data_6731 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for BOFC ; _BMRB_accession_number 6731 _BMRB_flat_file_name bmr6731.str _Entry_type original _Submission_date 2005-07-18 _Accession_date 2005-07-18 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Patterson Hayley M. . 2 Brannigan James A. . 3 Cutting Simon M. . 4 Wilson Keith S. . 5 Wilkinson Anthony J. . 6 Ab Eiso . . 7 Diercks Tammo . . 8 Folkers Gert . . 9 'de Jong' Rob . . 10 Truffault Vincent . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 812 "13C chemical shifts" 617 "15N chemical shifts" 140 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-01-29 original author . stop_ _Original_release_date 2007-01-29 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; The structure of BofC, an inter-compartmental signalling factor in sporulation in Bacillus ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16049010 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Patterson Hayley M. . 2 Brannigan James A. . 3 Cutting Simon M. . 4 Wilson Keith S. . 5 Wilkinson Anthony J. . 6 Ab Eiso . . 7 Diercks Tammo . . 8 Folkers Gert . . 9 'de Jong' Rob . . 10 Truffault Vincent . . 11 Kaptein Rob . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume 280 _Journal_issue 43 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 36214 _Page_last 36220 _Year 2005 _Details . loop_ _Keyword 'Bacillus subtilis' BofC 'sigma K checkpoint' Sporulation stop_ save_ ################################## # Molecular system description # ################################## save_system_BofC _Saveframe_category molecular_system _Mol_system_name BofC _Abbreviation_common BofC _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label BofC $BofC stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_BofC _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common BofC _Abbreviation_common BofC _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 140 _Mol_residue_sequence ; AEVEHYEPLQVHVQLEKVYL DGDVSIEHKHEKVFSMDDFW AAYAGWTLVEQKKGYVLFRK QMDDISPLSKVNGYIGVSDN GVISTFHGRPEPASEPIQSF FQIDLERLESHMQKNLLKGI PFRTKAEFEDVIEHMKTYSG ; loop_ _Residue_seq_code _Residue_label 1 ALA 2 GLU 3 VAL 4 GLU 5 HIS 6 TYR 7 GLU 8 PRO 9 LEU 10 GLN 11 VAL 12 HIS 13 VAL 14 GLN 15 LEU 16 GLU 17 LYS 18 VAL 19 TYR 20 LEU 21 ASP 22 GLY 23 ASP 24 VAL 25 SER 26 ILE 27 GLU 28 HIS 29 LYS 30 HIS 31 GLU 32 LYS 33 VAL 34 PHE 35 SER 36 MET 37 ASP 38 ASP 39 PHE 40 TRP 41 ALA 42 ALA 43 TYR 44 ALA 45 GLY 46 TRP 47 THR 48 LEU 49 VAL 50 GLU 51 GLN 52 LYS 53 LYS 54 GLY 55 TYR 56 VAL 57 LEU 58 PHE 59 ARG 60 LYS 61 GLN 62 MET 63 ASP 64 ASP 65 ILE 66 SER 67 PRO 68 LEU 69 SER 70 LYS 71 VAL 72 ASN 73 GLY 74 TYR 75 ILE 76 GLY 77 VAL 78 SER 79 ASP 80 ASN 81 GLY 82 VAL 83 ILE 84 SER 85 THR 86 