USER MOD reduce.3.24.130724 H: found=0, std=0, add=701, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 702 hydrogens (0 hets) HEADER RECEPTOR ASSOCIATED PROTEIN 04-MAR-03 1OP1 TITLE SOLUTION NMR STRUCTURE OF DOMAIN 1 OF RECEPTOR ASSOCIATED TITLE 2 PROTEIN COMPND MOL_ID: 1; COMPND 2 MOLECULE: ALPHA-2-MACROGLOBULIN RECEPTOR-ASSOCIATED COMPND 3 PROTEIN PRECURSOR; COMPND 4 CHAIN: A; COMPND 5 FRAGMENT: DOMAIN 1 OF RECEPTOR ASSOCIATED PROTEIN; COMPND 6 SYNONYM: ALPHA-2-MRAP, LOW DENSITY LIPOPROTEIN RECEPTOR- COMPND 7 RELATED PROTEIN- ASSOCIATED PROTEIN 1, RAP; COMPND 8 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: LRPAP1 OR A2MRAP; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: PGEX-2T KEYWDS HELICAL BUNDLE, RECEPTOR ASSOCIATED PROTEIN EXPDTA SOLUTION NMR AUTHOR Y.WU,M.MIGLIORINI,P.YU,D.K.STRICKLAND,Y-X.WANG REVDAT 2 24-FEB-09 1OP1 1 VERSN REVDAT 1 26-AUG-03 1OP1 0 JRNL AUTH Y.WU,M.MIGLIORINI,P.YU,D.K.STRICKLAND,Y.X.WANG JRNL TITL 1H, (13)C AND (15)N RESONANCE ASSIGNMENTS OF JRNL TITL 2 DOMAIN 1 OF RECEPTOR ASSOCIATED PROTEIN. JRNL REF J.BIOMOL.NMR V. 26 187 2003 JRNL REFN ISSN 0925-2738 JRNL PMID 12766414 JRNL DOI 10.1023/A:1023534107920 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : NIH-XPLOR 1.0.6 REMARK 3 AUTHORS : ~1.2 MM D1 OF RAP IN A 50 MM~1.2 MM D1 ~1.2 MM REMARK 3 D1 OF RAP INSCHWIETERS, C. D., KUSZEWSKI, J., REMARK 3 TJANDRA, N. AND CLORE, G. M. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1OP1 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 07-MAR-03. REMARK 100 THE RCSB ID CODE IS RCSB018524. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303.5 REMARK 210 PH : 6.5 REMARK 210 IONIC STRENGTH : 50 MM NACL, 75 MM NAPI REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : ~1.2 MM 15N/13C ISOTOPE REMARK 210 LABELED D1 OF RAP IN A 50 MM REMARK 210 NACL, 75 MM NAPI, PH 6.5; ~1.2 REMARK 210 MM 15N/13C ISOTPE-LABELED D1 REMARK 210 OF RAP IN A 50 MM NACL, 75 MM REMARK 210 NAPI, PH 6.5 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, 4D_ REMARK 210 13C/15N-SEPARATED_NOESY, 3D_ REMARK 210 13C-SEPARATED_NOESY, HNHA REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ, 800 MHZ REMARK 210 SPECTROMETER MODEL : INOVA REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE, INTERHLX REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS AND REMARK 210 SIMULATED ANNEALING PROTOCOL REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: THE STRUCTURE WAS DETERMINED USING MULTI-DIMENSIONM REMARK 210 HETERO-NUCLEAR NMR SPECTROSCOPY. THE CONSTRAINTS CONSISTS OF REMARK 210 NOE, DIHEDRAL, J-COUPLING, CHEMICAL SHIFT, CONFORMATIONAL REMARK 210 DATABASE AS WELL AS TWO SETS OF DIPOLAR COUPLINGS MEASURED REMARK 210 FROM TWO DIFFERENT ALIGNMENT MEDIA. 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: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 PHE A 20 -154.47 -133.21 REMARK 500 HIS A 36 83.76 50.41 REMARK 500 ASP A 91 -9.45 -44.95 REMARK 500 LYS A 93 -87.52 -140.94 REMARK 500 LYS A 94 -91.89 -87.25 REMARK 500 ASP A 95 -43.35 62.93 REMARK 500 ARG A 97 135.36 62.47 REMARK 500 REMARK 500 REMARK: NULL DBREF 1OP1 A 17 98 UNP P30533 AMRP_HUMAN 51 132 SEQRES 1 A 82 GLY GLU GLU PHE ARG MET GLU LYS LEU ASN GLN LEU TRP SEQRES 2 A 82 GLU LYS ALA GLN ARG LEU HIS LEU PRO PRO VAL ARG LEU SEQRES 3 A 82 ALA GLU LEU HIS ALA ASP LEU LYS ILE GLN GLU ARG ASP SEQRES 4 A 82 GLU LEU ALA TRP LYS LYS LEU LYS LEU ASP GLY LEU ASP SEQRES 5 A 82 GLU ASP GLY GLU LYS GLU ALA ARG LEU ILE ARG ASN LEU SEQRES 6 A 82 ASN VAL ILE LEU ALA LYS TYR GLY LEU ASP GLY LYS LYS SEQRES 7 A 82 ASP ALA ARG GLN HELIX 1 1 MET A 22 HIS A 36 1 15 HELIX 2 2 PRO A 38 GLY A 66 1 29 HELIX 3 3 GLY A 71 GLY A 89 1 19 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 LYS NZ :NH3+ 147:sc= -2.58! (180deg=-0.0891) USER MOD Set 1.2: A 98 GLN : amide:sc= -15.8! C(o=-18!,f=-8.8!) USER MOD Single : A 22 MET CE :methyl -155:sc= -0.13 (180deg=-0.95) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= -6.49! C(o=-6.5!,f=-15!) USER MOD Single : A 27 GLN : amide:sc= -0.311 K(o=-0.31,f=-2.2!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.537 X(o=-0.54,f=-0.13) USER MOD Single : A 36 HIS : no HD1:sc= -2.42! K(o=-2.4!,f=-0.67) USER MOD Single : A 46 HIS : no HD1:sc= -4.65! K(o=-4.7!,f=-0.55) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -7.6! C(o=-7.6!,f=-14!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -5.33! C(o=-5.3!,f=-11!) USER MOD Single : A 82 ASN : amide:sc= 0.61 K(o=0.61,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot -177:sc= 0.372 USER MOD Single : A 93 LYS NZ :NH3+ -94:sc= -17.4! (180deg=-18.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 63.454 56.205-124.475 1.00 3.86 N ATOM 2 CA GLY A 17 64.111 55.365-123.381 1.00 3.30 C ATOM 3 C GLY A 17 63.651 53.964-123.158 1.00 2.69 C ATOM 4 O GLY A 17 63.964 53.350-122.157 1.00 3.02 O ATOM 0 HA2 GLY A 17 65.179 55.328-123.594 1.00 3.30 H new ATOM 0 HA3 GLY A 17 63.992 55.902-122.440 1.00 3.30 H new ATOM 10 N GLU A 18 62.899 53.424-124.077 1.00 2.22 N ATOM 11 CA GLU A 18 62.407 52.027-123.911 1.00 1.80 C ATOM 12 C GLU A 18 63.486 51.047-124.376 1.00 1.69 C ATOM 13 O GLU A 18 63.994 51.142-125.476 1.00 2.25 O ATOM 14 CB GLU A 18 61.143 51.829-124.750 1.00 1.93 C ATOM 15 CG GLU A 18 60.034 52.745-124.229 1.00 2.18 C ATOM 16 CD GLU A 18 58.671 52.140-124.568 1.00 2.37 C ATOM 17 OE1 GLU A 18 58.507 50.948-124.366 1.00 2.72 O ATOM 18 OE2 GLU A 18 57.814 52.879-125.025 1.00 2.85 O ATOM 0 H GLU A 18 62.604 53.889-124.935 1.00 2.22 H new ATOM 0 HA GLU A 18 62.179 51.845-122.861 1.00 1.80 H new ATOM 0 HB2 GLU A 18 61.350 52.051-125.797 1.00 1.93 H new ATOM 0 HB3 GLU A 18 60.822 50.788-124.702 1.00 1.93 H new ATOM 0 HG2 GLU A 18 60.129 52.872-123.151 1.00 2.18 H new ATOM 0 HG3 GLU A 18 60.126 53.735-124.676 1.00 2.18 H new ATOM 25 N GLU A 19 63.839 50.103-123.547 1.00 1.26 N ATOM 26 CA GLU A 19 64.884 49.116-123.940 1.00 1.15 C ATOM 27 C GLU A 19 64.715 48.755-125.416 1.00 1.08 C ATOM 28 O GLU A 19 65.675 48.612-126.147 1.00 1.13 O ATOM 29 CB GLU A 19 64.737 47.854-123.088 1.00 1.08 C ATOM 30 CG GLU A 19 63.265 47.440-123.036 1.00 1.10 C ATOM 31 CD GLU A 19 62.492 48.412-122.143 1.00 1.29 C ATOM 32 OE1 GLU A 19 63.044 48.829-121.138 1.00 1.76 O ATOM 33 OE2 GLU A 19 61.361 48.723-122.479 1.00 1.53 O ATOM 0 H GLU A 19 63.448 49.973-122.614 1.00 1.26 H new ATOM 0 HA GLU A 19 65.872 49.550-123.783 1.00 1.15 H new ATOM 0 HB2 GLU A 19 65.338 47.047-123.508 1.00 1.08 H new ATOM 0 HB3 GLU A 19 65.110 48.038-122.080 1.00 1.08 H new ATOM 0 HG2 GLU A 19 62.841 47.437-124.040 1.00 1.10 H new ATOM 0 HG3 GLU A 19 63.175 46.425-122.649 1.00 1.10 H new ATOM 40 N PHE A 20 63.499 48.603-125.857 1.00 1.03 N ATOM 41 CA PHE A 20 63.257 48.246-127.284 1.00 0.99 C ATOM 42 C PHE A 20 62.164 49.148-127.857 1.00 1.08 C ATOM 43 O PHE A 20 61.946 50.249-127.393 1.00 1.18 O ATOM 44 CB PHE A 20 62.811 46.786-127.373 1.00 0.88 C ATOM 45 CG PHE A 20 63.751 45.925-126.566 1.00 0.80 C ATOM 46 CD1 PHE A 20 65.094 45.808-126.945 1.00 0.89 C ATOM 47 CD2 PHE A 20 63.281 45.248-125.436 1.00 0.85 C ATOM 48 CE1 PHE A 20 65.966 45.012-126.193 1.00 0.84 C ATOM 49 CE2 PHE A 20 64.153 44.453-124.683 1.00 0.81 C ATOM 50 CZ PHE A 20 65.496 44.334-125.061 1.00 0.69 C ATOM 0 H PHE A 20 62.658 48.711-125.290 1.00 1.03 H new ATOM 0 HA PHE A 20 64.176 48.382-127.854 1.00 0.99 H new ATOM 0 HB2 PHE A 20 61.793 46.682-126.998 1.00 0.88 H new ATOM 0 HB3 PHE A 20 62.803 46.459-128.413 1.00 0.88 H new ATOM 0 HD1 PHE A 20 65.457 46.332-127.817 1.00 0.89 H new ATOM 0 HD2 PHE A 20 62.245 45.339-125.144 1.00 0.85 H new ATOM 0 HE1 PHE A 20 67.002 44.921-126.486 1.00 0.84 H new ATOM 0 HE2 PHE A 20 63.790 43.931-123.810 1.00 0.81 H new ATOM 0 HZ PHE A 20 66.169 43.720-124.480 1.00 0.69 H new ATOM 60 N ARG A 21 61.473 48.688-128.863 1.00 1.08 N ATOM 61 CA ARG A 21 60.393 49.519-129.465 1.00 1.19 C ATOM 62 C ARG A 21 59.139 48.662-129.648 1.00 1.14 C ATOM 63 O ARG A 21 58.108 49.137-130.082 1.00 1.20 O ATOM 64 CB ARG A 21 60.856 50.047-130.824 1.00 1.28 C ATOM 65 CG ARG A 21 62.273 50.609-130.695 1.00 1.35 C ATOM 66 CD ARG A 21 62.436 51.809-131.628 1.00 1.59 C ATOM 67 NE ARG A 21 63.853 51.895-132.081 1.00 1.99 N ATOM 68 CZ ARG A 21 64.169 52.648-133.098 1.00 2.51 C ATOM 69 NH1 ARG A 21 63.244 53.330-133.717 1.00 3.43 N ATOM 70 NH2 ARG A 21 65.410 52.721-133.496 1.00 2.63 N ATOM 0 H ARG A 21 61.609 47.774-129.294 1.00 1.08 H new ATOM 0 HA ARG A 21 60.167 50.359-128.808 1.00 1.19 H new ATOM 0 HB2 ARG A 21 60.836 49.246-131.563 1.00 1.28 H new ATOM 0 HB3 ARG A 21 60.176 50.823-131.176 1.00 1.28 H new ATOM 0 HG2 ARG A 21 62.464 50.908-129.664 1.00 1.35 H new ATOM 0 HG3 ARG A 21 63.004 49.840-130.944 1.00 1.35 H new ATOM 0 HD2 ARG A 21 61.773 51.708-132.488 1.00 1.59 H new ATOM 0 HD3 ARG A 21 62.151 52.726-131.112 1.00 1.59 H new ATOM 0 HE ARG A 21 64.576 51.365-131.595 1.00 1.99 H new ATOM 0 HH11 ARG A 21 62.274 53.274-133.405 1.00 3.43 H new ATOM 0 HH12 ARG A 21 63.491 53.919-134.512 1.00 3.43 H new ATOM 0 HH21 ARG A 21 66.133 52.189-133.012 1.00 2.63 H new ATOM 0 HH22 ARG A 21 65.657 53.310-134.291 1.00 2.63 H new ATOM 84 N MET A 22 59.219 47.402-129.318 1.00 1.04 N ATOM 85 CA MET A 22 58.033 46.514-129.469 1.00 1.01 C ATOM 86 C MET A 22 57.367 46.325-128.106 1.00 1.06 C ATOM 87 O MET A 22 58.024 46.274-127.085 1.00 1.06 O ATOM 88 CB MET A 22 58.480 45.155-130.011 1.00 0.91 C ATOM 89 CG MET A 22 59.116 45.337-131.390 1.00 0.94 C ATOM 90 SD MET A 22 57.901 46.049-132.526 1.00 1.19 S ATOM 91 CE MET A 22 57.192 44.489-133.107 1.00 1.54 C ATOM 0 H MET A 22 60.056 46.949-128.950 1.00 1.04 H new ATOM 0 HA MET A 22 57.324 46.966-130.163 1.00 1.01 H new ATOM 0 HB2 MET A 22 59.195 44.697-129.327 1.00 0.91 H new ATOM 0 HB3 MET A 22 57.626 44.481-130.079 1.00 0.91 H new ATOM 0 HG2 MET A 22 59.987 45.988-131.317 1.00 0.94 H new ATOM 0 HG3 MET A 22 59.466 44.377-131.770 1.00 0.94 H new ATOM 0 HE1 MET A 22 56.758 44.633-134.096 1.00 1.54 H new ATOM 0 HE2 MET A 22 57.974 43.732-133.161 1.00 1.54 H new ATOM 0 HE3 MET A 22 56.417 44.161-132.414 1.00 1.54 H new ATOM 101 N GLU A 23 56.067 46.221-128.079 1.00 1.12 N ATOM 102 CA GLU A 23 55.363 46.037-126.779 1.00 1.20 C ATOM 103 C GLU A 23 55.630 44.628-126.249 1.00 1.15 C ATOM 104 O GLU A 23 55.813 44.425-125.066 1.00 1.18 O ATOM 105 CB GLU A 23 53.859 46.233-126.980 1.00 1.31 C ATOM 106 CG GLU