 CG TYR A 6 -3.541 -6.128 0.922 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.816 -7.488 0.840 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.504 -5.301 1.497 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.007 -8.008 1.311 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.695 -5.816 1.971 1.00 0.00 C ATOM 103 CZ TYR A 6 -5.943 -7.168 1.875 1.00 0.00 C ATOM 104 OH TYR A 6 -7.129 -7.682 2.345 1.00 0.00 O ATOM 105 H TYR A 6 -3.701 -2.732 0.319 1.00 0.00 H ATOM 106 HA TYR A 6 -2.165 -3.802 1.603 1.00 0.00 H ATOM 107 1HB TYR A 6 -2.156 -5.830 -0.644 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.427 -6.065 0.937 1.00 0.00 H ATOM 109 HD1 TYR A 6 -3.082 -8.145 0.397 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.310 -4.243 1.573 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.199 -9.068 1.236 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.429 -5.158 2.412 1.00 0.00 H ATOM 113 HH TYR A 6 -7.441 -8.367 1.748 1.00 0.00 H ATOM 114 N TRP A 7 -0.132 -2.613 0.728 1.00 0.00 N ATOM 115 CA TRP A 7 1.182 -2.097 0.364 1.00 0.00 C ATOM 116 C TRP A 7 2.268 -3.139 0.616 1.00 0.00 C ATOM 117 O TRP A 7 1.981 -4.261 1.035 1.00 0.00 O ATOM 118 CB TRP A 7 1.489 -0.823 1.152 1.00 0.00 C ATOM 119 CG TRP A 7 1.493 -1.030 2.636 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.300 -1.873 3.344 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.648 -0.384 3.595 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.010 -1.790 4.684 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.000 -0.882 4.864 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.370 0.570 3.504 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.368 -0.459 6.031 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.997 0.988 4.664 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.625 0.474 5.912 1.00 0.00 C ATOM 128 H TRP A 7 -0.615 -2.202 1.475 1.00 0.00 H ATOM 129 HA TRP A 7 1.165 -1.862 -0.691 1.00 0.00 H ATOM 130 1HB TRP A 7 2.462 -0.455 0.864 1.00 0.00 H ATOM 131 2HB TRP A 7 0.743 -0.076 0.921 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.053 -2.508 2.902 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.454 -2.297 5.396 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.670 0.978 2.550 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.643 -0.845 7.001 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.786 1.723 4.612 1.00 0.00 H ATOM 137 HH2 TRP A 7 -1.142 0.830 6.791 1.00 0.00 H ATOM 138 N TRP A 8 3.514 -2.758 0.359 1.00 0.00 N ATOM 139 CA TRP A 8 4.645 -3.657 0.558 1.00 0.00 C ATOM 140 C TRP A 8 5.955 -2.878 0.389 1.00 0.00 C ATOM 141 O TRP A 8 6.407 -2.208 1.318 1.00 0.00 O ATOM 142 CB TRP A 8 4.565 -4.821 -0.438 1.00 0.00 C ATOM 143 CG TRP A 8 5.662 -5.845 -0.313 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.825 -6.943 -1.110 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.693 -5.930 0.692 1.00 0.00 C ATOM 146 NE1 TRP A 8 6.920 -7.664 -0.710 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.465 -7.073 0.397 1.00 0.00 C ATOM 148 CE3 TRP A 8 7.058 -5.149 1.799 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.567 -7.450 1.160 1.00 0.00 C ATOM 150 CZ3 TRP A 8 8.150 -5.531 2.555 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.893 -6.669 2.231 1.00 0.00 C ATOM 152 H TRP A 8 3.678 -1.851 0.027 1.00 0.00 H ATOM 153 HA TRP A 8 4.596 -4.042 1.560 1.00 0.00 H ATOM 154 1HB TRP A 8 3.626 -5.333 -0.293 1.00 0.00 H ATOM 155 2HB TRP A 8 4.591 -4.425 -1.442 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.195 -7.175 -1.956 1.00 0.00 H ATOM 157 HE1 TRP A 8 7.253 -8.479 -1.143 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.498 -4.272 2.074 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.153 -8.326 0.923 1.00 0.00 H ATOM 160 HZ3 TRP A 8 8.441 -4.940 3.412 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.739 -6.929 2.853 1.00 0.00 H ATOM 162 N ARG A 9 6.559 -2.962 -0.791 1.00 0.00 N ATOM 163 CA ARG A 9 7.807 -2.259 -1.061 1.00 0.00 C ATOM 164 C ARG A 9 7.620 -0.744 -0.967 1.00 