PHE 87 HIS 88 GLY 89 ARG 90 PRO 91 GLU 92 PRO 93 ALA 94 SER 95 GLU 96 PRO 97 ILE 98 GLN 99 SER 100 PHE 101 PHE 102 GLN 103 ILE 104 ASP 105 LEU 106 GLU 107 ARG 108 LEU 109 GLU 110 SER 111 HIS 112 MET 113 GLN 114 LYS 115 ASN 116 LEU 117 LEU 118 LYS 119 GLY 120 ILE 121 PRO 122 PHE 123 ARG 124 THR 125 LYS 126 ALA 127 GLU 128 PHE 129 GLU 130 ASP 131 VAL 132 ILE 133 GLU 134 HIS 135 MET 136 LYS 137 THR 138 TYR 139 SER 140 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 2BW2 "Bofc From Bacillus Subtilis" 100.00 140 100.00 100.00 6.26e-98 DBJ BAI86261 "forespore regulator of the sigma-K checkpoint [Bacillus subtilis subsp. natto BEST195]" 100.00 170 99.29 100.00 6.26e-98 DBJ BAM53209 "Bypass of forespore C, intercompartmentalsignalingfactor [Bacillus subtilis BEST7613]" 100.00 170 100.00 100.00 3.11e-98 DBJ BAM58851 "Bypass of forespore C, intercompartmentalsignaling factor [Bacillus subtilis BEST7003]" 100.00 170 100.00 100.00 3.11e-98 DBJ GAK80383 "Bypass of forespore C, intercompartmental signaling factor [Bacillus subtilis Miyagi-4]" 100.00 170 99.29 100.00 6.26e-98 EMBL CAA63621 "bofC [Bacillus subtilis subsp. subtilis str. 168]" 100.00 170 100.00 100.00 3.11e-98 EMBL CAB14735 "Bypass of forespore C, intercompartmental signaling factor [Bacillus subtilis subsp. subtilis str. 168]" 100.00 170 100.00 100.00 3.11e-98 EMBL CAB75329 "BofC protein [Bacillus subtilis subsp. subtilis str. 168]" 100.00 170 100.00 100.00 3.11e-98 EMBL CCU59263 "bypass-of-forespore protein C, putative [Bacillus subtilis E1]" 100.00 170 100.00 100.00 3.11e-98 EMBL CEI58004 "general stress protein BofC [Bacillus subtilis]" 100.00 170 100.00 100.00 3.11e-98 GB ADM38725 "Bypass of forespore C, intercompartmental signaling factor [Bacillus subtilis subsp. spizizenii str. W23]" 100.00 170 97.14 97.86 1.51e-94 GB ADV93564 "Bypass of forespore C, intercompartmental signaling factor [Bacillus subtilis BSn5]" 100.00 170 100.00 100.00 3.11e-98 GB AEP87620 "sporulation protein BofC [Bacillus subtilis subsp. spizizenii TU-B-10]" 100.00 170 97.14 97.86 1.31e-94 GB AEP91767 "protein bofC [Bacillus subtilis subsp. subtilis str. RO-NN-1]" 100.00 170 100.00 100.00 3.11e-98 GB AFI29291 "Bypass of forespore C, intercompartmental signaling factor [Bacillus sp. JS]" 100.00 170 99.29 100.00 1.57e-97 REF NP_390653 "general stress protein BofC [Bacillus subtilis subsp. subtilis str. 168]" 100.00 170 100.00 100.00 3.11e-98 REF WP_003222663 "BofC [Bacillus subtilis]" 100.00 170 97.14 97.86 1.51e-94 REF WP_003229715 "MULTISPECIES: BofC [Bacillales]" 100.00 170 100.00 100.00 3.11e-98 REF WP_003237539 "sporulation protein BofC [Bacillus subtilis]" 100.00 170 97.86 97.86 2.35e-95 REF WP_010331022 "BofC [Bacillus vallismortis]" 100.00 170 97.14 97.86 4.95e-94 SP O05391 "RecName: Full=Protein BofC; AltName: Full=Bypass-of-forespore protein C; Flags: Precursor [Bacillus subtilis subsp. subtilis st" 100.00 170 100.00 100.00 3.11e-98 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $BofC 'Bacillus subtilis' 1423 Bacteria . Bacillus subtilis stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $BofC 'recombinant technology' 'E. coli' . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $BofC 0.5 mM '[U-15N; U-13C]' H2O 90 % . D2O 10 % . NaPO4 20 mM . EDTA 1 mM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer unknown _Model unknown _Field_strength 0 _Details 'spectrometer information not available' save_ ############################# # NMR applied experiments # ############################# save__1 _Saveframe_category NMR_applied_experiment _Sample_label $sample_one save_ save_NMR_applied_experiment _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_condition_one _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.0 . pH pressure 1013 . hPa temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $entry_citation $entry_citation DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 $entry_citation $entry_citation DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $entry_citation $entry_citation stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_shift_set_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_one stop_ _Sample_conditions_label $condition_one _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name BofC _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 2 GLU CA C 56.377 0.2 1 2 . 2 GLU HA H 4.320 0.02 1 3 . 2 GLU CB C 30.324 0.2 1 4 . 2 GLU HB2 H 1.864 0.02 2 5 . 2 GLU HB3 H 2.000 0.02 2 6 . 2 GLU CG C 36.137 0.2 1 7 . 2 GLU HG2 H 2.240 0.02 2 8 . 2 GLU HG3 H 2.242 0.02 2 9 . 2 GLU C C 176.257 0.2 1 10 . 3 VAL N N 120.934 0.15 1 11 . 3 VAL H H 8.198 0.02 1 12 . 3 VAL CA C 62.147 0.2 1 13 . 3 VAL HA H 4.024 0.02 1 14 . 3 VAL CB C 32.890 0.2 1 15 . 3 VAL HB H 1.963 0.02 1 16 . 3 VAL HG1 H 0.819 0.02 2 17 . 3 VAL HG2 H 0.851 0.02 2 18 . 3 VAL CG1 C 21.086 0.2 2 19 . 3 VAL CG2 C 20.403 0.2 2 20 . 3 VAL C C 175.757 0.2 1 21 . 4 GLU N N 124.499 0.15 1 22 . 4 GLU H H 8.379 0.02 1 23 . 4 GLU CA C 56.408 0.2 1 24 . 4 GLU HA H 4.152 0.02 1 25 . 4 GLU CB C 30.437 0.2 1 26 . 4 GLU HB2 H 1.803 0.02 1 27 . 4 GLU HB3 H 1.803 0.02 1 28 . 4 GLU CG C 36.187 0.2 1 29 . 4 GLU HG2 H 2.087 0.02 2 30 . 4 GLU HG3 H 2.143 0.02 2 31 . 4 GLU C C 175.787 0.2 1 32 . 5 HIS N N 120.096 0.15 1 33 . 5 HIS H H 8.323 0.02 1 34 . 5 HIS CA C 55.460 0.2 1 35 . 5 HIS HA H 4.580 0.02 1 36 . 5 HIS CB C 30.189 0.2 1 37 . 5 HIS HB2 H 3.001 0.02 2 38 . 5 HIS HB3 H 3.063 0.02 2 39 . 5 HIS C C 173.987 0.2 1 40 . 6 TYR N N 122.548 0.15 1 41 . 