A 23 53.588 47.664-127.446 1.00 1.39 C ATOM 107 CD GLU A 23 52.183 47.749-128.046 1.00 1.66 C ATOM 108 OE1 GLU A 23 51.237 47.821-127.279 1.00 2.30 O ATOM 109 OE2 GLU A 23 52.077 47.740-129.261 1.00 1.96 O ATOM 0 H GLU A 23 55.462 46.255-128.900 1.00 1.12 H new ATOM 0 HA GLU A 23 55.730 46.770-126.060 1.00 1.20 H new ATOM 0 HB2 GLU A 23 53.484 45.522-127.717 1.00 1.31 H new ATOM 0 HB3 GLU A 23 53.328 46.036-126.049 1.00 1.31 H new ATOM 0 HG2 GLU A 23 53.679 48.354-126.607 1.00 1.39 H new ATOM 0 HG3 GLU A 23 54.330 47.963-128.187 1.00 1.39 H new ATOM 116 N LYS A 24 55.654 43.652-127.113 1.00 1.08 N ATOM 117 CA LYS A 24 55.911 42.259-126.653 1.00 1.05 C ATOM 118 C LYS A 24 57.270 42.199-125.956 1.00 0.98 C ATOM 119 O LYS A 24 57.410 41.635-124.888 1.00 1.02 O ATOM 120 CB LYS A 24 55.916 41.317-127.858 1.00 1.00 C ATOM 121 CG LYS A 24 57.243 41.456-128.607 1.00 0.94 C ATOM 122 CD LYS A 24 57.172 40.678-129.922 1.00 0.95 C ATOM 123 CE LYS A 24 56.502 41.542-130.992 1.00 1.49 C ATOM 124 NZ LYS A 24 55.791 40.665-131.964 1.00 2.08 N ATOM 0 H LYS A 24 55.507 43.758-128.117 1.00 1.08 H new ATOM 0 HA LYS A 24 55.129 41.955-125.957 1.00 1.05 H new ATOM 0 HB2 LYS A 24 55.778 40.287-127.529 1.00 1.00 H new ATOM 0 HB3 LYS A 24 55.085 41.554-128.522 1.00 1.00 H new ATOM 0 HG2 LYS A 24 57.452 42.507-128.805 1.00 0.94 H new ATOM 0 HG3 LYS A 24 58.061 41.079-127.993 1.00 0.94 H new ATOM 0 HD2 LYS A 24 58.174 40.395-130.244 1.00 0.95 H new ATOM 0 HD3 LYS A 24 56.610 39.755-129.781 1.00 0.95 H new ATOM 0 HE2 LYS A 24 55.799 42.234-130.528 1.00 1.49 H new ATOM 0 HE3 LYS A 24 57.249 42.145-131.508 1.00 1.49 H new ATOM 0 HZ1 LYS A 24 55.335 41.252-132.692 1.00 2.08 H new ATOM 0 HZ2 LYS A 24 56.473 40.022-132.415 1.00 2.08 H new ATOM 0 HZ3 LYS A 24 55.068 40.108-131.465 1.00 2.08 H new ATOM 138 N LEU A 25 58.272 42.778-126.554 1.00 0.88 N ATOM 139 CA LEU A 25 59.626 42.760-125.934 1.00 0.83 C ATOM 140 C LEU A 25 59.615 43.611-124.664 1.00 0.91 C ATOM 141 O LEU A 25 60.016 43.170-123.605 1.00 0.91 O ATOM 142 CB LEU A 25 60.646 43.333-126.921 1.00 0.75 C ATOM 143 CG LEU A 25 61.073 42.245-127.908 1.00 0.66 C ATOM 144 CD1 LEU A 25 60.998 42.792-129.335 1.00 0.68 C ATOM 145 CD2 LEU A 25 62.510 41.817-127.603 1.00 0.63 C ATOM 0 H LEU A 25 58.212 43.265-127.448 1.00 0.88 H new ATOM 0 HA LEU A 25 59.898 41.735-125.683 1.00 0.83 H new ATOM 0 HB2 LEU A 25 60.213 44.176-127.459 1.00 0.75 H new ATOM 0 HB3 LEU A 25 61.515 43.711-126.383 1.00 0.75 H new ATOM 0 HG LEU A 25 60.408 41.387-127.812 1.00 0.66 H new ATOM 0 HD11 LEU A 25 61.302 42.017-130.038 1.00 0.68 H new ATOM 0 HD12 LEU A 25 59.975 43.099-129.554 1.00 0.68 H new ATOM 0 HD13 LEU A 25 61.663 43.650-129.431 1.00 0.68 H new ATOM 0 HD21 LEU A 25 62.816 41.042-128.306 1.00 0.63 H new ATOM 0 HD22 LEU A 25 63.174 42.676-127.699 1.00 0.63 H new ATOM 0 HD23 LEU A 25 62.566 41.428-126.586 1.00 0.63 H new ATOM 157 N ASN A 26 59.159 44.830-124.761 1.00 1.02 N ATOM 158 CA ASN A 26 59.123 45.709-123.558 1.00 1.12 C ATOM 159 C ASN A 26 58.285 45.046-122.462 1.00 1.18 C ATOM 160 O ASN A 26 58.525 45.232-121.285 1.00 1.20 O ATOM 161 CB ASN A 26 58.501 47.057-123.931 1.00 1.22 C ATOM 162 CG ASN A 26 59.099 47.547-125.250 1.00 1.18 C ATOM 163 OD1 ASN A 26 59.925 46.880-125.841 1.00 1.08 O ATOM 164 ND2 ASN A 26 58.716 48.694-125.741 1.00 1.28 N ATOM 0 H ASN A 26 58.810 45.255-125.620 1.00 1.02 H new ATOM 0 HA ASN A 26 60.138 45.864-123.192 1.00 1.12 H new ATOM 0 HB2 ASN A 26 57.420 46.957-124.025 1.00 1.22 H new ATOM 0 HB3 ASN A 26 58.687 47.786-123.142 1.00 1.22 H new ATOM 0 HD21 ASN A 26 59.110 49.030-126.620 1.00 1.28 H new ATOM 0 HD22 ASN A 26 58.023 49.255-125.246 1.00 1.28 H new ATOM 171 N GLN A 27 57.303 44.274-122.839 1.00 1.24 N ATOM 172 CA GLN A 27 56.449 43.601-121.819 1.00 1.34 C ATOM 173 C GLN A 27 57.236 42.468-121.157 1.00 1.27 C ATOM 174 O GLN A 27 57.310 42.377-119.948 1.00 1.34 O ATOM 175 CB GLN A 27 55.201 43.029-122.496 1.00 1.39 C ATOM 176 CG GLN A 27 54.205 44.158-122.776 1.00 1.48 C ATOM 177 CD GLN A 27 52.906 43.901-122.010 1.00 1.89 C ATOM 178 OE1 GLN A 27 52.594 42.774-121.680 1.00 2.42 O ATOM 179 NE2 GLN A 27 52.129 44.906-121.711 1.00 2.42 N ATOM 0 H GLN A 27 57.055 44.080-123.809 1.00 1.24 H new ATOM 0 HA GLN A 27 56.152 44.325-121.061 1.00 1.34 H new ATOM 0 HB2 GLN A 27 55.475 42.533-123.427 1.00 1.39 H new ATOM 0 HB3 GLN A 27 54.741 42.275-121.857 1.00 1.39 H new ATOM 0 HG2 GLN A 27 54.632 45.115-122.477 1.00 1.48 H new ATOM 0 HG3 GLN A 27 54.002 44.220-123.845 1.00 1.48 H new ATOM 0 HE21 GLN A 27 52.390 45.852-121.988 1.00 2.42 H new ATOM 0 HE22 GLN A 27 51.261 44.745-121.201 1.00 2.42 H new ATOM 188 N LEU A 28 57.831 41.607-121.938 1.00 1.16 N ATOM 189 CA LEU A 28 58.616 40.490-121.343 1.00 1.11 C ATOM 190 C LEU A 28 59.777 41.077-120.546 1.00 1.05 C ATOM 191 O LEU A 28 60.084 40.640-119.453 1.00 1.10 O ATOM 192 CB LEU A 28 59.160 39.593-122.458 1.00 1.02 C ATOM 193 CG LEU A 28 58.007 38.823-123.102 1.00 1.11 C ATOM 194 CD1 LEU A 28 58.396 38.416-124.524 1.00 1.26 C ATOM 195 CD2 LEU A 28 57.709 37.568-122.278 1.00 1.24 C ATOM 0 H LEU A 28 57.807 41.629-122.957 1.00 1.16 H new ATOM 0 HA LEU A 28 57.979 39.896-120.688 1.00 1.11 H new ATOM 0 HB2 LEU A 28 59.672 40.197-123.208 1.00 1.02 H new ATOM 0 HB3 LEU A 28 59.895 38.897-122.053 1.00 1.02 H new ATOM 0 HG LEU A 28 57.121 39.457-123.134 1.00 1.11 H new ATOM 0 HD11 LEU A 28 57.574 37.867-124.983 1.00 1.26 H new ATOM 0 HD12 LEU A 28 58.610 39.308-125.112 1.00 1.26 H new ATOM 0 HD13 LEU A 28 59.282 37.782-124.491 1.00 1.26 H new ATOM 0 HD21 LEU A 28 56.887 37.018-122.737 1.00 1.24 H new ATOM 0 HD22 LEU A 28 58.596 36.935-122.246 1.00 1.24 H new ATOM 0 HD23 LEU A 28 57.432 37.856-121.264 1.00 1.24 H new ATOM 207 N TRP A 29 60.419 42.076-121.084 1.00 0.99 N ATOM 208 CA TRP A 29 61.555 42.709-120.365 1.00 0.95 C ATOM 209 C TRP A 29 61.058 43.234-119.024 1.00 1.09 C ATOM 210 O TRP A 29 61.501 42.815-117.973 1.00 1.10 O ATOM 211 CB TRP A 29 62.085 43.873-121.200 1.00 0.93 C ATOM 212 CG TRP A 29 63.230 44.534-120.512 1.00 0.93 C ATOM 213 CD1 TRP A 29 63.294 45.853-120.274 1.00 1.01 C ATOM 214 CD2 TRP A 29 64.468 43.958-119.986 1.00 0.86 C ATOM 215 NE1 TRP A 29 64.480 46.140-119.634 1.00 1.01 N ATOM 216 CE2 TRP A 29 65.238 45.006-119.428 1.00 0.92 C ATOM 217 CE3 TRP A 29 64.994 42.651-119.930 1.00 0.80 C ATOM 218 CZ2 TRP A 29 66.480 44.770-118.839 1.00 0.89 C ATOM 219 CZ3 TRP A 29 66.245 42.412-119.337 1.00 0.77 C ATOM 220 CH2 TRP A 29 66.985 43.470-118.792 1.00 0.82 C ATOM 0 H TRP A 29 60.203 42.482-121.995 1.00 0.99 H new ATOM 0 HA TRP A 29 62.350 41.981-120.204 1.00 0.95 H new ATOM 0 HB2 TRP A 29 62.401 43.511-122.178 1.00 0.93 H new ATOM 0 HB3 TRP A 29 61.289 44.598-121.370 1.00 0.93 H new ATOM 0 HD1 TRP A 29 62.536 46.575-120.542 1.00 1.01 H new ATOM 0 HE1 TRP A 29 64.763 47.077-119.347 1.00 1.01 H new ATOM 0 HE3 TRP A 29 64.431 41.828-120.346 1.00 0.80 H new ATOM 0 HZ2 TRP A 29 67.048 45.589-118.422 1.00 0.89 H new ATOM 0 HZ3 TRP A 29 66.639 41.407-119.301 1.00 0.77 H new ATOM 0 HH2 TRP A 29 67.945 43.279-118.336 1.00 0.82 H new ATOM 231 N GLU A 30 60.130 44.143-119.057 1.00 1.20 N ATOM 232 CA GLU A 30 59.586 44.694-117.786 1.00 1.35 C ATOM 233 C GLU A 30 59.210 43.530-116.868 1.00 1.39 C ATOM 234 O GLU A 30 59.373 43.595-115.665 1.00 1.45 O ATOM 235 CB GLU A 30 58.345 45.538-118.082 1.00 1.47 C ATOM 236 CG GLU A 30 58.769 46.968-118.423 1.00 1.50 C ATOM 237 CD GLU A 30 57.568 47.740-118.974 1.00 1.79 C ATOM 238 OE1 GLU A 30 57.248 47.549-120.135 1.00 2.27 O ATOM 239 OE2 GLU A 30 56.989 48.509-118.224 1.00 2.13 O ATOM 0 H GLU A 30 59.723 44.530-119.908 1.00 1.20 H new ATOM 0 HA GLU A 30 60.335 45.321-117.302 1.00 1.35 H new ATOM 0 HB2 GLU A 30 57.787 45.105-118.913 1.00 1.47 H new ATOM 0 HB3 GLU A 30 57.680 45.541-117.219 1.00 1.47 H new ATOM 0 HG2 GLU A 30 59.157 47.465-117.534 1.00 1.50 H new ATOM 0 HG3 GLU A 30 59.574 46.954-119.158 1.00 1.50 H new ATOM 246 N LYS A 31 58.712 42.461-117.430 1.00 1.38 N ATOM 247 CA LYS A 31 58.330 41.289-116.595 1.00 1.45 C ATOM 248 C LYS A 31 59.560 40.792-115.835 1.00 1.38 C ATOM 249 O LYS A 31 59.552 40.688-114.624 1.00 1.47 O ATOM 250 CB LYS A 31 57.797 40.172-117.496 1.00 1.44 C ATOM 251 CG LYS A 31 56.359 39.834-117.099 1.00 1.65 C ATOM 252 CD LYS A 31 55.925 38.547-117.803 1.00 1.72 C ATOM 253 CE LYS A 31 55.482 38.870-119.231 1.00 1.50 C ATOM 254 NZ LYS A 31 54.040 39.248-119.230 1.00 1.93 N ATOM 0 H LYS A 31 58.554 42.350-118.432 1.00 1.38 H new ATOM 0 HA LYS A 31 57.555 41.580-115.886 1.00 1.45 H new ATOM 0 HB2 LYS A 31 57.833 40.485-118.540 1.00 1.44 H new ATOM 0 HB3 LYS A 31 58.427 39.287-117.407 1.00 1.44 H new ATOM 0 HG2 LYS A 31 56.288 39.712-116.018 1.00 1.65 H new ATOM 0 HG3 LYS A 31 55.693 40.653-117.372 1.00 1.65 H new ATOM 0 HD2 LYS A 31 56.749 37.833-117.819 1.00 1.72 H new ATOM 0 HD3 LYS A 31 55.108 38.078-117.255 1.00 1.72 H new ATOM 0 HE2 LYS A 31 56.083 39.686-119.634 1.00 1.50 H new ATOM 0 HE3 LYS A 31 55.642 38.007-119.877 1.00 1.50 H new ATOM 0 HZ1 LYS A 31 53.738 39.468-120.201 1.00 1.93 H new ATOM 0 HZ2 LYS A 31 53.474 38.457-118.862 1.00 1.93 H new ATOM 0 HZ3 LYS A 31 53.901 40.083-118.627 1.00 1.93 H new ATOM 268 N ALA A 32 60.624 40.494-116.531 1.00 1.24 N ATOM 269 CA ALA A 32 61.850 40.019-115.832 1.00 1.19 C ATOM 270 C ALA A 32 62.284 41.090-114.834 1.00 1.24 C ATOM 271 O ALA A 32 62.379 40.848-113.645 1.00 1.31 O ATOM 272 CB ALA A 32 62.967 39.780-116.850 1.00 1.03 C ATOM 0 H ALA A 32 60.696 40.559-117.546 1.00 1.24 H new ATOM 0 HA ALA A 32 61.643 39.084-115.311 1.00 1.19 H new ATOM 0 HB1 ALA A 32 63.862 39.433-116.333 1.00 1.03 H new ATOM 0 HB2 ALA A 32 62.648 39.026-117.570 1.00 1.03 H new ATOM 0 HB3 ALA A 32 63.188 40.711-117.373 1.00 1.03 H new ATOM 278 N GLN A 33 62.529 42.283-115.305 1.00 1.21 N ATOM 279 CA GLN A 33 62.935 43.370-114.377 1.00 1.28 C ATOM 280 C GLN A 33 62.020 43.323-113.156 1.00 1.43 C ATOM 281 O GLN A 33 62.424 43.625-112.050 1.00 1.48 O ATOM 282 CB GLN A 33 62.795 44.724-115.077 1.00 1.29 C ATOM 283 CG GLN A 33 63.981 44.936-116.021 1.00 1.16 C ATOM 284 CD GLN A 33 63.969 46.376-116.539 1.00 1.21 C ATOM 285 OE1 GLN A 33 65.000 47.014-116.617 1.00 1.53 O ATOM 286 NE2 GLN A 33 62.838 46.917-116.900 1.00 1.38 N ATOM 0 H GLN A 33 62.465 42.548-116.288 1.00 1.21 H new ATOM 0 HA GLN A 33 63.973 43.238-114.073 1.00 1.28 H new ATOM 0 HB2 GLN A 33 