USER MOD reduce.3.24.130724 H: found=0, std=0, add=652, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 648 hydrogens (0 hets) HEADER MEMBRANE PROTEIN 08-JUN-06 2H95 TITLE STRUCTURE OF THE AMANTADINE-BLOCKED INFLUENZA A M2 PROTON TITLE 2 CHANNEL TRANS-MEMBRANE DOMAIN BY SOLID-STATE NMR TITLE 3 SPECTROSCOPY COMPND MOL_ID: 1; COMPND 2 MOLECULE: MATRIX PROTEIN 2; COMPND 3 CHAIN: A, B, C, D; COMPND 4 FRAGMENT: TRANSMEMBRANE DOMAIN (RESIDUES 26-43); COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THE PEPTIDE WAS SYNTHESIZED USING SOLID SOURCE 4 PHASE PEPTIDE SYNTHESIS. THIS SEQUENCE OCCURS NATURALLY IN SOURCE 5 THE INFLUENZA A VIRUS (UDORN/72). KEYWDS ALPHA HELIX, PROTEIN-LIGAND, MEMBRANE PROTEIN EXPDTA SOLID-STATE NMR AUTHOR J.HU,T.ASBURY,T.A.CROSS REVDAT 3 24-FEB-09 2H95 1 VERSN REVDAT 2 26-JUN-07 2H95 1 JRNL REVDAT 1 24-APR-07 2H95 0 JRNL AUTH J.HU,T.ASBURY,S.ACHUTHAN,C.LI,R.BERTRAM,J.R.QUINE, JRNL AUTH 2 R.FU,T.A.CROSS JRNL TITL BACKBONE STRUCTURE OF THE AMANTADINE-BLOCKED JRNL TITL 2 TRANS-MEMBRANE DOMAIN M2 PROTON CHANNEL FROM JRNL TITL 3 INFLUENZA A VIRUS. JRNL REF BIOPHYS.J. V. 92 4335 2007 JRNL REFN ISSN 0006-3495 JRNL PMID 17384070 JRNL DOI 10.1529/BIOPHYSJ.106.090183 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : XPLOR-NIH 2.9.9 REMARK 3 AUTHORS : SCHWIETERS, KUSZEWSKI, TJANDRA, CLORE REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REFINEMENT WAS CARRIED OUT IN VACUO REMARK 3 ON INITIAL MONOMER COORDINATES CONSISTING OF TWO ALPHA-HELICAL REMARK 3 FRAGMENTS (3.6 RESIDUES PER TURN) HAVING TILT AND ROTATIONAL REMARK 3 ORIENTATIONS WITH RESPECT TO THE BILAYER DERIVED FROM PISEMA REMARK 3 DIPOLAR WAVE ANALYSIS. ENERGY MINIMIZATION USED A GLOBAL REMARK 3 PENALTY FUNCTION INCORPORATING ORIENTATIONAL RESTRAINTS, REMARK 3 HYDROGEN BONDING AND THE CHARMM EMPIRICAL FUNCTION. THE REMARK 3 ORIENTATIONAL RESTRAINTS IMPOSED ON THE STRUCTURE DURING REMARK 3 REFINEMENT ARE 16 15N CHEMICAL SHIFTS AND 16 15N-1H DIPOLAR REMARK 3 COUPLINGS FROM PISEMA EXPERIMENTS. A SYMMETRIC, TETRAMERIC REMARK 3 BUNDLE MODEL OF M2-TMD WAS CONSTRUCTED BY A SERIES OF RIGID- REMARK 3 BODY TRANSFORMATIONS OF THE REFINED M2-TMD MONOMER. THE REMARK 3 RESULTING HOMO-TETRAMER IS THE LOWEST FREE ENERGY CONFORMER REMARK 3 BASED ON ROTATIONAL CONFORMATIONAL SEARCH. NOTE THAT THE HIS37 REMARK 3 AND TRP41 SIDECHAIN POSITIONS ARE CONSISTENT WITH MEASURED REMARK 3 ORIENTATIONAL CONSTRAINTS. THE ROTAMERIC STATES OF OTHER REMARK 3 RESIDUES ARE TAKEN FROM A BACKBONE DEPENDENT SIDECHAIN ROTAMER REMARK 3 LIBRARY (SCRWL). REMARK 4 REMARK 4 2H95 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 09-JUN-06. REMARK 100 THE RCSB ID CODE IS RCSB038085. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 308 REMARK 210 PH : 8.8 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : M2-TMD (~120 MG) AND DMPC (~ REMARK 210 75 MG) WERE FIRST CO-DISSOLVED REMARK 210 IN 10 ML TFE, FOLLOWED BY THE REMARK 210 REMOVAL OF THE SOLVENT UNDER REMARK 210 VACUUM. THE PEPTIDE/LIPID REMARK 210 MIXTURE WAS REHYDRATED AND REMARK 210 SONICATED TO MAKE LIPOSOMES IN REMARK 210 A CITRATE-BORATE-PHOSPHATE REMARK 210 (CBP) BUFFER (PH 8.8) WITH 1 REMARK 210 MM EDTA AND 10 MM AMANTADINE REMARK 210 AT 310 K. THE LIPOSOMES WERE REMARK 210 PELLETED BY REMARK 210 ULTRACENTRIFUGATION . THEN THE REMARK 210 PELLET WAS SPREAD ON GLASS REMARK 210 SLIDES AND DEHYDRATED IN A 75% REMARK 210 HUMIDITY CHAMBER. THE REMARK 210 DEHYDRATED SLIDES WERE REMARK 210 REHYDRATED WITH 1.5 MICROL REMARK 210 LITER CBP BUFFER PER SLIDE REMARK 210 FOLLOWED BY BEING STACKED INTO REMARK 210 A GLASS TUBE AND INCUBATED AT REMARK 210 316 K FOR 24 HOURS IN 96% REMARK 210 RELATIVE HUMIDITY. FINALLY, REMARK 210 THE GLASS TUBE WAS SEALED AT REMARK 210 BOTH ENDS WITH EPOXY AND TWO REMARK 210 GLASSCAPS. REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : SOLID-STATE NMR PISEMA REMARK 210 SPECTROMETER FIELD STRENGTH : 400 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : ENERGY MINIMIZATION WITH REMARK 210 ORIENTATIONAL CONSTRAINTS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 72 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 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 217 REMARK 217 SOLID STATE NMR STUDY REMARK 217 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLID REMARK 217 STATE NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 217 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 217 THESE RECORDS ARE MEANINGLESS. DBREF 2H95 A 26 43 UNP P35938 M2_IAUSS 26 43 DBREF 2H95 B 26 43 UNP P35938 M2_IAUSS 26 43 DBREF 2H95 C 26 43 UNP P35938 M2_IAUSS 26 43 DBREF 2H95 D 26 43 UNP P35938 M2_IAUSS 26 43 SEQRES 1 A 18 LEU VAL VAL ALA ALA SER ILE ILE GLY ILE LEU HIS LEU SEQRES 2 A 18 ILE LEU TRP ILE LEU SEQRES 1 B 18 LEU VAL VAL ALA ALA SER ILE ILE GLY ILE LEU HIS LEU SEQRES 2 B 18 ILE LEU TRP ILE LEU SEQRES 1 C 18 LEU VAL VAL ALA ALA SER ILE ILE GLY ILE LEU HIS LEU SEQRES 2 C 18 ILE LEU TRP ILE LEU SEQRES 1 D 18 LEU VAL VAL ALA ALA SER ILE ILE GLY ILE LEU HIS LEU SEQRES 2 D 18 ILE LEU TRP ILE LEU HELIX 1 1 LEU A 26 LEU A 43 1 18 HELIX 2 2 LEU B 26 LEU B 43 1 18 HELIX 3 3 LEU C 26 LEU C 43 1 18 HELIX 4 4 LEU D 26 LEU D 43 1 18 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 31 SER OG : rot -36:sc= 0.281 USER MOD Single : A 37 HIS : no HE2:sc= 0.0506 K(o=0.051,f=-1.8) USER MOD Single : B 31 SER OG : rot -38:sc= 0.283 USER MOD Single : B 37 HIS : no HE2:sc= 0.0554 K(o=0.055,f=-1.9!) USER MOD Single : C 31 SER OG : rot -40:sc= 0.464 USER MOD Single : C 37 HIS : no HE2:sc= 0.024 K(o=0.024,f=-1.8!) USER MOD Single : D 31 SER OG : rot -41:sc= 0.457 USER MOD Single : D 37 HIS : no HE2:sc= 0.0272 K(o=0.027,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 26 -7.033 -5.116 0.203 1.00 0.00 N ATOM 2 CA LEU A 26 -6.885 -4.344 -1.063 1.00 0.00 C ATOM 3 C LEU A 26 -5.415 -4.362 -1.490 1.00 0.00 C ATOM 4 O LEU A 26 -5.097 -4.542 -2.648 1.00 0.00 O ATOM 5 CB LEU A 26 -7.326 -2.898 -0.829 1.00 0.00 C ATOM 6 CG LEU A 26 -8.750 -2.878 -0.271 1.00 0.00 C ATOM 7 CD1 LEU A 26 -9.201 -1.430 -0.074 1.00 0.00 C ATOM 8 CD2 LEU A 26 -9.693 -3.576 -1.253 1.00 0.00 C ATOM 0 HA LEU A 26 -7.502 -4.791 -1.842 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.645 -2.408 -0.133 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.283 -2.339 -1.764 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.772 -3.399 0.686 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -10.216 -1.416 0.324 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.530 -0.932 0.626 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -9.179 -0.909 -1.031 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -10.708 -3.562 -0.855 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -9.671 -3.056 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -9.373 -4.608 -1.394 1.00 0.00 H new ATOM 19 N VAL A 27 -4.513 -4.183 -0.565 1.00 0.00 N ATOM 20 CA VAL A 27 -3.064 -4.192 -0.915 1.00 0.00 C ATOM 21 C VAL A 27 -2.661 -5.586 -1.400 1.00 0.00 C ATOM 22 O VAL A 27 -1.902 -5.735 -2.337 1.00 0.00 O ATOM 23 CB VAL A 27 -2.264 -3.850 0.343 1.00 0.00 C ATOM 24 CG1 VAL A 27 -0.764 -3.921 0.046 1.00 0.00 C ATOM 25 CG2 VAL A 27 -2.625 -2.438 0.810 1.00 0.00 C ATOM 0 H VAL A 27 -4.718 -4.030 0.422 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.866 -3.466 -1.704 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.507 -4.568 1.126 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.203 -3.676 0.948 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -0.505 -4.928 -0.280 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.515 -3.209 -0.741 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.055 -2.194 1.706 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.387 -1.722 0.023 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.691 -2.390 1.034 1.00 0.00 H new ATOM 35 N VAL A 28 -3.168 -6.608 -0.766 1.00 0.00 N ATOM 36 CA VAL A 28 -2.813 -7.994 -1.183 1.00 0.00 C ATOM 37 C VAL A 28 -3.347 -8.240 -2.595 1.00 0.00 C ATOM 38 O VAL A 28 -2.657 -8.755 -3.453 1.00 0.00 O ATOM 39 CB VAL A 28 -3.444 -9.003 -0.221 1.00 0.00 C ATOM 40 CG1 VAL A 28 -3.255 -10.416 -0.773 1.00 0.00 C ATOM 41 CG2 VAL A 28 -2.767 -8.896 1.148 1.00 0.00 C ATOM 0 H VAL A 28 -3.812 -6.543 0.022 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.730 -8.113 -1.167 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.508 -8.791 -0.117 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -3.704 -11.137 -0.089 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.736 -10.493 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.191 -10.627 -0.876 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.216 -9.615 1.833 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -1.703 -9.109 1.045 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -2.899 -7.888 1.541 1.00 0.00 H new ATOM 51 N ALA A 29 -4.577 -7.877 -2.839 1.00 0.00 N ATOM 52 CA ALA A 29 -5.168 -8.088 -4.191 1.00 0.00 C ATOM 53 C ALA A 29 -4.467 -7.188 -5.210 1.00 0.00 C ATOM 54 O ALA A 29 -4.037 -7.636 -6.254 1.00 0.00 O ATOM 55 CB ALA A 29 -6.658 -7.744 -4.157 1.00 0.00 C ATOM 0 H ALA A 29 -5.200 -7.442 -2.158 1.00 0.00 H new ATOM 0 HA ALA A 29 -5.038 -9.131 -4.478 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -7.090 -7.898 -5.146 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.163 -8.387 -3.436 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -6.784 -6.701 -3.865 1.00 0.00 H new ATOM 61 N ALA A 30 -4.340 -5.923 -4.917 1.00 0.00 N ATOM 62 CA