6 TYR H H 8.179 0.02 1 42 . 6 TYR CA C 57.513 0.2 1 43 . 6 TYR HA H 4.556 0.02 1 44 . 6 TYR CB C 39.164 0.2 1 45 . 6 TYR HB2 H 2.870 0.02 2 46 . 6 TYR HB3 H 2.985 0.02 2 47 . 6 TYR CD1 C 133.137 0.2 1 48 . 6 TYR HD1 H 7.045 0.02 1 49 . 6 TYR CE1 C 118.228 0.2 1 50 . 6 TYR HE1 H 6.740 0.02 1 51 . 6 TYR CE2 C 118.228 0.2 1 52 . 6 TYR HE2 H 6.740 0.02 1 53 . 6 TYR CD2 C 133.137 0.2 1 54 . 6 TYR HD2 H 7.045 0.02 1 55 . 6 TYR C C 174.917 0.2 1 56 . 7 GLU N N 124.157 0.15 1 57 . 7 GLU H H 8.186 0.02 1 58 . 7 GLU CA C 53.464 0.2 1 59 . 7 GLU HA H 4.559 0.02 1 60 . 7 GLU CB C 30.323 0.2 1 61 . 7 GLU HB2 H 1.770 0.02 2 62 . 7 GLU HB3 H 1.919 0.02 2 63 . 7 GLU CG C 35.797 0.2 1 64 . 7 GLU HG2 H 2.180 0.02 1 65 . 7 GLU HG3 H 2.180 0.02 1 66 . 7 GLU C C 173.587 0.2 1 67 . 8 PRO CD C 50.133 0.2 1 68 . 8 PRO CA C 62.370 0.2 1 69 . 8 PRO HA H 4.062 0.02 1 70 . 8 PRO CB C 31.332 0.2 1 71 . 8 PRO HB2 H 1.051 0.02 2 72 . 8 PRO HB3 H 1.227 0.02 2 73 . 8 PRO CG C 26.855 0.2 1 74 . 8 PRO HG2 H 1.706 0.02 1 75 . 8 PRO HG3 H 1.706 0.02 1 76 . 8 PRO HD2 H 3.573 0.02 2 77 . 8 PRO HD3 H 3.618 0.02 2 78 . 8 PRO C C 176.147 0.2 1 79 . 9 LEU N N 121.959 0.15 1 80 . 9 LEU H H 8.139 0.02 1 81 . 9 LEU CA C 54.367 0.2 1 82 . 9 LEU HA H 4.227 0.02 1 83 . 9 LEU CB C 43.093 0.2 1 84 . 9 LEU HB2 H 1.302 0.02 2 85 . 9 LEU HB3 H 1.399 0.02 2 86 . 9 LEU CG C 26.740 0.2 1 87 . 9 LEU HG H 1.439 0.02 1 88 . 9 LEU HD1 H 0.667 0.02 2 89 . 9 LEU HD2 H 0.689 0.02 2 90 . 9 LEU CD1 C 23.990 0.2 2 91 . 9 LEU CD2 C 24.808 0.2 2 92 . 9 LEU C C 176.017 0.2 1 93 . 10 GLN N N 122.236 0.15 1 94 . 10 GLN H H 8.212 0.02 1 95 . 10 GLN CA C 54.970 0.2 1 96 . 10 GLN HA H 4.789 0.02 1 97 . 10 GLN CB C 29.562 0.2 1 98 . 10 GLN HB2 H 1.829 0.02 2 99 . 10 GLN HB3 H 1.921 0.02 2 100 . 10 GLN CG C 33.956 0.2 1 101 . 10 GLN HG2 H 2.076 0.02 2 102 . 10 GLN HG3 H 2.199 0.02 2 103 . 10 GLN NE2 N 110.969 0.15 1 104 . 10 GLN HE21 H 6.667 0.02 2 105 . 10 GLN HE22 H 7.474 0.02 2 106 . 10 GLN C C 175.447 0.2 1 107 . 11 VAL N N 124.814 0.15 1 108 . 11 VAL H H 8.723 0.02 1 109 . 11 VAL CA C 61.227 0.2 1 110 . 11 VAL HA H 3.933 0.02 1 111 . 11 VAL CB C 35.125 0.2 1 112 . 11 VAL HB H 1.389 0.02 1 113 . 11 VAL HG1 H 0.251 0.02 2 114 . 11 VAL HG2 H 0.279 0.02 2 115 . 11 VAL CG1 C 21.273 0.2 2 116 . 11 VAL CG2 C 21.449 0.2 2 117 . 11 VAL C C 173.887 0.2 1 118 . 12 HIS N N 127.991 0.15 1 119 . 12 HIS H H 8.462 0.02 1 120 . 12 HIS CA C 53.523 0.2 1 121 . 12 HIS HA H 4.917 0.02 1 122 . 12 HIS CB C 30.287 0.2 1 123 . 12 HIS HB2 H 3.207 0.02 2 124 . 12 HIS HB3 H 3.558 0.02 2 125 . 12 HIS C C 172.257 0.2 1 126 . 13 VAL N N 128.363 0.15 1 127 . 13 VAL H H 9.132 0.02 1 128 . 13 VAL CA C 60.374 0.2 1 129 . 13 VAL HA H 4.396 0.02 1 130 . 13 VAL CB C 33.411 0.2 1 131 . 