0.00 C ATOM 165 O ARG A 9 8.328 -0.075 -0.213 1.00 0.00 O ATOM 166 CB ARG A 9 8.351 -2.642 -2.440 1.00 0.00 C ATOM 167 CG ARG A 9 8.643 -4.126 -2.588 1.00 0.00 C ATOM 168 CD ARG A 9 9.679 -4.592 -1.578 1.00 0.00 C ATOM 169 NE ARG A 9 9.970 -6.019 -1.709 1.00 0.00 N ATOM 170 CZ ARG A 9 10.841 -6.670 -0.942 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.509 -6.030 0.009 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.045 -7.967 -1.128 1.00 0.00 N ATOM 173 H ARG A 9 6.156 -3.504 -1.495 1.00 0.00 H ATOM 174 HA ARG A 9 8.521 -2.564 -0.311 1.00 0.00 H ATOM 175 1HB ARG A 9 7.627 -2.367 -3.192 1.00 0.00 H ATOM 176 2HB ARG A 9 9.265 -2.098 -2.618 1.00 0.00 H ATOM 177 1HG ARG A 9 7.730 -4.681 -2.432 1.00 0.00 H ATOM 178 2HG ARG A 9 9.015 -4.314 -3.584 1.00 0.00 H ATOM 179 1HD ARG A 9 10.591 -4.034 -1.733 1.00 0.00 H ATOM 180 2HD ARG A 9 9.305 -4.400 -0.582 1.00 0.00 H ATOM 181 HE ARG A 9 9.490 -6.516 -2.403 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.360 -5.052 0.154 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.162 -6.525 0.581 1.00 0.00 H ATOM 184 1HH2 ARG A 9 10.544 -8.456 -1.843 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.700 -8.457 -0.553 1.00 0.00 H ATOM 186 N PRO A 10 6.666 -0.172 -1.729 1.00 0.00 N ATOM 187 CA PRO A 10 6.410 1.272 -1.710 1.00 0.00 C ATOM 188 C PRO A 10 6.036 1.776 -0.321 1.00 0.00 C ATOM 189 O PRO A 10 6.852 2.384 0.372 1.00 0.00 O ATOM 190 CB PRO A 10 5.241 1.457 -2.689 1.00 0.00 C ATOM 191 CG PRO A 10 4.644 0.101 -2.853 1.00 0.00 C ATOM 192 CD PRO A 10 5.768 -0.875 -2.662 1.00 0.00 C ATOM 193 HA PRO A 10 7.261 1.822 -2.061 1.00 0.00 H ATOM 194 1HB PRO A 10 4.530 2.155 -2.274 1.00 0.00 H ATOM 195 2HB PRO A 10 5.616 1.836 -3.629 1.00 0.00 H ATOM 196 1HG PRO A 10 3.880 -0.056 -2.105 1.00 0.00 H ATOM 197 2HG PRO A 10 4.225 0.002 -3.843 1.00 0.00 H ATOM 198 1HD PRO A 10 5.398 -1.792 -2.233 1.00 0.00 H ATOM 199 2HD PRO A 10 6.261 -1.068 -3.602 1.00 0.00 H ATOM 200 N SER A 11 4.801 1.519 0.076 1.00 0.00 N ATOM 201 CA SER A 11 4.308 1.942 1.382 1.00 0.00 C ATOM 202 C SER A 11 4.350 3.461 1.513 1.00 0.00 C ATOM 203 O SER A 11 4.916 4.152 0.666 1.00 0.00 O ATOM 204 CB SER A 11 5.137 1.300 2.496 1.00 0.00 C ATOM 205 OG SER A 11 5.066 -0.115 2.434 1.00 0.00 O ATOM 206 H SER A 11 4.207 1.031 -0.525 1.00 0.00 H ATOM 207 HA SER A 11 3.284 1.612 1.472 1.00 0.00 H ATOM 208 1HB SER A 11 6.168 1.600 2.395 1.00 0.00 H ATOM 209 2HB SER A 11 4.760 1.624 3.455 1.00 0.00 H ATOM 210 HG SER A 11 4.147 -0.389 2.396 1.00 0.00 H ATOM 211 N ILE A 12 3.746 3.974 2.581 1.00 0.00 N ATOM 212 CA ILE A 12 3.715 5.411 2.823 1.00 0.00 C ATOM 213 C ILE A 12 2.961 6.134 1.708 1.00 0.00 C ATOM 214 O ILE A 12 1.757 6.409 1.892 1.00 0.00 O ATOM 215 CB ILE A 12 5.140 5.992 2.934 1.00 0.00 C ATOM 216 CG1 ILE A 12 5.895 5.326 4.086 1.00 0.00 C ATOM 217 CG2 ILE A 12 5.092 7.501 3.133 1.00 0.00 C ATOM 218 CD1 ILE A 12 5.232 5.519 5.433 1.00 0.00 C ATOM 219 OXT ILE A 12 3.582 6.419 0.664 1.00 0.00 O ATOM 220 H ILE A 12 3.313 3.372 3.220 1.00 0.00 H ATOM 221 HA ILE A 12 3.204 5.580 3.759 1.00 0.00 H ATOM 222 HB ILE A 12 5.661 5.792 2.010 1.00 0.00 H ATOM 223 1HG1 ILE A 12 5.960 4.265 3.900 1.00 0.00 H ATOM 224 2HG1 ILE A 12 6.891 5.739 4.143 1.00 0.00 H ATOM 225 1HG2 ILE A 12 5.211 7.994 2.180 1.00 0.00 H ATOM 226 2HG2 ILE A 12 5.889 7.803 3.797 1.00 0.00 H ATOM 227 3HG2 ILE A 12 4.141 7.777 3.564 1.00 0.00 H ATOM 228 1HD1 ILE A 12 4.898 4.564 5.810 1.00 0.00 H ATOM 229 2HD1 ILE A 12 4.386 6.181 5.328 1.00 0.00 H ATOM 230 3HD1 ILE A 12 5.942 5.951 6.125 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 18 ATOM 1 N HIS A 1 -7.107 5.986 3.439 1.00 0.00 N ATOM 2 CA HIS A 1 -5.743 5.406 3.551 1.00 0.00 C ATOM 3 C HIS A 1 -5.466 4.427 2.412 1.00 0.00 C ATOM 4 O HIS A 1 -6.361 3.705 1.974 1.00 0.00 O ATOM 5 CB HIS A 1 -5.626 4.693 4.900 1.00 0.00 C ATOM 6 CG HIS A 1 -5.840 5.596 6.074 1.00 0.00 C ATOM 7 ND1 HIS A 1 -5.053 6.701 6.329 1.00 0.00 N ATOM 8 CD2 HIS A 1 -6.761 5.556 7.067 1.00 0.00 C ATOM 9 CE1 HIS A 1 -5.480 7.298 7.428 1.00 0.00 C