ALA A 30 -3.665 -5.001 -5.873 1.00 0.00 C ATOM 63 C ALA A 30 -2.247 -5.509 -6.146 1.00 0.00 C ATOM 64 O ALA A 30 -1.741 -5.411 -7.246 1.00 0.00 O ATOM 65 CB ALA A 30 -3.593 -3.602 -5.259 1.00 0.00 C ATOM 0 H ALA A 30 -4.674 -5.488 -4.057 1.00 0.00 H new ATOM 0 HA ALA A 30 -4.227 -4.962 -6.806 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -3.100 -2.924 -5.955 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.601 -3.242 -5.055 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.027 -3.642 -4.329 1.00 0.00 H new ATOM 71 N SER A 31 -1.604 -6.053 -5.150 1.00 0.00 N ATOM 72 CA SER A 31 -0.219 -6.568 -5.345 1.00 0.00 C ATOM 73 C SER A 31 -0.244 -7.751 -6.315 1.00 0.00 C ATOM 74 O SER A 31 0.596 -7.871 -7.185 1.00 0.00 O ATOM 75 CB SER A 31 0.346 -7.027 -4.001 1.00 0.00 C ATOM 76 OG SER A 31 -0.385 -8.158 -3.548 1.00 0.00 O ATOM 0 H SER A 31 -1.978 -6.163 -4.208 1.00 0.00 H new ATOM 0 HA SER A 31 0.408 -5.776 -5.754 1.00 0.00 H new ATOM 0 HB2 SER A 31 1.402 -7.279 -4.104 1.00 0.00 H new ATOM 0 HB3 SER A 31 0.280 -6.220 -3.271 1.00 0.00 H new ATOM 0 HG SER A 31 -1.326 -8.063 -3.803 1.00 0.00 H new ATOM 82 N ILE A 32 -1.203 -8.626 -6.173 1.00 0.00 N ATOM 83 CA ILE A 32 -1.279 -9.800 -7.087 1.00 0.00 C ATOM 84 C ILE A 32 -1.647 -9.327 -8.495 1.00 0.00 C ATOM 85 O ILE A 32 -1.004 -9.676 -9.466 1.00 0.00 O ATOM 86 CB ILE A 32 -2.349 -10.771 -6.583 1.00 0.00 C ATOM 87 CG1 ILE A 32 -1.980 -11.251 -5.177 1.00 0.00 C ATOM 88 CG2 ILE A 32 -2.433 -11.973 -7.525 1.00 0.00 C ATOM 89 CD1 ILE A 32 -3.200 -11.902 -4.523 1.00 0.00 C ATOM 0 H ILE A 32 -1.935 -8.578 -5.465 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.312 -10.303 -7.112 1.00 0.00 H new ATOM 0 HB ILE A 32 -3.314 -10.264 -6.554 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.158 -11.965 -5.229 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.635 -10.411 -4.573 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.195 -12.664 -7.166 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -2.695 -11.633 -8.527 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.469 -12.480 -7.555 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.937 -12.244 -3.522 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -4.009 -11.175 -4.457 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.524 -12.752 -5.123 1.00 0.00 H new ATOM 101 N ILE A 33 -2.677 -8.536 -8.614 1.00 0.00 N ATOM 102 CA ILE A 33 -3.090 -8.042 -9.958 1.00 0.00 C ATOM 103 C ILE A 33 -2.006 -7.129 -10.534 1.00 0.00 C ATOM 104 O ILE A 33 -1.685 -7.196 -11.704 1.00 0.00 O ATOM 105 CB ILE A 33 -4.398 -7.261 -9.834 1.00 0.00 C ATOM 106 CG1 ILE A 33 -5.460 -8.146 -9.175 1.00 0.00 C ATOM 107 CG2 ILE A 33 -4.878 -6.842 -11.225 1.00 0.00 C ATOM 108 CD1 ILE A 33 -6.666 -7.290 -8.783 1.00 0.00 C ATOM 0 H ILE A 33 -3.252 -8.210 -7.837 1.00 0.00 H new ATOM 0 HA ILE A 33 -3.233 -8.894 -10.623 1.00 0.00 H new ATOM 0 HB ILE A 33 -4.233 -6.373 -9.224 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -5.768 -8.935 -9.861 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -5.045 -8.635 -8.293 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -5.811 -6.285 -11.136 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.123 -6.212 -11.696 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -5.043 -7.730 -11.836 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -7.422 -7.920 -8.314 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -6.351 -6.517 -8.082 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -7.085 -6.822 -9.674 1.00 0.00 H new ATOM 120 N GLY A 34 -1.434 -6.274 -9.731 1.00 0.00 N ATOM 121 CA GLY A 34 -0.376 -5.363 -10.250 1.00 0.00 C ATOM 122 C GLY A 34 0.822 -6.185 -10.731 1.00 0.00 C ATOM 123 O GLY A 34 1.395 -5.915 -11.768 1.00 0.00 O ATOM 0 H GLY A 34 -1.653 -6.167 -8.741 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -0.770 -4.762 -11.070 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -0.064 -4.670 -9.469 1.00 0.00 H new ATOM 127 N ILE A 35 1.208 -7.186 -9.989 1.00 0.00 N ATOM 128 CA ILE A 35 2.369 -8.022 -10.409 1.00 0.00 C ATOM 129 C ILE A 35 2.046 -8.720 -11.732 1.00 0.00 C ATOM 130 O ILE A 35 2.684 -8.488 -12.740 1.00 0.00 O ATOM 131 CB ILE A 35 2.650 -9.070 -9.332 1.00 0.00 C ATOM 132 CG1 ILE A 35 3.064 -8.366 -8.037 1.00 0.00 C ATOM 133 CG2 ILE A 35 3.779 -9.994 -9.792 1.00 0.00 C ATOM 134 CD1 ILE A 35 2.917 -9.332 -6.860 1.00 0.00 C ATOM 0 H ILE A 35 0.770 -7.462 -9.110 1.00 0.00 H new ATOM 0 HA ILE A 35 3.247 -7.389 -10.541 1.00 0.00 H new ATOM 0 HB ILE A 35 1.750 -9.660 -9.158 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.096 -8.022 -8.112 1.00 0.00 H new ATOM 0 HG13 ILE A 35 2.444 -7.484 -7.876 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.976 -10.739 -9.021 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.486 -10.495 -10.715 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.681 -9.407 -9.968 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.212 -8.830 -5.938 1.00 0.00 H new ATOM 0 HD12 ILE A 35 1.879 -9.654 -6.781 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.555 -10.201 -7.020 1.00 0.00 H new ATOM 146 N LEU A 36 1.064 -9.579 -11.734 1.00 0.00 N ATOM 147 CA LEU A 36 0.705 -10.298 -12.989 1.00 0.00 C ATOM 148 C LEU A 36 0.296 -9.286 -14.062 1.00 0.00 C ATOM 149 O LEU A 36 0.638 -9.423 -15.220 1.00 0.00 O ATOM 150 CB LEU A 36 -0.460 -11.252 -12.720 1.00 0.00 C ATOM 151 CG LEU A 36 -0.140 -12.121 -11.502 1.00 0.00 C ATOM 152 CD1 LEU A 36 -1.338 -13.015 -11.183 1.00 0.00 C ATOM 153 CD2 LEU A 36 1.080 -12.994 -11.806 1.00 0.00 C ATOM 0 H LEU A 36 0.495 -9.814 -10.921 1.00 0.00 H new ATOM 0 HA LEU A 36 1.567 -10.867 -13.336 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.375 -10.685 -12.545 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.637 -11.881 -13.592 1.00 0.00 H new ATOM 0 HG LEU A 36 0.073 -11.481 -10.646 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.109 -13.634 -10.315 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.208 -12.395 -10.967 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.552 -13.655 -12.039 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.309 -13.614 -10.939 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.866 -13.633 -12.662 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.935 -12.358 -12.033 1.00 0.00 H new ATOM 165 N HIS A 37 -0.435 -8.272 -13.688 1.00 0.00 N ATOM 166 CA HIS A 37 -0.869 -7.253 -14.686 1.00 0.00 C ATOM 167 C HIS A 37 0.360 -6.575 -15.296 1.00 0.00 C ATOM 168 O HIS A 37 0.416 -6.326 -16.485 1.00 0.00 O ATOM 169 CB HIS A 37 -1.742 -6.212 -13.985 1.00 0.00 C ATOM 170 CG HIS A 37 -1.943 -5.008 -14.865 1.00 0.00 C ATOM 171 ND1 HIS A 37 -1.899 -3.726 -14.348 1.00 0.00 N ATOM 172 CD2 HIS A 37 -2.248 -4.865 -16.202 1.00 0.00 C ATOM 173 CE1 HIS A 37 -2.168 -2.875 -15.346 1.00 0.00 C ATOM 174 NE2 HIS A 37 -2.404 -3.508 -16.498 1.00 0.00 N ATOM 0 H HIS A 37 -0.751 -8.105 -12.733 1.00 0.00 H new ATOM 0 HA HIS A 37 -1.439 -7.733 -15.481 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -2.708 -6.650 -13.733 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -1.275 -5.910 -13.048 1.00 0.00 H new ATOM 0 HD1 HIS A 37 -1.698 -3.474 -13.380 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -2.350 -5.675 -16.910 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -2.191 -1.801 -15.233 1.00 0.00 H new ATOM 182 N LEU A 38 1.344 -6.265 -14.497 1.00 0.00 N ATOM 183 CA LEU A 38 2.563 -5.601 -15.036 1.00 0.00 C ATOM 184 C LEU A 38 3.336 -6.575 -15.927 1.00 0.00 C ATOM 185 O LEU A 38 3.856 -6.207 -16.960 1.00 0.00 O ATOM 186 CB LEU A 38 3.459 -5.177 -13.871 1.00 0.00 C ATOM 187 CG LEU A 38 2.735 -4.143 -13.007 1.00 0.00 C ATOM 188 CD1 LEU A 38 3.645 -3.722 -11.852 1.00 0.00 C ATOM 189 CD2 LEU A 38 2.391 -2.918 -13.856 1.00 0.00 C ATOM 0 H LEU A 38 1.356 -6.443 -13.493 1.00 0.00 H new ATOM 0 HA LEU A 38 2.268 -4.730 -15.621 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.723 -6.046 -13.269 1.00 0.00 H new ATOM 0 HB3 LEU A 38 4.391 -4.758 -14.251 1.00 0.00 H new ATOM 0 HG LEU A 38 1.818 -4.578 -12.610 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.132 -2.985 -11.234 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.892 -4.594 -11.247 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.561 -3.286 -12.251 1.00 0.00 H new ATOM 0 HD21 LEU A 38 1.875 -2.182 -13.240 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.308 -2.481 -14.253 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.745 -3.217 -14.681 1.00 0.00 H new ATOM 201 N ILE A 39 3.408 -7.817 -15.532 1.00 0.00 N ATOM 202 CA ILE A 39 4.150 -8.815 -16.353 1.00 0.00 C ATOM 203 C ILE A 39 3.504 -8.908 -17.736 1.00 0.00 C ATOM 204 O ILE A 39 4.176 -8.891 -18.748 1.00 0.00 O ATOM 205 CB ILE A 39 4.096 -10.186 -15.678 1.00 0.00 C ATOM 206 CG1 ILE A 39 4.820 -10.125 -14.331 1.00 0.00 C ATOM 207 CG2 ILE A 39 4.782 -11.219 -16.576 1.00 0.00 C ATOM 208 CD1 ILE A 39 4.621 -11.445 -13.585 1.00 0.00 C ATOM 0 H ILE A 39 2.986 -8.183 -14.678 1.00 0.00 H new ATOM 0 HA ILE A 39 5.190 -8.502 -16.449 1.00 0.00 H new ATOM 0 HB ILE A 39 3.056 -10.471 -15.517 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.883 -9.939 -14.485 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.435 -9.297 -13.736 1.00 0.00 H new ATOM 0 HG21 ILE A 39 4.746 -12.198 -16.098 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.268 -11.265 -17.536 1.00 0.00 H new ATOM 0 HG23 ILE A 39 5.821 -10.931 -16.734 1.00 0.00 H new ATOM 0 HD11 ILE A 39 5.137 -11.402 -12.626 1.00 0.00 H new ATOM 0 HD12 ILE A 