13 VAL HB H 1.780 0.02 1 132 . 13 VAL HG1 H 0.774 0.02 2 133 . 13 VAL HG2 H 0.479 0.02 2 134 . 13 VAL CG1 C 21.721 0.2 2 135 . 13 VAL CG2 C 21.785 0.2 2 136 . 13 VAL C C 173.437 0.2 1 137 . 14 GLN N N 130.178 0.15 1 138 . 14 GLN H H 8.819 0.02 1 139 . 14 GLN CA C 54.338 0.2 1 140 . 14 GLN HA H 4.747 0.02 1 141 . 14 GLN CB C 30.629 0.2 1 142 . 14 GLN CG C 34.467 0.2 1 143 . 14 GLN NE2 N 116.480 0.15 1 144 . 14 GLN HE21 H 7.103 0.02 2 145 . 14 GLN HE22 H 7.976 0.02 2 146 . 14 GLN C C 172.987 0.2 1 147 . 15 LEU N N 125.726 0.15 1 148 . 15 LEU H H 8.809 0.02 1 149 . 15 LEU CA C 53.392 0.2 1 150 . 15 LEU HA H 4.657 0.02 1 151 . 15 LEU CB C 42.689 0.2 1 152 . 15 LEU HB2 H 1.089 0.02 2 153 . 15 LEU HB3 H 1.579 0.02 2 154 . 15 LEU CG C 26.088 0.2 1 155 . 15 LEU HG H 1.048 0.02 1 156 . 15 LEU HD1 H 0.493 0.02 2 157 . 15 LEU HD2 H -0.413 0.02 2 158 . 15 LEU CD1 C 25.341 0.2 2 159 . 15 LEU CD2 C 23.468 0.2 2 160 . 15 LEU C C 176.397 0.2 1 161 . 16 GLU N N 124.014 0.15 1 162 . 16 GLU H H 9.115 0.02 1 163 . 16 GLU CA C 54.912 0.2 1 164 . 16 GLU HA H 5.270 0.02 1 165 . 16 GLU CB C 31.982 0.2 1 166 . 16 GLU HB2 H 1.818 0.02 2 167 . 16 GLU HB3 H 2.045 0.02 2 168 . 16 GLU CG C 37.071 0.2 1 169 . 16 GLU HG2 H 2.242 0.02 2 170 . 16 GLU HG3 H 2.082 0.02 2 171 . 16 GLU C C 174.707 0.2 1 172 . 17 LYS N N 124.899 0.15 1 173 . 17 LYS H H 8.915 0.02 1 174 . 17 LYS CA C 55.267 0.2 1 175 . 17 LYS HA H 4.795 0.02 1 176 . 17 LYS CB C 34.417 0.2 1 177 . 17 LYS HB2 H 1.168 0.02 2 178 . 17 LYS HB3 H 1.815 0.02 2 179 . 17 LYS CG C 26.347 0.2 1 180 . 17 LYS HG2 H 1.180 0.02 2 181 . 17 LYS HG3 H 1.767 0.02 2 182 . 17 LYS CD C 30.247 0.2 1 183 . 17 LYS HD2 H 1.691 0.02 1 184 . 17 LYS HD3 H 1.691 0.02 1 185 . 17 LYS CE C 42.227 0.2 1 186 . 17 LYS HE2 H 2.921 0.02 2 187 . 17 LYS HE3 H 3.041 0.02 2 188 . 17 LYS C C 174.157 0.2 1 189 . 18 VAL N N 122.200 0.15 1 190 . 18 VAL H H 8.317 0.02 1 191 . 18 VAL CA C 61.162 0.2 1 192 . 18 VAL HA H 4.573 0.02 1 193 . 18 VAL CB C 33.150 0.2 1 194 . 18 VAL HB H 1.839 0.02 1 195 . 18 VAL HG1 H 0.875 0.02 2 196 . 18 VAL HG2 H 0.933 0.02 2 197 . 18 VAL CG1 C 20.471 0.2 2 198 . 18 VAL CG2 C 20.896 0.2 2 199 . 18 VAL C C 175.897 0.2 1 200 . 19 TYR N N 126.538 0.15 1 201 . 19 TYR H H 8.942 0.02 1 202 . 19 TYR CA C 58.877 0.2 1 203 . 19 TYR HA H 4.700 0.02 1 204 . 19 TYR CB C 40.917 0.2 1 205 . 19 TYR HB2 H 3.161 0.02 2 206 . 19 TYR HB3 H 3.304 0.02 2 207 . 19 TYR CD1 C 133.861 0.2 1 208 . 19 TYR HD1 H 6.918 0.02 1 209 . 19 TYR CE1 C 117.734 0.2 1 210 . 19 TYR HE1 H 6.683 0.02 1 211 . 19 TYR CE2 C 117.734 0.2 1 212 . 19 TYR HE2 H 6.683 0.02 1 213 . 19 TYR CD2 C 133.861 0.2 1 214 . 19 TYR HD2 H 6.918 0.02 1 215 . 19 TYR C C 178.367 0.2 1 216 . 20 LEU N N 120.487 0.15 1 217 . 20 LEU H H 8.498 0.02 1 218 . 