ATOM 10 NE2 HIS A 1 -6.514 6.625 7.893 1.00 0.00 N ATOM 11 1H HIS A 1 -7.154 6.810 4.071 1.00 0.00 H ATOM 12 2H HIS A 1 -7.787 5.252 3.726 1.00 0.00 H ATOM 13 3H HIS A 1 -7.252 6.266 2.449 1.00 0.00 H ATOM 14 HA HIS A 1 -5.023 6.210 3.509 1.00 0.00 H ATOM 15 1HB HIS A 1 -6.362 3.905 4.948 1.00 0.00 H ATOM 16 2HB HIS A 1 -4.638 4.262 4.986 1.00 0.00 H ATOM 17 HD1 HIS A 1 -4.294 7.000 5.786 1.00 0.00 H ATOM 18 HD2 HIS A 1 -7.543 4.820 7.186 1.00 0.00 H ATOM 19 HE1 HIS A 1 -5.054 8.188 7.869 1.00 0.00 H ATOM 20 HE2 HIS A 1 -6.978 6.812 8.736 1.00 0.00 H ATOM 21 N PRO A 2 -4.217 4.390 1.913 1.00 0.00 N ATOM 22 CA PRO A 2 -3.831 3.496 0.820 1.00 0.00 C ATOM 23 C PRO A 2 -3.602 2.063 1.293 1.00 0.00 C ATOM 24 O PRO A 2 -2.525 1.499 1.098 1.00 0.00 O ATOM 25 CB PRO A 2 -2.526 4.111 0.321 1.00 0.00 C ATOM 26 CG PRO A 2 -1.929 4.748 1.527 1.00 0.00 C ATOM 27 CD PRO A 2 -3.085 5.219 2.373 1.00 0.00 C ATOM 28 HA PRO A 2 -4.563 3.500 0.027 1.00 0.00 H ATOM 29 1HB PRO A 2 -1.888 3.334 -0.076 1.00 0.00 H ATOM 30 2HB PRO A 2 -2.737 4.838 -0.447 1.00 0.00 H ATOM 31 1HG PRO A 2 -1.339 4.025 2.070 1.00 0.00 H ATOM 32 2HG PRO A 2 -1.316 5.587 1.233 1.00 0.00 H ATOM 33 1HD PRO A 2 -2.881 5.044 3.419 1.00 0.00 H ATOM 34 2HD PRO A 2 -3.279 6.266 2.196 1.00 0.00 H ATOM 35 N LEU A 3 -4.621 1.480 1.915 1.00 0.00 N ATOM 36 CA LEU A 3 -4.530 0.112 2.415 1.00 0.00 C ATOM 37 C LEU A 3 -5.467 -0.826 1.657 1.00 0.00 C ATOM 38 O LEU A 3 -5.755 -1.932 2.116 1.00 0.00 O ATOM 39 CB LEU A 3 -4.821 0.081 3.921 1.00 0.00 C ATOM 40 CG LEU A 3 -6.195 0.610 4.348 1.00 0.00 C ATOM 41 CD1 LEU A 3 -7.323 -0.197 3.725 1.00 0.00 C ATOM 42 CD2 LEU A 3 -6.314 0.612 5.865 1.00 0.00 C ATOM 43 H LEU A 3 -5.454 1.979 2.040 1.00 0.00 H ATOM 44 HA LEU A 3 -3.518 -0.221 2.257 1.00 0.00 H ATOM 45 1HB LEU A 3 -4.735 -0.941 4.259 1.00 0.00 H ATOM 46 2HB LEU A 3 -4.066 0.669 4.421 1.00 0.00 H ATOM 47 HG LEU A 3 -6.292 1.630 4.005 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -8.226 -0.058 4.301 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -7.058 -1.245 3.721 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -7.488 0.137 2.711 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -7.326 0.865 6.146 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -5.633 1.341 6.278 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -6.068 -0.367 6.246 1.00 0.00 H ATOM 54 N LYS A 4 -5.939 -0.380 0.495 1.00 0.00 N ATOM 55 CA LYS A 4 -6.840 -1.185 -0.322 1.00 0.00 C ATOM 56 C LYS A 4 -6.087 -2.315 -1.021 1.00 0.00 C ATOM 57 O LYS A 4 -6.687 -3.300 -1.452 1.00 0.00 O ATOM 58 CB LYS A 4 -7.546 -0.306 -1.356 1.00 0.00 C ATOM 59 CG LYS A 4 -8.509 -1.070 -2.250 1.00 0.00 C ATOM 60 CD LYS A 4 -9.181 -0.151 -3.258 1.00 0.00 C ATOM 61 CE LYS A 4 -10.146 -0.912 -4.151 1.00 0.00 C ATOM 62 NZ LYS A 4 -10.808 -0.018 -5.141 1.00 0.00 N ATOM 63 H LYS A 4 -5.672 0.507 0.178 1.00 0.00 H ATOM 64 HA LYS A 4 -7.579 -1.618 0.333 1.00 0.00 H ATOM 65 1HB LYS A 4 -8.100 0.463 -0.840 1.00 0.00 H ATOM 66 2HB LYS A 4 -6.800 0.159 -1.984 1.00 0.00 H ATOM 67 1HG LYS A 4 -7.963 -1.833 -2.783 1.00 0.00 H ATOM 68 2HG LYS A 4 -9.269 -1.531 -1.634 1.00 0.00 H ATOM 69 1HD LYS A 4 -9.725 0.615 -2.725 1.00 0.00 H ATOM 70 2HD LYS A 4 -8.420 0.308 -3.873 1.00 0.00 H ATOM 71 1HE LYS A 4 -9.600 -1.677 -4.680 1.00 0.00 H ATOM 72 2HE LYS A 4 -10.903 -1.371 -3.532 1.00 0.00 H ATOM 73 1HZ LYS A 4 -10.173 0.155 -5.947 1.00 0.00 H ATOM 74 2HZ LYS A 4 -11.044 0.894 -4.699 1.00 0.00 H ATOM 75 3HZ LYS A 4 -11.683 -0.458 -5.491 1.00 0.00 H ATOM 76 N GLN A 5 -4.771 -2.166 -1.128 1.00 0.00 N ATOM 77 CA GLN A 5 -3.933 -3.173 -1.771 1.00 0.00 C ATOM 78 C GLN A 5 -2.937 -3.776 -0.778 1.00 0.00 C ATOM 79 O GLN A 5 -2.201 -4.703 -1.112 1.00 0.00 O ATOM 80 CB GLN A 5 -3.188 -2.556 -2.958 1.00 0.00 C ATOM 81 CG GLN A 5 -2.287 -3.533 -3.696 1.00 0.00 C ATOM 82 CD GLN A 5 -1.567 -2.892 -4.867 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.198 -2.389 -5.797 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.240 -2.908 -4.827 1.00 0.00 N ATOM 85 H GLN A 5 -4.352 -1.360 -0.762 1.00 0.00 H ATOM 86 HA GLN A 5 -4.579 -3.958 -2.134 1.00 0.00 H ATOM 87 1HB GLN A 5 -3.911 -2.168 -3.660 1.00 0.00 H ATOM 88 2HB GLN A 5 -2.577 -1.740 -2.598 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.548 -3.914 -3.008 1.00 0.00 H ATOM 90 2HG GLN A 5 -2.890 -4.350 -4.066 1.00 0.00 H ATOM 91 1HE2 GLN A 5 0.195 -3.326 -4.055 1.00 0.00 H ATOM 92 2HE2 GLN A 5 0.250 -2.500 -5.572 1.00 0.00 H ATOM 93 N TYR A 6 -2.921 -3.242 0.445 1.00 0.00 N ATOM 94 CA TYR A 6 -2.018 -3.722 1.492 1.00 0.00 C ATOM 95 C TYR A 6 -0.565 -3.350 1.193 1.00 0.00 C ATOM 96 O TYR A 6 0.345 -3.796 1.888 1.00 0.00 O ATOM 97 CB TYR A 6 -2.142 -5.242 1.662 1.00 0.00 C ATOM 98 CG TYR A 6 -3.531 -5.719 2.049 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.786 -7.073 2.233 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.584 -4.825 2.231 1.00 0.00 C ATOM 101 CE1 TYR A 6 -5.044 -7.522 2.585 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.844 -5.269 2.584 1.00 0.00 C ATOM 103 CZ TYR A 6 -6.069 -6.617 2.759 1.00 0.00 C ATOM 104 OH TYR A 6 -7.323 -7.062 3.110 1.00 0.00 O ATOM 105 H TYR A 6 -3.530 -2.504 0.650 1.00 0.00 H ATOM 106 HA TYR A 6 -2.310 -3.245 2.415 1.00 0.00 H ATOM 107 1HB TYR A 6 -1.877 -5.725 0.736 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.457 -5.563 2.434 1.00 0.00 H ATOM 109 HD1 TYR A 6 -2.982 -7.781 2.095 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.407 -3.769 2.094 1.00 0.00 H ATOM 111 HE1 TYR A 6 -5.221 -8.578 2.724 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.647 -4.559 2.721 1.00 0.00 H ATOM 113 HH TYR A 6 -7.499 -6.834 4.026 1.00 0.00 H ATOM 114 N TRP A 7 -0.358 -2.526 0.162 1.00 0.00 N ATOM 115 CA TRP A 7 0.980 -2.080 -0.234 1.00 0.00 C ATOM 116 C TRP A 7 2.001 -3.218 -0.152 1.00 0.00 C ATOM 117 O TRP A 7 1.634 -4.389 -0.065 1.00 0.00 O ATOM 118 CB TRP A 7 1.424 -0.899 0.638 1.00 0.00 C ATOM 119 CG TRP A 7 1.500 -1.221 2.100 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.289 -2.164 2.694 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.753 -0.601 3.153 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.082 -2.165 4.051 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.143 -1.216 4.358 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.204 0.416 3.195 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.607 -0.846 5.590 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.737 0.780 4.418 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.330 0.151 5.601 1.00 0.00 C ATOM 128 H TRP A 7 -1.129 -2.201 -0.348 1.00 0.00 H ATOM 129 HA TRP A 7 0.921 -1.748 -1.260 1.00 0.00 H ATOM 130 1HB TRP A 7 2.400 -0.569 0.319 1.00 0.00 H ATOM 131 2HB TRP A 7 0.720 -0.088 0.512 1.00 0.00 H ATOM 132 HD1 TRP A 7 2.974 -2.807 2.160 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.531 -2.751 4.695 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.531 0.913 2.293 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.910 -1.322 6.511 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.479 1.564 4.469 1.00 0.00 H ATOM 137 HH2 TRP A 7 -0.773 0.467 6.534 1.00 0.00 H ATOM 138 N TRP A 8 3.283 -2.864 -0.187 1.00 0.00 N ATOM 139 CA TRP A 8 4.352 -3.853 -0.117 1.00 0.00 C ATOM 140 C TRP A 8 5.696 -3.138 0.059 1.00 0.00 C ATOM 141 O TRP A 8 6.078 -2.794 1.178 1.00 0.00 O ATOM 142 CB TRP A 8 4.347 -4.715 -1.387 1.00 0.00 C ATOM 143 CG TRP A 8 5.385 -5.806 -1.421 1.00 0.00 C ATOM 144 CD1 TRP A 8 5.602 -6.670 -2.457 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.285 -6.215 -0.370 1.00 0.00 C ATOM 146 NE1 TRP A 8 6.615 -7.541 -2.148 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.045 -7.291 -0.873 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.543 -5.770 0.934 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.033 -7.925 -0.124 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.522 -6.404 1.675 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.258 -7.469 1.144 1.00 0.00 C ATOM 152 H TRP A 8 3.517 -1.916 -0.262 1.00 0.00 H ATOM 153 HA TRP A 8 4.176 -4.479 0.739 1.00 