61.860 44.761-115.636 1.00 1.29 H new ATOM 0 HB3 GLN A 33 62.757 45.525-114.339 1.00 1.29 H new ATOM 0 HG2 GLN A 33 64.916 44.734-115.499 1.00 1.16 H new ATOM 0 HG3 GLN A 33 63.925 44.237-116.856 1.00 1.16 H new ATOM 0 HE21 GLN A 33 61.973 46.381-116.834 1.00 1.38 H new ATOM 0 HE22 GLN A 33 62.819 47.876-117.248 1.00 1.38 H new ATOM 295 N ARG A 34 60.790 42.930-113.348 1.00 1.51 N ATOM 296 CA ARG A 34 59.850 42.844-112.199 1.00 1.67 C ATOM 297 C ARG A 34 60.266 41.674-111.313 1.00 1.69 C ATOM 298 O ARG A 34 60.359 41.795-110.108 1.00 1.78 O ATOM 299 CB ARG A 34 58.427 42.621-112.714 1.00 1.74 C ATOM 300 CG ARG A 34 57.529 43.771-112.251 1.00 1.91 C ATOM 301 CD ARG A 34 57.248 43.628-110.753 1.00 2.46 C ATOM 302 NE ARG A 34 55.782 43.770-110.500 1.00 2.89 N ATOM 303 CZ ARG A 34 55.086 44.696-111.105 1.00 3.51 C ATOM 304 NH1 ARG A 34 55.678 45.567-111.875 1.00 4.05 N ATOM 305 NH2 ARG A 34 53.797 44.765-110.919 1.00 4.00 N ATOM 0 H ARG A 34 60.397 42.665-114.251 1.00 1.51 H new ATOM 0 HA ARG A 34 59.878 43.771-111.626 1.00 1.67 H new ATOM 0 HB2 ARG A 34 58.428 42.562-113.802 1.00 1.74 H new ATOM 0 HB3 ARG A 34 58.040 41.672-112.344 1.00 1.74 H new ATOM 0 HG2 ARG A 34 58.012 44.727-112.452 1.00 1.91 H new ATOM 0 HG3 ARG A 34 56.593 43.763-112.810 1.00 1.91 H new ATOM 0 HD2 ARG A 34 57.596 42.657-110.399 1.00 2.46 H new ATOM 0 HD3 ARG A 34 57.798 44.386-110.196 1.00 2.46 H new ATOM 0 HE ARG A 34 55.319 43.137-109.848 1.00 2.89 H new ATOM 0 HH11 ARG A 34 56.689 45.527-112.007 1.00 4.05 H new ATOM 0 HH12 ARG A 34 55.130 46.288-112.345 1.00 4.05 H new ATOM 0 HH21 ARG A 34 53.334 44.097-110.302 1.00 4.00 H new ATOM 0 HH22 ARG A 34 53.252 45.487-111.390 1.00 4.00 H new ATOM 319 N LEU A 35 60.539 40.547-111.905 1.00 1.61 N ATOM 320 CA LEU A 35 60.975 39.377-111.099 1.00 1.63 C ATOM 321 C LEU A 35 62.364 39.683-110.546 1.00 1.57 C ATOM 322 O LEU A 35 62.898 38.962-109.727 1.00 1.60 O ATOM 323 CB LEU A 35 61.035 38.131-111.986 1.00 1.59 C ATOM 324 CG LEU A 35 59.619 37.610-112.232 1.00 1.70 C ATOM 325 CD1 LEU A 35 58.978 38.394-113.378 1.00 1.92 C ATOM 326 CD2 LEU A 35 59.680 36.126-112.604 1.00 2.08 C ATOM 0 H LEU A 35 60.479 40.386-112.910 1.00 1.61 H new ATOM 0 HA LEU A 35 60.273 39.191-110.286 1.00 1.63 H new ATOM 0 HB2 LEU A 35 61.516 38.370-112.935 1.00 1.59 H new ATOM 0 HB3 LEU A 35 61.639 37.360-111.508 1.00 1.59 H new ATOM 0 HG LEU A 35 59.024 37.736-111.327 1.00 1.70 H new ATOM 0 HD11 LEU A 35 57.968 38.022-113.553 1.00 1.92 H new ATOM 0 HD12 LEU A 35 58.935 39.451-113.116 1.00 1.92 H new ATOM 0 HD13 LEU A 35 59.573 38.268-114.283 1.00 1.92 H new ATOM 0 HD21 LEU A 35 58.671 35.753-112.780 1.00 2.08 H new ATOM 0 HD22 LEU A 35 60.275 36.002-113.509 1.00 2.08 H new ATOM 0 HD23 LEU A 35 60.137 35.565-111.789 1.00 2.08 H new ATOM 338 N HIS A 36 62.945 40.764-110.992 1.00 1.50 N ATOM 339 CA HIS A 36 64.299 41.149-110.502 1.00 1.45 C ATOM 340 C HIS A 36 65.252 39.957-110.609 1.00 1.37 C ATOM 341 O HIS A 36 65.478 39.244-109.652 1.00 1.49 O ATOM 342 CB HIS A 36 64.203 41.590-109.040 1.00 1.59 C ATOM 343 CG HIS A 36 63.869 43.055-108.978 1.00 1.67 C ATOM 344 ND1 HIS A 36 64.721 43.984-108.401 1.00 1.74 N ATOM 345 CD2 HIS A 36 62.779 43.767-109.415 1.00 1.73 C ATOM 346 CE1 HIS A 36 64.135 45.191-108.505 1.00 1.85 C ATOM 347 NE2 HIS A 36 62.949 45.115-109.115 1.00 1.84 N ATOM 0 H HIS A 36 62.538 41.400-111.678 1.00 1.50 H new ATOM 0 HA HIS A 36 64.680 41.969-111.111 1.00 1.45 H new ATOM 0 HB2 HIS A 36 63.438 41.010-108.524 1.00 1.59 H new ATOM 0 HB3 HIS A 36 65.147 41.400-108.529 1.00 1.59 H new ATOM 0 HD2 HIS A 36 61.920 43.345-109.916 1.00 1.73 H new ATOM 0 HE1 HIS A 36 64.571 46.109-108.140 1.00 1.85 H new ATOM 0 HE2 HIS A 36 62.306 45.881-109.317 1.00 1.84 H new ATOM 355 N LEU A 37 65.826 39.745-111.761 1.00 1.23 N ATOM 356 CA LEU A 37 66.778 38.610-111.920 1.00 1.18 C ATOM 357 C LEU A 37 68.203 39.132-111.707 1.00 1.13 C ATOM 358 O LEU A 37 68.496 40.271-112.014 1.00 1.09 O ATOM 359 CB LEU A 37 66.659 38.027-113.332 1.00 1.11 C ATOM 360 CG LEU A 37 65.214 37.601-113.599 1.00 1.16 C ATOM 361 CD1 LEU A 37 64.336 38.842-113.770 1.00 1.18 C ATOM 362 CD2 LEU A 37 65.160 36.764-114.880 1.00 1.15 C ATOM 0 H LEU A 37 65.677 40.308-112.598 1.00 1.23 H new ATOM 0 HA LEU A 37 66.548 37.832-111.192 1.00 1.18 H new ATOM 0 HB2 LEU A 37 66.971 38.768-114.068 1.00 1.11 H new ATOM 0 HB3 LEU A 37 67.325 37.171-113.439 1.00 1.11 H new ATOM 0 HG LEU A 37 64.850 37.011-112.758 1.00 1.16 H new ATOM 0 HD11 LEU A 37 63.307 38.536-113.960 1.00 1.18 H new ATOM 0 HD12 LEU A 37 64.374 39.443-112.861 1.00 1.18 H new ATOM 0 HD13 LEU A 37 64.700 39.432-114.611 1.00 1.18 H new ATOM 0 HD21 LEU A 37 64.131 36.459-115.072 1.00 1.15 H new ATOM 0 HD22 LEU A 37 65.525 37.357-115.718 1.00 1.15 H new ATOM 0 HD23 LEU A 37 65.785 35.879-114.763 1.00 1.15 H new ATOM 374 N PRO A 38 69.087 38.315-111.194 1.00 1.17 N ATOM 375 CA PRO A 38 70.490 38.751-110.965 1.00 1.16 C ATOM 376 C PRO A 38 71.106 39.355-112.228 1.00 1.05 C ATOM 377 O PRO A 38 70.640 39.116-113.319 1.00 0.99 O ATOM 378 CB PRO A 38 71.189 37.441-110.595 1.00 1.23 C ATOM 379 CG PRO A 38 70.130 36.338-110.451 1.00 1.30 C ATOM 380 CD PRO A 38 68.758 36.918-110.814 1.00 1.26 C ATOM 0 HA PRO A 38 70.577 39.528-110.205 1.00 1.16 H new ATOM 0 HB2 PRO A 38 71.914 37.170-111.363 1.00 1.23 H new ATOM 0 HB3 PRO A 38 71.741 37.558-109.662 1.00 1.23 H new ATOM 0 HG2 PRO A 38 70.369 35.498-111.103 1.00 1.30 H new ATOM 0 HG3 PRO A 38 70.120 35.956-109.430 1.00 1.30 H new ATOM 0 HD2 PRO A 38 68.292 36.374-111.635 1.00 1.26 H new ATOM 0 HD3 PRO A 38 68.066 36.879-109.973 1.00 1.26 H new ATOM 388 N PRO A 39 72.145 40.130-112.087 1.00 1.04 N ATOM 389 CA PRO A 39 72.804 40.748-113.267 1.00 0.97 C ATOM 390 C PRO A 39 73.307 39.694-114.259 1.00 0.91 C ATOM 391 O PRO A 39 73.471 39.957-115.434 1.00 0.85 O ATOM 392 CB PRO A 39 73.977 41.503-112.639 1.00 1.03 C ATOM 393 CG PRO A 39 73.963 41.272-111.121 1.00 1.12 C ATOM 394 CD PRO A 39 72.728 40.441-110.758 1.00 1.13 C ATOM 0 HA PRO A 39 72.129 41.380-113.844 1.00 0.97 H new ATOM 0 HB2 PRO A 39 74.919 41.157-113.064 1.00 1.03 H new ATOM 0 HB3 PRO A 39 73.901 42.568-112.859 1.00 1.03 H new ATOM 0 HG2 PRO A 39 74.871 40.755-110.810 1.00 1.12 H new ATOM 0 HG3 PRO A 39 73.944 42.226-110.594 1.00 1.12 H new ATOM 0 HD2 PRO A 39 72.994 39.537-110.211 1.00 1.13 H new ATOM 0 HD3 PRO A 39 72.033 41.000-110.131 1.00 1.13 H new ATOM 402 N VAL A 40 73.551 38.500-113.790 1.00 0.95 N ATOM 403 CA VAL A 40 74.048 37.428-114.697 1.00 0.93 C ATOM 404 C VAL A 40 72.870 36.800-115.439 1.00 0.89 C ATOM 405 O VAL A 40 72.871 36.692-116.650 1.00 0.84 O ATOM 406 CB VAL A 40 74.779 36.363-113.872 1.00 1.01 C ATOM 407 CG1 VAL A 40 73.779 35.353-113.304 1.00 1.05 C ATOM 408 CG2 VAL A 40 75.789 35.636-114.762 1.00 1.03 C ATOM 0 H VAL A 40 73.427 38.221-112.817 1.00 0.95 H new ATOM 0 HA VAL A 40 74.739 37.853-115.425 1.00 0.93 H new ATOM 0 HB VAL A 40 75.298 36.849-113.046 1.00 1.01 H new ATOM 0 HG11 VAL A 40 74.312 34.602-112.720 1.00 1.05 H new ATOM 0 HG12 VAL A 40 73.064 35.870-112.664 1.00 1.05 H new ATOM 0 HG13 VAL A 40 73.248 34.867-114.123 1.00 1.05 H new ATOM 0 HG21 VAL A 40 76.310 34.878-114.177 1.00 1.03 H new ATOM 0 HG22 VAL A 40 75.266 35.159-115.591 1.00 1.03 H new ATOM 0 HG23 VAL A 40 76.511 36.353-115.153 1.00 1.03 H new ATOM 418 N ARG A 41 71.860 36.397-114.725 1.00 0.92 N ATOM 419 CA ARG A 41 70.678 35.788-115.392 1.00 0.91 C ATOM 420 C ARG A 41 69.943 36.878-116.165 1.00 0.84 C ATOM 421 O ARG A 41 69.356 36.637-117.203 1.00 0.80 O ATOM 422 CB ARG A 41 69.745 35.185-114.339 1.00 1.01 C ATOM 423 CG ARG A 41 68.857 34.124-114.992 1.00 1.37 C ATOM 424 CD ARG A 41 68.113 33.342-113.908 1.00 1.45 C ATOM 425 NE ARG A 41 69.070 32.449-113.195 1.00 1.95 N ATOM 426 CZ ARG A 41 68.733 31.909-112.056 1.00 2.45 C ATOM 427 NH1 ARG A 41 67.556 32.146-111.544 1.00 3.06 N ATOM 428 NH2 ARG A 41 69.572 31.130-111.430 1.00 2.81 N ATOM 0 H ARG A 41 71.801 36.462-113.709 1.00 0.92 H new ATOM 0 HA ARG A 41 70.999 34.999-116.072 1.00 0.91 H new ATOM 0 HB2 ARG A 41 70.328 34.740-113.533 1.00 1.01 H new ATOM 0 HB3 ARG A 41 69.129 35.966-113.893 1.00 1.01 H new ATOM 0 HG2 ARG A 41 68.144 34.597-115.668 1.00 1.37 H new ATOM 0 HG3 ARG A 41 69.464 33.446-115.592 1.00 1.37 H new ATOM 0 HD2 ARG A 41 67.647 34.030-113.203 1.00 1.45 H new ATOM 0 HD3 ARG A 41 67.312 32.752-114.355 1.00 1.45 H new ATOM 0 HE ARG A 41 69.988 32.260-113.597 1.00 1.95 H new ATOM 0 HH11 ARG A 41 66.899 32.753-112.034 1.00 3.06 H new ATOM 0 HH12 ARG A 41 67.293 31.724-110.654 1.00 3.06 H new ATOM 0 HH21 ARG A 41 70.491 30.943-111.831 1.00 2.81 H new ATOM 0 HH22 ARG A 41 69.309 30.708-110.540 1.00 2.81 H new ATOM 442 N LEU A 42 69.984 38.084-115.671 1.00 0.83 N ATOM 443 CA LEU A 42 69.302 39.199-116.377 1.00 0.79 C ATOM 444 C LEU A 42 70.181 39.660-117.532 1.00 0.73 C ATOM 445 O LEU A 42 69.696 40.047-118.572 1.00 0.69 O ATOM 446 CB LEU A 42 69.066 40.366-115.420 1.00 0.85 C ATOM 447 CG LEU A 42 68.001 41.287-116.016 1.00 0.85 C ATOM 448 CD1 LEU A 42 66.641 40.967-115.395 1.00 0.94 C ATOM 449 CD2 LEU A 42 68.364 42.743-115.723 1.00 0.91 C ATOM 0 H LEU A 42 70.461 38.344-114.808 1.00 0.83 H new ATOM 0 HA LEU A 42 68.339 38.854-116.752 1.00 0.79 H new ATOM 0 HB2 LEU A 42 68.743 39.996-114.447 1.00 0.85 H new ATOM 0 HB3 LEU A 42 69.993 40.916-115.260 1.00 0.85 H new ATOM 0 HG LEU A 42 67.952 41.133-117.094 1.00 0.85 H new ATOM 0 HD11 LEU A 42 65.883 41.624-115.821 1.00 0.94 H new ATOM 0 HD12 LEU A 42 66.381 39.929-115.604 1.00 0.94 H new ATOM 0 HD13 LEU A 42 66.689 41.119-114.317 1.00 0.94 H new ATOM 0 HD21 LEU A 42 67.605 43.400-116.148 1.00 0.91 H new ATOM 0 HD22 LEU A 42 68.414 42.896-114.645 1.00 0.91 H new ATOM 0 HD23 LEU A 42 69.332 42.973-116.167 1.00 0.91 H new ATOM 461 N ALA A 43 71.474 39.614-117.369 1.00 0.74 N ATOM 462 CA ALA A 43 72.364 40.036-118.481 1.00 0.72 C ATOM 463 C ALA A 43 72.260 38.994-119.591 1.00 0.68 C ATOM 464 O ALA A 43 72.327 39.306-120.764 1.00 0.66 O ATOM 465 CB ALA A 43 73.809 40.126-117.986 1.00 0.79 C ATOM 0 H ALA A 43 71.948 39.305-116.520 1.00 0.74 H new ATOM 0 HA ALA A 43 72.065 41.016-118.853 1.00 0.72 H new ATOM 0 HB1 ALA A 43 74.456 40.436-118.807 1.00 0.79 H new ATOM 0 HB2 ALA A 43 73.872 40.856-117.179 1.00 0.79 H new ATOM 0 HB3 ALA A 43 74.130 39.151-117.620 1.00 0.79 H new ATOM 471 N GLU A 44 72.074 37.754-119.225 