20 LEU CA C 57.522 0.2 1 219 . 20 LEU HA H 3.987 0.02 1 220 . 20 LEU CB C 43.587 0.2 1 221 . 20 LEU HB2 H 1.017 0.02 2 222 . 20 LEU HB3 H 1.379 0.02 2 223 . 20 LEU CG C 26.958 0.2 1 224 . 20 LEU HG H 1.793 0.02 1 225 . 20 LEU HD1 H 0.990 0.02 2 226 . 20 LEU HD2 H 0.774 0.02 2 227 . 20 LEU CD1 C 22.626 0.2 2 228 . 20 LEU CD2 C 25.875 0.2 2 229 . 20 LEU C C 176.517 0.2 1 230 . 21 ASP N N 110.119 0.15 1 231 . 21 ASP H H 7.760 0.02 1 232 . 21 ASP CA C 53.190 0.2 1 233 . 21 ASP HA H 3.975 0.02 1 234 . 21 ASP CB C 40.966 0.2 1 235 . 21 ASP HB2 H 1.942 0.02 2 236 . 21 ASP HB3 H 2.861 0.02 2 237 . 21 ASP C C 175.197 0.2 1 238 . 22 GLY N N 105.921 0.15 1 239 . 22 GLY H H 7.817 0.02 1 240 . 22 GLY CA C 44.643 0.2 1 241 . 22 GLY HA2 H 3.501 0.02 2 242 . 22 GLY HA3 H 4.158 0.02 2 243 . 22 GLY C C 174.197 0.2 1 244 . 23 ASP N N 122.553 0.15 1 245 . 23 ASP H H 8.095 0.02 1 246 . 23 ASP CA C 54.526 0.2 1 247 . 23 ASP HA H 4.566 0.02 1 248 . 23 ASP CB C 42.037 0.2 1 249 . 23 ASP HB2 H 2.696 0.02 2 250 . 23 ASP HB3 H 2.702 0.02 2 251 . 23 ASP C C 174.607 0.2 1 252 . 24 VAL N N 119.670 0.15 1 253 . 24 VAL H H 8.059 0.02 1 254 . 24 VAL CA C 60.299 0.2 1 255 . 24 VAL HA H 5.438 0.02 1 256 . 24 VAL CB C 35.643 0.2 1 257 . 24 VAL HB H 1.963 0.02 1 258 . 24 VAL HG1 H 0.852 0.02 2 259 . 24 VAL HG2 H 0.994 0.02 2 260 . 24 VAL CG1 C 21.035 0.2 2 261 . 24 VAL CG2 C 21.418 0.2 2 262 . 24 VAL C C 176.817 0.2 1 263 . 25 SER N N 122.718 0.15 1 264 . 25 SER H H 9.335 0.02 1 265 . 25 SER CA C 56.774 0.2 1 266 . 25 SER HA H 5.001 0.02 1 267 . 25 SER CB C 65.379 0.2 1 268 . 25 SER HB2 H 4.014 0.02 2 269 . 25 SER HB3 H 4.071 0.02 2 270 . 25 SER C C 173.457 0.2 1 271 . 26 ILE N N 126.034 0.15 1 272 . 26 ILE H H 8.765 0.02 1 273 . 26 ILE CA C 60.770 0.2 1 274 . 26 ILE HA H 5.112 0.02 1 275 . 26 ILE CB C 40.459 0.2 1 276 . 26 ILE HB H 1.716 0.02 1 277 . 26 ILE HG2 H 0.638 0.02 1 278 . 26 ILE CG2 C 18.128 0.2 1 279 . 26 ILE CG1 C 28.438 0.2 1 280 . 26 ILE HG12 H 0.972 0.02 2 281 . 26 ILE HG13 H 1.568 0.02 2 282 . 26 ILE HD1 H 0.886 0.02 1 283 . 26 ILE CD1 C 13.810 0.2 1 284 . 26 ILE C C 175.657 0.2 1 285 . 27 GLU N N 128.398 0.15 1 286 . 27 GLU H H 9.025 0.02 1 287 . 27 GLU CA C 54.563 0.2 1 288 . 27 GLU HA H 4.758 0.02 1 289 . 27 GLU CB C 34.007 0.2 1 290 . 27 GLU HB2 H 1.919 0.02 2 291 . 27 GLU HB3 H 1.989 0.02 2 292 . 27 GLU CG C 36.467 0.2 1 293 . 27 GLU HG2 H 2.115 0.02 2 294 . 27 GLU HG3 H 2.279 0.02 2 295 . 27 GLU C C 173.747 0.2 1 296 . 28 HIS N N 121.598 0.15 1 297 . 28 HIS H H 8.767 0.02 1 298 . 28 HIS CA C 55.231 0.2 1 299 . 28 HIS HA H 5.438 0.02 1 300 . 28 HIS CB C 33.425 0.2 1 301 . 28 HIS HB2 H 2.795 0.02 2 302 . 28 HIS HB3 H 2.986 0.02 2 303 . 28 HIS CD2 C 118.262 0.2 1 304 . 28 HIS CE1 C 137.607 0.2 1 305 . 