0.00 H ATOM 154 1HB TRP A 8 3.381 -5.187 -1.480 1.00 0.00 H ATOM 155 2HB TRP A 8 4.506 -4.078 -2.244 1.00 0.00 H ATOM 156 HD1 TRP A 8 5.070 -6.635 -3.397 1.00 0.00 H ATOM 157 HE1 TRP A 8 6.967 -8.237 -2.740 1.00 0.00 H ATOM 158 HE3 TRP A 8 5.986 -4.958 1.369 1.00 0.00 H ATOM 159 HZ2 TRP A 8 8.610 -8.747 -0.519 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.731 -6.076 2.683 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.013 -7.934 1.761 1.00 0.00 H ATOM 162 N ARG A 9 6.401 -2.907 -1.042 1.00 0.00 N ATOM 163 CA ARG A 9 7.689 -2.225 -0.992 1.00 0.00 C ATOM 164 C ARG A 9 7.513 -0.731 -0.706 1.00 0.00 C ATOM 165 O ARG A 9 8.178 -0.184 0.174 1.00 0.00 O ATOM 166 CB ARG A 9 8.455 -2.423 -2.302 1.00 0.00 C ATOM 167 CG ARG A 9 8.751 -3.880 -2.621 1.00 0.00 C ATOM 168 CD ARG A 9 9.595 -4.528 -1.536 1.00 0.00 C ATOM 169 NE ARG A 9 9.889 -5.928 -1.832 1.00 0.00 N ATOM 170 CZ ARG A 9 10.612 -6.718 -1.040 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.113 -6.250 0.097 1.00 0.00 N ATOM 172 NH2 ARG A 9 10.834 -7.979 -1.385 1.00 0.00 N ATOM 173 H ARG A 9 6.048 -3.193 -1.903 1.00 0.00 H ATOM 174 HA ARG A 9 8.260 -2.663 -0.187 1.00 0.00 H ATOM 175 1HB ARG A 9 7.874 -2.012 -3.113 1.00 0.00 H ATOM 176 2HB ARG A 9 9.395 -1.894 -2.240 1.00 0.00 H ATOM 177 1HG ARG A 9 7.818 -4.416 -2.705 1.00 0.00 H ATOM 178 2HG ARG A 9 9.283 -3.932 -3.560 1.00 0.00 H ATOM 179 1HD ARG A 9 10.526 -3.986 -1.451 1.00 0.00 H ATOM 180 2HD ARG A 9 9.061 -4.472 -0.600 1.00 0.00 H ATOM 181 HE ARG A 9 9.530 -6.300 -2.665 1.00 0.00 H ATOM 182 1HH1 ARG A 9 10.948 -5.301 0.364 1.00 0.00 H ATOM 183 2HH1 ARG A 9 11.656 -6.848 0.687 1.00 0.00 H ATOM 184 1HH2 ARG A 9 10.458 -8.336 -2.240 1.00 0.00 H ATOM 185 2HH2 ARG A 9 11.376 -8.572 -0.792 1.00 0.00 H ATOM 186 N PRO A 10 6.615 -0.045 -1.442 1.00 0.00 N ATOM 187 CA PRO A 10 6.374 1.386 -1.245 1.00 0.00 C ATOM 188 C PRO A 10 5.488 1.665 -0.035 1.00 0.00 C ATOM 189 O PRO A 10 4.281 1.872 -0.170 1.00 0.00 O ATOM 190 CB PRO A 10 5.662 1.793 -2.533 1.00 0.00 C ATOM 191 CG PRO A 10 4.925 0.568 -2.953 1.00 0.00 C ATOM 192 CD PRO A 10 5.769 -0.602 -2.519 1.00 0.00 C ATOM 193 HA PRO A 10 7.298 1.936 -1.150 1.00 0.00 H ATOM 194 1HB PRO A 10 4.988 2.613 -2.333 1.00 0.00 H ATOM 195 2HB PRO A 10 6.390 2.088 -3.273 1.00 0.00 H ATOM 196 1HG PRO A 10 3.961 0.537 -2.466 1.00 0.00 H ATOM 197 2HG PRO A 10 4.804 0.564 -4.026 1.00 0.00 H ATOM 198 1HD PRO A 10 5.140 -1.396 -2.144 1.00 0.00 H ATOM 199 2HD PRO A 10 6.372 -0.953 -3.341 1.00 0.00 H ATOM 200 N SER A 11 6.094 1.670 1.147 1.00 0.00 N ATOM 201 CA SER A 11 5.360 1.924 2.382 1.00 0.00 C ATOM 202 C SER A 11 5.042 3.409 2.528 1.00 0.00 C ATOM 203 O SER A 11 5.940 4.232 2.703 1.00 0.00 O ATOM 204 CB SER A 11 6.165 1.442 3.590 1.00 0.00 C ATOM 205 OG SER A 11 6.424 0.050 3.508 1.00 0.00 O ATOM 206 H SER A 11 7.058 1.498 1.192 1.00 0.00 H ATOM 207 HA SER A 11 4.433 1.373 2.335 1.00 0.00 H ATOM 208 1HB SER A 11 7.107 1.968 3.625 1.00 0.00 H ATOM 209 2HB SER A 11 5.608 1.640 4.494 1.00 0.00 H ATOM 210 HG SER A 11 5.625 -0.408 3.238 1.00 0.00 H ATOM 211 N ILE A 12 3.757 3.744 2.454 1.00 0.00 N ATOM 212 CA ILE A 12 3.322 5.129 2.576 1.00 0.00 C ATOM 213 C ILE A 12 3.920 5.989 1.465 1.00 0.00 C ATOM 214 O ILE A 12 4.836 5.502 0.770 1.00 0.00 O ATOM 215 CB ILE A 12 3.713 5.722 3.946 1.00 0.00 C ATOM 216 CG1 ILE A 12 3.071 4.916 5.076 1.00 0.00 C ATOM 217 CG2 ILE A 12 3.300 7.186 4.037 1.00 0.00 C ATOM 218 CD1 ILE A 12 1.559 4.898 5.019 1.00 0.00 C ATOM 219 OXT ILE A 12 3.464 7.140 1.298 1.00 0.00 O ATOM 220 H ILE A 12 3.088 3.043 2.312 1.00 0.00 H ATOM 221 HA ILE A 12 2.244 5.149 2.493 1.00 0.00 H ATOM 222 HB ILE A 12 4.787 5.671 4.042 1.00 0.00 H ATOM 223 1HG1 ILE A 12 3.417 3.895 5.023 1.00 0.00 H ATOM 224 2HG1 ILE A 12 3.363 5.342 6.025 1.00 0.00 H ATOM 225 1HG2 ILE A 12 4.110 7.811 3.690 1.00 0.00 H ATOM 226 2HG2 ILE A 12 3.069 7.432 5.063 1.00 0.00 H ATOM 227 3HG2 ILE A 12 2.427 7.351 3.422 1.00 0.00 H ATOM 228 1HD1 ILE A 12 1.211 5.727 4.422 1.00 0.00 H ATOM 229 2HD1 ILE A 12 1.160 4.983 6.019 1.00 