1.00 0.71 N ATOM 472 CA GLU A 44 71.942 36.686-120.252 1.00 0.72 C ATOM 473 C GLU A 44 70.556 36.789-120.885 1.00 0.66 C ATOM 474 O GLU A 44 70.391 36.637-122.079 1.00 0.62 O ATOM 475 CB GLU A 44 72.104 35.315-119.591 1.00 0.81 C ATOM 476 CG GLU A 44 72.420 34.266-120.660 1.00 1.31 C ATOM 477 CD GLU A 44 73.924 34.262-120.942 1.00 1.53 C ATOM 478 OE1 GLU A 44 74.682 34.091-120.002 1.00 2.03 O ATOM 479 OE2 GLU A 44 74.291 34.429-122.093 1.00 2.03 O ATOM 0 H GLU A 44 72.008 37.437-118.258 1.00 0.71 H new ATOM 0 HA GLU A 44 72.711 36.805-121.015 1.00 0.72 H new ATOM 0 HB2 GLU A 44 72.904 35.348-118.852 1.00 0.81 H new ATOM 0 HB3 GLU A 44 71.191 35.045-119.061 1.00 0.81 H new ATOM 0 HG2 GLU A 44 72.100 33.280-120.323 1.00 1.31 H new ATOM 0 HG3 GLU A 44 71.868 34.485-121.574 1.00 1.31 H new ATOM 486 N LEU A 45 69.558 37.060-120.089 1.00 0.67 N ATOM 487 CA LEU A 45 68.180 37.190-120.638 1.00 0.65 C ATOM 488 C LEU A 45 68.097 38.468-121.474 1.00 0.57 C ATOM 489 O LEU A 45 67.570 38.472-122.568 1.00 0.56 O ATOM 490 CB LEU A 45 67.174 37.264-119.488 1.00 0.74 C ATOM 491 CG LEU A 45 65.755 37.332-120.055 1.00 0.75 C ATOM 492 CD1 LEU A 45 65.221 35.914-120.265 1.00 0.97 C ATOM 493 CD2 LEU A 45 64.849 38.076-119.071 1.00 0.86 C ATOM 0 H LEU A 45 69.638 37.197-119.081 1.00 0.67 H new ATOM 0 HA LEU A 45 67.948 36.326-121.261 1.00 0.65 H new ATOM 0 HB2 LEU A 45 67.278 36.391-118.843 1.00 0.74 H new ATOM 0 HB3 LEU A 45 67.373 38.141-118.872 1.00 0.74 H new ATOM 0 HG LEU A 45 65.770 37.860-121.008 1.00 0.75 H new ATOM 0 HD11 LEU A 45 64.210 35.962-120.669 1.00 0.97 H new ATOM 0 HD12 LEU A 45 65.866 35.382-120.964 1.00 0.97 H new ATOM 0 HD13 LEU A 45 65.206 35.386-119.312 1.00 0.97 H new ATOM 0 HD21 LEU A 45 63.837 38.125-119.474 1.00 0.86 H new ATOM 0 HD22 LEU A 45 64.835 37.547-118.118 1.00 0.86 H new ATOM 0 HD23 LEU A 45 65.229 39.086-118.919 1.00 0.86 H new ATOM 505 N HIS A 46 68.619 39.553-120.968 1.00 0.59 N ATOM 506 CA HIS A 46 68.577 40.830-121.733 1.00 0.57 C ATOM 507 C HIS A 46 69.389 40.675-123.020 1.00 0.53 C ATOM 508 O HIS A 46 68.977 41.102-124.080 1.00 0.51 O ATOM 509 CB HIS A 46 69.178 41.951-120.882 1.00 0.63 C ATOM 510 CG HIS A 46 68.939 43.278-121.550 1.00 0.66 C ATOM 511 ND1 HIS A 46 69.942 43.957-122.224 1.00 0.71 N ATOM 512 CD2 HIS A 46 67.819 44.066-121.653 1.00 0.69 C ATOM 513 CE1 HIS A 46 69.412 45.099-122.697 1.00 0.76 C ATOM 514 NE2 HIS A 46 68.120 45.216-122.378 1.00 0.74 N ATOM 0 H HIS A 46 69.073 39.609-120.056 1.00 0.59 H new ATOM 0 HA HIS A 46 67.544 41.076-121.981 1.00 0.57 H new ATOM 0 HB2 HIS A 46 68.729 41.947-119.889 1.00 0.63 H new ATOM 0 HB3 HIS A 46 70.247 41.787-120.750 1.00 0.63 H new ATOM 0 HD2 HIS A 46 66.852 43.830-121.235 1.00 0.69 H new ATOM 0 HE1 HIS A 46 69.964 45.833-123.266 1.00 0.76 H new ATOM 0 HE2 HIS A 46 67.490 45.982-122.615 1.00 0.74 H new ATOM 522 N ALA A 47 70.541 40.063-122.939 1.00 0.56 N ATOM 523 CA ALA A 47 71.372 39.880-124.162 1.00 0.59 C ATOM 524 C ALA A 47 70.625 38.983-125.147 1.00 0.54 C ATOM 525 O ALA A 47 70.336 39.370-126.263 1.00 0.53 O ATOM 526 CB ALA A 47 72.702 39.227-123.783 1.00 0.67 C ATOM 0 H ALA A 47 70.940 39.683-122.081 1.00 0.56 H new ATOM 0 HA ALA A 47 71.565 40.849-124.623 1.00 0.59 H new ATOM 0 HB1 ALA A 47 73.310 39.093-124.678 1.00 0.67 H new ATOM 0 HB2 ALA A 47 73.232 39.865-123.076 1.00 0.67 H new ATOM 0 HB3 ALA A 47 72.513 38.256-123.324 1.00 0.67 H new ATOM 532 N ASP A 48 70.298 37.792-124.740 1.00 0.53 N ATOM 533 CA ASP A 48 69.558 36.880-125.653 1.00 0.52 C ATOM 534 C ASP A 48 68.301 37.596-126.142 1.00 0.43 C ATOM 535 O ASP A 48 67.972 37.572-127.312 1.00 0.42 O ATOM 536 CB ASP A 48 69.166 35.605-124.902 1.00 0.60 C ATOM 537 CG ASP A 48 70.422 34.789-124.589 1.00 0.75 C ATOM 538 OD1 ASP A 48 71.318 34.778-125.416 1.00 1.32 O ATOM 539 OD2 ASP A 48 70.465 34.188-123.528 1.00 1.31 O ATOM 0 H ASP A 48 70.510 37.410-123.818 1.00 0.53 H new ATOM 0 HA ASP A 48 70.187 36.611-126.501 1.00 0.52 H new ATOM 0 HB2 ASP A 48 68.646 35.860-123.979 1.00 0.60 H new ATOM 0 HB3 ASP A 48 68.476 35.014-125.504 1.00 0.60 H new ATOM 544 N LEU A 49 67.603 38.250-125.253 1.00 0.42 N ATOM 545 CA LEU A 49 66.377 38.983-125.667 1.00 0.40 C ATOM 546 C LEU A 49 66.769 40.050-126.686 1.00 0.38 C ATOM 547 O LEU A 49 66.030 40.346-127.602 1.00 0.38 O ATOM 548 CB LEU A 49 65.730 39.645-124.449 1.00 0.47 C ATOM 549 CG LEU A 49 64.822 38.636-123.742 1.00 0.55 C ATOM 550 CD1 LEU A 49 64.215 39.281-122.495 1.00 0.74 C ATOM 551 CD2 LEU A 49 63.699 38.208-124.690 1.00 0.75 C ATOM 0 H LEU A 49 67.830 38.307-124.260 1.00 0.42 H new ATOM 0 HA LEU A 49 65.662 38.289-126.109 1.00 0.40 H new ATOM 0 HB2 LEU A 49 66.499 40.001-123.764 1.00 0.47 H new ATOM 0 HB3 LEU A 49 65.152 40.516-124.759 1.00 0.47 H new ATOM 0 HG LEU A 49 65.407 37.763-123.452 1.00 0.55 H new ATOM 0 HD11 LEU A 49 63.568 38.562-121.992 1.00 0.74 H new ATOM 0 HD12 LEU A 49 65.013 39.587-121.819 1.00 0.74 H new ATOM 0 HD13 LEU A 49 63.630 40.154-122.785 1.00 0.74 H new ATOM 0 HD21 LEU A 49 63.052 37.489-124.187 1.00 0.75 H new ATOM 0 HD22 LEU A 49 63.115 39.081-124.980 1.00 0.75 H new ATOM 0 HD23 LEU A 49 64.129 37.748-125.580 1.00 0.75 H new ATOM 563 N LYS A 50 67.937 40.621-126.546 1.00 0.42 N ATOM 564 CA LYS A 50 68.373 41.653-127.525 1.00 0.49 C ATOM 565 C LYS A 50 68.491 40.991-128.894 1.00 0.50 C ATOM 566 O LYS A 50 67.854 41.396-129.843 1.00 0.52 O ATOM 567 CB LYS A 50 69.727 42.236-127.110 1.00 0.59 C ATOM 568 CG LYS A 50 69.571 43.012-125.799 1.00 0.63 C ATOM 569 CD LYS A 50 69.851 44.497-126.043 1.00 1.05 C ATOM 570 CE LYS A 50 71.362 44.735-126.063 1.00 0.93 C ATOM 571 NZ LYS A 50 71.715 45.593-127.230 1.00 1.61 N ATOM 0 H LYS A 50 68.602 40.417-125.800 1.00 0.42 H new ATOM 0 HA LYS A 50 67.647 42.465-127.559 1.00 0.49 H new ATOM 0 HB2 LYS A 50 70.457 41.436-126.986 1.00 0.59 H new ATOM 0 HB3 LYS A 50 70.106 42.895-127.892 1.00 0.59 H new ATOM 0 HG2 LYS A 50 68.563 42.882-125.406 1.00 0.63 H new ATOM 0 HG3 LYS A 50 70.259 42.621-125.049 1.00 0.63 H new ATOM 0 HD2 LYS A 50 69.410 44.810-126.989 1.00 1.05 H new ATOM 0 HD3 LYS A 50 69.388 45.099-125.261 1.00 1.05 H new ATOM 0 HE2 LYS A 50 71.678 45.215-125.137 1.00 0.93 H new ATOM 0 HE3 LYS A 50 71.890 43.783-126.125 1.00 0.93 H new ATOM 0 HZ1 LYS A 50 72.742 45.755-127.244 1.00 1.61 H new ATOM 0 HZ2 LYS A 50 71.428 45.118-128.110 1.00 1.61 H new ATOM 0 HZ3 LYS A 50 71.222 46.505-127.152 1.00 1.61 H new ATOM 585 N ILE A 51 69.277 39.955-129.005 1.00 0.52 N ATOM 586 CA ILE A 51 69.385 39.271-130.321 1.00 0.58 C ATOM 587 C ILE A 51 67.966 39.058-130.838 1.00 0.52 C ATOM 588 O ILE A 51 67.653 39.331-131.984 1.00 0.56 O ATOM 589 CB ILE A 51 70.083 37.921-130.153 1.00 0.63 C ATOM 590 CG1 ILE A 51 71.593 38.140-130.065 1.00 0.74 C ATOM 591 CG2 ILE A 51 69.767 37.029-131.355 1.00 0.68 C ATOM 592 CD1 ILE A 51 71.911 38.980-128.829 1.00 0.71 C ATOM 0 H ILE A 51 69.841 39.559-128.253 1.00 0.52 H new ATOM 0 HA ILE A 51 69.968 39.871-131.020 1.00 0.58 H new ATOM 0 HB ILE A 51 69.730 37.439-129.241 1.00 0.63 H new ATOM 0 HG12 ILE A 51 72.108 37.181-130.009 1.00 0.74 H new ATOM 0 HG13 ILE A 51 71.952 38.643-130.963 1.00 0.74 H new ATOM 0 HG21 ILE A 51 70.265 36.067-131.235 1.00 0.68 H new ATOM 0 HG22 ILE A 51 68.690 36.875-131.420 1.00 0.68 H new ATOM 0 HG23 ILE A 51 70.121 37.509-132.267 1.00 0.68 H new ATOM 0 HD11 ILE A 51 72.988 39.138-128.764 1.00 0.71 H new ATOM 0 HD12 ILE A 51 71.407 39.943-128.904 1.00 0.71 H new ATOM 0 HD13 ILE A 51 71.566 38.459-127.936 1.00 0.71 H new ATOM 604 N GLN A 52 67.096 38.595-129.981 1.00 0.45 N ATOM 605 CA GLN A 52 65.685 38.388-130.393 1.00 0.43 C ATOM 606 C GLN A 52 65.096 39.742-130.780 1.00 0.42 C ATOM 607 O GLN A 52 64.213 39.834-131.609 1.00 0.45 O ATOM 608 CB GLN A 52 64.893 37.794-129.227 1.00 0.44 C ATOM 609 CG GLN A 52 63.676 37.040-129.765 1.00 0.56 C ATOM 610 CD GLN A 52 64.143 35.853-130.608 1.00 0.74 C ATOM 611 OE1 GLN A 52 64.525 34.829-130.077 1.00 1.27 O ATOM 612 NE2 GLN A 52 64.129 35.946-131.910 1.00 0.80 N ATOM 0 H GLN A 52 67.306 38.352-129.013 1.00 0.45 H new ATOM 0 HA GLN A 52 65.635 37.702-131.238 1.00 0.43 H new ATOM 0 HB2 GLN A 52 65.526 37.119-128.651 1.00 0.44 H new ATOM 0 HB3 GLN A 52 64.573 38.586-128.551 1.00 0.44 H new ATOM 0 HG2 GLN A 52 63.056 36.691-128.939 1.00 0.56 H new ATOM 0 HG3 GLN A 52 63.059 37.707-130.367 1.00 0.56 H new ATOM 0 HE21 GLN A 52 63.808 36.805-132.357 1.00 0.80 H new ATOM 0 HE22 GLN A 52 64.439 35.159-132.481 1.00 0.80 H new ATOM 621 N GLU A 53 65.592 40.802-130.194 1.00 0.43 N ATOM 622 CA GLU A 53 65.073 42.150-130.544 1.00 0.49 C ATOM 623 C GLU A 53 65.609 42.531-131.921 1.00 0.57 C ATOM 624 O GLU A 53 64.914 43.108-132.730 1.00 0.65 O ATOM 625 CB GLU A 53 65.536 43.180-129.511 1.00 0.55 C ATOM 626 CG GLU A 53 65.098 44.578-129.960 1.00 0.66 C ATOM 627 CD GLU A 53 66.326 45.480-130.102 1.00 0.87 C ATOM 628 OE1 GLU A 53 67.378 44.965-130.444 1.00 1.36 O ATOM 629 OE2 GLU A 53 66.195 46.670-129.866 1.00 1.40 O ATOM 0 H GLU A 53 66.331 40.788-129.491 1.00 0.43 H new ATOM 0 HA GLU A 53 63.983 42.133-130.553 1.00 0.49 H new ATOM 0 HB2 GLU A 53 65.111 42.949-128.534 1.00 0.55 H new ATOM 0 HB3 GLU A 53 66.620 43.143-129.404 1.00 0.55 H new ATOM 0 HG2 GLU A 53 64.568 44.516-130.910 1.00 0.66 H new ATOM 0 HG3 GLU A 53 64.404 45.003-129.235 1.00 0.66 H new ATOM 636 N ARG A 54 66.840 42.197-132.202 1.00 0.61 N ATOM 637 CA ARG A 54 67.404 42.526-133.537 1.00 0.73 C ATOM 638 C ARG A 54 66.567 41.815-134.598 1.00 0.71 C ATOM 639 O ARG A 54 66.152 42.402-135.579 1.00 0.78 O ATOM 640 CB ARG A 54 68.853 42.041-133.619 1.00 0.81 C ATOM 641 CG ARG A 54 69.757 42.991-132.830 1.00 0.87 C ATOM 642 CD ARG A 54 70.751 43.660-133.781 1.00 1.10 C ATOM 643 NE ARG A 54 71.838 44.304-132.992 1.00 1.74 N ATOM 644 CZ ARG A 54 72.942 44.673-133.582 1.00 2.23 C ATOM 645 NH1 ARG A 54 73.094 44.476-134.863 1.00 2.47 N ATOM 646 NH2 ARG A 54 73.894 45.237-132.891 1.00 2.97 N ATOM 0 H ARG A 54 67.474 41.713-131.567 1.00 0.61 H new ATOM 0 HA ARG A 54 67.383 43.604-133.698 1.00 0.73 H new ATOM 0 HB2 ARG A 54 68.932 41.030-133.218 1.00 0.81 H new ATOM 0 HB3 ARG A 54 69.174 41.997-134.660 1.00 0.81 H new ATOM 0 HG2 ARG A 54 69.155 43.747-132.326 1.00 0.87 H new ATOM 0 HG3 ARG A 54 70.292 42.441-132.056 1.00 0.87 H new ATOM 0 HD2 ARG A 54 71.171 42.921-134.463 1.00 1.10 H new ATOM 0 HD3 ARG A 54 70.241 44.404-134.392 1.00 1.10 H