39 3.557 -11.612 -13.418 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.028 -12.264 -14.179 1.00 0.00 H new ATOM 220 N LEU A 40 2.204 -9.010 -17.786 1.00 0.00 N ATOM 221 CA LEU A 40 1.507 -9.111 -19.099 1.00 0.00 C ATOM 222 C LEU A 40 1.883 -7.933 -20.000 1.00 0.00 C ATOM 223 O LEU A 40 2.034 -8.087 -21.196 1.00 0.00 O ATOM 224 CB LEU A 40 -0.006 -9.095 -18.868 1.00 0.00 C ATOM 225 CG LEU A 40 -0.397 -10.236 -17.927 1.00 0.00 C ATOM 226 CD1 LEU A 40 -1.918 -10.267 -17.772 1.00 0.00 C ATOM 227 CD2 LEU A 40 0.082 -11.567 -18.510 1.00 0.00 C ATOM 0 H LEU A 40 1.592 -9.028 -16.970 1.00 0.00 H new ATOM 0 HA LEU A 40 1.808 -10.039 -19.584 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.308 -8.139 -18.441 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.530 -9.199 -19.818 1.00 0.00 H new ATOM 0 HG LEU A 40 0.067 -10.079 -16.953 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -2.199 -11.079 -17.102 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.261 -9.319 -17.357 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.380 -10.425 -18.747 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.197 -12.379 -17.839 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.381 -11.725 -19.484 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.166 -11.546 -18.623 1.00 0.00 H new ATOM 239 N TRP A 41 2.050 -6.759 -19.455 1.00 0.00 N ATOM 240 CA TRP A 41 2.416 -5.592 -20.306 1.00 0.00 C ATOM 241 C TRP A 41 3.803 -5.810 -20.913 1.00 0.00 C ATOM 242 O TRP A 41 4.022 -5.568 -22.083 1.00 0.00 O ATOM 243 CB TRP A 41 2.424 -4.334 -19.435 1.00 0.00 C ATOM 244 CG TRP A 41 1.097 -3.654 -19.546 1.00 0.00 C ATOM 245 CD1 TRP A 41 0.277 -3.351 -18.503 1.00 0.00 C ATOM 246 CD2 TRP A 41 0.418 -3.189 -20.752 1.00 0.00 C ATOM 247 NE1 TRP A 41 -0.857 -2.731 -19.005 1.00 0.00 N ATOM 248 CE2 TRP A 41 -0.812 -2.614 -20.374 1.00 0.00 C ATOM 249 CE3 TRP A 41 0.742 -3.209 -22.125 1.00 0.00 C ATOM 250 CZ2 TRP A 41 -1.691 -2.078 -21.311 1.00 0.00 C ATOM 251 CZ3 TRP A 41 -0.146 -2.667 -23.073 1.00 0.00 C ATOM 252 CH2 TRP A 41 -1.360 -2.103 -22.663 1.00 0.00 C ATOM 0 H TRP A 41 1.949 -6.558 -18.460 1.00 0.00 H new ATOM 0 HA TRP A 41 1.692 -5.480 -21.113 1.00 0.00 H new ATOM 0 HB2 TRP A 41 2.626 -4.597 -18.397 1.00 0.00 H new ATOM 0 HB3 TRP A 41 3.220 -3.661 -19.754 1.00 0.00 H new ATOM 0 HD1 TRP A 41 0.476 -3.558 -17.462 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.631 -2.402 -18.428 1.00 0.00 H new ATOM 0 HE3 TRP A 41 1.676 -3.642 -22.450 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -2.627 -1.644 -20.990 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 0.110 -2.686 -24.122 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -2.038 -1.688 -23.394 1.00 0.00 H new ATOM 263 N ILE A 42 4.746 -6.261 -20.131 1.00 0.00 N ATOM 264 CA ILE A 42 6.116 -6.489 -20.669 1.00 0.00 C ATOM 265 C ILE A 42 6.056 -7.487 -21.828 1.00 0.00 C ATOM 266 O ILE A 42 6.746 -7.342 -22.818 1.00 0.00 O ATOM 267 CB ILE A 42 7.003 -7.046 -19.555 1.00 0.00 C ATOM 268 CG1 ILE A 42 6.877 -6.152 -18.319 1.00 0.00 C ATOM 269 CG2 ILE A 42 8.461 -7.072 -20.017 1.00 0.00 C ATOM 270 CD1 ILE A 42 7.602 -6.800 -17.138 1.00 0.00 C ATOM 0 H ILE A 42 4.626 -6.481 -19.142 1.00 0.00 H new ATOM 0 HA ILE A 42 6.529 -5.548 -21.032 1.00 0.00 H new ATOM 0 HB ILE A 42 6.686 -8.060 -19.312 1.00 0.00 H new ATOM 0 HG12 ILE A 42 7.302 -5.169 -18.524 1.00 0.00 H new ATOM 0 HG13 ILE A 42 5.826 -6.000 -18.074 1.00 0.00 H new ATOM 0 HG21 ILE A 42 9.088 -7.470 -19.219 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.552 -7.705 -20.900 1.00 0.00 H new ATOM 0 HG23 ILE A 42 8.783 -6.060 -20.262 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.510 -6.161 -16.260 1.00 0.00 H new ATOM 0 HD12 ILE A 42 7.157 -7.772 -16.927 1.00 0.00 H new ATOM 0 HD13 ILE A 42 8.656 -6.929 -17.384 1.00 0.00 H new ATOM 282 N LEU A 43 5.245 -8.502 -21.711 1.00 0.00 N ATOM 283 CA LEU A 43 5.148 -9.508 -22.806 1.00 0.00 C ATOM 284 C LEU A 43 4.493 -8.873 -24.034 1.00 0.00 C ATOM 285 O LEU A 43 4.965 -9.017 -25.145 1.00 0.00 O ATOM 286 CB LEU A 43 4.307 -10.696 -22.335 1.00 0.00 C ATOM 287 CG LEU A 43 4.888 -11.249 -21.033 1.00 0.00 C ATOM 288 CD1 LEU A 43 4.171 -12.548 -20.664 1.00 0.00 C ATOM 289 CD2 LEU A 43 6.382 -11.527 -21.220 1.00 0.00 C ATOM 0 H LEU A 43 4.645 -8.678 -20.905 1.00 0.00 H new ATOM 0 HA LEU A 43 6.148 -9.852 -23.069 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.274 -10.385 -22.181 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.296 -11.473 -23.099 1.00 0.00 H new ATOM 0 HG LEU A 43 4.750 -10.519 -20.235 1.00 0.00 H new ATOM 0 HD11 LEU A 43 4.586 -12.942 -19.736 1.00 0.00 H new ATOM 0 HD12 LEU A 43 3.107 -12.351 -20.531 1.00 0.00 H new ATOM 0 HD13 LEU A 43 4.308 -13.279 -21.461 1.00 0.00 H new ATOM 0 HD21 LEU A 43 6.798 -11.921 -20.293 1.00 0.00 H new ATOM 0 HD22 LEU A 43 6.519 -12.257 -22.018 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.894 -10.601 -21.482 1.00 0.00 H new TER 301 LEU A 43 ATOM 302 N LEU B 26 -8.116 7.033 0.203 1.00 0.00 N ATOM 303 CA LEU B 26 -7.344 6.885 -1.063 1.00 0.00 C ATOM 304 C LEU B 26 -7.362 5.415 -1.490 1.00 0.00 C ATOM 305 O LEU B 26 -7.542 5.097 -2.648 1.00 0.00 O ATOM 306 CB LEU B 26 -5.898 7.326 -0.829 1.00 0.00 C ATOM 307 CG LEU B 26 -5.878 8.750 -0.271 1.00 0.00 C ATOM 308 CD1 LEU B 26 -4.430 9.201 -0.074 1.00 0.00 C ATOM 309 CD2 LEU B 26 -6.576 9.693 -1.253 1.00 0.00 C ATOM 0 HA LEU B 26 -7.791 7.502 -1.842 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -5.408 6.645 -0.133 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -5.339 7.283 -1.764 1.00 0.00 H new ATOM 0 HG LEU B 26 -6.399 8.772 0.686 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -4.416 10.216 0.324 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -3.932 8.530 0.626 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -3.909 9.179 -1.031 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -6.562 10.708 -0.855 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -6.056 9.671 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -7.608 9.373 -1.394 1.00 0.00 H new ATOM 320 N VAL B 27 -7.183 4.512 -0.565 1.00 0.00 N ATOM 321 CA VAL B 27 -7.192 3.064 -0.915 1.00 0.00 C ATOM 322 C VAL B 27 -8.586 2.661 -1.400 1.00 0.00 C ATOM 323 O VAL B 27 -8.735 1.902 -2.337 1.00 0.00 O ATOM 324 CB VAL B 27 -6.850 2.264 0.343 1.00 0.00 C ATOM 325 CG1 VAL B 27 -6.921 0.764 0.046 1.00 0.00 C ATOM 326 CG2 VAL B 27 -5.438 2.625 0.810 1.00 0.00 C ATOM 0 H VAL B 27 -7.030 4.716 0.423 1.00 0.00 H new ATOM 0 HA VAL B 27 -6.466 2.866 -1.704 1.00 0.00 H new ATOM 0 HB VAL B 27 -7.568 2.507 1.126 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -6.676 0.203 0.948 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -7.928 0.505 -0.280 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -6.209 0.515 -0.741 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -5.194 2.055 1.706 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -4.722 2.387 0.023 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -5.390 3.691 1.034 1.00 0.00 H new ATOM 336 N VAL B 28 -9.608 3.168 -0.766 1.00 0.00 N ATOM 337 CA VAL B 28 -10.994 2.813 -1.183 1.00 0.00 C ATOM 338 C VAL B 28 -11.240 3.347 -2.595 1.00 0.00 C ATOM 339 O VAL B 28 -11.755 2.657 -3.453 1.00 0.00 O ATOM 340 CB VAL B 28 -12.003 3.444 -0.221 1.00 0.00 C ATOM 341 CG1 VAL B 28 -13.416 3.254 -0.773 1.00 0.00 C ATOM 342 CG2 VAL B 28 -11.896 2.767 1.148 1.00 0.00 C ATOM 0 H VAL B 28 -9.543 3.812 0.022 1.00 0.00 H new ATOM 0 HA VAL B 28 -11.113 1.730 -1.167 1.00 0.00 H new ATOM 0 HB VAL B 28 -11.791 4.508 -0.117 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -14.137 3.703 -0.090 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -13.493 3.734 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -13.627 2.189 -0.875 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -12.615 3.216 1.833 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -12.109 1.703 1.045 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -10.888 2.899 1.541 1.00 0.00 H new ATOM 352 N ALA B 29 -10.877 4.577 -2.839 1.00 0.00 N ATOM 353 CA ALA B 29 -11.088 5.168 -4.191 1.00 0.00 C ATOM 354 C ALA B 29 -10.188 4.467 -5.210 1.00 0.00 C ATOM 355 O ALA B 29 -10.636 4.037 -6.254 1.00 0.00 O ATOM 356 CB ALA B 29 -10.744 6.658 -4.157 1.00 0.00 C ATOM 0 H ALA B 29 -10.442 5.200 -2.158 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.131 5.038 -4.478 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -10.898 7.090 -5.146 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -11.387 7.163 -3.436 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -9.701 6.784 -3.865 1.00 0.00 H new ATOM 362 N ALA B 30 -8.923 4.340 -4.917 1.00 0.00 N ATOM 363 CA ALA B 30 -8.001 3.665 -5.873 1.00 0.00 C ATOM 364 C ALA B 30 -8.509 2.247 -6.146 1.00 0.00 C ATOM 365 O ALA B 30 -8.411 1.741 -7.246 1.00 0.00 O ATOM 366 CB ALA B 30 -6.602 3.593 -5.259 1.00 0.00 C ATOM 0 H ALA B 30 -8.488 4.674 -4.057 1.00 0.00 H new ATOM 0 HA ALA B 30 -7.962 4.227 -6.806 1.00 0.00 H new ATOM 0 HB1 ALA B 30 -5.924 3.100 -5.955 1.00 0.00 H new ATOM 0 HB2 ALA B 30 -6.242 4.601 -5.055 1.00 0.00 H new ATOM 0 HB3 ALA B 30 -6.642 3.027 -4.329 1.00 0.00 H new ATOM 372 N SER B 31 -9.053 1.604 -5.150 1.00 0.00 N ATOM 373 CA SER B 31 -9.568 0.219 -5.345 1.00 0.00 C ATOM 374 C SER B 31 -10.751 0.244 -6.315 1.00 0.00 C ATOM 375 O SER B 31 -10.871 -0.596 -7.185 1.00 0.00 O ATOM 376 CB SER B 31 -10.027 -0.346 -4.001 1.00 0.00 C ATOM 377 OG SER B 31 -11.158 0.385 -3.548 1.00 0.00 O ATOM 