28 HIS HD2 H 7.062 0.02 1 306 . 28 HIS HE1 H 7.883 0.02 1 307 . 28 HIS C C 175.397 0.2 1 308 . 29 LYS N N 122.783 0.15 1 309 . 29 LYS H H 9.488 0.02 1 310 . 29 LYS CA C 54.674 0.2 1 311 . 29 LYS HA H 4.663 0.02 1 312 . 29 LYS CB C 36.067 0.2 1 313 . 29 LYS HB2 H 1.555 0.02 2 314 . 29 LYS HB3 H 1.819 0.02 2 315 . 29 LYS CG C 24.803 0.2 1 316 . 29 LYS HG2 H 1.262 0.02 1 317 . 29 LYS HG3 H 1.262 0.02 1 318 . 29 LYS CD C 29.072 0.2 1 319 . 29 LYS HD2 H 1.617 0.02 1 320 . 29 LYS HD3 H 1.617 0.02 1 321 . 29 LYS CE C 42.070 0.2 1 322 . 29 LYS HE2 H 2.817 0.02 2 323 . 29 LYS HE3 H 2.883 0.02 2 324 . 29 LYS C C 174.217 0.2 1 325 . 30 HIS N N 122.929 0.15 1 326 . 30 HIS H H 8.754 0.02 1 327 . 30 HIS CA C 55.657 0.2 1 328 . 30 HIS HA H 5.195 0.02 1 329 . 30 HIS CB C 30.903 0.2 1 330 . 30 HIS HB2 H 2.874 0.02 2 331 . 30 HIS HB3 H 2.949 0.02 2 332 . 30 HIS C C 175.107 0.2 1 333 . 31 GLU N N 123.915 0.15 1 334 . 31 GLU H H 8.882 0.02 1 335 . 31 GLU CA C 55.085 0.2 1 336 . 31 GLU HA H 4.675 0.02 1 337 . 31 GLU CB C 32.955 0.2 1 338 . 31 GLU HB2 H 1.687 0.02 2 339 . 31 GLU HB3 H 1.997 0.02 2 340 . 31 GLU CG C 35.706 0.2 1 341 . 31 GLU HG2 H 2.102 0.02 2 342 . 31 GLU HG3 H 2.237 0.02 2 343 . 31 GLU C C 175.127 0.2 1 344 . 32 LYS N N 123.836 0.15 1 345 . 32 LYS H H 8.583 0.02 1 346 . 32 LYS CA C 55.310 0.2 1 347 . 32 LYS HA H 4.675 0.02 1 348 . 32 LYS CB C 32.945 0.2 1 349 . 32 LYS HB2 H 1.368 0.02 2 350 . 32 LYS HB3 H 1.655 0.02 2 351 . 32 LYS CG C 25.227 0.2 1 352 . 32 LYS HG2 H 1.040 0.02 2 353 . 32 LYS HG3 H 1.264 0.02 2 354 . 32 LYS CD C 29.437 0.2 1 355 . 32 LYS HD2 H 1.573 0.02 2 356 . 32 LYS HD3 H 1.582 0.02 2 357 . 32 LYS CE C 42.197 0.2 1 358 . 32 LYS HE2 H 2.859 0.02 2 359 . 32 LYS C C 175.677 0.2 1 360 . 33 VAL N N 124.309 0.15 1 361 . 33 VAL H H 8.781 0.02 1 362 . 33 VAL CA C 61.816 0.2 1 363 . 33 VAL HA H 4.080 0.02 1 364 . 33 VAL CB C 34.277 0.2 1 365 . 33 VAL HB H 1.726 0.02 1 366 . 33 VAL HG1 H 0.458 0.02 2 367 . 33 VAL HG2 H 0.666 0.02 2 368 . 33 VAL CG1 C 21.173 0.2 2 369 . 33 VAL CG2 C 21.714 0.2 2 370 . 33 VAL C C 174.887 0.2 1 371 . 34 PHE N N 125.679 0.15 1 372 . 34 PHE H H 9.030 0.02 1 373 . 34 PHE CA C 59.433 0.2 1 374 . 34 PHE HA H 4.471 0.02 1 375 . 34 PHE CB C 39.767 0.2 1 376 . 34 PHE HB2 H 2.853 0.02 2 377 . 34 PHE HB3 H 3.104 0.02 2 378 . 34 PHE CD1 C 131.677 0.2 1 379 . 34 PHE HD1 H 7.231 0.02 1 380 . 34 PHE CE1 C 132.497 0.2 1 381 . 34 PHE HE1 H 7.160 0.02 1 382 . 34 PHE CE2 C 132.497 0.2 1 383 . 34 PHE HE2 H 7.160 0.02 1 384 . 34 PHE CD2 C 131.677 0.2 1 385 . 34 PHE HD2 H 7.231 0.02 1 386 . 34 PHE C C 175.747 0.2 1 387 . 35 SER N N 113.114 0.15 1 388 . 35 SER H H 7.808 0.02 1 389 . 35 SER CA C 55.817 0.2 1 390 . 35 SER HA H 4.630 0.02 1 391 . 35 SER CB C 64.171 0.2 1 392 . 