new ATOM 0 HE ARG A 54 71.719 44.457-131.990 1.00 1.74 H new ATOM 0 HH11 ARG A 54 72.350 44.034-135.403 1.00 2.47 H new ATOM 0 HH12 ARG A 54 73.957 44.764-135.324 1.00 2.47 H new ATOM 0 HH21 ARG A 54 73.776 45.390-131.889 1.00 2.97 H new ATOM 0 HH22 ARG A 54 74.757 45.525-133.352 1.00 2.97 H new ATOM 660 N ASP A 55 66.306 40.551-134.399 1.00 0.62 N ATOM 661 CA ASP A 55 65.486 39.796-135.386 1.00 0.62 C ATOM 662 C ASP A 55 64.039 40.292-135.325 1.00 0.57 C ATOM 663 O ASP A 55 63.424 40.568-136.337 1.00 0.61 O ATOM 664 CB ASP A 55 65.529 38.304-135.051 1.00 0.60 C ATOM 665 CG ASP A 55 66.980 37.821-135.056 1.00 0.71 C ATOM 666 OD1 ASP A 55 67.689 38.145-135.994 1.00 1.36 O ATOM 667 OD2 ASP A 55 67.359 37.134-134.121 1.00 1.19 O ATOM 0 H ASP A 55 66.626 40.010-133.596 1.00 0.62 H new ATOM 0 HA ASP A 55 65.884 39.953-136.388 1.00 0.62 H new ATOM 0 HB2 ASP A 55 65.079 38.127-134.074 1.00 0.60 H new ATOM 0 HB3 ASP A 55 64.945 37.740-135.778 1.00 0.60 H new ATOM 672 N GLU A 56 63.490 40.412-134.145 1.00 0.51 N ATOM 673 CA GLU A 56 62.085 40.893-134.026 1.00 0.51 C ATOM 674 C GLU A 56 61.970 42.267-134.681 1.00 0.59 C ATOM 675 O GLU A 56 61.259 42.449-135.646 1.00 0.63 O ATOM 676 CB GLU A 56 61.693 40.989-132.551 1.00 0.49 C ATOM 677 CG GLU A 56 61.383 39.589-132.013 1.00 0.56 C ATOM 678 CD GLU A 56 59.982 39.166-132.458 1.00 1.07 C ATOM 679 OE1 GLU A 56 59.772 39.043-133.653 1.00 1.77 O ATOM 680 OE2 GLU A 56 59.142 38.971-131.596 1.00 1.51 O ATOM 0 H GLU A 56 63.953 40.198-133.262 1.00 0.51 H new ATOM 0 HA GLU A 56 61.416 40.192-134.525 1.00 0.51 H new ATOM 0 HB2 GLU A 56 62.503 41.440-131.977 1.00 0.49 H new ATOM 0 HB3 GLU A 56 60.823 41.635-132.436 1.00 0.49 H new ATOM 0 HG2 GLU A 56 62.122 38.876-132.379 1.00 0.56 H new ATOM 0 HG3 GLU A 56 61.447 39.584-130.925 1.00 0.56 H new ATOM 687 N LEU A 57 62.675 43.238-134.184 1.00 0.63 N ATOM 688 CA LEU A 57 62.597 44.577-134.818 1.00 0.74 C ATOM 689 C LEU A 57 62.748 44.377-136.322 1.00 0.79 C ATOM 690 O LEU A 57 61.895 44.748-137.105 1.00 0.84 O ATOM 691 CB LEU A 57 63.727 45.470-134.299 1.00 0.81 C ATOM 692 CG LEU A 57 63.360 46.018-132.919 1.00 0.82 C ATOM 693 CD1 LEU A 57 64.614 46.569-132.240 1.00 1.36 C ATOM 694 CD2 LEU A 57 62.335 47.144-133.072 1.00 1.31 C ATOM 0 H LEU A 57 63.294 43.165-133.377 1.00 0.63 H new ATOM 0 HA LEU A 57 61.647 45.058-134.583 1.00 0.74 H new ATOM 0 HB2 LEU A 57 64.655 44.901-134.240 1.00 0.81 H new ATOM 0 HB3 LEU A 57 63.901 46.292-134.993 1.00 0.81 H new ATOM 0 HG LEU A 57 62.936 45.217-132.313 1.00 0.82 H new ATOM 0 HD11 LEU A 57 64.353 46.960-131.256 1.00 1.36 H new ATOM 0 HD12 LEU A 57 65.349 45.771-132.130 1.00 1.36 H new ATOM 0 HD13 LEU A 57 65.035 47.369-132.848 1.00 1.36 H new ATOM 0 HD21 LEU A 57 62.074 47.534-132.088 1.00 1.31 H new ATOM 0 HD22 LEU A 57 62.761 47.944-133.678 1.00 1.31 H new ATOM 0 HD23 LEU A 57 61.440 46.757-133.558 1.00 1.31 H new ATOM 706 N ALA A 58 63.817 43.761-136.733 1.00 0.79 N ATOM 707 CA ALA A 58 63.999 43.514-138.183 1.00 0.86 C ATOM 708 C ALA A 58 62.677 42.993-138.745 1.00 0.82 C ATOM 709 O ALA A 58 62.315 43.264-139.875 1.00 0.89 O ATOM 710 CB ALA A 58 65.097 42.470-138.395 1.00 0.87 C ATOM 0 H ALA A 58 64.567 43.421-136.131 1.00 0.79 H new ATOM 0 HA ALA A 58 64.289 44.434-138.690 1.00 0.86 H new ATOM 0 HB1 ALA A 58 65.228 42.291-139.462 1.00 0.87 H new ATOM 0 HB2 ALA A 58 66.033 42.835-137.971 1.00 0.87 H new ATOM 0 HB3 ALA A 58 64.814 41.539-137.903 1.00 0.87 H new ATOM 716 N TRP A 59 61.943 42.248-137.959 1.00 0.73 N ATOM 717 CA TRP A 59 60.648 41.723-138.460 1.00 0.71 C ATOM 718 C TRP A 59 59.637 42.865-138.580 1.00 0.76 C ATOM 719 O TRP A 59 58.929 42.969-139.567 1.00 0.83 O ATOM 720 CB TRP A 59 60.092 40.644-137.531 1.00 0.64 C ATOM 721 CG TRP A 59 58.817 40.144-138.120 1.00 0.67 C ATOM 722 CD1 TRP A 59 58.713 39.135-139.015 1.00 0.71 C ATOM 723 CD2 TRP A 59 57.466 40.626-137.884 1.00 0.71 C ATOM 724 NE1 TRP A 59 57.385 38.977-139.357 1.00 0.75 N ATOM 725 CE2 TRP A 59 56.574 39.871-138.679 1.00 0.75 C ATOM 726 CE3 TRP A 59 56.936 41.637-137.064 1.00 0.73 C ATOM 727 CZ2 TRP A 59 55.199 40.115-138.662 1.00 0.81 C ATOM 728 CZ3 TRP A 59 55.555 41.883-137.043 1.00 0.81 C ATOM 729 CH2 TRP A 59 54.689 41.124-137.840 1.00 0.84 C ATOM 0 H TRP A 59 62.185 41.985-137.003 1.00 0.73 H new ATOM 0 HA TRP A 59 60.820 41.277-139.440 1.00 0.71 H new ATOM 0 HB2 TRP A 59 60.807 39.829-137.422 1.00 0.64 H new ATOM 0 HB3 TRP A 59 59.918 41.051-136.535 1.00 0.64 H new ATOM 0 HD1 TRP A 59 59.535 38.549-139.399 1.00 0.71 H new ATOM 0 HE1 TRP A 59 57.044 38.287-140.026 1.00 0.75 H new ATOM 0 HE3 TRP A 59 57.596 42.228-136.446 1.00 0.73 H new ATOM 0 HZ2 TRP A 59 54.535 39.528-139.279 1.00 0.81 H new ATOM 0 HZ3 TRP A 59 55.158 42.662-136.409 1.00 0.81 H new ATOM 0 HH2 TRP A 59 53.627 41.318-137.820 1.00 0.84 H new ATOM 740 N LYS A 60 59.553 43.737-137.604 1.00 0.76 N ATOM 741 CA LYS A 60 58.573 44.850-137.739 1.00 0.85 C ATOM 742 C LYS A 60 58.879 45.536-139.065 1.00 0.93 C ATOM 743 O LYS A 60 57.999 45.996-139.767 1.00 0.99 O ATOM 744 CB LYS A 60 58.716 45.855-136.588 1.00 0.89 C ATOM 745 CG LYS A 60 59.770 46.911-136.940 1.00 0.95 C ATOM 746 CD LYS A 60 60.202 47.658-135.675 1.00 1.37 C ATOM 747 CE LYS A 60 59.589 49.059-135.675 1.00 1.47 C ATOM 748 NZ LYS A 60 59.527 49.573-134.277 1.00 2.03 N ATOM 0 H LYS A 60 60.104 43.726-136.746 1.00 0.76 H new ATOM 0 HA LYS A 60 57.553 44.467-137.707 1.00 0.85 H new ATOM 0 HB2 LYS A 60 57.758 46.337-136.394 1.00 0.89 H new ATOM 0 HB3 LYS A 60 59.002 45.335-135.674 1.00 0.89 H new ATOM 0 HG2 LYS A 60 60.634 46.435-137.404 1.00 0.95 H new ATOM 0 HG3 LYS A 60 59.364 47.614-137.667 1.00 0.95 H new ATOM 0 HD2 LYS A 60 59.882 47.110-134.789 1.00 1.37 H new ATOM 0 HD3 LYS A 60 61.289 47.725-135.633 1.00 1.37 H new ATOM 0 HE2 LYS A 60 60.186 49.729-136.294 1.00 1.47 H new ATOM 0 HE3 LYS A 60 58.589 49.030-136.108 1.00 1.47 H new ATOM 0 HZ1 LYS A 60 59.110 50.526-134.276 1.00 2.03 H new ATOM 0 HZ2 LYS A 60 58.940 48.938-133.699 1.00 2.03 H new ATOM 0 HZ3 LYS A 60 60.487 49.615-133.880 1.00 2.03 H new ATOM 762 N LYS A 61 60.138 45.581-139.421 1.00 0.94 N ATOM 763 CA LYS A 61 60.523 46.206-140.714 1.00 1.05 C ATOM 764 C LYS A 61 60.053 45.295-141.852 1.00 1.04 C ATOM 765 O LYS A 61 59.613 45.754-142.888 1.00 1.13 O ATOM 766 CB LYS A 61 62.041 46.366-140.783 1.00 1.10 C ATOM 767 CG LYS A 61 62.551 46.966-139.471 1.00 1.11 C ATOM 768 CD LYS A 61 63.678 47.958-139.766 1.00 1.37 C ATOM 769 CE LYS A 61 64.057 48.697-138.481 1.00 1.77 C ATOM 770 NZ LYS A 61 64.958 49.837-138.810 1.00 2.30 N ATOM 0 H LYS A 61 60.912 45.211-138.870 1.00 0.94 H new ATOM 0 HA LYS A 61 60.061 47.189-140.802 1.00 1.05 H new ATOM 0 HB2 LYS A 61 62.512 45.399-140.960 1.00 1.10 H new ATOM 0 HB3 LYS A 61 62.312 47.010-141.619 1.00 1.10 H new ATOM 0 HG2 LYS A 61 61.737 47.469-138.949 1.00 1.11 H new ATOM 0 HG3 LYS A 61 62.912 46.175-138.813 1.00 1.11 H new ATOM 0 HD2 LYS A 61 64.545 47.431-140.165 1.00 1.37 H new ATOM 0 HD3 LYS A 61 63.360 48.670-140.527 1.00 1.37 H new ATOM 0 HE2 LYS A 61 63.160 49.062-137.981 1.00 1.77 H new ATOM 0 HE3 LYS A 61 64.553 48.016-137.790 1.00 1.77 H new ATOM 0 HZ1 LYS A 61 65.216 50.339-137.936 1.00 2.30 H new ATOM 0 HZ2 LYS A 61 65.819 49.478-139.269 1.00 2.30 H new ATOM 0 HZ3 LYS A 61 64.469 50.491-139.454 1.00 2.30 H new ATOM 784 N LEU A 62 60.136 44.001-141.660 1.00 0.97 N ATOM 785 CA LEU A 62 59.687 43.055-142.724 1.00 0.97 C ATOM 786 C LEU A 62 58.231 43.344-143.075 1.00 0.98 C ATOM 787 O LEU A 62 57.902 43.657-144.202 1.00 1.05 O ATOM 788 CB LEU A 62 59.780 41.615-142.213 1.00 0.90 C ATOM 789 CG LEU A 62 61.183 41.054-142.471 1.00 0.94 C ATOM 790 CD1 LEU A 62 61.494 39.957-141.450 1.00 0.88 C ATOM 791 CD2 LEU A 62 61.252 40.460-143.881 1.00 1.02 C ATOM 0 H LEU A 62 60.495 43.561-140.813 1.00 0.97 H new ATOM 0 HA LEU A 62 60.323 43.181-143.600 1.00 0.97 H new ATOM 0 HB2 LEU A 62 59.558 41.584-141.146 1.00 0.90 H new ATOM 0 HB3 LEU A 62 59.035 40.995-142.711 1.00 0.90 H new ATOM 0 HG LEU A 62 61.911 41.860-142.378 1.00 0.94 H new ATOM 0 HD11 LEU A 62 62.492 39.560-141.635 1.00 0.88 H new ATOM 0 HD12 LEU A 62 61.451 40.374-140.444 1.00 0.88 H new ATOM 0 HD13 LEU A 62 60.761 39.155-141.543 1.00 0.88 H new ATOM 0 HD21 LEU A 62 62.251 40.063-144.060 1.00 1.02 H new ATOM 0 HD22 LEU A 62 60.520 39.658-143.974 1.00 1.02 H new ATOM 0 HD23 LEU A 62 61.034 41.237-144.614 1.00 1.02 H new ATOM 803 N LYS A 63 57.352 43.233-142.116 1.00 0.93 N ATOM 804 CA LYS A 63 55.912 43.494-142.403 1.00 0.97 C ATOM 805 C LYS A 63 55.748 44.939-142.871 1.00 1.06 C ATOM 806 O LYS A 63 55.024 45.223-143.805 1.00 1.11 O ATOM 807 CB LYS A 63 55.075 43.255-141.144 1.00 0.94 C ATOM 808 CG LYS A 63 55.747 43.915-139.940 1.00 1.04 C ATOM 809 CD LYS A 63 54.709 44.135-138.839 1.00 0.97 C ATOM 810 CE LYS A 63 53.892 45.390-139.151 1.00 1.16 C ATOM 811 NZ LYS A 63 52.471 45.165-138.763 1.00 1.99 N ATOM 0 H LYS A 63 57.566 42.975-141.153 1.00 0.93 H new ATOM 0 HA LYS A 63 55.569 42.816-143.184 1.00 0.97 H new ATOM 0 HB2 LYS A 63 54.073 43.661-141.280 1.00 0.94 H new ATOM 0 HB3 LYS A 63 54.964 42.185-140.968 1.00 0.94 H new ATOM 0 HG2 LYS A 63 56.557 43.286-139.571 1.00 1.04 H new ATOM 0 HG3 LYS A 63 56.190 44.867-140.233 1.00 1.04 H new ATOM 0 HD2 LYS A 63 54.051 43.269-138.766 1.00 0.97 H new ATOM 0 HD3 LYS A 63 55.204 44.241-137.874 1.00 0.97 H new ATOM 0 HE2 LYS A 63 54.297 46.245-138.610 1.00 1.16 H new ATOM 0 HE3 LYS A 63 53.958 45.625-140.213 1.00 1.16 H new ATOM 0 HZ1 LYS A 63 51.914 46.018-138.975 1.00 1.99 H new ATOM 0 HZ2 LYS A 63 52.088 44.360-139.298 1.00 1.99 H new ATOM 0 HZ3 LYS A 63 52.417 44.960-137.745 1.00 1.99 H new ATOM 825 N LEU A 64 56.426 45.854-142.238 1.00 1.09 N ATOM 826 CA LEU A 64 56.327 47.280-142.651 1.00 1.20 C ATOM 827 C LEU A 64 56.631 47.394-144.144 1.00 1.26 C ATOM 828 O LEU A 64 55.913 48.031-144.890 1.00 1.33 O ATOM 829 CB LEU A 64 57.341 48.095-141.851 1.00 1.22 C ATOM 830 CG LEU A 64 56.707 48.568-140.542 1.00 1.23 C ATOM 831 CD1 LEU A 64 57.743 49.341-139.721 1.00 1.49 C ATOM 832 CD2 LEU A 64 55.518 49.480-140.853 1.00 1.50 C ATOM 0 H LEU A 64 57.047 45.674-141.449 1.00 1.09 H new ATOM 0 HA LEU A 64 55.323 47.658-142.461 1.00 1.20 H new ATOM 0 HB2 LEU A 64 58.223 47.490-141.641 1.00 1.22 H new ATOM 0 HB3 LEU A 64 57.674 48.953-142.435 1.00 1.22 H new ATOM 0 HG LEU A 64 56.364 47.705-139.972 1.00 