0.00 H ATOM 230 3HD1 ILE A 12 1.226 3.970 4.576 1.00 0.00 H TER 231 ILE A 12 ENDMDL MODEL 19 ATOM 1 N HIS A 1 -5.908 7.294 -0.625 1.00 0.00 N ATOM 2 CA HIS A 1 -5.234 6.111 -0.031 1.00 0.00 C ATOM 3 C HIS A 1 -6.187 4.922 0.067 1.00 0.00 C ATOM 4 O HIS A 1 -6.935 4.795 1.037 1.00 0.00 O ATOM 5 CB HIS A 1 -4.721 6.492 1.360 1.00 0.00 C ATOM 6 CG HIS A 1 -3.740 7.623 1.346 1.00 0.00 C ATOM 7 ND1 HIS A 1 -2.541 7.573 0.665 1.00 0.00 N ATOM 8 CD2 HIS A 1 -3.786 8.843 1.932 1.00 0.00 C ATOM 9 CE1 HIS A 1 -1.892 8.712 0.835 1.00 0.00 C ATOM 10 NE2 HIS A 1 -2.626 9.500 1.599 1.00 0.00 N ATOM 11 1H HIS A 1 -5.182 8.017 -0.804 1.00 0.00 H ATOM 12 2H HIS A 1 -6.615 7.632 0.059 1.00 0.00 H ATOM 13 3H HIS A 1 -6.358 6.990 -1.511 1.00 0.00 H ATOM 14 HA HIS A 1 -4.396 5.842 -0.656 1.00 0.00 H ATOM 15 1HB HIS A 1 -5.556 6.786 1.977 1.00 0.00 H ATOM 16 2HB HIS A 1 -4.235 5.635 1.804 1.00 0.00 H ATOM 17 HD1 HIS A 1 -2.214 6.814 0.139 1.00 0.00 H ATOM 18 HD2 HIS A 1 -4.586 9.228 2.549 1.00 0.00 H ATOM 19 HE1 HIS A 1 -0.927 8.957 0.417 1.00 0.00 H ATOM 20 HE2 HIS A 1 -2.424 10.436 1.803 1.00 0.00 H ATOM 21 N PRO A 2 -6.175 4.030 -0.939 1.00 0.00 N ATOM 22 CA PRO A 2 -7.044 2.848 -0.958 1.00 0.00 C ATOM 23 C PRO A 2 -6.669 1.839 0.121 1.00 0.00 C ATOM 24 O PRO A 2 -5.525 1.390 0.196 1.00 0.00 O ATOM 25 CB PRO A 2 -6.816 2.255 -2.350 1.00 0.00 C ATOM 26 CG PRO A 2 -5.466 2.739 -2.753 1.00 0.00 C ATOM 27 CD PRO A 2 -5.315 4.101 -2.136 1.00 0.00 C ATOM 28 HA PRO A 2 -8.083 3.122 -0.846 1.00 0.00 H ATOM 29 1HB PRO A 2 -6.849 1.177 -2.294 1.00 0.00 H ATOM 30 2HB PRO A 2 -7.579 2.610 -3.026 1.00 0.00 H ATOM 31 1HG PRO A 2 -4.707 2.069 -2.374 1.00 0.00 H ATOM 32 2HG PRO A 2 -5.405 2.806 -3.828 1.00 0.00 H ATOM 33 1HD PRO A 2 -4.285 4.279 -1.862 1.00 0.00 H ATOM 34 2HD PRO A 2 -5.663 4.864 -2.815 1.00 0.00 H ATOM 35 N LEU A 3 -7.641 1.485 0.956 1.00 0.00 N ATOM 36 CA LEU A 3 -7.413 0.528 2.034 1.00 0.00 C ATOM 37 C LEU A 3 -7.296 -0.901 1.504 1.00 0.00 C ATOM 38 O LEU A 3 -6.914 -1.813 2.238 1.00 0.00 O ATOM 39 CB LEU A 3 -8.531 0.632 3.078 1.00 0.00 C ATOM 40 CG LEU A 3 -9.950 0.371 2.564 1.00 0.00 C ATOM 41 CD1 LEU A 3 -10.085 -1.034 1.998 1.00 0.00 C ATOM 42 CD2 LEU A 3 -10.966 0.599 3.674 1.00 0.00 C ATOM 43 H LEU A 3 -8.531 1.878 0.847 1.00 0.00 H ATOM 44 HA LEU A 3 -6.481 0.792 2.504 1.00 0.00 H ATOM 45 1HB LEU A 3 -8.322 -0.078 3.865 1.00 0.00 H ATOM 46 2HB LEU A 3 -8.504 1.625 3.501 1.00 0.00 H ATOM 47 HG LEU A 3 -10.163 1.069 1.769 1.00 0.00 H ATOM 48 1HD1 LEU A 3 -9.829 -1.025 0.948 1.00 0.00 H ATOM 49 2HD1 LEU A 3 -11.102 -1.374 2.116 1.00 0.00 H ATOM 50 3HD1 LEU A 3 -9.419 -1.700 2.525 1.00 0.00 H ATOM 51 1HD2 LEU A 3 -10.577 0.215 4.604 1.00 0.00 H ATOM 52 2HD2 LEU A 3 -11.886 0.088 3.429 1.00 0.00 H ATOM 53 3HD2 LEU A 3 -11.159 1.658 3.773 1.00 0.00 H ATOM 54 N LYS A 4 -7.626 -1.094 0.229 1.00 0.00 N ATOM 55 CA LYS A 4 -7.553 -2.416 -0.386 1.00 0.00 C ATOM 56 C LYS A 4 -6.132 -2.737 -0.842 1.00 0.00 C ATOM 57 O LYS A 4 -5.796 -3.896 -1.082 1.00 0.00 O ATOM 58 CB LYS A 4 -8.513 -2.499 -1.576 1.00 0.00 C ATOM 59 CG LYS A 4 -8.499 -3.850 -2.276 1.00 0.00 C ATOM 60 CD LYS A 4 -9.467 -3.879 -3.448 1.00 0.00 C ATOM 61 CE LYS A 4 -9.453 -5.228 -4.148 1.00 0.00 C ATOM 62 NZ LYS A 4 -10.398 -5.266 -5.297 1.00 0.00 N ATOM 63 H LYS A 4 -7.924 -0.333 -0.310 1.00 0.00 H ATOM 64 HA LYS A 4 -7.851 -3.140 0.355 1.00 0.00 H ATOM 65 1HB LYS A 4 -9.518 -2.310 -1.228 1.00 0.00 H ATOM 66 2HB LYS A 4 -8.242 -1.742 -2.296 1.00 0.00 H ATOM 67 1HG LYS A 4 -7.502 -4.043 -2.642 1.00 0.00 H ATOM 68 2HG LYS A 4 -8.781 -4.614 -1.568 1.00 0.00 H ATOM 69 1HD LYS A 4 -10.464 -3.684 -3.083 1.00 0.00 H ATOM 70 2HD LYS A 4 -9.184 -3.113 -4.155 1.00 0.00 H ATOM 71 1HE LYS A 4 -8.453 -5.421 -4.509 1.00 0.00 H ATOM 72 2HE LYS A 4 -9.731 -5.992 -3.437 1.00 0.00 H ATOM 73 1HZ LYS A 4 -10.000 -5.838 -6.069 1.00 0.00 H ATOM 74 2HZ LYS A 4 -10.573 -4.304 -5.649 1.00 0.00 H ATOM 75 3HZ LYS A 4 -11.303 -5.685 -5.001 1.00 0.00 H ATOM 76 N GLN A 5 -5.301 -1.706 -0.957 1.00 0.00 N ATOM 77 CA GLN A 5 -3.919 -1.885 -1.385 1.00 0.00 C ATOM 78 C GLN A 5 -2.979 -1.939 -0.185 1.00 0.00 C ATOM 79 O GLN A 5 -2.521 -0.906 0.304 1.00 0.00 O ATOM 80 CB GLN A 5 -3.504 -0.751 -2.324 1.00 0.00 C ATOM 81 CG GLN A 5 -2.070 -0.864 -2.818 1.00 0.00 C ATOM 82 CD GLN A 5 -1.682 0.270 -3.745 1.00 0.00 C ATOM 83 OE1 GLN A 5 -2.289 0.462 -4.799 1.00 0.00 O ATOM 84 NE2 GLN A 5 -0.664 1.030 -3.357 1.00 0.00 N ATOM 85 H GLN A 5 -5.625 -0.806 -0.753 1.00 0.00 H ATOM 86 HA GLN A 5 -3.857 -2.821 -1.919 1.00 0.00 H ATOM 87 1HB GLN A 5 -4.159 -0.751 -3.183 1.00 0.00 H ATOM 88 2HB GLN A 5 -3.608 0.189 -1.802 1.00 0.00 H ATOM 89 1HG GLN A 5 -1.407 -0.854 -1.966 1.00 0.00 H ATOM 90 2HG GLN A 5 -1.959 -1.798 -3.349 1.00 0.00 H ATOM 91 1HE2 GLN A 5 -0.227 0.818 -2.505 1.00 0.00 H ATOM 92 2HE2 GLN A 5 -0.391 1.770 -3.938 1.00 0.00 H ATOM 93 N TYR A 6 -2.693 -3.150 0.283 1.00 0.00 N ATOM 94 CA TYR A 6 -1.805 -3.340 1.423 1.00 0.00 C ATOM 95 C TYR A 6 -0.354 -3.029 1.052 1.00 0.00 C ATOM 96 O TYR A 6 0.502 -2.911 1.926 1.00 0.00 O ATOM 97 CB TYR A 6 -1.910 -4.776 1.947 1.00 0.00 C ATOM 98 CG TYR A 6 -3.298 -5.172 2.419 1.00 0.00 C ATOM 99 CD1 TYR A 6 -3.536 -6.448 2.915 1.00 0.00 C ATOM 100 CD2 TYR A 6 -4.366 -4.279 2.374 1.00 0.00 C ATOM 101 CE1 TYR A 6 -4.793 -6.823 3.350 1.00 0.00 C ATOM 102 CE2 TYR A 6 -5.625 -4.648 2.808 1.00 0.00 C ATOM 103 CZ TYR A 6 -5.833 -5.921 3.295 1.00 0.00 C ATOM 104 OH TYR A 6 -7.085 -6.292 3.727 1.00 0.00 O ATOM 105 H TYR A 6 -3.088 -3.935 -0.152 1.00 0.00 H ATOM 106 HA TYR A 6 -2.116 -2.660 2.202 1.00 0.00 H ATOM 107 1HB TYR A 6 -1.626 -5.458 1.160 1.00 0.00 H ATOM 108 2HB TYR A 6 -1.232 -4.896 2.779 1.00 0.00 H ATOM 109 HD1 TYR A 6 -2.720 -7.155 2.958 1.00 0.00 H ATOM 110 HD2 TYR A 6 -4.202 -3.282 1.994 1.00 0.00 H ATOM 111 HE1 TYR A 6 -4.956 -7.821 3.731 1.00 0.00 H ATOM 112 HE2 TYR A 6 -6.439 -3.942 2.764 1.00 0.00 H ATOM 113 HH TYR A 6 -7.749 -5.925 3.138 1.00 0.00 H ATOM 114 N TRP A 7 -0.090 -2.902 -0.249 1.00 0.00 N ATOM 115 CA TRP A 7 1.251 -2.605 -0.758 1.00 0.00 C ATOM 116 C TRP A 7 2.316 -3.448 -0.057 1.00 0.00 C ATOM 117 O TRP A 7 2.001 -4.375 0.689 1.00 0.00 O ATOM 118 CB TRP A 7 1.571 -1.113 -0.602 1.00 0.00 C ATOM 119 CG TRP A 7 1.555 -0.629 0.817 1.00 0.00 C ATOM 120 CD1 TRP A 7 2.344 -1.067 1.843 1.00 0.00 C ATOM 121 CD2 TRP A 7 0.709 0.388 1.368 1.00 0.00 C ATOM 122 NE1 TRP A 7 2.040 -0.386 2.996 1.00 0.00 N ATOM 123 CE2 TRP A 7 1.040 0.512 2.732 1.00 0.00 C ATOM 124 CE3 TRP A 7 -0.294 1.205 0.841 1.00 0.00 C ATOM 125 CZ2 TRP A 7 0.402 1.421 3.572 1.00 0.00 C ATOM 126 CZ3 TRP A 7 -0.927 2.106 1.677 1.00 0.00 C ATOM 127 CH2 TRP A 7 -0.576 2.208 3.029 1.00 0.00 C ATOM 128 H TRP A 7 -0.821 -3.012 -0.893 1.00 0.00 H ATOM 129 HA TRP A 7 1.261 -2.851 -1.809 1.00 0.00 H ATOM 130 1HB TRP A 7 2.551 -0.918 -1.006 1.00 0.00 H ATOM 131 2HB TRP A 7 0.842 -0.539 -1.156 1.00 0.00 H ATOM 132 HD1 TRP A 7 3.094 -1.839 1.746 1.00 0.00 H ATOM 133 HE1 TRP A 7 2.469 -0.522 3.867 1.00 0.00 H ATOM 134 HE3 TRP A 7 -0.577 1.141 -0.199 1.00 0.00 H ATOM 135 HZ2 TRP A 7 0.660 1.512 4.617 1.00 0.00 H ATOM 136 HZ3 TRP A 7 -1.705 2.746 1.288 1.00 0.00 H ATOM 137 HH2 TRP A 7 -1.098 2.926 3.646 1.00 0.00 H ATOM 138 N TRP A 8 3.581 -3.121 -0.307 1.00 0.00 N ATOM 139 CA TRP A 8 4.693 -3.846 0.294 1.00 0.00 C ATOM 140 C TRP A 8 5.925 -2.936 0.357 1.00 0.00 C ATOM 141 O TRP A 8 6.081 -2.159 1.299 1.00 0.00 O ATOM 142 CB TRP A 8 4.987 -5.115 -0.518 1.00 0.00 C ATOM 143 CG TRP A 8 6.099 -5.976 0.023 1.00 0.00 C ATOM 144 CD1 TRP A 8 6.567 -7.125 -0.547 1.00 0.00 C ATOM 145 CD2 TRP A 8 6.823 -5.825 1.261 1.00 0.00 C ATOM 146 NE1 TRP A 8 7.575 -7.660 0.214 1.00 0.00 N ATOM 147 CE2 TRP A 8 7.746 -6.889 1.332 1.00 0.00 C ATOM 148 CE3 TRP A 8 6.804 -4.891 2.307 1.00 0.00 C ATOM 149 CZ2 TRP A 8 8.630 -7.045 2.397 1.00 0.00 C ATOM 150 CZ3 TRP A 8 7.681 -5.052 3.364 1.00 0.00 C ATOM 151 CH2 TRP A 8 8.584 -6.119 3.400 1.00 0.00 C ATOM 152 H TRP A 8 3.769 -2.376 -0.913 1.00 0.00 H ATOM 153 HA TRP A 8 4.414 -4.121 1.295 1.00 0.00 H ATOM 154 1HB TRP A 8 4.094 -5.719 -0.546 1.00 0.00 H ATOM 155 2HB