0 H SER B 31 -9.163 1.978 -4.208 1.00 0.00 H new ATOM 0 HA SER B 31 -8.776 -0.408 -5.754 1.00 0.00 H new ATOM 0 HB2 SER B 31 -10.279 -1.402 -4.104 1.00 0.00 H new ATOM 0 HB3 SER B 31 -9.220 -0.280 -3.271 1.00 0.00 H new ATOM 0 HG SER B 31 -11.048 1.332 -3.775 1.00 0.00 H new ATOM 383 N ILE B 32 -11.626 1.203 -6.173 1.00 0.00 N ATOM 384 CA ILE B 32 -12.800 1.279 -7.087 1.00 0.00 C ATOM 385 C ILE B 32 -12.327 1.647 -8.495 1.00 0.00 C ATOM 386 O ILE B 32 -12.676 1.004 -9.466 1.00 0.00 O ATOM 387 CB ILE B 32 -13.771 2.349 -6.583 1.00 0.00 C ATOM 388 CG1 ILE B 32 -14.251 1.980 -5.177 1.00 0.00 C ATOM 389 CG2 ILE B 32 -14.973 2.433 -7.525 1.00 0.00 C ATOM 390 CD1 ILE B 32 -14.902 3.200 -4.523 1.00 0.00 C ATOM 0 H ILE B 32 -11.578 1.935 -5.465 1.00 0.00 H new ATOM 0 HA ILE B 32 -13.303 0.312 -7.112 1.00 0.00 H new ATOM 0 HB ILE B 32 -13.264 3.314 -6.554 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -14.965 1.158 -5.229 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -13.411 1.635 -4.573 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -15.664 3.195 -7.166 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -14.633 2.695 -8.527 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -15.480 1.469 -7.555 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -15.244 2.937 -3.522 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -14.175 4.009 -4.457 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -15.752 3.524 -5.123 1.00 0.00 H new ATOM 402 N ILE B 33 -11.536 2.677 -8.614 1.00 0.00 N ATOM 403 CA ILE B 33 -11.042 3.090 -9.958 1.00 0.00 C ATOM 404 C ILE B 33 -10.129 2.006 -10.534 1.00 0.00 C ATOM 405 O ILE B 33 -10.196 1.685 -11.704 1.00 0.00 O ATOM 406 CB ILE B 33 -10.261 4.398 -9.834 1.00 0.00 C ATOM 407 CG1 ILE B 33 -11.146 5.460 -9.175 1.00 0.00 C ATOM 408 CG2 ILE B 33 -9.842 4.878 -11.225 1.00 0.00 C ATOM 409 CD1 ILE B 33 -10.291 6.666 -8.783 1.00 0.00 C ATOM 0 H ILE B 33 -11.210 3.252 -7.837 1.00 0.00 H new ATOM 0 HA ILE B 33 -11.894 3.233 -10.623 1.00 0.00 H new ATOM 0 HB ILE B 33 -9.373 4.233 -9.224 1.00 0.00 H new ATOM 0 HG12 ILE B 33 -11.935 5.768 -9.861 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -11.635 5.045 -8.293 1.00 0.00 H new ATOM 0 HG21 ILE B 33 -9.285 5.811 -11.136 1.00 0.00 H new ATOM 0 HG22 ILE B 33 -9.212 4.123 -11.696 1.00 0.00 H new ATOM 0 HG23 ILE B 33 -10.730 5.043 -11.836 1.00 0.00 H new ATOM 0 HD11 ILE B 33 -10.921 7.422 -8.314 1.00 0.00 H new ATOM 0 HD12 ILE B 33 -9.518 6.352 -8.081 1.00 0.00 H new ATOM 0 HD13 ILE B 33 -9.823 7.085 -9.674 1.00 0.00 H new ATOM 421 N GLY B 34 -9.274 1.434 -9.731 1.00 0.00 N ATOM 422 CA GLY B 34 -8.363 0.376 -10.250 1.00 0.00 C ATOM 423 C GLY B 34 -9.185 -0.822 -10.731 1.00 0.00 C ATOM 424 O GLY B 34 -8.915 -1.395 -11.768 1.00 0.00 O ATOM 0 H GLY B 34 -9.167 1.653 -8.741 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -7.762 0.770 -11.070 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -7.670 0.064 -9.469 1.00 0.00 H new ATOM 428 N ILE B 35 -10.187 -1.208 -9.989 1.00 0.00 N ATOM 429 CA ILE B 35 -11.022 -2.369 -10.409 1.00 0.00 C ATOM 430 C ILE B 35 -11.720 -2.046 -11.732 1.00 0.00 C ATOM 431 O ILE B 35 -11.488 -2.684 -12.740 1.00 0.00 O ATOM 432 CB ILE B 35 -12.070 -2.650 -9.332 1.00 0.00 C ATOM 433 CG1 ILE B 35 -11.366 -3.064 -8.037 1.00 0.00 C ATOM 434 CG2 ILE B 35 -12.994 -3.779 -9.792 1.00 0.00 C ATOM 435 CD1 ILE B 35 -12.333 -2.917 -6.860 1.00 0.00 C ATOM 0 H ILE B 35 -10.463 -0.770 -9.110 1.00 0.00 H new ATOM 0 HA ILE B 35 -10.389 -3.247 -10.542 1.00 0.00 H new ATOM 0 HB ILE B 35 -12.660 -1.750 -9.158 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -11.022 -4.095 -8.112 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -10.484 -2.444 -7.876 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -13.739 -3.976 -9.021 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -13.495 -3.486 -10.715 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -12.407 -4.681 -9.968 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -11.832 -3.212 -5.938 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -12.656 -1.879 -6.782 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -13.202 -3.556 -7.021 1.00 0.00 H new ATOM 447 N LEU B 36 -12.579 -1.064 -11.734 1.00 0.00 N ATOM 448 CA LEU B 36 -13.298 -0.705 -12.989 1.00 0.00 C ATOM 449 C LEU B 36 -12.286 -0.296 -14.062 1.00 0.00 C ATOM 450 O LEU B 36 -12.423 -0.638 -15.220 1.00 0.00 O ATOM 451 CB LEU B 36 -14.252 0.460 -12.720 1.00 0.00 C ATOM 452 CG LEU B 36 -15.121 0.140 -11.502 1.00 0.00 C ATOM 453 CD1 LEU B 36 -16.015 1.338 -11.183 1.00 0.00 C ATOM 454 CD2 LEU B 36 -15.994 -1.080 -11.806 1.00 0.00 C ATOM 0 H LEU B 36 -12.814 -0.495 -10.921 1.00 0.00 H new ATOM 0 HA LEU B 36 -13.867 -1.567 -13.336 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -13.685 1.375 -12.545 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -14.881 0.637 -13.592 1.00 0.00 H new ATOM 0 HG LEU B 36 -14.481 -0.073 -10.646 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -16.634 1.109 -10.315 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -15.395 2.208 -10.967 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -16.655 1.552 -12.039 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -16.614 -1.309 -10.939 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -16.633 -0.866 -12.662 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -15.358 -1.935 -12.033 1.00 0.00 H new ATOM 466 N HIS B 37 -11.272 0.435 -13.688 1.00 0.00 N ATOM 467 CA HIS B 37 -10.253 0.868 -14.686 1.00 0.00 C ATOM 468 C HIS B 37 -9.575 -0.360 -15.296 1.00 0.00 C ATOM 469 O HIS B 37 -9.326 -0.416 -16.485 1.00 0.00 O ATOM 470 CB HIS B 37 -9.212 1.742 -13.985 1.00 0.00 C ATOM 471 CG HIS B 37 -8.008 1.943 -14.865 1.00 0.00 C ATOM 472 ND1 HIS B 37 -6.726 1.899 -14.348 1.00 0.00 N ATOM 473 CD2 HIS B 37 -7.865 2.248 -16.202 1.00 0.00 C ATOM 474 CE1 HIS B 37 -5.875 2.168 -15.346 1.00 0.00 C ATOM 475 NE2 HIS B 37 -6.508 2.403 -16.498 1.00 0.00 N ATOM 0 H HIS B 37 -11.105 0.752 -12.733 1.00 0.00 H new ATOM 0 HA HIS B 37 -10.733 1.437 -15.482 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -9.650 2.708 -13.734 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -8.910 1.275 -13.047 1.00 0.00 H new ATOM 0 HD1 HIS B 37 -6.474 1.698 -13.380 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -8.675 2.351 -16.909 1.00 0.00 H new ATOM 0 HE1 HIS B 37 -4.801 2.192 -15.232 1.00 0.00 H new ATOM 483 N LEU B 38 -9.265 -1.344 -14.497 1.00 0.00 N ATOM 484 CA LEU B 38 -8.601 -2.564 -15.036 1.00 0.00 C ATOM 485 C LEU B 38 -9.575 -3.336 -15.927 1.00 0.00 C ATOM 486 O LEU B 38 -9.208 -3.856 -16.960 1.00 0.00 O ATOM 487 CB LEU B 38 -8.177 -3.459 -13.871 1.00 0.00 C ATOM 488 CG LEU B 38 -7.143 -2.735 -13.007 1.00 0.00 C ATOM 489 CD1 LEU B 38 -6.722 -3.645 -11.852 1.00 0.00 C ATOM 490 CD2 LEU B 38 -5.918 -2.391 -13.856 1.00 0.00 C ATOM 0 H LEU B 38 -9.443 -1.356 -13.493 1.00 0.00 H new ATOM 0 HA LEU B 38 -7.730 -2.270 -15.621 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -9.046 -3.723 -13.269 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -7.758 -4.391 -14.251 1.00 0.00 H new ATOM 0 HG LEU B 38 -7.578 -1.818 -12.610 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -5.985 -3.132 -11.234 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -7.594 -3.892 -11.247 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -6.286 -4.561 -12.251 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -5.182 -1.875 -13.240 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -5.481 -3.308 -14.253 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -6.217 -1.745 -14.681 1.00 0.00 H new ATOM 502 N ILE B 39 -10.817 -3.409 -15.532 1.00 0.00 N ATOM 503 CA ILE B 39 -11.815 -4.150 -16.353 1.00 0.00 C ATOM 504 C ILE B 39 -11.908 -3.504 -17.736 1.00 0.00 C ATOM 505 O ILE B 39 -11.891 -4.176 -18.748 1.00 0.00 O ATOM 506 CB ILE B 39 -13.186 -4.096 -15.678 1.00 0.00 C ATOM 507 CG1 ILE B 39 -13.125 -4.820 -14.331 1.00 0.00 C ATOM 508 CG2 ILE B 39 -14.219 -4.782 -16.576 1.00 0.00 C ATOM 509 CD1 ILE B 39 -14.445 -4.621 -13.585 1.00 0.00 C ATOM 0 H ILE B 39 -11.183 -2.988 -14.678 1.00 0.00 H new ATOM 0 HA ILE B 39 -11.502 -5.190 -16.449 1.00 0.00 H new ATOM 0 HB ILE B 39 -13.471 -3.056 -15.517 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -12.939 -5.883 -14.485 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -12.297 -4.435 -13.736 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -15.198 -4.746 -16.098 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -14.265 -4.268 -17.536 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -13.931 -5.821 -16.734 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -14.402 -5.137 -12.626 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -14.612 -3.557 -13.418 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -15.264 -5.028 -14.179 1.00 0.00 H new ATOM 521 N LEU B 40 -12.010 -2.204 -17.786 1.00 0.00 N ATOM 522 CA LEU B 40 -12.111 -1.507 -19.099 1.00 0.00 C ATOM 523 C LEU B 40 -10.933 -1.883 -20.000 1.00 0.00 C ATOM 524 O LEU B 40 -11.087 -2.034 -21.196 1.00 0.00 O ATOM 525 CB LEU B 40 -12.095 0.006 -18.868 1.00 0.00 C ATOM 526 CG LEU B 40 -13.236 0.397 -17.927 1.00 0.00 C ATOM 527 CD1 LEU B 40 -13.267 1.918 -17.772 1.00 0.00 C ATOM 528 CD2 LEU B 40 -14.567 -0.082 -18.510 1.00 0.00 C ATOM 0 H LEU B 40 -12.028 -1.592 -16.970 1.00 0.00 H new ATOM 0 HA LEU B 40 -13.039 -1.808 -19.584 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.139 0.308 -18.441 