1.23 H new ATOM 0 HD11 LEU A 64 57.290 49.678-138.788 1.00 1.49 H new ATOM 0 HD12 LEU A 64 58.590 48.692-139.500 1.00 1.49 H new ATOM 0 HD13 LEU A 64 58.087 50.205-140.290 1.00 1.49 H new ATOM 0 HD21 LEU A 64 55.065 49.818-139.921 1.00 1.50 H new ATOM 0 HD22 LEU A 64 55.861 50.343-141.424 1.00 1.50 H new ATOM 0 HD23 LEU A 64 54.780 48.929-141.436 1.00 1.50 H new ATOM 844 N ASP A 65 57.687 46.773-144.584 1.00 1.25 N ATOM 845 CA ASP A 65 58.038 46.833-146.030 1.00 1.33 C ATOM 846 C ASP A 65 57.155 45.847-146.797 1.00 1.30 C ATOM 847 O ASP A 65 57.032 45.915-148.003 1.00 1.37 O ATOM 848 CB ASP A 65 59.509 46.455-146.216 1.00 1.36 C ATOM 849 CG ASP A 65 60.396 47.508-145.549 1.00 1.39 C ATOM 850 OD1 ASP A 65 60.102 48.683-145.700 1.00 1.77 O ATOM 851 OD2 ASP A 65 61.353 47.122-144.898 1.00 1.81 O ATOM 0 H ASP A 65 58.324 46.226-144.005 1.00 1.25 H new ATOM 0 HA ASP A 65 57.877 47.843-146.407 1.00 1.33 H new ATOM 0 HB2 ASP A 65 59.701 45.474-145.781 1.00 1.36 H new ATOM 0 HB3 ASP A 65 59.746 46.385-147.278 1.00 1.36 H new ATOM 856 N GLY A 66 56.535 44.933-146.100 1.00 1.22 N ATOM 857 CA GLY A 66 55.655 43.942-146.780 1.00 1.21 C ATOM 858 C GLY A 66 56.497 42.778-147.304 1.00 1.20 C ATOM 859 O GLY A 66 56.459 42.452-148.474 1.00 1.27 O ATOM 0 H GLY A 66 56.601 44.831-145.087 1.00 1.22 H new ATOM 0 HA2 GLY A 66 54.901 43.574-146.085 1.00 1.21 H new ATOM 0 HA3 GLY A 66 55.123 44.418-147.604 1.00 1.21 H new ATOM 863 N LEU A 67 57.257 42.146-146.451 1.00 1.13 N ATOM 864 CA LEU A 67 58.095 41.006-146.912 1.00 1.15 C ATOM 865 C LEU A 67 57.498 39.694-146.401 1.00 1.09 C ATOM 866 O LEU A 67 57.476 38.699-147.099 1.00 1.13 O ATOM 867 CB LEU A 67 59.518 41.176-146.381 1.00 1.15 C ATOM 868 CG LEU A 67 60.322 42.035-147.361 1.00 1.27 C ATOM 869 CD1 LEU A 67 61.456 42.749-146.621 1.00 1.59 C ATOM 870 CD2 LEU A 67 60.915 41.140-148.452 1.00 1.82 C ATOM 0 H LEU A 67 57.333 42.370-145.459 1.00 1.13 H new ATOM 0 HA LEU A 67 58.120 40.985-148.002 1.00 1.15 H new ATOM 0 HB2 LEU A 67 59.498 41.647-145.398 1.00 1.15 H new ATOM 0 HB3 LEU A 67 59.992 40.202-146.259 1.00 1.15 H new ATOM 0 HG LEU A 67 59.663 42.778-147.810 1.00 1.27 H new ATOM 0 HD11 LEU A 67 62.023 43.358-147.325 1.00 1.59 H new ATOM 0 HD12 LEU A 67 61.037 43.388-145.844 1.00 1.59 H new ATOM 0 HD13 LEU A 67 62.116 42.010-146.167 1.00 1.59 H new ATOM 0 HD21 LEU A 67 61.488 41.749-149.151 1.00 1.82 H new ATOM 0 HD22 LEU A 67 61.570 40.397-147.997 1.00 1.82 H new ATOM 0 HD23 LEU A 67 60.110 40.635-148.986 1.00 1.82 H new ATOM 882 N ASP A 68 57.001 39.682-145.194 1.00 1.01 N ATOM 883 CA ASP A 68 56.395 38.431-144.656 1.00 0.99 C ATOM 884 C ASP A 68 54.872 38.530-144.754 1.00 1.01 C ATOM 885 O ASP A 68 54.231 39.205-143.974 1.00 1.00 O ATOM 886 CB ASP A 68 56.806 38.246-143.190 1.00 0.93 C ATOM 887 CG ASP A 68 56.415 36.842-142.726 1.00 0.96 C ATOM 888 OD1 ASP A 68 55.888 36.097-143.536 1.00 1.42 O ATOM 889 OD2 ASP A 68 56.649 36.535-141.569 1.00 1.45 O ATOM 0 H ASP A 68 56.988 40.481-144.560 1.00 1.01 H new ATOM 0 HA ASP A 68 56.745 37.577-145.235 1.00 0.99 H new ATOM 0 HB2 ASP A 68 57.881 38.391-143.081 1.00 0.93 H new ATOM 0 HB3 ASP A 68 56.319 38.996-142.567 1.00 0.93 H new ATOM 894 N GLU A 69 54.291 37.858-145.709 1.00 1.07 N ATOM 895 CA GLU A 69 52.810 37.906-145.864 1.00 1.12 C ATOM 896 C GLU A 69 52.175 36.803-145.017 1.00 1.13 C ATOM 897 O GLU A 69 51.059 36.926-144.553 1.00 1.26 O ATOM 898 CB GLU A 69 52.443 37.696-147.334 1.00 1.21 C ATOM 899 CG GLU A 69 52.876 36.296-147.775 1.00 1.25 C ATOM 900 CD GLU A 69 52.932 36.236-149.302 1.00 1.56 C ATOM 901 OE1 GLU A 69 52.038 36.780-149.930 1.00 1.99 O ATOM 902 OE2 GLU A 69 53.868 35.648-149.818 1.00 1.86 O ATOM 0 H GLU A 69 54.779 37.276-146.390 1.00 1.07 H new ATOM 0 HA GLU A 69 52.441 38.877-145.534 1.00 1.12 H new ATOM 0 HB2 GLU A 69 51.368 37.816-147.472 1.00 1.21 H new ATOM 0 HB3 GLU A 69 52.930 38.450-147.952 1.00 1.21 H new ATOM 0 HG2 GLU A 69 53.853 36.057-147.355 1.00 1.25 H new ATOM 0 HG3 GLU A 69 52.176 35.551-147.397 1.00 1.25 H new ATOM 909 N ASP A 70 52.878 35.723-144.816 1.00 1.13 N ATOM 910 CA ASP A 70 52.314 34.609-144.003 1.00 1.24 C ATOM 911 C ASP A 70 52.840 34.709-142.572 1.00 1.15 C ATOM 912 O ASP A 70 52.818 33.753-141.823 1.00 1.19 O ATOM 913 CB ASP A 70 52.737 33.269-144.611 1.00 1.37 C ATOM 914 CG ASP A 70 52.177 33.154-146.030 1.00 1.44 C ATOM 915 OD1 ASP A 70 51.057 33.588-146.241 1.00 1.74 O ATOM 916 OD2 ASP A 70 52.878 32.633-146.882 1.00 1.70 O ATOM 0 H ASP A 70 53.818 35.564-145.179 1.00 1.13 H new ATOM 0 HA ASP A 70 51.226 34.677-143.996 1.00 1.24 H new ATOM 0 HB2 ASP A 70 53.824 33.193-144.630 1.00 1.37 H new ATOM 0 HB3 ASP A 70 52.371 32.447-143.996 1.00 1.37 H new ATOM 921 N GLY A 71 53.311 35.862-142.187 1.00 1.05 N ATOM 922 CA GLY A 71 53.839 36.028-140.804 1.00 0.97 C ATOM 923 C GLY A 71 54.713 34.827-140.441 1.00 0.95 C ATOM 924 O GLY A 71 55.100 34.654-139.303 1.00 0.92 O ATOM 0 H GLY A 71 53.353 36.697-142.771 1.00 1.05 H new ATOM 0 HA2 GLY A 71 54.420 36.948-140.734 1.00 0.97 H new ATOM 0 HA3 GLY A 71 53.014 36.117-140.097 1.00 0.97 H new ATOM 928 N GLU A 72 55.031 33.995-141.397 1.00 1.01 N ATOM 929 CA GLU A 72 55.884 32.812-141.092 1.00 1.03 C ATOM 930 C GLU A 72 57.124 33.281-140.331 1.00 0.93 C ATOM 931 O GLU A 72 57.468 32.751-139.290 1.00 0.91 O ATOM 932 CB GLU A 72 56.309 32.135-142.397 1.00 1.12 C ATOM 933 CG GLU A 72 56.567 30.649-142.140 1.00 1.71 C ATOM 934 CD GLU A 72 57.450 30.083-143.254 1.00 2.13 C ATOM 935 OE1 GLU A 72 56.931 29.846-144.332 1.00 2.48 O ATOM 936 OE2 GLU A 72 58.631 29.896-143.009 1.00 2.69 O ATOM 0 H GLU A 72 54.738 34.083-142.370 1.00 1.01 H new ATOM 0 HA GLU A 72 55.325 32.099-140.486 1.00 1.03 H new ATOM 0 HB2 GLU A 72 55.531 32.255-143.151 1.00 1.12 H new ATOM 0 HB3 GLU A 72 57.209 32.609-142.789 1.00 1.12 H new ATOM 0 HG2 GLU A 72 57.053 30.515-141.173 1.00 1.71 H new ATOM 0 HG3 GLU A 72 55.622 30.107-142.100 1.00 1.71 H new ATOM 943 N LYS A 73 57.788 34.286-140.833 1.00 0.90 N ATOM 944 CA LYS A 73 58.991 34.803-140.129 1.00 0.84 C ATOM 945 C LYS A 73 58.587 35.191-138.710 1.00 0.75 C ATOM 946 O LYS A 73 59.259 34.872-137.747 1.00 0.70 O ATOM 947 CB LYS A 73 59.529 36.028-140.872 1.00 0.86 C ATOM 948 CG LYS A 73 59.622 35.713-142.367 1.00 0.98 C ATOM 949 CD LYS A 73 60.691 36.596-143.012 1.00 1.22 C ATOM 950 CE LYS A 73 62.064 36.234-142.444 1.00 1.41 C ATOM 951 NZ LYS A 73 63.074 36.246-143.540 1.00 2.17 N ATOM 0 H LYS A 73 57.549 34.769-141.699 1.00 0.90 H new ATOM 0 HA LYS A 73 59.770 34.041-140.098 1.00 0.84 H new ATOM 0 HB2 LYS A 73 58.873 36.883-140.709 1.00 0.86 H new ATOM 0 HB3 LYS A 73 60.511 36.301-140.484 1.00 0.86 H new ATOM 0 HG2 LYS A 73 59.868 34.661-142.513 1.00 0.98 H new ATOM 0 HG3 LYS A 73 58.658 35.884-142.846 1.00 0.98 H new ATOM 0 HD2 LYS A 73 60.686 36.460-144.093 1.00 1.22 H new ATOM 0 HD3 LYS A 73 60.473 37.647-142.822 1.00 1.22 H new ATOM 0 HE2 LYS A 73 62.347 36.944-141.667 1.00 1.41 H new ATOM 0 HE3 LYS A 73 62.029 35.249-141.978 1.00 1.41 H new ATOM 0 HZ1 LYS A 73 64.008 36.000-143.154 1.00 2.17 H new ATOM 0 HZ2 LYS A 73 62.806 35.552-144.267 1.00 2.17 H new ATOM 0 HZ3 LYS A 73 63.114 37.194-143.965 1.00 2.17 H new ATOM 965 N GLU A 74 57.483 35.871-138.575 1.00 0.76 N ATOM 966 CA GLU A 74 57.015 36.275-137.224 1.00 0.73 C ATOM 967 C GLU A 74 56.771 35.023-136.381 1.00 0.79 C ATOM 968 O GLU A 74 57.011 35.010-135.193 1.00 0.79 O ATOM 969 CB GLU A 74 55.709 37.056-137.350 1.00 0.78 C ATOM 970 CG GLU A 74 55.555 37.975-136.140 1.00 0.78 C ATOM 971 CD GLU A 74 54.094 38.408-136.007 1.00 0.93 C ATOM 972 OE1 GLU A 74 53.437 38.531-137.028 1.00 1.37 O ATOM 973 OE2 GLU A 74 53.656 38.610-134.887 1.00 1.52 O ATOM 0 H GLU A 74 56.884 36.165-139.346 1.00 0.76 H new ATOM 0 HA GLU A 74 57.771 36.900-136.748 1.00 0.73 H new ATOM 0 HB2 GLU A 74 55.709 37.642-138.269 1.00 0.78 H new ATOM 0 HB3 GLU A 74 54.865 36.369-137.410 1.00 0.78 H new ATOM 0 HG2 GLU A 74 55.875 37.458-135.235 1.00 0.78 H new ATOM 0 HG3 GLU A 74 56.195 38.850-136.251 1.00 0.78 H new ATOM 980 N ALA A 75 56.294 33.971-136.989 1.00 0.88 N ATOM 981 CA ALA A 75 56.036 32.720-136.221 1.00 0.98 C ATOM 982 C ALA A 75 57.359 32.173-135.697 1.00 0.95 C ATOM 983 O ALA A 75 57.460 31.765-134.559 1.00 0.96 O ATOM 984 CB ALA A 75 55.374 31.684-137.131 1.00 1.08 C ATOM 0 H ALA A 75 56.072 33.924-137.983 1.00 0.88 H new ATOM 0 HA ALA A 75 55.372 32.935-135.384 1.00 0.98 H new ATOM 0 HB1 ALA A 75 55.187 30.771-136.566 1.00 1.08 H new ATOM 0 HB2 ALA A 75 54.430 32.079-137.505 1.00 1.08 H new ATOM 0 HB3 ALA A 75 56.033 31.463-137.970 1.00 1.08 H new ATOM 990 N ARG A 76 58.379 32.164-136.506 1.00 0.95 N ATOM 991 CA ARG A 76 59.685 31.646-136.017 1.00 0.95 C ATOM 992 C ARG A 76 60.171 32.546-134.886 1.00 0.86 C ATOM 993 O ARG A 76 60.594 32.081-133.846 1.00 0.91 O ATOM 994 CB ARG A 76 60.707 31.642-137.156 1.00 0.96 C ATOM 995 CG ARG A 76 61.816 30.637-136.840 1.00 1.61 C ATOM 996 CD ARG A 76 62.980 30.836-137.813 1.00 1.74 C ATOM 997 NE ARG A 76 62.535 31.683-138.954 1.00 2.47 N ATOM 998 CZ ARG A 76 63.417 32.228-139.745 1.00 2.98 C ATOM 999 NH1 ARG A 76 64.691 32.033-139.536 1.00 3.55 N ATOM 1000 NH2 ARG A 76 63.027 32.969-140.746 1.00 3.23 N ATOM 0 H ARG A 76 58.367 32.488-137.473 1.00 0.95 H new ATOM 0 HA ARG A 76 59.566 30.625-135.655 1.00 0.95 H new ATOM 0 HB2 ARG A 76 60.220 31.380-138.095 1.00 0.96 H new ATOM 0 HB3 ARG A 76 61.130 32.639-137.284 1.00 0.96 H new ATOM 0 HG2 ARG A 76 62.159 30.769-135.814 1.00 1.61 H new ATOM 0 HG3 ARG A 76 61.432 29.620-136.919 1.00 1.61 H new ATOM 0 HD2 ARG A 76 63.819 31.308-137.301 1.00 1.74 H new ATOM 0 HD3 ARG A 76 63.332 29.871-138.178 1.00 1.74 H new ATOM 0 HE ARG A 76 61.540 31.837-139.117 1.00 2.47 H new ATOM 0 HH11 ARG A 76 64.997 31.454-138.754 1.00 3.55 H new ATOM 0 HH12 ARG A 76 65.380 32.459-140.155 1.00 3.55 H new ATOM 0 HH21 ARG A 76 62.032 33.122-140.910 1.00 3.23 H new ATOM 0 HH22 ARG A 76 63.717 33.395-141.364 1.00 3.23 H new ATOM 1014 N LEU A 77 60.094 33.833-135.071 1.00 0.74 N ATOM 1015 CA LEU A 77 60.530 34.761-133.993 1.00 0.65 C ATOM 1016 C LEU A 77 59.669 34.500-132.761 1.00 0.71 C ATOM 1017 O LEU A 77 60.162 34.344-131.662 1.00 0.72 O ATOM 1018 CB LEU A 77 60.351 36.208-134.455 1.00 0.58 C ATOM 1019 CG LEU A 77 61.587 36.645-135.241 1.00 0.59 C ATOM 1020 CD1 LEU A 77 61.220 37.809-136.161 1.00 1.02 C ATOM 1021 CD2 LEU A 77 