TRP A 8 5.246 -4.831 -1.527 1.00 0.00 H ATOM 156 HD1 TRP A 8 6.213 -7.524 -1.487 1.00 0.00 H ATOM 157 HE1 TRP A 8 8.084 -8.470 -0.003 1.00 0.00 H ATOM 158 HE3 TRP A 8 6.114 -4.066 2.308 1.00 0.00 H ATOM 159 HZ2 TRP A 8 9.335 -7.862 2.440 1.00 0.00 H ATOM 160 HZ3 TRP A 8 7.675 -4.342 4.177 1.00 0.00 H ATOM 161 HH2 TRP A 8 9.249 -6.204 4.247 1.00 0.00 H ATOM 162 N ARG A 9 6.793 -3.030 -0.643 1.00 0.00 N ATOM 163 CA ARG A 9 8.000 -2.211 -0.685 1.00 0.00 C ATOM 164 C ARG A 9 7.655 -0.721 -0.700 1.00 0.00 C ATOM 165 O ARG A 9 8.239 0.061 0.051 1.00 0.00 O ATOM 166 CB ARG A 9 8.853 -2.569 -1.906 1.00 0.00 C ATOM 167 CG ARG A 9 9.306 -4.019 -1.929 1.00 0.00 C ATOM 168 CD ARG A 9 10.149 -4.359 -0.710 1.00 0.00 C ATOM 169 NE ARG A 9 10.588 -5.753 -0.721 1.00 0.00 N ATOM 170 CZ ARG A 9 11.339 -6.301 0.233 1.00 0.00 C ATOM 171 NH1 ARG A 9 11.743 -5.576 1.268 1.00 0.00 N ATOM 172 NH2 ARG A 9 11.687 -7.578 0.149 1.00 0.00 N ATOM 173 H ARG A 9 6.619 -3.661 -1.367 1.00 0.00 H ATOM 174 HA ARG A 9 8.567 -2.423 0.208 1.00 0.00 H ATOM 175 1HB ARG A 9 8.285 -2.379 -2.803 1.00 0.00 H ATOM 176 2HB ARG A 9 9.733 -1.941 -1.910 1.00 0.00 H ATOM 177 1HG ARG A 9 8.436 -4.658 -1.941 1.00 0.00 H ATOM 178 2HG ARG A 9 9.893 -4.189 -2.819 1.00 0.00 H ATOM 179 1HD ARG A 9 11.017 -3.718 -0.698 1.00 0.00 H ATOM 180 2HD ARG A 9 9.560 -4.185 0.179 1.00 0.00 H ATOM 181 HE ARG A 9 10.307 -6.311 -1.475 1.00 0.00 H ATOM 182 1HH1 ARG A 9 11.485 -4.612 1.336 1.00 0.00 H ATOM 183 2HH1 ARG A 9 12.307 -5.993 1.980 1.00 0.00 H ATOM 184 1HH2 ARG A 9 11.387 -8.128 -0.630 1.00 0.00 H ATOM 185 2HH2 ARG A 9 12.252 -7.990 0.864 1.00 0.00 H ATOM 186 N PRO A 10 6.702 -0.300 -1.555 1.00 0.00 N ATOM 187 CA PRO A 10 6.292 1.098 -1.659 1.00 0.00 C ATOM 188 C PRO A 10 5.267 1.475 -0.593 1.00 0.00 C ATOM 189 O PRO A 10 4.135 0.994 -0.610 1.00 0.00 O ATOM 190 CB PRO A 10 5.663 1.190 -3.063 1.00 0.00 C ATOM 191 CG PRO A 10 5.736 -0.191 -3.645 1.00 0.00 C ATOM 192 CD PRO A 10 5.947 -1.131 -2.492 1.00 0.00 C ATOM 193 HA PRO A 10 7.138 1.765 -1.596 1.00 0.00 H ATOM 194 1HB PRO A 10 4.640 1.523 -2.977 1.00 0.00 H ATOM 195 2HB PRO A 10 6.223 1.895 -3.659 1.00 0.00 H ATOM 196 1HG PRO A 10 4.812 -0.423 -4.151 1.00 0.00 H ATOM 197 2HG PRO A 10 6.566 -0.253 -4.334 1.00 0.00 H ATOM 198 1HD PRO A 10 5.000 -1.429 -2.070 1.00 0.00 H ATOM 199 2HD PRO A 10 6.517 -1.991 -2.800 1.00 0.00 H ATOM 200 N SER A 11 5.672 2.337 0.333 1.00 0.00 N ATOM 201 CA SER A 11 4.787 2.776 1.406 1.00 0.00 C ATOM 202 C SER A 11 4.098 4.089 1.047 1.00 0.00 C ATOM 203 O SER A 11 3.037 4.410 1.584 1.00 0.00 O ATOM 204 CB SER A 11 5.569 2.936 2.711 1.00 0.00 C ATOM 205 OG SER A 11 6.165 1.711 3.103 1.00 0.00 O ATOM 206 H SER A 11 6.588 2.686 0.295 1.00 0.00 H ATOM 207 HA SER A 11 4.033 2.018 1.541 1.00 0.00 H ATOM 208 1HB SER A 11 6.347 3.672 2.574 1.00 0.00 H ATOM 209 2HB SER A 11 4.899 3.262 3.493 1.00 0.00 H ATOM 210 HG SER A 11 6.839 1.465 2.465 1.00 0.00 H ATOM 211 N ILE A 12 4.706 4.842 0.139 1.00 0.00 N ATOM 212 CA ILE A 12 4.151 6.119 -0.292 1.00 0.00 C ATOM 213 C ILE A 12 4.072 6.190 -1.815 1.00 0.00 C ATOM 214 O ILE A 12 5.123 6.030 -2.469 1.00 0.00 O ATOM 215 CB ILE A 12 4.994 7.302 0.231 1.00 0.00 C ATOM 216 CG1 ILE A 12 5.036 7.289 1.761 1.00 0.00 C ATOM 217 CG2 ILE A 12 4.433 8.625 -0.272 1.00 0.00 C ATOM 218 CD1 ILE A 12 3.672 7.403 2.404 1.00 0.00 C ATOM 219 OXT ILE A 12 2.959 6.405 -2.339 1.00 0.00 O ATOM 220 H ILE A 12 5.548 4.530 -0.251 1.00 0.00 H ATOM 221 HA ILE A 12 3.154 6.205 0.115 1.00 0.00 H ATOM 222 HB ILE A 12 5.998 7.196 -0.151 1.00 0.00 H ATOM 223 1HG1 ILE A 12 5.483 6.364 2.093 1.00 0.00 H ATOM 224 2HG1 ILE A 12 5.637 8.118 2.104 1.00 0.00 H ATOM 225 1HG2 ILE A 12 3.379 8.512 -0.484 1.00 0.00 H ATOM 226 2HG2 ILE A 12 4.951 8.917 -1.173 1.00 0.00 H ATOM 227 3HG2 ILE A 12 4.568 9.385 0.484 1.00 0.00 H ATOM 228 1HD1 ILE A 12 3.045 6.591 2.067 1.00 0.00 H ATOM 229 2HD1 ILE A 12 3.221 8.345 2.128 1.00 0.00 H ATOM 230 3HD1 ILE A 12 3.775 7.355 3.477 1.00 0.00 H TER 231 ILE A 12 ENDMDL MASTER 104 0 0 0 0 0 0 6 4370 19 0 1 END