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -12.199 0.530 -19.818 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.079 -0.067 -16.953 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -14.079 2.199 -17.102 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -12.319 2.261 -17.357 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -13.425 2.380 -18.747 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -15.379 0.197 -17.839 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -14.725 0.381 -19.484 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -14.546 -1.166 -18.623 1.00 0.00 H new ATOM 540 N TRP B 41 -9.759 -2.050 -19.455 1.00 0.00 N ATOM 541 CA TRP B 41 -8.592 -2.416 -20.306 1.00 0.00 C ATOM 542 C TRP B 41 -8.810 -3.803 -20.913 1.00 0.00 C ATOM 543 O TRP B 41 -8.568 -4.022 -22.083 1.00 0.00 O ATOM 544 CB TRP B 41 -7.334 -2.424 -19.435 1.00 0.00 C ATOM 545 CG TRP B 41 -6.654 -1.098 -19.546 1.00 0.00 C ATOM 546 CD1 TRP B 41 -6.351 -0.277 -18.503 1.00 0.00 C ATOM 547 CD2 TRP B 41 -6.189 -0.418 -20.752 1.00 0.00 C ATOM 548 NE1 TRP B 41 -5.731 0.857 -19.005 1.00 0.00 N ATOM 549 CE2 TRP B 41 -5.614 0.812 -20.374 1.00 0.00 C ATOM 550 CE3 TRP B 41 -6.209 -0.743 -22.125 1.00 0.00 C ATOM 551 CZ2 TRP B 41 -5.078 1.691 -21.311 1.00 0.00 C ATOM 552 CZ3 TRP B 41 -5.667 0.146 -23.073 1.00 0.00 C ATOM 553 CH2 TRP B 41 -5.103 1.360 -22.663 1.00 0.00 C ATOM 0 H TRP B 41 -9.558 -1.949 -18.460 1.00 0.00 H new ATOM 0 HA TRP B 41 -8.480 -1.692 -21.113 1.00 0.00 H new ATOM 0 HB2 TRP B 41 -7.597 -2.626 -18.397 1.00 0.00 H new ATOM 0 HB3 TRP B 41 -6.661 -3.220 -19.754 1.00 0.00 H new ATOM 0 HD1 TRP B 41 -6.558 -0.475 -17.462 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -5.402 1.631 -18.428 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -6.642 -1.678 -22.450 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -4.644 2.627 -20.990 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -5.686 -0.110 -24.122 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -4.688 2.038 -23.394 1.00 0.00 H new ATOM 564 N ILE B 42 -9.261 -4.746 -20.131 1.00 0.00 N ATOM 565 CA ILE B 42 -9.489 -6.116 -20.669 1.00 0.00 C ATOM 566 C ILE B 42 -10.487 -6.056 -21.828 1.00 0.00 C ATOM 567 O ILE B 42 -10.342 -6.746 -22.818 1.00 0.00 O ATOM 568 CB ILE B 42 -10.046 -7.004 -19.555 1.00 0.00 C ATOM 569 CG1 ILE B 42 -9.152 -6.877 -18.319 1.00 0.00 C ATOM 570 CG2 ILE B 42 -10.072 -8.461 -20.017 1.00 0.00 C ATOM 571 CD1 ILE B 42 -9.800 -7.602 -17.138 1.00 0.00 C ATOM 0 H ILE B 42 -9.481 -4.626 -19.142 1.00 0.00 H new ATOM 0 HA ILE B 42 -8.548 -6.529 -21.031 1.00 0.00 H new ATOM 0 HB ILE B 42 -11.061 -6.688 -19.312 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -8.169 -7.301 -18.524 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -9.001 -5.826 -18.074 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -10.470 -9.089 -19.219 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -10.705 -8.552 -20.900 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -9.060 -8.783 -20.262 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -9.161 -7.510 -16.260 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -10.773 -7.157 -16.928 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -9.928 -8.656 -17.384 1.00 0.00 H new ATOM 583 N LEU B 43 -11.502 -5.245 -21.711 1.00 0.00 N ATOM 584 CA LEU B 43 -12.508 -5.148 -22.806 1.00 0.00 C ATOM 585 C LEU B 43 -11.873 -4.493 -24.034 1.00 0.00 C ATOM 586 O LEU B 43 -12.017 -4.965 -25.145 1.00 0.00 O ATOM 587 CB LEU B 43 -13.696 -4.307 -22.335 1.00 0.00 C ATOM 588 CG LEU B 43 -14.249 -4.888 -21.033 1.00 0.00 C ATOM 589 CD1 LEU B 43 -15.548 -4.171 -20.664 1.00 0.00 C ATOM 590 CD2 LEU B 43 -14.527 -6.382 -21.220 1.00 0.00 C ATOM 0 H LEU B 43 -11.678 -4.645 -20.905 1.00 0.00 H new ATOM 0 HA LEU B 43 -12.852 -6.148 -23.069 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -13.385 -3.274 -22.181 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -14.473 -4.296 -23.099 1.00 0.00 H new ATOM 0 HG LEU B 43 -13.519 -4.750 -20.235 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -15.942 -4.586 -19.736 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -15.351 -3.107 -20.531 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -16.279 -4.308 -21.461 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -14.921 -6.798 -20.293 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -15.257 -6.519 -22.018 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -13.601 -6.894 -21.482 1.00 0.00 H new TER 602 LEU B 43 ATOM 603 N LEU C 26 4.033 8.116 0.203 1.00 0.00 N ATOM 604 CA LEU C 26 3.885 7.344 -1.063 1.00 0.00 C ATOM 605 C LEU C 26 2.415 7.363 -1.490 1.00 0.00 C ATOM 606 O LEU C 26 2.097 7.542 -2.648 1.00 0.00 O ATOM 607 CB LEU C 26 4.326 5.898 -0.829 1.00 0.00 C ATOM 608 CG LEU C 26 5.750 5.878 -0.271 1.00 0.00 C ATOM 609 CD1 LEU C 26 6.201 4.430 -0.074 1.00 0.00 C ATOM 610 CD2 LEU C 26 6.693 6.576 -1.253 1.00 0.00 C ATOM 0 HA LEU C 26 4.502 7.791 -1.843 1.00 0.00 H new ATOM 0 HB2 LEU C 26 3.645 5.408 -0.133 1.00 0.00 H new ATOM 0 HB3 LEU C 26 4.283 5.339 -1.764 1.00 0.00 H new ATOM 0 HG LEU C 26 5.772 6.399 0.686 1.00 0.00 H new ATOM 0 HD11 LEU C 26 7.216 4.416 0.324 1.00 0.00 H new ATOM 0 HD12 LEU C 26 5.530 3.932 0.626 1.00 0.00 H new ATOM 0 HD13 LEU C 26 6.179 3.909 -1.031 1.00 0.00 H new ATOM 0 HD21 LEU C 26 7.708 6.562 -0.855 1.00 0.00 H new ATOM 0 HD22 LEU C 26 6.671 6.056 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU C 26 6.373 7.608 -1.394 1.00 0.00 H new ATOM 621 N VAL C 27 1.513 7.183 -0.565 1.00 0.00 N ATOM 622 CA VAL C 27 0.064 7.192 -0.915 1.00 0.00 C ATOM 623 C VAL C 27 -0.339 8.587 -1.400 1.00 0.00 C ATOM 624 O VAL C 27 -1.098 8.735 -2.337 1.00 0.00 O ATOM 625 CB VAL C 27 -0.736 6.850 0.343 1.00 0.00 C ATOM 626 CG1 VAL C 27 -2.236 6.921 0.046 1.00 0.00 C ATOM 627 CG2 VAL C 27 -0.375 5.438 0.810 1.00 0.00 C ATOM 0 H VAL C 27 1.718 7.029 0.422 1.00 0.00 H new ATOM 0 HA VAL C 27 -0.134 6.466 -1.704 1.00 0.00 H new ATOM 0 HB VAL C 27 -0.493 7.568 1.126 1.00 0.00 H new ATOM 0 HG11 VAL C 27 -2.797 6.676 0.948 1.00 0.00 H new ATOM 0 HG12 VAL C 27 -2.495 7.928 -0.280 1.00 0.00 H new ATOM 0 HG13 VAL C 27 -2.485 6.209 -0.741 1.00 0.00 H new ATOM 0 HG21 VAL C 27 -0.945 5.194 1.706 1.00 0.00 H new ATOM 0 HG22 VAL C 27 -0.613 4.722 0.023 1.00 0.00 H new ATOM 0 HG23 VAL C 27 0.691 5.390 1.034 1.00 0.00 H new ATOM 637 N VAL C 28 0.168 9.608 -0.766 1.00 0.00 N ATOM 638 CA VAL C 28 -0.186 10.994 -1.183 1.00 0.00 C ATOM 639 C VAL C 28 0.347 11.240 -2.595 1.00 0.00 C ATOM 640 O VAL C 28 -0.343 11.755 -3.453 1.00 0.00 O ATOM 641 CB VAL C 28 0.444 12.003 -0.221 1.00 0.00 C ATOM 642 CG1 VAL C 28 0.255 13.416 -0.773 1.00 0.00 C ATOM 643 CG2 VAL C 28 -0.233 11.896 1.148 1.00 0.00 C ATOM 0 H VAL C 28 0.812 9.543 0.022 1.00 0.00 H new ATOM 0 HA VAL C 28 -1.269 11.113 -1.167 1.00 0.00 H new ATOM 0 HB VAL C 28 1.508 11.791 -0.117 1.00 0.00 H new ATOM 0 HG11 VAL C 28 0.703 14.137 -0.089 1.00 0.00 H new ATOM 0 HG12 VAL C 28 0.736 13.493 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL C 28 -0.809 13.627 -0.876 1.00 0.00 H new ATOM 0 HG21 VAL C 28 0.216 12.615 1.833 1.00 0.00 H new ATOM 0 HG22 VAL C 28 -1.297 12.108 1.045 1.00 0.00 H new ATOM 0 HG23 VAL C 28 -0.101 10.888 1.542 1.00 0.00 H new ATOM 653 N ALA C 29 1.578 10.877 -2.839 1.00 0.00 N ATOM 654 CA ALA C 29 2.168 11.088 -4.191 1.00 0.00 C ATOM 655 C ALA C 29 1.467 10.188 -5.210 1.00 0.00 C ATOM 656 O ALA C 29 1.038 10.636 -6.254 1.00 0.00 O ATOM 657 CB ALA C 29 3.658 10.744 -4.157 1.00 0.00 C ATOM 0 H ALA C 29 2.201 10.443 -2.158 1.00 0.00 H new ATOM 0 HA ALA C 29 2.037 12.131 -4.479 1.00 0.00 H new ATOM 0 HB1 ALA C 29 4.090 10.898 -5.146 1.00 0.00 H new ATOM 0 HB2 ALA C 29 4.163 11.387 -3.436 1.00 0.00 H new ATOM 0 HB3 ALA C 29 3.784 9.702 -3.865 1.00 0.00 H new ATOM 663 N ALA C 30 1.340 8.923 -4.917 1.00 0.00 N ATOM 664 CA ALA C 30 0.665 8.001 -5.873 1.00 0.00 C ATOM 665 C ALA C 30 -0.753 8.509 -6.146 1.00 0.00 C ATOM 666 O ALA C 30 -1.259 8.411 -7.246 1.00 0.00 O ATOM 667 CB ALA C 30 0.593 6.602 -5.259 1.00 0.00 C ATOM 0 H ALA C 30 1.674 8.488 -4.057 1.00 0.00 H new ATOM 0 HA ALA C 30 1.227 7.962 -6.806 1.00 0.00 H new ATOM 0 HB1 ALA C 30 0.100 5.924 -5.955 1.00 0.00 H new ATOM 0 HB2 ALA C 30 1.601 6.242 -5.055 1.00 0.00 H new ATOM 0 HB3 ALA C 30 0.027 6.642 -4.329 1.00 0.00 H new ATOM 673 N SER C 31 -1.396 9.053 -5.150 1.00 0.00 N ATOM 674 CA SER C 31 -2.781 9.568 -5.345 1.00 0.00 C ATOM 675 C SER C 31 -2.756 10.751 -6.315 1.00 0.00 C ATOM 676 O SER C 31 -3.596 10.871 -7.185 1.00 0.00 O ATOM 677 CB SER C 31 -3.346 10.027 -4.001 1.00 0.00 C ATOM 678 OG SER C 31 -2.615 11.158 -3.548 1.00 0.00 O ATOM 0 H SER C 31 -1.022 9.163 -4.208 1.00 0.00 H new ATOM 0 HA SER C 31 -3.408 8.776 -5.754 1.00 0.00 H new ATOM 0 HB2 SER C 31 -4.402 10.279 -4.104 1.00 0.00 H new ATOM 0 HB3 SER C 31 -3.280 9.220 -3.271 1.00 0.00 H new ATOM 0 HG SER C 31 -1.663 11.034 -3.747 1.00 0.00 H new ATOM 684 N ILE C 32 -1.797 11.626 -6.173 1.00 0.00 N ATOM 685 CA ILE C 32 -1.721 12.800 -7.087 1.00 0.00 C ATOM 686 C ILE C 32 -1.353 12.327 -8.495 1.00 0.00 C ATOM 687 O ILE C 32 -1.996 12.676 -9.466 1.00 0.00 O ATOM 688 CB ILE C 32 -0.651 13.771 -6.583 1.00 0.00 C ATOM 689 CG1 ILE C 32 -1.020 14.251 -5.177 1.00 0.00 C ATOM 690 CG2 ILE C 32 -0.567 14.973 -7.525 1.00 0.00 C ATOM 691 CD1 ILE C 32 0.200 14.902 -4.523 1.00 0.00 C ATOM 0 H ILE C 32 -1.065 11.578 -5.465 1.00 0.00 H new ATOM 0 HA ILE C 32 -2.688 13.303 -7.112 1.00 0.00 H new ATOM 0 HB ILE C 32 0.314 13.264 -6.554 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -1.842 14.965 -5.229 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -1.365 13.411 -4.573 1.00 0.00 H new ATOM 0 HG21 ILE C 32 0.195 15.664 -7.166 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -0.305 14.633 -8.527 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -1.531 15.480 -7.555 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -0.063 15.244 -3.522 1.00 0.00 H new ATOM 0 HD12 ILE C 32 1.009 14.175 -4.457 1.00 0.00 H new ATOM 0 HD13 ILE C 32 0.524 15.752 -5.123 1.00 0.00 H new ATOM 703 N ILE C 33 -0.323 11.536 -8.614 1.00 0.00 N ATOM 704 CA ILE C 33 0.090 11.042 -9.958 1.00 0.00 C ATOM 705 C ILE C 33 -0.994 10.129 -10.534 1.00 0.00 C ATOM 706 O ILE C 33 -1.314 10.196 -11.704 1.00 0.00 O ATOM 707 CB ILE C 33 1.399 10.261 -9.834 1.00 0.00 C ATOM 708 CG1 ILE C 33 2.460 11.146 -9.175 1.00 0.00 C ATOM 709 CG2 ILE C 33 1.878 9.842 -11.225 1.00 0.00 C ATOM 710 CD1 ILE C 33 3.666 10.291 -8.783 1.00 0.00 C ATOM 0 H ILE C 33 0.252 11.210 -7.837 1.00 0.00 H new ATOM 0 HA ILE C 33 0.232 11.893 -10.623 1.00 0.00 H new ATOM 0 HB ILE C 33 1.235 9.373 -9.224 1.00 0.00 H new ATOM 0 HG12 ILE C 33 2.768 11.935 -9.861 1.00 0.00 H new ATOM 0 HG13 ILE C 33 2.045 11.634 -8.293 1.00 0.00 H new ATOM 0 HG21 ILE C 33 2.811 9.285 -11.136 1.00 0.00 H new ATOM 0 HG22 ILE C 33 1.123 9.212 -11.695 1.00 0.00 H new ATOM 0 HG23 ILE C 33 2.042 10.730 -11.836 1.00 0.00 H new ATOM 0 HD11 ILE C 33 4.422 10.921 -8.314 1.00 0.00 H new ATOM 0 HD12 ILE C 33 3.352 9.518 -8.082 1.00 0.00 H new ATOM 0 HD13 ILE C 33 4.086 9.824 -9.674 1.00 0.00 H new ATOM 722 N GLY C 34 -1.566 9.274 -9.731 1.00 0.00 N ATOM 723 CA GLY C 34 -2.624 8.364 -10.250 1.00 0.00 C ATOM 724 C GLY C 34 -3.822 9.185 -10.731 1.00 0.00 C ATOM 725 O GLY C 34 -4.395 8.915 -11.768 1.00 0.00 O ATOM 0 H GLY C 34 -1.347 9.167 -8.741 1.00 0.00 H new ATOM 0 HA2 GLY C 34 -2.230 7.763 -11.070 1.00 0.00 H new ATOM 0 HA3 GLY C 34 -2.936 7.671 -9.469 1.00 0.00 H new ATOM 729 N ILE C 35 -4.208 10.187 -9.989 1.00 0.00 N ATOM 730 CA ILE C 35 -5.369 11.022 -10.409 1.00 0.00 C ATOM 731 C ILE C 35 -5.046 11.720 -11.732 1.00 0.00 C ATOM 732 O ILE C 35 -5.684 11.488 -12.740 1.00 0.00 O ATOM 733 CB ILE C 35 -5.650 12.070 -9.332 1.00 0.00 C ATOM 734 CG1 ILE C 35 -6.064 11.366 -8.037 1.00 0.00 C ATOM 735 CG2 ILE C 35 -6.779 12.994 -9.792 1.00 0.00 C ATOM 736 CD1 ILE C 35 -5.917 12.333 -6.860 1.00 0.00 C ATOM 0 H ILE C 35 -3.770 10.463 -9.110 1.00 0.00 H new ATOM 0 HA ILE C 35 -6.247 10.389 -10.542 1.00 0.00 H new ATOM 0 HB ILE C 35 -4.750 12.660 -9.158 1.00 0.00 H new ATOM 0 HG12 ILE C 35 -7.095 11.022 -8.112 1.00 0.00 H new ATOM 0 HG13 ILE C 35 -5.444 10.484 -7.876 1.00 0.00 H new ATOM 0 HG21 ILE C 35 -6.976 13.739 -9.021 1.00 0.00 H new ATOM 0 HG22 ILE C 35 -6.486 13.495 -10.715 1.00 0.00 H new ATOM 0 HG23 ILE C 35 -7.681 12.407 -9.968 1.00 0.00 H new ATOM 0 HD11 ILE C 35 -6.212 11.832 -5.938 1.00 0.00 H new ATOM 0 HD12 ILE C 35 -4.879 12.656 -6.782 1.00 0.00 H new ATOM 0 HD13 ILE C 35 -6.556 13.202 -7.021 1.00 0.00 H new ATOM 748 N LEU C 36 -4.064 12.579 -11.734 1.00 0.00 N ATOM 749 CA LEU C 36 -3.705 13.298 -12.989 1.00 0.00 C ATOM 750 C LEU C 36 -3.296 12.286 -14.062 1.00 0.00 C ATOM 751 O LEU C 36 -3.638 12.423 -15.220 1.00 0.00 O ATOM 752 CB LEU C 36 -2.540 14.252 -12.720 1.00 0.00 C ATOM 753 CG LEU C 36 -2.860 15.121 -11.502 1.00 0.00 C ATOM 754 CD1 LEU C 36 -1.661 16.015 -11.183 1.00 0.00 C ATOM 755 CD2 LEU C 36 -4.080 15.994 -11.806 1.00 0.00 C ATOM 0 H LEU C 36 -3.495 12.814 -10.921 1.00 0.00 H new ATOM 0 HA LEU C 36 -4.567 13.867 -13.336 1.00 0.00 H new ATOM 0 HB2 LEU C 36 -1.625 13.685 -12.545 1.00 0.00 H new ATOM 0 HB3 LEU C 36 -2.363 14.881 -13.592 1.00 0.00 H new ATOM 0 HG LEU C 36 -3.074 14.481 -10.646 1.00 0.00 H new ATOM 0 HD11 LEU C 36 -1.889 16.634 -10.315 1.00 0.00 H new ATOM 0 HD12 LEU C 36 -0.791 15.394 -10.967 1.00 0.00 H new ATOM 0 HD13 LEU C 36 -1.446 16.655 -12.039 1.00 0.00 H new ATOM 0 HD21 LEU C 36 -4.309 16.614 -10.939 1.00 0.00 H new ATOM 0 HD22 LEU C 36 -3.866 16.633 -12.662 1.00 0.00 H new ATOM 0 HD23 LEU C 36 -4.935 15.358 -12.033 1.00 0.00 H new ATOM 767 N HIS C 37 -2.565 11.272 -13.688 1.00 0.00 N ATOM 768 CA HIS C 37 -2.131 10.253 -14.686 1.00 0.00 C ATOM 769 C HIS C 37 -3.360 9.575 -15.296 1.00 0.00 C ATOM 770 O HIS C 37 -3.416 9.326 -16.485 1.00 0.00 O ATOM 771 CB HIS C 37 -1.258 9.212 -13.985 1.00 0.00 C ATOM 772 CG HIS C 37 -1.057 8.008 -14.865 1.00 0.00 C ATOM 773 ND1 HIS C 37 -1.101 6.726 -14.348 1.00 0.00 N ATOM 774 CD2 HIS C 37 -0.751 7.865 -16.202 1.00 0.00 C ATOM 775 CE1 HIS C 37 -0.832 5.875 -15.346 1.00 0.00 C ATOM 776 NE2 HIS C 37 -0.596 6.508 -16.498 1.00 0.00 N ATOM 0 H HIS C 37 -2.249 11.105 -12.733 1.00 0.00 H new ATOM 0 HA HIS C 37 -1.561 10.733 -15.481 1.00 0.00 H new ATOM 0 HB2 HIS C 37 -0.292 9.650 -13.733 1.00 0.00 H new ATOM 0 HB3 HIS C 37 -1.725 8.910 -13.048 1.00 0.00 H new ATOM 0 HD1 HIS C 37 -1.302 6.474 -13.380 1.00 0.00 H new ATOM 0 HD2 HIS C 37 -0.647 8.675 -16.909 1.00 0.00 H new ATOM 0 HE1 HIS C 37 -0.809 4.801 -15.233 1.00 0.00 H new ATOM 784 N LEU C 38 -4.344 9.265 -14.497 1.00 0.00 N ATOM 785 CA LEU C 38 -5.563 8.601 -15.036 1.00 0.00 C ATOM 786 C LEU C 38 -6.336 9.575 -15.927 1.00 0.00 C ATOM 787 O LEU C 38 -6.856 9.208 -16.960 1.00 0.00 O ATOM 788 CB LEU C 38 -6.459 8.177 -13.871 1.00 0.00 C ATOM 789 CG LEU C 38 -5.735 7.143 -13.007 1.00 0.00 C ATOM 790 CD1 LEU C 38 -6.645 6.722 -11.852 1.00 0.00 C ATOM 791 CD2 LEU C 38 -5.391 5.918 -13.856 1.00 0.00 C ATOM 0 H LEU C 38 -4.356 9.443 -13.493 1.00 0.00 H new ATOM 0 HA LEU C 38 -5.268 7.730 -15.621 1.00 0.00 H new ATOM 0 HB2 LEU C 38 -6.723 9.046 -13.269 1.00 0.00 H new ATOM 0 HB3 LEU C 38 -7.391 7.758 -14.251 1.00 0.00 H new ATOM 0 HG LEU C 38 -4.818 7.578 -12.610 1.00 0.00 H new ATOM 0 HD11 LEU C 38 -6.132 5.985 -11.234 1.00 0.00 H new ATOM 0 HD12 LEU C 38 -6.892 7.594 -11.247 1.00 0.00 H new ATOM 0 HD13 LEU C 38 -7.561 6.286 -12.251 1.00 0.00 H new ATOM 0 HD21 LEU C 38 -4.875 5.182 -13.240 1.00 0.00 H new ATOM 0 HD22 LEU C 38 -6.308 5.481 -14.253 1.00 0.00 H new ATOM 0 HD23 LEU C 38 -4.745 6.217 -14.681 1.00 0.00 H new ATOM 803 N ILE C 39 -6.408 10.817 -15.532 1.00 0.00 N ATOM 804 CA ILE C 39 -7.150 11.815 -16.353 1.00 0.00 C ATOM 805 C ILE C 39 -6.504 11.908 -17.736 1.00 0.00 C ATOM 806 O ILE C 39 -7.175 11.891 -18.748 1.00 0.00 O ATOM 807 CB ILE C 39 -7.096 13.186 -15.678 1.00 0.00 C ATOM 808 CG1 ILE C 39 -7.820 13.125 -14.331 1.00 0.00 C ATOM 809 CG2 ILE C 39 -7.782 14.219 -16.576 1.00 0.00 C ATOM 810 CD1 ILE C 39 -7.621 14.446 -13.585 1.00 0.00 C ATOM 0 H ILE C 39 -5.986 11.183 -14.678 1.00 0.00 H new ATOM 0 HA ILE C 39 -8.190 11.502 -16.449 1.00 0.00 H new ATOM 0 HB ILE C 39 -6.056 13.471 -15.517 1.00 0.00 H new ATOM 0 HG12 ILE C 39 -8.883 12.939 -14.485 1.00 0.00 H new ATOM 0 HG13 ILE C 39 -7.434 12.297 -13.736 1.00 0.00 H new ATOM 0 HG21 ILE C 39 -7.746 15.198 -16.098 1.00 0.00 H new ATOM 0 HG22 ILE C 39 -7.268 14.265 -17.536 1.00 0.00 H new ATOM 0 HG23 ILE C 39 -8.821 13.931 -16.734 1.00 0.00 H new ATOM 0 HD11 ILE C 39 -8.136 14.403 -12.626 1.00 0.00 H new ATOM 0 HD12 ILE C 39 -6.557 14.613 -13.418 1.00 0.00 H new ATOM 0 HD13 ILE C 39 -8.028 15.264 -14.179 1.00 0.00 H new ATOM 822 N LEU C 40 -5.204 12.010 -17.786 1.00 0.00 N ATOM 823 CA LEU C 40 -4.507 12.111 -19.099 1.00 0.00 C ATOM 824 C LEU C 40 -4.883 10.933 -20.000 1.00 0.00 C ATOM 825 O LEU C 40 -5.034 11.087 -21.196 1.00 0.00 O ATOM 826 CB LEU C 40 -2.994 12.095 -18.868 1.00 0.00 C ATOM 827 CG LEU C 40 -2.603 13.236 -17.927 1.00 0.00 C ATOM 828 CD1 LEU C 40 -1.082 13.267 -17.772 1.00 0.00 C ATOM 829 CD2 LEU C 40 -3.082 14.567 -18.510 1.00 0.00 C ATOM 0 H LEU C 40 -4.592 12.028 -16.970 1.00 0.00 H new ATOM 0 HA LEU C 40 -4.808 13.039 -19.584 1.00 0.00 H new ATOM 0 HB2 LEU C 40 -2.692 11.139 -18.441 1.00 0.00 H new ATOM 0 HB3 LEU C 40 -2.470 12.199 -19.818 1.00 0.00 H new ATOM 0 HG LEU C 40 -3.067 13.079 -16.953 1.00 0.00 H new ATOM 0 HD11 LEU C 40 -0.801 14.079 -17.102 1.00 0.00 H new ATOM 0 HD12 LEU C 40 -0.739 12.319 -17.357 1.00 0.00 H new ATOM 0 HD13 LEU C 40 -0.620 13.425 -18.747 1.00 0.00 H new ATOM 0 HD21 LEU C 40 -2.803 15.379 -17.839 1.00 0.00 H new ATOM 0 HD22 LEU C 40 -2.619 14.725 -19.484 1.00 0.00 H new ATOM 0 HD23 LEU C 40 -4.166 14.546 -18.623 1.00 0.00 H new ATOM 841 N TRP C 41 -5.049 9.759 -19.455 1.00 0.00 N ATOM 842 CA TRP C 41 -5.416 8.592 -20.306 1.00 0.00 C ATOM 843 C TRP C 41 -6.803 8.811 -20.913 1.00 0.00 C ATOM 844 O TRP C 41 -7.022 8.568 -22.083 1.00 0.00 O ATOM 845 CB TRP C 41 -5.424 7.334 -19.435 1.00 0.00 C ATOM 846 CG TRP C 41 -4.097 6.654 -19.546 1.00 0.00 C ATOM 847 CD1 TRP C 41 -3.277 6.351 -18.503 1.00 0.00 C ATOM 848 CD2 TRP C 41 -3.418 6.189 -20.752 1.00 0.00 C ATOM 849 NE1 TRP C 41 -2.143 5.731 -19.005 1.00 0.00 N ATOM 850 CE2 TRP C 41 -2.188 5.614 -20.374 1.00 0.00 C ATOM 851 CE3 TRP C 41 -3.742 6.209 -22.125 1.00 0.00 C ATOM 852 CZ2 TRP C 41 -1.309 5.078 -21.311 1.00 0.00 C ATOM 853 CZ3 TRP C 41 -2.854 5.667 -23.073 1.00 0.00 C ATOM 854 CH2 TRP C 41 -1.639 5.103 -22.663 1.00 0.00 C ATOM 0 H TRP C 41 -4.947 9.558 -18.460 1.00 0.00 H new ATOM 0 HA TRP C 41 -4.693 8.479 -21.114 1.00 0.00 H new ATOM 0 HB2 TRP C 41 -5.626 7.597 -18.397 1.00 0.00 H new ATOM 0 HB3 TRP C 41 -6.220 6.661 -19.754 1.00 0.00 H new ATOM 0 HD1 TRP C 41 -3.476 6.558 -17.462 1.00 0.00 H new ATOM 0 HE1 TRP C 41 -1.369 5.402 -18.428 1.00 0.00 H new ATOM 0 HE3 TRP C 41 -4.676 6.642 -22.450 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 -0.374 4.644 -20.990 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 -3.111 5.686 -24.122 1.00 0.00 H new ATOM 0 HH2 TRP C 41 -0.960 4.689 -23.394 1.00 0.00 H new ATOM 865 N ILE C 42 -7.745 9.261 -20.131 1.00 0.00 N ATOM 866 CA ILE C 42 -9.116 9.489 -20.669 1.00 0.00 C ATOM 867 C ILE C 42 -9.056 10.487 -21.828 1.00 0.00 C ATOM 868 O ILE C 42 -9.746 10.342 -22.818 1.00 0.00 O ATOM 869 CB ILE C 42 -10.003 10.047 -19.555 1.00 0.00 C ATOM 870 CG1 ILE C 42 -9.877 9.152 -18.319 1.00 0.00 C ATOM 871 CG2 ILE C 42 -11.461 10.072 -20.017 1.00 0.00 C ATOM 872 CD1 ILE C 42 -10.602 9.800 -17.138 1.00 0.00 C ATOM 0 H ILE C 42 -7.625 9.481 -19.142 1.00 0.00 H new ATOM 0 HA ILE C 42 -9.529 8.548 -21.031 1.00 0.00 H new ATOM 0 HB ILE C 42 -9.687 11.061 -19.312 1.00 0.00 H new ATOM 0 HG12 ILE C 42 -10.302 8.170 -18.525 1.00 0.00 H new ATOM 0 HG13 ILE C 42 -8.826 9.000 -18.074 1.00 0.00 H new ATOM 0 HG21 ILE C 42 -12.089 10.470 -19.220 1.00 0.00 H new ATOM 0 HG22 ILE C 42 -11.552 10.704 -20.900 1.00 0.00 H new ATOM 0 HG23 ILE C 42 -11.783 9.059 -20.261 1.00 0.00 H new ATOM 0 HD11 ILE C 42 -10.511 9.161 -16.260 1.00 0.00 H new ATOM 0 HD12 ILE C 42 -10.157 10.772 -16.927 1.00 0.00 H new ATOM 0 HD13 ILE C 42 -11.656 9.929 -17.385 1.00 0.00 H new ATOM 884 N LEU C 43 -8.245 11.502 -21.711 1.00 0.00 N ATOM 885 CA LEU C 43 -8.148 12.508 -22.806 1.00 0.00 C ATOM 886 C LEU C 43 -7.493 11.873 -24.034 1.00 0.00 C ATOM 887 O LEU C 43 -7.965 12.017 -25.145 1.00 0.00 O ATOM 888 CB LEU C 43 -7.307 13.696 -22.335 1.00 0.00 C ATOM 889 CG LEU C 43 -7.888 14.249 -21.033 1.00 0.00 C ATOM 890 CD1 LEU C 43 -7.171 15.548 -20.664 1.00 0.00 C ATOM 891 CD2 LEU C 43 -9.382 14.527 -21.220 1.00 0.00 C ATOM 0 H LEU C 43 -7.645 11.678 -20.905 1.00 0.00 H new ATOM 0 HA LEU C 43 -9.148 12.852 -23.069 1.00 0.00 H new ATOM 0 HB2 LEU C 43 -6.274 13.385 -22.181 1.00 0.00 H new ATOM 0 HB3 LEU C 43 -7.296 14.473 -23.099 1.00 0.00 H new ATOM 0 HG LEU C 43 -7.750 13.519 -20.235 1.00 0.00 H new ATOM 0 HD11 LEU C 43 -7.586 15.942 -19.736 1.00 0.00 H new ATOM 0 HD12 LEU C 43 -6.107 15.351 -20.531 1.00 0.00 H new ATOM 0 HD13 LEU C 43 -7.308 16.279 -21.461 1.00 0.00 H new ATOM 0 HD21 LEU C 43 -9.798 14.921 -20.293 1.00 0.00 H new ATOM 0 HD22 LEU C 43 -9.519 15.257 -22.018 1.00 0.00 H new ATOM 0 HD23 LEU C 43 -9.894 13.601 -21.482 1.00 0.00 H new TER 903 LEU C 43 ATOM 904 N LEU D 26 5.116 -4.033 0.203 1.00 0.00 N ATOM 905 CA LEU D 26 4.344 -3.885 -1.063 1.00 0.00 C ATOM 906 C LEU D 26 4.362 -2.415 -1.490 1.00 0.00 C ATOM 907 O LEU D 26 4.542 -2.097 -2.648 1.00 0.00 O ATOM 908 CB LEU D 26 2.898 -4.326 -0.829 1.00 0.00 C ATOM 909 CG LEU D 26 2.878 -5.750 -0.271 1.00 0.00 C ATOM 910 CD1 LEU D 26 1.430 -6.201 -0.074 1.00 0.00 C ATOM 911 CD2 LEU D 26 3.576 -6.693 -1.253 1.00 0.00 C ATOM 0 HA LEU D 26 4.791 -4.502 -1.842 1.00 0.00 H new ATOM 0 HB2 LEU D 26 2.408 -3.645 -0.133 1.00 0.00 H new ATOM 0 HB3 LEU D 26 2.339 -4.283 -1.764 1.00 0.00 H new ATOM 0 HG LEU D 26 3.399 -5.772 0.686 1.00 0.00 H new ATOM 0 HD11 LEU D 26 1.416 -7.216 0.324 1.00 0.00 H new ATOM 0 HD12 LEU D 26 0.932 -5.530 0.626 1.00 0.00 H new ATOM 0 HD13 LEU D 26 0.909 -6.179 -1.031 1.00 0.00 H new ATOM 0 HD21 LEU D 26 3.562 -7.708 -0.855 1.00 0.00 H new ATOM 0 HD22 LEU D 26 3.056 -6.671 -2.211 1.00 0.00 H new ATOM 0 HD23 LEU D 26 4.608 -6.373 -1.394 1.00 0.00 H new ATOM 922 N VAL D 27 4.183 -1.513 -0.565 1.00 0.00 N ATOM 923 CA VAL D 27 4.192 -0.064 -0.915 1.00 0.00 C ATOM 924 C VAL D 27 5.586 0.339 -1.400 1.00 0.00 C ATOM 925 O VAL D 27 5.735 1.098 -2.337 1.00 0.00 O ATOM 926 CB VAL D 27 3.850 0.736 0.343 1.00 0.00 C ATOM 927 CG1 VAL D 27 3.921 2.236 0.046 1.00 0.00 C ATOM 928 CG2 VAL D 27 2.438 0.375 0.810 1.00 0.00 C ATOM 0 H VAL D 27 4.030 -1.718 0.422 1.00 0.00 H new ATOM 0 HA VAL D 27 3.466 0.134 -1.704 1.00 0.00 H new ATOM 0 HB VAL D 27 4.568 0.493 1.126 1.00 0.00 H new ATOM 0 HG11 VAL D 27 3.676 2.797 0.948 1.00 0.00 H new ATOM 0 HG12 VAL D 27 4.928 2.495 -0.280 1.00 0.00 H new ATOM 0 HG13 VAL D 27 3.209 2.485 -0.741 1.00 0.00 H new ATOM 0 HG21 VAL D 27 2.194 0.945 1.706 1.00 0.00 H new ATOM 0 HG22 VAL D 27 1.722 0.613 0.023 1.00 0.00 H new ATOM 0 HG23 VAL D 27 2.390 -0.691 1.034 1.00 0.00 H new ATOM 938 N VAL D 28 6.608 -0.168 -0.766 1.00 0.00 N ATOM 939 CA VAL D 28 7.994 0.187 -1.183 1.00 0.00 C ATOM 940 C VAL D 28 8.240 -0.347 -2.595 1.00 0.00 C ATOM 941 O VAL D 28 8.755 0.343 -3.453 1.00 0.00 O ATOM 942 CB VAL D 28 9.003 -0.444 -0.221 1.00 0.00 C ATOM 943 CG1 VAL D 28 10.416 -0.255 -0.773 1.00 0.00 C ATOM 944 CG2 VAL D 28 8.896 0.233 1.148 1.00 0.00 C ATOM 0 H VAL D 28 6.543 -0.812 0.022 1.00 0.00 H new ATOM 0 HA VAL D 28 8.113 1.270 -1.167 1.00 0.00 H new ATOM 0 HB VAL D 28 8.791 -1.508 -0.117 1.00 0.00 H new ATOM 0 HG11 VAL D 28 11.137 -0.704 -0.089 1.00 0.00 H new ATOM 0 HG12 VAL D 28 10.493 -0.736 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL D 28 10.627 0.809 -0.876 1.00 0.00 H new ATOM 0 HG21 VAL D 28 9.615 -0.216 1.833 1.00 0.00 H new ATOM 0 HG22 VAL D 28 9.109 1.297 1.045 1.00 0.00 H new ATOM 0 HG23 VAL D 28 7.888 0.101 1.541 1.00 0.00 H new ATOM 954 N ALA D 29 7.877 -1.577 -2.839 1.00 0.00 N ATOM 955 CA ALA D 29 8.088 -2.168 -4.191 1.00 0.00 C ATOM 956 C ALA D 29 7.188 -1.467 -5.210 1.00 0.00 C ATOM 957 O ALA D 29 7.636 -1.037 -6.254 1.00 0.00 O ATOM 958 CB ALA D 29 7.744 -3.658 -4.157 1.00 0.00 C ATOM 0 H ALA D 29 7.442 -2.200 -2.158 1.00 0.00 H new ATOM 0 HA ALA D 29 9.131 -2.038 -4.478 1.00 0.00 H new ATOM 0 HB1 ALA D 29 7.898 -4.090 -5.146 1.00 0.00 H new ATOM 0 HB2 ALA D 29 8.387 -4.163 -3.436 1.00 0.00 H new ATOM 0 HB3 ALA D 29 6.701 -3.784 -3.865 1.00 0.00 H new ATOM 964 N ALA D 30 5.923 -1.340 -4.917 1.00 0.00 N ATOM 965 CA ALA D 30 5.001 -0.665 -5.873 1.00 0.00 C ATOM 966 C ALA D 30 5.509 0.753 -6.146 1.00 0.00 C ATOM 967 O ALA D 30 5.411 1.259 -7.246 1.00 0.00 O ATOM 968 CB ALA D 30 3.602 -0.593 -5.259 1.00 0.00 C ATOM 0 H ALA D 30 5.488 -1.674 -4.057 1.00 0.00 H new ATOM 0 HA ALA D 30 4.962 -1.227 -6.806 1.00 0.00 H new ATOM 0 HB1 ALA D 30 2.924 -0.100 -5.955 1.00 0.00 H new ATOM 0 HB2 ALA D 30 3.242 -1.601 -5.055 1.00 0.00 H new ATOM 0 HB3 ALA D 30 3.642 -0.027 -4.329 1.00 0.00 H new ATOM 974 N SER D 31 6.053 1.396 -5.150 1.00 0.00 N ATOM 975 CA SER D 31 6.568 2.781 -5.345 1.00 0.00 C ATOM 976 C SER D 31 7.751 2.756 -6.315 1.00 0.00 C ATOM 977 O SER D 31 7.871 3.596 -7.185 1.00 0.00 O ATOM 978 CB SER D 31 7.027 3.346 -4.001 1.00 0.00 C ATOM 979 OG SER D 31 8.158 2.615 -3.548 1.00 0.00 O ATOM 0 H SER D 31 6.163 1.022 -4.208 1.00 0.00 H new ATOM 0 HA SER D 31 5.776 3.408 -5.754 1.00 0.00 H new ATOM 0 HB2 SER D 31 7.279 4.402 -4.104 1.00 0.00 H new ATOM 0 HB3 SER D 31 6.220 3.280 -3.271 1.00 0.00 H new ATOM 0 HG SER D 31 8.027 1.662 -3.732 1.00 0.00 H new ATOM 985 N ILE D 32 8.626 1.797 -6.173 1.00 0.00 N ATOM 986 CA ILE D 32 9.800 1.721 -7.087 1.00 0.00 C ATOM 987 C ILE D 32 9.327 1.353 -8.495 1.00 0.00 C ATOM 988 O ILE D 32 9.676 1.996 -9.466 1.00 0.00 O ATOM 989 CB ILE D 32 10.771 0.651 -6.583 1.00 0.00 C ATOM 990 CG1 ILE D 32 11.251 1.020 -5.177 1.00 0.00 C ATOM 991 CG2 ILE D 32 11.973 0.567 -7.525 1.00 0.00 C ATOM 992 CD1 ILE D 32 11.902 -0.200 -4.523 1.00 0.00 C ATOM 0 H ILE D 32 8.578 1.065 -5.465 1.00 0.00 H new ATOM 0 HA ILE D 32 10.303 2.688 -7.112 1.00 0.00 H new ATOM 0 HB ILE D 32 10.264 -0.314 -6.554 1.00 0.00 H new ATOM 0 HG12 ILE D 32 11.965 1.842 -5.229 1.00 0.00 H new ATOM 0 HG13 ILE D 32 10.411 1.365 -4.573 1.00 0.00 H new ATOM 0 HG21 ILE D 32 12.664 -0.195 -7.166 1.00 0.00 H new ATOM 0 HG22 ILE D 32 11.633 0.305 -8.527 1.00 0.00 H new ATOM 0 HG23 ILE D 32 12.480 1.531 -7.555 1.00 0.00 H new ATOM 0 HD11 ILE D 32 12.244 0.063 -3.522 1.00 0.00 H new ATOM 0 HD12 ILE D 32 11.175 -1.009 -4.457 1.00 0.00 H new ATOM 0 HD13 ILE D 32 12.752 -0.524 -5.123 1.00 0.00 H new ATOM 1004 N ILE D 33 8.536 0.323 -8.614 1.00 0.00 N ATOM 1005 CA ILE D 33 8.042 -0.090 -9.958 1.00 0.00 C ATOM 1006 C ILE D 33 7.129 0.994 -10.534 1.00 0.00 C ATOM 1007 O ILE D 33 7.196 1.315 -11.704 1.00 0.00 O ATOM 1008 CB ILE D 33 7.261 -1.398 -9.834 1.00 0.00 C ATOM 1009 CG1 ILE D 33 8.146 -2.460 -9.175 1.00 0.00 C ATOM 1010 CG2 ILE D 33 6.842 -1.878 -11.225 1.00 0.00 C ATOM 1011 CD1 ILE D 33 7.290 -3.666 -8.783 1.00 0.00 C ATOM 0 H ILE D 33 8.210 -0.252 -7.837 1.00 0.00 H new ATOM 0 HA ILE D 33 8.894 -0.233 -10.623 1.00 0.00 H new ATOM 0 HB ILE D 33 6.373 -1.233 -9.224 1.00 0.00 H new ATOM 0 HG12 ILE D 33 8.935 -2.768 -9.861 1.00 0.00 H new ATOM 0 HG13 ILE D 33 8.635 -2.045 -8.293 1.00 0.00 H new ATOM 0 HG21 ILE D 33 6.285 -2.811 -11.136 1.00 0.00 H new ATOM 0 HG22 ILE D 33 6.212 -1.123 -11.696 1.00 0.00 H new ATOM 0 HG23 ILE D 33 7.730 -2.043 -11.836 1.00 0.00 H new ATOM 0 HD11 ILE D 33 7.920 -4.422 -8.314 1.00 0.00 H new ATOM 0 HD12 ILE D 33 6.517 -3.351 -8.082 1.00 0.00 H new ATOM 0 HD13 ILE D 33 6.822 -4.085 -9.674 1.00 0.00 H new ATOM 1023 N GLY D 34 6.274 1.566 -9.731 1.00 0.00 N ATOM 1024 CA GLY D 34 5.363 2.624 -10.250 1.00 0.00 C ATOM 1025 C GLY D 34 6.185 3.822 -10.731 1.00 0.00 C ATOM 1026 O GLY D 34 5.915 4.395 -11.768 1.00 0.00 O ATOM 0 H GLY D 34 6.167 1.347 -8.741 1.00 0.00 H new ATOM 0 HA2 GLY D 34 4.762 2.230 -11.070 1.00 0.00 H new ATOM 0 HA3 GLY D 34 4.670 2.936 -9.469 1.00 0.00 H new ATOM 1030 N ILE D 35 7.187 4.208 -9.989 1.00 0.00 N ATOM 1031 CA ILE D 35 8.022 5.369 -10.409 1.00 0.00 C ATOM 1032 C ILE D 35 8.720 5.046 -11.732 1.00 0.00 C ATOM 1033 O ILE D 35 8.488 5.684 -12.740 1.00 0.00 O ATOM 1034 CB ILE D 35 9.070 