62.683 37.088-134.268 1.00 1.09 C ATOM 0 H LEU A 77 59.749 34.282-135.920 1.00 0.74 H new ATOM 0 HA LEU A 77 61.581 34.598-133.757 1.00 0.65 H new ATOM 0 HB2 LEU A 77 59.461 36.295-135.078 1.00 0.58 H new ATOM 0 HB3 LEU A 77 60.204 36.861-133.595 1.00 0.58 H new ATOM 0 HG LEU A 77 61.951 35.810-135.839 1.00 0.59 H new ATOM 0 HD11 LEU A 77 62.101 38.121-136.722 1.00 1.02 H new ATOM 0 HD12 LEU A 77 60.441 37.493-136.855 1.00 1.02 H new ATOM 0 HD13 LEU A 77 60.856 38.644-135.563 1.00 1.02 H new ATOM 0 HD21 LEU A 77 63.564 37.399-134.829 1.00 1.09 H new ATOM 0 HD22 LEU A 77 62.321 37.923-133.668 1.00 1.09 H new ATOM 0 HD23 LEU A 77 62.945 36.257-133.613 1.00 1.09 H new ATOM 1033 N ILE A 78 58.382 34.428-132.946 1.00 0.77 N ATOM 1034 CA ILE A 78 57.480 34.148-131.798 1.00 0.87 C ATOM 1035 C ILE A 78 57.938 32.857-131.133 1.00 0.95 C ATOM 1036 O ILE A 78 58.286 32.829-129.969 1.00 0.99 O ATOM 1037 CB ILE A 78 56.051 33.975-132.306 1.00 0.97 C ATOM 1038 CG1 ILE A 78 55.407 35.349-132.446 1.00 0.92 C ATOM 1039 CG2 ILE A 78 55.250 33.134-131.311 1.00 1.10 C ATOM 1040 CD1 ILE A 78 54.418 35.331-133.609 1.00 0.98 C ATOM 0 H ILE A 78 57.915 34.551-133.845 1.00 0.77 H new ATOM 0 HA ILE A 78 57.511 34.972-131.085 1.00 0.87 H new ATOM 0 HB ILE A 78 56.062 33.471-133.272 1.00 0.97 H new ATOM 0 HG12 ILE A 78 54.894 35.618-131.523 1.00 0.92 H new ATOM 0 HG13 ILE A 78 56.173 36.106-132.617 1.00 0.92 H new ATOM 0 HG21 ILE A 78 54.230 33.012-131.676 1.00 1.10 H new ATOM 0 HG22 ILE A 78 55.717 32.155-131.204 1.00 1.10 H new ATOM 0 HG23 ILE A 78 55.231 33.635-130.343 1.00 1.10 H new ATOM 0 HD11 ILE A 78 53.957 36.314-133.710 1.00 0.98 H new ATOM 0 HD12 ILE A 78 54.944 35.081-134.530 1.00 0.98 H new ATOM 0 HD13 ILE A 78 53.646 34.586-133.418 1.00 0.98 H new ATOM 1052 N ARG A 79 57.951 31.786-131.875 1.00 0.99 N ATOM 1053 CA ARG A 79 58.402 30.488-131.298 1.00 1.09 C ATOM 1054 C ARG A 79 59.733 30.705-130.573 1.00 1.02 C ATOM 1055 O ARG A 79 60.007 30.085-129.566 1.00 1.08 O ATOM 1056 CB ARG A 79 58.588 29.466-132.423 1.00 1.16 C ATOM 1057 CG ARG A 79 59.623 28.420-132.002 1.00 1.60 C ATOM 1058 CD ARG A 79 59.642 27.280-133.023 1.00 1.67 C ATOM 1059 NE ARG A 79 58.737 26.189-132.564 1.00 2.43 N ATOM 1060 CZ ARG A 79 58.367 25.254-133.397 1.00 2.95 C ATOM 1061 NH1 ARG A 79 58.793 25.273-134.630 1.00 3.52 N ATOM 1062 NH2 ARG A 79 57.573 24.300-132.996 1.00 3.32 N ATOM 0 H ARG A 79 57.669 31.752-132.855 1.00 0.99 H new ATOM 0 HA ARG A 79 57.657 30.114-130.596 1.00 1.09 H new ATOM 0 HB2 ARG A 79 57.638 28.982-132.648 1.00 1.16 H new ATOM 0 HB3 ARG A 79 58.914 29.968-133.334 1.00 1.16 H new ATOM 0 HG2 ARG A 79 60.610 28.877-131.933 1.00 1.60 H new ATOM 0 HG3 ARG A 79 59.382 28.032-131.012 1.00 1.60 H new ATOM 0 HD2 ARG A 79 59.323 27.646-133.999 1.00 1.67 H new ATOM 0 HD3 ARG A 79 60.657 26.900-133.141 1.00 1.67 H new ATOM 0 HE ARG A 79 58.407 26.173-131.599 1.00 2.43 H new ATOM 0 HH11 ARG A 79 59.415 26.018-134.943 1.00 3.52 H new ATOM 0 HH12 ARG A 79 58.504 24.543-135.281 1.00 3.52 H new ATOM 0 HH21 ARG A 79 57.241 24.284-132.032 1.00 3.32 H new ATOM 0 HH22 ARG A 79 57.284 23.570-133.647 1.00 3.32 H new ATOM 1076 N ASN A 80 60.559 31.588-131.072 1.00 0.92 N ATOM 1077 CA ASN A 80 61.863 31.847-130.397 1.00 0.86 C ATOM 1078 C ASN A 80 61.599 32.527-129.062 1.00 0.82 C ATOM 1079 O ASN A 80 61.965 32.024-128.025 1.00 0.82 O ATOM 1080 CB ASN A 80 62.736 32.746-131.276 1.00 0.77 C ATOM 1081 CG ASN A 80 62.932 32.088-132.643 1.00 0.90 C ATOM 1082 OD1 ASN A 80 62.752 32.719-133.665 1.00 1.36 O ATOM 1083 ND2 ASN A 80 63.298 30.837-132.704 1.00 1.56 N ATOM 0 H ASN A 80 60.387 32.138-131.914 1.00 0.92 H new ATOM 0 HA ASN A 80 62.386 30.905-130.233 1.00 0.86 H new ATOM 0 HB2 ASN A 80 62.267 33.723-131.395 1.00 0.77 H new ATOM 0 HB3 ASN A 80 63.702 32.912-130.799 1.00 0.77 H new ATOM 0 HD21 ASN A 80 63.433 30.389-133.610 1.00 1.56 H new ATOM 0 HD22 ASN A 80 63.449 30.307-131.845 1.00 1.56 H new ATOM 1090 N LEU A 81 60.944 33.649-129.066 1.00 0.82 N ATOM 1091 CA LEU A 81 60.649 34.312-127.769 1.00 0.83 C ATOM 1092 C LEU A 81 60.038 33.260-126.852 1.00 0.96 C ATOM 1093 O LEU A 81 60.296 33.215-125.666 1.00 0.99 O ATOM 1094 CB LEU A 81 59.652 35.456-127.978 1.00 0.82 C ATOM 1095 CG LEU A 81 60.325 36.594-128.745 1.00 0.69 C ATOM 1096 CD1 LEU A 81 59.259 37.424-129.464 1.00 1.38 C ATOM 1097 CD2 LEU A 81 61.090 37.486-127.763 1.00 1.38 C ATOM 0 H LEU A 81 60.604 34.131-129.898 1.00 0.82 H new ATOM 0 HA LEU A 81 61.559 34.727-127.335 1.00 0.83 H new ATOM 0 HB2 LEU A 81 58.783 35.097-128.529 1.00 0.82 H new ATOM 0 HB3 LEU A 81 59.292 35.817-127.015 1.00 0.82 H new ATOM 0 HG LEU A 81 61.018 36.180-129.477 1.00 0.69 H new ATOM 0 HD11 LEU A 81 59.738 38.236-130.011 1.00 1.38 H new ATOM 0 HD12 LEU A 81 58.713 36.789-130.161 1.00 1.38 H new ATOM 0 HD13 LEU A 81 58.566 37.839-128.732 1.00 1.38 H new ATOM 0 HD21 LEU A 81 61.571 38.298-128.308 1.00 1.38 H new ATOM 0 HD22 LEU A 81 60.396 37.900-127.032 1.00 1.38 H new ATOM 0 HD23 LEU A 81 61.848 36.895-127.249 1.00 1.38 H new ATOM 1109 N ASN A 82 59.242 32.397-127.415 1.00 1.05 N ATOM 1110 CA ASN A 82 58.611 31.315-126.617 1.00 1.20 C ATOM 1111 C ASN A 82 59.698 30.374-126.105 1.00 1.21 C ATOM 1112 O ASN A 82 59.719 30.001-124.949 1.00 1.26 O ATOM 1113 CB ASN A 82 57.635 30.555-127.518 1.00 1.28 C ATOM 1114 CG ASN A 82 56.263 31.229-127.474 1.00 1.33 C ATOM 1115 OD1 ASN A 82 55.425 30.876-126.668 1.00 1.68 O ATOM 1116 ND2 ASN A 82 55.995 32.192-128.313 1.00 1.71 N ATOM 0 H ASN A 82 59.000 32.396-128.406 1.00 1.05 H new ATOM 0 HA ASN A 82 58.073 31.730-125.765 1.00 1.20 H new ATOM 0 HB2 ASN A 82 58.009 30.536-128.542 1.00 1.28 H new ATOM 0 HB3 ASN A 82 57.553 29.519-127.189 1.00 1.28 H new ATOM 0 HD21 ASN A 82 55.083 32.648-128.292 1.00 1.71 H new ATOM 0 HD22 ASN A 82 56.698 32.489-128.990 1.00 1.71 H new ATOM 1123 N VAL A 83 60.613 30.003-126.954 1.00 1.18 N ATOM 1124 CA VAL A 83 61.712 29.104-126.512 1.00 1.22 C ATOM 1125 C VAL A 83 62.541 29.837-125.458 1.00 1.14 C ATOM 1126 O VAL A 83 62.778 29.335-124.377 1.00 1.20 O ATOM 1127 CB VAL A 83 62.599 28.749-127.707 1.00 1.19 C ATOM 1128 CG1 VAL A 83 63.777 27.897-127.233 1.00 1.28 C ATOM 1129 CG2 VAL A 83 61.780 27.959-128.732 1.00 1.27 C ATOM 0 H VAL A 83 60.647 30.283-127.934 1.00 1.18 H new ATOM 0 HA VAL A 83 61.299 28.186-126.093 1.00 1.22 H new ATOM 0 HB VAL A 83 62.973 29.664-128.166 1.00 1.19 H new ATOM 0 HG11 VAL A 83 64.409 27.644-128.084 1.00 1.28 H new ATOM 0 HG12 VAL A 83 64.360 28.457-126.502 1.00 1.28 H new ATOM 0 HG13 VAL A 83 63.403 26.982-126.774 1.00 1.28 H new ATOM 0 HG21 VAL A 83 62.411 27.705-129.584 1.00 1.27 H new ATOM 0 HG22 VAL A 83 61.406 27.044-128.272 1.00 1.27 H new ATOM 0 HG23 VAL A 83 60.939 28.564-129.070 1.00 1.27 H new ATOM 1139 N ILE A 84 62.973 31.031-125.763 1.00 1.02 N ATOM 1140 CA ILE A 84 63.774 31.804-124.776 1.00 0.95 C ATOM 1141 C ILE A 84 63.062 31.775-123.424 1.00 1.04 C ATOM 1142 O ILE A 84 63.668 31.529-122.399 1.00 1.07 O ATOM 1143 CB ILE A 84 63.923 33.248-125.246 1.00 0.82 C ATOM 1144 CG1 ILE A 84 65.027 33.319-126.300 1.00 0.73 C ATOM 1145 CG2 ILE A 84 64.299 34.137-124.059 1.00 0.80 C ATOM 1146 CD1 ILE A 84 64.727 34.458-127.268 1.00 0.64 C ATOM 0 H ILE A 84 62.805 31.502-126.652 1.00 1.02 H new ATOM 0 HA ILE A 84 64.764 31.359-124.681 1.00 0.95 H new ATOM 0 HB ILE A 84 62.981 33.593-125.672 1.00 0.82 H new ATOM 0 HG12 ILE A 84 65.993 33.478-125.821 1.00 0.73 H new ATOM 0 HG13 ILE A 84 65.091 32.375-126.840 1.00 0.73 H new ATOM 0 HG21 ILE A 84 64.405 35.168-124.396 1.00 0.80 H new ATOM 0 HG22 ILE A 84 63.518 34.082-123.301 1.00 0.80 H new ATOM 0 HG23 ILE A 84 65.242 33.796-123.633 1.00 0.80 H new ATOM 0 HD11 ILE A 84 65.513 34.512-128.021 1.00 0.64 H new ATOM 0 HD12 ILE A 84 63.769 34.278-127.755 1.00 0.64 H new ATOM 0 HD13 ILE A 84 64.685 35.399-126.720 1.00 0.64 H new ATOM 1158 N LEU A 85 61.776 32.012-123.408 1.00 1.09 N ATOM 1159 CA LEU A 85 61.042 31.979-122.112 1.00 1.19 C ATOM 1160 C LEU A 85 61.066 30.553-121.567 1.00 1.31 C ATOM 1161 O LEU A 85 61.390 30.323-120.420 1.00 1.36 O ATOM 1162 CB LEU A 85 59.590 32.431-122.313 1.00 1.26 C ATOM 1163 CG LEU A 85 59.474 33.950-122.131 1.00 1.20 C ATOM 1164 CD1 LEU A 85 59.932 34.332-120.723 1.00 1.27 C ATOM 1165 CD2 LEU A 85 60.344 34.676-123.159 1.00 1.05 C ATOM 0 H LEU A 85 61.208 32.225-124.228 1.00 1.09 H new ATOM 0 HA LEU A 85 61.523 32.656-121.406 1.00 1.19 H new ATOM 0 HB2 LEU A 85 59.250 32.150-123.310 1.00 1.26 H new ATOM 0 HB3 LEU A 85 58.942 31.922-121.600 1.00 1.26 H new ATOM 0 HG LEU A 85 58.434 34.243-122.275 1.00 1.20 H new ATOM 0 HD11 LEU A 85 59.850 35.411-120.594 1.00 1.27 H new ATOM 0 HD12 LEU A 85 59.304 33.829-119.987 1.00 1.27 H new ATOM 0 HD13 LEU A 85 60.969 34.028-120.583 1.00 1.27 H new ATOM 0 HD21 LEU A 85 60.252 35.753-123.018 1.00 1.05 H new ATOM 0 HD22 LEU A 85 61.385 34.381-123.028 1.00 1.05 H new ATOM 0 HD23 LEU A 85 60.016 34.412-124.164 1.00 1.05 H new ATOM 1177 N ALA A 86 60.741 29.592-122.384 1.00 1.39 N ATOM 1178 CA ALA A 86 60.763 28.181-121.912 1.00 1.51 C ATOM 1179 C ALA A 86 62.171 27.850-121.418 1.00 1.48 C ATOM 1180 O ALA A 86 62.384 26.887-120.707 1.00 1.58 O ATOM 1181 CB ALA A 86 60.393 27.251-123.069 1.00 1.57 C ATOM 0 H ALA A 86 60.462 29.722-123.356 1.00 1.39 H new ATOM 0 HA ALA A 86 60.046 28.047-121.102 1.00 1.51 H new ATOM 0 HB1 ALA A 86 60.409 26.217-122.724 1.00 1.57 H new ATOM 0 HB2 ALA A 86 59.394 27.498-123.429 1.00 1.57 H new ATOM 0 HB3 ALA A 86 61.112 27.374-123.879 1.00 1.57 H new ATOM 1187 N LYS A 87 63.137 28.645-121.795 1.00 1.35 N ATOM 1188 CA LYS A 87 64.537 28.386-121.356 1.00 1.33 C ATOM 1189 C LYS A 87 64.772 29.018-119.986 1.00 1.32 C ATOM 1190 O LYS A 87 65.269 28.385-119.076 1.00 1.39 O ATOM 1191 CB LYS A 87 65.501 29.002-122.368 1.00 1.21 C ATOM 1192 CG LYS A 87 66.846 28.276-122.304 1.00 1.25 C ATOM 1193 CD LYS A 87 67.943 29.184-122.864 1.00 1.18 C ATOM 1194 CE LYS A 87 68.859 28.372-123.781 1.00 1.66 C ATOM 1195 NZ LYS A 87 69.678 27.434-122.962 1.00 2.41 N ATOM 0 H LYS A 87 63.015 29.465-122.390 1.00 1.35 H new ATOM 0 HA LYS A 87 64.705 27.311-121.291 1.00 1.33 H new ATOM 0 HB2 LYS A 87 65.085 28.929-123.373 1.00 1.21 H new ATOM 0 HB3 LYS A 87 65.638 30.062-122.156 1.00 1.21 H new ATOM 0 HG2 LYS A 87 67.075 28.003-121.274 1.00 1.25 H new ATOM 0 HG3 LYS A 87 66.799 27.349-122.876 1.00 1.25 H new ATOM 0 HD2 