5.650 -9.332 1.00 0.00 C ATOM 1035 CG1 ILE D 35 8.366 6.064 -8.037 1.00 0.00 C ATOM 1036 CG2 ILE D 35 9.994 6.779 -9.792 1.00 0.00 C ATOM 1037 CD1 ILE D 35 9.332 5.917 -6.860 1.00 0.00 C ATOM 0 H ILE D 35 7.463 3.770 -9.110 1.00 0.00 H new ATOM 0 HA ILE D 35 7.389 6.247 -10.542 1.00 0.00 H new ATOM 0 HB ILE D 35 9.660 4.750 -9.158 1.00 0.00 H new ATOM 0 HG12 ILE D 35 8.022 7.096 -8.112 1.00 0.00 H new ATOM 0 HG13 ILE D 35 7.484 5.444 -7.876 1.00 0.00 H new ATOM 0 HG21 ILE D 35 10.739 6.976 -9.021 1.00 0.00 H new ATOM 0 HG22 ILE D 35 10.495 6.486 -10.715 1.00 0.00 H new ATOM 0 HG23 ILE D 35 9.407 7.681 -9.968 1.00 0.00 H new ATOM 0 HD11 ILE D 35 8.830 6.212 -5.938 1.00 0.00 H new ATOM 0 HD12 ILE D 35 9.654 4.879 -6.781 1.00 0.00 H new ATOM 0 HD13 ILE D 35 10.201 6.555 -7.020 1.00 0.00 H new ATOM 1049 N LEU D 36 9.579 4.064 -11.734 1.00 0.00 N ATOM 1050 CA LEU D 36 10.298 3.705 -12.989 1.00 0.00 C ATOM 1051 C LEU D 36 9.286 3.296 -14.062 1.00 0.00 C ATOM 1052 O LEU D 36 9.423 3.638 -15.220 1.00 0.00 O ATOM 1053 CB LEU D 36 11.252 2.540 -12.720 1.00 0.00 C ATOM 1054 CG LEU D 36 12.121 2.860 -11.502 1.00 0.00 C ATOM 1055 CD1 LEU D 36 13.015 1.662 -11.183 1.00 0.00 C ATOM 1056 CD2 LEU D 36 12.994 4.080 -11.806 1.00 0.00 C ATOM 0 H LEU D 36 9.814 3.495 -10.921 1.00 0.00 H new ATOM 0 HA LEU D 36 10.867 4.567 -13.336 1.00 0.00 H new ATOM 0 HB2 LEU D 36 10.685 1.625 -12.545 1.00 0.00 H new ATOM 0 HB3 LEU D 36 11.881 2.363 -13.592 1.00 0.00 H new ATOM 0 HG LEU D 36 11.481 3.073 -10.646 1.00 0.00 H new ATOM 0 HD11 LEU D 36 13.634 1.891 -10.315 1.00 0.00 H new ATOM 0 HD12 LEU D 36 12.395 0.792 -10.967 1.00 0.00 H new ATOM 0 HD13 LEU D 36 13.655 1.448 -12.039 1.00 0.00 H new ATOM 0 HD21 LEU D 36 13.614 4.309 -10.939 1.00 0.00 H new ATOM 0 HD22 LEU D 36 13.633 3.866 -12.662 1.00 0.00 H new ATOM 0 HD23 LEU D 36 12.358 4.935 -12.033 1.00 0.00 H new ATOM 1068 N HIS D 37 8.272 2.565 -13.688 1.00 0.00 N ATOM 1069 CA HIS D 37 7.253 2.131 -14.686 1.00 0.00 C ATOM 1070 C HIS D 37 6.575 3.360 -15.296 1.00 0.00 C ATOM 1071 O HIS D 37 6.326 3.416 -16.485 1.00 0.00 O ATOM 1072 CB HIS D 37 6.212 1.258 -13.985 1.00 0.00 C ATOM 1073 CG HIS D 37 5.008 1.057 -14.865 1.00 0.00 C ATOM 1074 ND1 HIS D 37 3.726 1.101 -14.348 1.00 0.00 N ATOM 1075 CD2 HIS D 37 4.865 0.752 -16.202 1.00 0.00 C ATOM 1076 CE1 HIS D 37 2.875 0.832 -15.346 1.00 0.00 C ATOM 1077 NE2 HIS D 37 3.508 0.596 -16.498 1.00 0.00 N ATOM 0 H HIS D 37 8.105 2.249 -12.733 1.00 0.00 H new ATOM 0 HA HIS D 37 7.733 1.561 -15.481 1.00 0.00 H new ATOM 0 HB2 HIS D 37 6.650 0.292 -13.733 1.00 0.00 H new ATOM 0 HB3 HIS D 37 5.910 1.725 -13.048 1.00 0.00 H new ATOM 0 HD1 HIS D 37 3.474 1.302 -13.380 1.00 0.00 H new ATOM 0 HD2 HIS D 37 5.675 0.650 -16.910 1.00 0.00 H new ATOM 0 HE1 HIS D 37 1.801 0.809 -15.233 1.00 0.00 H new ATOM 1085 N LEU D 38 6.265 4.344 -14.497 1.00 0.00 N ATOM 1086 CA LEU D 38 5.601 5.563 -15.036 1.00 0.00 C ATOM 1087 C LEU D 38 6.575 6.336 -15.927 1.00 0.00 C ATOM 1088 O LEU D 38 6.207 6.856 -16.960 1.00 0.00 O ATOM 1089 CB LEU D 38 5.177 6.459 -13.871 1.00 0.00 C ATOM 1090 CG LEU D 38 4.143 5.735 -13.007 1.00 0.00 C ATOM 1091 CD1 LEU D 38 3.722 6.645 -11.852 1.00 0.00 C ATOM 1092 CD2 LEU D 38 2.918 5.391 -13.856 1.00 0.00 C ATOM 0 H LEU D 38 6.443 4.356 -13.493 1.00 0.00 H new ATOM 0 HA LEU D 38 4.730 5.268 -15.621 1.00 0.00 H new ATOM 0 HB2 LEU D 38 6.046 6.723 -13.269 1.00 0.00 H new ATOM 0 HB3 LEU D 38 4.758 7.391 -14.251 1.00 0.00 H new ATOM 0 HG LEU D 38 4.578 4.818 -12.610 1.00 0.00 H new ATOM 0 HD11 LEU D 38 2.985 6.132 -11.234 1.00 0.00 H new ATOM 0 HD12 LEU D 38 4.594 6.892 -11.247 1.00 0.00 H new ATOM 0 HD13 LEU D 38 3.286 7.561 -12.251 1.00 0.00 H new ATOM 0 HD21 LEU D 38 2.182 4.875 -13.240 1.00 0.00 H new ATOM 0 HD22 LEU D 38 2.481 6.308 -14.253 1.00 0.00 H new ATOM 0 HD23 LEU D 38 3.217 4.745 -14.681 1.00 0.00 H new ATOM 1104 N ILE D 39 7.817 6.408 -15.532 1.00 0.00 N ATOM 1105 CA ILE D 39 8.815 7.150 -16.353 1.00 0.00 C ATOM 1106 C ILE D 39 8.908 6.504 -17.736 1.00 0.00 C ATOM 1107 O ILE D 39 8.891 7.176 -18.748 1.00 0.00 O ATOM 1108 CB ILE D 39 10.186 7.096 -15.678 1.00 0.00 C ATOM 1109 CG1 ILE D 39 10.125 7.820 -14.331 1.00 0.00 C ATOM 1110 CG2 ILE D 39 11.219 7.782 -16.576 1.00 0.00 C ATOM 1111 CD1 ILE D 39 11.445 7.621 -13.585 1.00 0.00 C ATOM 0 H ILE D 39 8.183 5.986 -14.678 1.00 0.00 H new ATOM 0 HA ILE D 39 8.502 8.190 -16.449 1.00 0.00 H new ATOM 0 HB ILE D 39 10.471 6.056 -15.517 1.00 0.00 H new ATOM 0 HG12 ILE D 39 9.939 8.883 -14.485 1.00 0.00 H new ATOM 0 HG13 ILE D 39 9.297 7.435 -13.736 1.00 0.00 H new ATOM 0 HG21 ILE D 39 12.198 7.746 -16.098 1.00 0.00 H new ATOM 0 HG22 ILE D 39 11.265 7.268 -17.536 1.00 0.00 H new ATOM 0 HG23 ILE D 39 10.931 8.821 -16.734 1.00 0.00 H new ATOM 0 HD11 ILE D 39 11.402 8.137 -12.626 1.00 0.00 H new ATOM 0 HD12 ILE D 39 11.612 6.557 -13.418 1.00 0.00 H new ATOM 0 HD13 ILE D 39 12.264 8.028 -14.179 1.00 0.00 H new ATOM 1123 N LEU D 40 9.010 5.204 -17.786 1.00 0.00 N ATOM 1124 CA LEU D 40 9.111 4.507 -19.099 1.00 0.00 C ATOM 1125 C LEU D 40 7.933 4.883 -20.000 1.00 0.00 C ATOM 1126 O LEU D 40 8.087 5.034 -21.196 1.00 0.00 O ATOM 1127 CB LEU D 40 9.095 2.994 -18.868 1.00 0.00 C ATOM 1128 CG LEU D 40 10.236 2.603 -17.927 1.00 0.00 C ATOM 1129 CD1 LEU D 40 10.267 1.082 -17.772 1.00 0.00 C ATOM 1130 CD2 LEU D 40 11.567 3.082 -18.510 1.00 0.00 C ATOM 0 H LEU D 40 9.028 4.592 -16.970 1.00 0.00 H new ATOM 0 HA LEU D 40 10.039 4.808 -19.584 1.00 0.00 H new ATOM 0 HB2 LEU D 40 8.139 2.692 -18.441 1.00 0.00 H new ATOM 0 HB3 LEU D 40 9.199 2.470 -19.818 1.00 0.00 H new ATOM 0 HG LEU D 40 10.079 3.067 -16.953 1.00 0.00 H new ATOM 0 HD11 LEU D 40 11.079 0.801 -17.102 1.00 0.00 H new ATOM 0 HD12 LEU D 40 9.319 0.739 -17.357 1.00 0.00 H new ATOM 0 HD13 LEU D 40 10.425 0.620 -18.747 1.00 0.00 H new ATOM 0 HD21 LEU D 40 12.379 2.803 -17.839 1.00 0.00 H new ATOM 0 HD22 LEU D 40 11.725 2.619 -19.484 1.00 0.00 H new ATOM 0 HD23 LEU D 40 11.546 4.166 -18.623 1.00 0.00 H new ATOM 1142 N TRP D 41 6.759 5.050 -19.455 1.00 0.00 N ATOM 1143 CA TRP D 41 5.592 5.416 -20.306 1.00 0.00 C ATOM 1144 C TRP D 41 5.810 6.803 -20.913 1.00 0.00 C ATOM 1145 O TRP D 41 5.568 7.022 -22.083 1.00 0.00 O ATOM 1146 CB TRP D 41 4.334 5.424 -19.435 1.00 0.00 C ATOM 1147 CG TRP D 41 3.654 4.097 -19.546 1.00 0.00 C ATOM 1148 CD1 TRP D 41 3.351 3.277 -18.503 1.00 0.00 C ATOM 1149 CD2 TRP D 41 3.189 3.418 -20.752 1.00 0.00 C ATOM 1150 NE1 TRP D 41 2.731 2.143 -19.005 1.00 0.00 N ATOM 1151 CE2 TRP D 41 2.614 2.188 -20.374 1.00 0.00 C ATOM 1152 CE3 TRP D 41 3.209 3.743 -22.125 1.00 0.00 C ATOM 1153 CZ2 TRP D 41 2.078 1.309 -21.311 1.00 0.00 C ATOM 1154 CZ3 TRP D 41 2.667 2.854 -23.073 1.00 0.00 C ATOM 1155 CH2 TRP D 41 2.103 1.640 -22.663 1.00 0.00 C ATOM 0 H TRP D 41 6.558 4.949 -18.460 1.00 0.00 H new ATOM 0 HA TRP D 41 5.480 4.692 -21.113 1.00 0.00 H new ATOM 0 HB2 TRP D 41 4.597 5.626 -18.397 1.00 0.00 H new ATOM 0 HB3 TRP D 41 3.661 6.220 -19.754 1.00 0.00 H new ATOM 0 HD1 TRP D 41 3.558 3.476 -17.462 1.00 0.00 H new ATOM 0 HE1 TRP D 41 2.402 1.369 -18.428 1.00 0.00 H new ATOM 0 HE3 TRP D 41 3.642 4.678 -22.450 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 1.644 0.373 -20.990 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 2.686 3.110 -24.122 1.00 0.00 H new ATOM 0 HH2 TRP D 41 1.688 0.962 -23.394 1.00 0.00 H new ATOM 1166 N ILE D 42 6.261 7.746 -20.131 1.00 0.00 N ATOM 1167 CA ILE D 42 6.489 9.116 -20.669 1.00 0.00 C ATOM 1168 C ILE D 42 7.487 9.056 -21.828 1.00 0.00 C ATOM 1169 O ILE D 42 7.342 9.746 -22.818 1.00 0.00 O ATOM 1170 CB ILE D 42 7.046 10.004 -19.555 1.00 0.00 C ATOM 1171 CG1 ILE D 42 6.152 9.877 -18.319 1.00 0.00 C ATOM 1172 CG2 ILE D 42 7.072 11.461 -20.017 1.00 0.00 C ATOM 1173 CD1 ILE D 42 6.800 10.602 -17.138 1.00 0.00 C ATOM 0 H ILE D 42 6.481 7.626 -19.142 1.00 0.00 H new ATOM 0 HA ILE D 42 5.548 9.529 -21.031 1.00 0.00 H new ATOM 0 HB ILE D 42 8.061 9.688 -19.312 1.00 0.00 H new ATOM 0 HG12 ILE D 42 5.169 10.301 -18.524 1.00 0.00 H new ATOM 0 HG13 ILE D 42 6.001 8.826 -18.074 1.00 0.00 H new ATOM 0 HG21 ILE D 42 7.470 12.089 -19.219 1.00 0.00 H new ATOM 0 HG22 ILE D 42 7.705 11.552 -20.900 1.00 0.00 H new ATOM 0 HG23 ILE D 42 6.060 11.783 -20.262 1.00 0.00 H new ATOM 0 HD11 ILE D 42 6.161 10.510 -16.260 1.00 0.00 H new ATOM 0 HD12 ILE D 42 7.773 10.157 -16.928 1.00 0.00 H new ATOM 0 HD13 ILE D 42 6.928 11.656 -17.384 1.00 0.00 H new ATOM 1185 N LEU D 43 8.502 8.245 -21.711 1.00 0.00 N ATOM 1186 CA LEU D 43 9.508 8.148 -22.806 1.00 0.00 C ATOM 1187 C LEU D 43 8.873 7.493 -24.034 1.00 0.00 C ATOM 1188 O LEU D 43 9.017 7.965 -25.145 1.00 0.00 O ATOM 1189 CB LEU D 43 10.696 7.307 -22.335 1.00 0.00 C ATOM 1190 CG LEU D 43 11.249 7.888 -21.033 1.00 0.00 C ATOM 1191 CD1 LEU D 43 12.548 7.171 -20.664 1.00 0.00 C ATOM 1192 CD2 LEU D 43 11.527 9.382 -21.220 1.00 0.00 C ATOM 0 H LEU D 43 8.678 7.645 -20.905 1.00 0.00 H new ATOM 0 HA LEU D 43 9.852 9.148 -23.069 1.00 0.00 H new ATOM 0 HB2 LEU D 43 10.385 6.274 -22.181 1.00 0.00 H new ATOM 0 HB3 LEU D 43 11.473 7.296 -23.099 1.00 0.00 H new ATOM 0 HG LEU D 43 10.519 7.750 -20.235 1.00 0.00 H new ATOM 0 HD11 LEU D 43 12.942 7.586 -19.736 1.00 0.00 H new ATOM 0 HD12 LEU D 43 12.351 6.107 -20.531 1.00 0.00 H new ATOM 0 HD13 LEU D 43 13.279 7.308 -21.461 1.00 0.00 H new ATOM 0 HD21 LEU D 43 11.921 9.798 -20.293 1.00 0.00 H new ATOM 0 HD22 LEU D 43 12.257 9.519 -22.018 1.00 0.00 H new ATOM 0 HD23 LEU D 43 10.601 9.894 -21.482 1.00 0.00 H new TER 1204 LEU D 43 END