LYS A 87 67.498 30.011-123.417 1.00 1.18 H new ATOM 0 HD3 LYS A 87 68.521 29.620-122.049 1.00 1.18 H new ATOM 0 HE2 LYS A 87 68.265 27.815-124.506 1.00 1.66 H new ATOM 0 HE3 LYS A 87 69.509 29.039-124.347 1.00 1.66 H new ATOM 0 HZ1 LYS A 87 70.301 26.882-123.586 1.00 2.41 H new ATOM 0 HZ2 LYS A 87 70.255 27.975-122.287 1.00 2.41 H new ATOM 0 HZ3 LYS A 87 69.050 26.789-122.441 1.00 2.41 H new ATOM 1209 N TYR A 88 64.416 30.262-119.830 1.00 1.25 N ATOM 1210 CA TYR A 88 64.618 30.930-118.514 1.00 1.26 C ATOM 1211 C TYR A 88 63.446 30.588-117.597 1.00 1.39 C ATOM 1212 O TYR A 88 63.383 31.021-116.463 1.00 1.45 O ATOM 1213 CB TYR A 88 64.690 32.447-118.708 1.00 1.15 C ATOM 1214 CG TYR A 88 65.963 32.803-119.437 1.00 1.05 C ATOM 1215 CD1 TYR A 88 67.168 32.908-118.732 1.00 1.05 C ATOM 1216 CD2 TYR A 88 65.939 33.030-120.819 1.00 0.98 C ATOM 1217 CE1 TYR A 88 68.348 33.238-119.407 1.00 0.98 C ATOM 1218 CE2 TYR A 88 67.120 33.361-121.494 1.00 0.92 C ATOM 1219 CZ TYR A 88 68.325 33.465-120.788 1.00 0.92 C ATOM 1220 OH TYR A 88 69.488 33.791-121.454 1.00 0.90 O ATOM 0 H TYR A 88 63.995 30.844-120.554 1.00 1.25 H new ATOM 0 HA TYR A 88 65.550 30.583-118.068 1.00 1.26 H new ATOM 0 HB2 TYR A 88 63.825 32.793-119.274 1.00 1.15 H new ATOM 0 HB3 TYR A 88 64.660 32.950-117.741 1.00 1.15 H new ATOM 0 HD1 TYR A 88 67.187 32.734-117.666 1.00 1.05 H new ATOM 0 HD2 TYR A 88 65.010 32.950-121.364 1.00 0.98 H new ATOM 0 HE1 TYR A 88 69.277 33.318-118.862 1.00 0.98 H new ATOM 0 HE2 TYR A 88 67.102 33.536-122.560 1.00 0.92 H new ATOM 0 HH TYR A 88 69.288 33.961-122.398 1.00 0.90 H new ATOM 1230 N GLY A 89 62.512 29.817-118.083 1.00 1.45 N ATOM 1231 CA GLY A 89 61.338 29.451-117.242 1.00 1.59 C ATOM 1232 C GLY A 89 60.577 30.721-116.865 1.00 1.60 C ATOM 1233 O GLY A 89 59.676 30.700-116.049 1.00 1.69 O ATOM 0 H GLY A 89 62.511 29.425-119.025 1.00 1.45 H new ATOM 0 HA2 GLY A 89 60.685 28.769-117.785 1.00 1.59 H new ATOM 0 HA3 GLY A 89 61.667 28.929-116.343 1.00 1.59 H new ATOM 1237 N LEU A 90 60.935 31.830-117.453 1.00 1.53 N ATOM 1238 CA LEU A 90 60.238 33.106-117.132 1.00 1.57 C ATOM 1239 C LEU A 90 58.923 33.180-117.909 1.00 1.64 C ATOM 1240 O LEU A 90 58.254 34.195-117.919 1.00 1.90 O ATOM 1241 CB LEU A 90 61.130 34.285-117.526 1.00 1.50 C ATOM 1242 CG LEU A 90 61.058 35.365-116.447 1.00 1.49 C ATOM 1243 CD1 LEU A 90 61.979 36.526-116.826 1.00 1.64 C ATOM 1244 CD2 LEU A 90 59.620 35.874-116.331 1.00 2.00 C ATOM 0 H LEU A 90 61.682 31.907-118.143 1.00 1.53 H new ATOM 0 HA LEU A 90 60.030 33.147-116.063 1.00 1.57 H new ATOM 0 HB2 LEU A 90 62.160 33.949-117.651 1.00 1.50 H new ATOM 0 HB3 LEU A 90 60.809 34.692-118.485 1.00 1.50 H new ATOM 0 HG LEU A 90 61.374 34.946-115.492 1.00 1.49 H new ATOM 0 HD11 LEU A 90 61.928 37.297-116.057 1.00 1.64 H new ATOM 0 HD12 LEU A 90 63.004 36.165-116.911 1.00 1.64 H new ATOM 0 HD13 LEU A 90 61.662 36.945-117.781 1.00 1.64 H new ATOM 0 HD21 LEU A 90 59.568 36.644-115.562 1.00 2.00 H new ATOM 0 HD22 LEU A 90 59.304 36.293-117.286 1.00 2.00 H new ATOM 0 HD23 LEU A 90 58.962 35.048-116.062 1.00 2.00 H new ATOM 1256 N ASP A 91 58.545 32.114-118.562 1.00 1.65 N ATOM 1257 CA ASP A 91 57.272 32.128-119.336 1.00 1.70 C ATOM 1258 C ASP A 91 56.173 32.774-118.493 1.00 1.81 C ATOM 1259 O ASP A 91 55.092 33.053-118.972 1.00 2.10 O ATOM 1260 CB ASP A 91 56.870 30.693-119.687 1.00 1.82 C ATOM 1261 CG ASP A 91 58.067 29.960-120.295 1.00 1.80 C ATOM 1262 OD1 ASP A 91 59.135 30.023-119.710 1.00 2.21 O ATOM 1263 OD2 ASP A 91 57.895 29.346-121.336 1.00 1.99 O ATOM 0 H ASP A 91 59.062 31.236-118.592 1.00 1.65 H new ATOM 0 HA ASP A 91 57.411 32.699-120.254 1.00 1.70 H new ATOM 0 HB2 ASP A 91 56.527 30.172-118.793 1.00 1.82 H new ATOM 0 HB3 ASP A 91 56.038 30.699-120.391 1.00 1.82 H new ATOM 1268 N GLY A 92 56.442 33.016-117.239 1.00 2.09 N ATOM 1269 CA GLY A 92 55.415 33.647-116.365 1.00 2.42 C ATOM 1270 C GLY A 92 54.836 32.597-115.417 1.00 2.35 C ATOM 1271 O GLY A 92 55.526 31.704-114.968 1.00 2.82 O ATOM 0 H GLY A 92 57.329 32.804-116.783 1.00 2.09 H new ATOM 0 HA2 GLY A 92 55.860 34.462-115.794 1.00 2.42 H new ATOM 0 HA3 GLY A 92 54.621 34.080-116.973 1.00 2.42 H new ATOM 1275 N LYS A 93 53.572 32.694-115.113 1.00 2.69 N ATOM 1276 CA LYS A 93 52.948 31.699-114.197 1.00 3.43 C ATOM 1277 C LYS A 93 51.540 31.368-114.698 1.00 3.52 C ATOM 1278 O LYS A 93 51.342 30.432-115.446 1.00 3.86 O ATOM 1279 CB LYS A 93 52.865 32.253-112.763 1.00 4.42 C ATOM 1280 CG LYS A 93 53.452 33.674-112.676 1.00 5.09 C ATOM 1281 CD LYS A 93 52.378 34.725-113.015 1.00 6.04 C ATOM 1282 CE LYS A 93 52.388 35.047-114.514 1.00 6.93 C ATOM 1283 NZ LYS A 93 51.465 34.121-115.228 1.00 7.42 N ATOM 0 H LYS A 93 52.944 33.419-115.459 1.00 2.69 H new ATOM 0 HA LYS A 93 53.563 30.799-114.185 1.00 3.43 H new ATOM 0 HB2 LYS A 93 51.825 32.266-112.436 1.00 4.42 H new ATOM 0 HB3 LYS A 93 53.404 31.592-112.084 1.00 4.42 H new ATOM 0 HG2 LYS A 93 53.840 33.853-111.673 1.00 5.09 H new ATOM 0 HG3 LYS A 93 54.292 33.769-113.364 1.00 5.09 H new ATOM 0 HD2 LYS A 93 51.395 34.354-112.724 1.00 6.04 H new ATOM 0 HD3 LYS A 93 52.558 35.634-112.442 1.00 6.04 H new ATOM 0 HE2 LYS A 93 52.081 36.080-114.677 1.00 6.93 H new ATOM 0 HE3 LYS A 93 53.398 34.948-114.911 1.00 6.93 H new ATOM 0 HZ1 LYS A 93 52.000 33.304-115.584 1.00 7.42 H new ATOM 0 HZ2 LYS A 93 50.727 33.793-114.573 1.00 7.42 H new ATOM 0 HZ3 LYS A 93 51.022 34.619-116.026 1.00 7.42 H new ATOM 1297 N LYS A 94 50.560 32.129-114.293 1.00 3.76 N ATOM 1298 CA LYS A 94 49.170 31.855-114.749 1.00 4.40 C ATOM 1299 C LYS A 94 48.923 32.573-116.077 1.00 4.66 C ATOM 1300 O LYS A 94 49.187 32.043-117.138 1.00 5.12 O ATOM 1301 CB LYS A 94 48.177 32.364-113.701 1.00 5.07 C ATOM 1302 CG LYS A 94 48.338 31.565-112.404 1.00 5.63 C ATOM 1303 CD LYS A 94 48.077 30.080-112.677 1.00 6.37 C ATOM 1304 CE LYS A 94 49.408 29.344-112.854 1.00 7.26 C ATOM 1305 NZ LYS A 94 49.256 28.285-113.891 1.00 7.79 N ATOM 0 H LYS A 94 50.663 32.928-113.667 1.00 3.76 H new ATOM 0 HA LYS A 94 49.035 30.782-114.883 1.00 4.40 H new ATOM 0 HB2 LYS A 94 48.347 33.424-113.510 1.00 5.07 H new ATOM 0 HB3 LYS A 94 47.158 32.267-114.075 1.00 5.07 H new ATOM 0 HG2 LYS A 94 49.343 31.700-112.005 1.00 5.63 H new ATOM 0 HG3 LYS A 94 47.643 31.934-111.650 1.00 5.63 H new ATOM 0 HD2 LYS A 94 47.516 29.642-111.852 1.00 6.37 H new ATOM 0 HD3 LYS A 94 47.466 29.967-113.573 1.00 6.37 H new ATOM 0 HE2 LYS A 94 50.188 30.046-113.148 1.00 7.26 H new ATOM 0 HE3 LYS A 94 49.719 28.900-111.908 1.00 7.26 H new ATOM 0 HZ1 LYS A 94 50.151 28.175-114.409 1.00 7.79 H new ATOM 0 HZ2 LYS A 94 49.008 27.385-113.434 1.00 7.79 H new ATOM 0 HZ3 LYS A 94 48.503 28.555-114.555 1.00 7.79 H new ATOM 1319 N ASP A 95 48.418 33.775-116.028 1.00 4.87 N ATOM 1320 CA ASP A 95 48.156 34.522-117.289 1.00 5.65 C ATOM 1321 C ASP A 95 47.109 33.773-118.115 1.00 6.05 C ATOM 1322 O ASP A 95 46.199 34.363-118.663 1.00 6.40 O ATOM 1323 CB ASP A 95 49.453 34.636-118.093 1.00 6.36 C ATOM 1324 CG ASP A 95 50.000 36.060-117.980 1.00 6.36 C ATOM 1325 OD1 ASP A 95 49.823 36.660-116.933 1.00 6.76 O ATOM 1326 OD2 ASP A 95 50.587 36.526-118.943 1.00 6.27 O ATOM 0 H ASP A 95 48.176 34.271-115.170 1.00 4.87 H new ATOM 0 HA ASP A 95 47.787 35.520-117.051 1.00 5.65 H new ATOM 0 HB2 ASP A 95 50.188 33.922-117.721 1.00 6.36 H new ATOM 0 HB3 ASP A 95 49.268 34.388-119.138 1.00 6.36 H new ATOM 1331 N ALA A 96 47.229 32.477-118.206 1.00 6.38 N ATOM 1332 CA ALA A 96 46.241 31.689-118.994 1.00 7.12 C ATOM 1333 C ALA A 96 45.367 30.871-118.042 1.00 7.59 C ATOM 1334 O ALA A 96 44.416 30.233-118.449 1.00 7.85 O ATOM 1335 CB ALA A 96 46.981 30.747-119.945 1.00 7.54 C ATOM 0 H ALA A 96 47.970 31.929-117.768 1.00 6.38 H new ATOM 0 HA ALA A 96 45.613 32.367-119.572 1.00 7.12 H new ATOM 0 HB1 ALA A 96 46.258 30.170-120.522 1.00 7.54 H new ATOM 0 HB2 ALA A 96 47.604 31.330-120.623 1.00 7.54 H new ATOM 0 HB3 ALA A 96 47.610 30.068-119.369 1.00 7.54 H new ATOM 1341 N ARG A 97 45.680 30.884-116.775 1.00 8.01 N ATOM 1342 CA ARG A 97 44.866 30.108-115.798 1.00 8.75 C ATOM 1343 C ARG A 97 44.948 28.617-116.134 1.00 9.19 C ATOM 1344 O ARG A 97 44.841 28.222-117.278 1.00 9.42 O ATOM 1345 CB ARG A 97 43.409 30.568-115.872 1.00 9.02 C ATOM 1346 CG ARG A 97 42.637 30.021-114.668 1.00 9.45 C ATOM 1347 CD ARG A 97 41.644 28.956-115.137 1.00 9.78 C ATOM 1348 NE ARG A 97 42.269 28.127-116.205 1.00 10.08 N ATOM 1349 CZ ARG A 97 41.734 26.985-116.542 1.00 10.54 C ATOM 1350 NH1 ARG A 97 40.651 26.570-115.944 1.00 10.84 N ATOM 1351 NH2 ARG A 97 42.282 26.259-117.479 1.00 10.89 N ATOM 0 H ARG A 97 46.464 31.399-116.375 1.00 8.01 H new ATOM 0 HA ARG A 97 45.250 30.274-114.792 1.00 8.75 H new ATOM 0 HB2 ARG A 97 43.361 31.657-115.884 1.00 9.02 H new ATOM 0 HB3 ARG A 97 42.953 30.219-116.798 1.00 9.02 H new ATOM 0 HG2 ARG A 97 43.329 29.593-113.943 1.00 9.45 H new ATOM 0 HG3 ARG A 97 42.108 30.830-114.164 1.00 9.45 H new ATOM 0 HD2 ARG A 97 41.349 28.325-114.299 1.00 9.78 H new ATOM 0 HD3 ARG A 97 40.738 29.430-115.514 1.00 9.78 H new ATOM 0 HE ARG A 97 43.115 28.452-116.673 1.00 10.08 H new ATOM 0 HH11 ARG A 97 40.222 27.138-115.213 1.00 10.84 H new ATOM 0 HH12 ARG A 97 40.233 25.678-116.207 1.00 10.84 H new ATOM 0 HH21 ARG A 97 43.128 26.584-117.947 1.00 10.89 H new ATOM 0 HH22 ARG A 97 41.864 25.367-117.743 1.00 10.89 H new ATOM 1365 N GLN A 98 45.137 27.787-115.146 1.00 9.55 N ATOM 1366 CA GLN A 98 45.225 26.322-115.409 1.00 10.25 C ATOM 1367 C GLN A 98 44.225 25.583-114.516 1.00 10.67 C ATOM 1368 O GLN A 98 43.452 26.250-113.849 1.00 11.09 O ATOM 1369 CB GLN A 98 46.644 25.834-115.105 1.00 10.68 C ATOM 1370 CG GLN A 98 46.762 25.494-113.618 1.00 10.92 C ATOM 1371 CD GLN A 98 46.090 26.589-112.789 1.00 11.20 C ATOM 1372 OE1 GLN A 98 45.059 26.365-112.187 1.00 11.44 O ATOM 1373 NE2 GLN A 98 46.635 27.773-112.731 1.00 11.41 N ATOM 1374 OXT GLN A 98 44.251 24.363-114.515 1.00 10.77 O ATOM 0 H GLN A 98 45.234 28.059-114.168 1.00 9.55 H new ATOM 0 HA GLN A 98 44.991 26.124-116.455 1.00 10.25 H new ATOM 0 HB2 GLN A 98 46.875 24.956-115.709 1.00 10.68 H new ATOM 0 HB3 GLN A 98 47.369 26.603-115.371 1.00 10.68 H new ATOM 0 HG2 GLN A 98 46.293 24.531-113.416 1.00 10.92 H new ATOM 0 HG3 GLN A 98 47.811 25.403-113.337 1.00 10.92 H new ATOM 0 HE21 GLN A 98 47.501 27.961-113.236 1.00 11.41 H new ATOM 0 HE22 GLN A 98 46.195 28.510-112.180 1.00 11.41 H new TER 1383 GLN A 98 END