35 SER HB2 H 3.768 0.02 2 393 . 35 SER HB3 H 3.928 0.02 2 394 . 35 SER C C 175.567 0.2 1 395 . 36 MET CA C 56.111 0.2 1 396 . 36 MET HA H 4.295 0.02 1 397 . 36 MET CB C 29.760 0.2 1 398 . 36 MET HB2 H 2.050 0.02 2 399 . 36 MET HB3 H 2.054 0.02 2 400 . 36 MET CG C 32.155 0.2 1 401 . 36 MET HG2 H 2.370 0.02 2 402 . 36 MET HG3 H 2.648 0.02 2 403 . 36 MET HE H 1.366 0.02 1 404 . 36 MET CE C 15.676 0.2 1 405 . 36 MET C C 177.407 0.2 1 406 . 37 ASP N N 117.965 0.15 1 407 . 37 ASP H H 8.170 0.02 1 408 . 37 ASP CA C 57.873 0.2 1 409 . 37 ASP HA H 4.611 0.02 1 410 . 37 ASP CB C 40.257 0.2 1 411 . 37 ASP HB2 H 2.483 0.02 2 412 . 37 ASP HB3 H 2.732 0.02 2 413 . 37 ASP C C 179.197 0.2 1 414 . 38 ASP N N 119.862 0.15 1 415 . 38 ASP H H 7.514 0.02 1 416 . 38 ASP CA C 56.805 0.2 1 417 . 38 ASP HA H 4.431 0.02 1 418 . 38 ASP CB C 40.291 0.2 1 419 . 38 ASP HB2 H 2.772 0.02 2 420 . 38 ASP HB3 H 2.805 0.02 2 421 . 38 ASP C C 178.297 0.2 1 422 . 39 PHE N N 123.513 0.15 1 423 . 39 PHE H H 7.592 0.02 1 424 . 39 PHE CA C 61.343 0.2 1 425 . 39 PHE HA H 4.221 0.02 1 426 . 39 PHE CB C 39.187 0.2 1 427 . 39 PHE HB2 H 3.009 0.02 2 428 . 39 PHE HB3 H 3.060 0.02 2 429 . 39 PHE CD1 C 131.800 0.2 1 430 . 39 PHE HD1 H 6.334 0.02 1 431 . 39 PHE CE1 C 130.288 0.2 1 432 . 39 PHE HE1 H 6.449 0.02 1 433 . 39 PHE CE2 C 130.288 0.2 1 434 . 39 PHE HE2 H 6.449 0.02 1 435 . 39 PHE CD2 C 131.800 0.2 1 436 . 39 PHE HD2 H 6.334 0.02 1 437 . 39 PHE C C 176.447 0.2 1 438 . 40 TRP N N 116.867 0.15 1 439 . 40 TRP H H 8.298 0.02 1 440 . 40 TRP CA C 59.217 0.2 1 441 . 40 TRP HA H 4.562 0.02 1 442 . 40 TRP CB C 29.755 0.2 1 443 . 40 TRP HB2 H 3.213 0.02 2 444 . 40 TRP HB3 H 3.462 0.02 2 445 . 40 TRP CD1 C 130.127 0.2 1 446 . 40 TRP CE3 C 129.297 0.2 1 447 . 40 TRP NE1 N 128.891 0.15 1 448 . 40 TRP HD1 H 7.383 0.02 1 449 . 40 TRP HE3 H 7.152 0.02 1 450 . 40 TRP CZ2 C 114.933 0.2 1 451 . 40 TRP HE1 H 10.214 0.02 1 452 . 40 TRP CH2 C 123.879 0.2 1 453 . 40 TRP HZ2 H 7.427 0.02 1 454 . 40 TRP HH2 H 6.902 0.02 1 455 . 40 TRP C C 180.597 0.2 1 456 . 41 ALA N N 119.444 0.15 1 457 . 41 ALA H H 7.712 0.02 1 458 . 41 ALA CA C 54.794 0.2 1 459 . 41 ALA HA H 4.175 0.02 1 460 . 41 ALA HB H 1.502 0.02 1 461 . 41 ALA CB C 18.206 0.2 1 462 . 41 ALA C C 180.087 0.2 1 463 . 42 ALA N N 120.941 0.15 1 464 . 42 ALA H H 7.629 0.02 1 465 . 42 ALA CA C 53.983 0.2 1 466 . 42 ALA HA H 3.915 0.02 1 467 . 42 ALA HB H 1.088 0.02 1 468 . 42 ALA CB C 17.735 0.2 1 469 . 42 ALA C C 178.597 0.2 1 470 . 43 TYR N N 115.592 0.15 1 471 . 43 TYR H H 7.050 0.02 1 472 . 43 TYR CA C 58.307 0.2 1 473 . 43 TYR HA H 4.088 0.02 1 474 . 43 TYR CB C 37.859 0.2 1 475 . 43 TYR HB2 H 1.606 0.02 2 476 . 43 TYR HB3 H 2.068 0.02 2 477 . 43 TYR CD1 C 132.617 0.2 1 478 . 43 TYR HD1 H 5.679 0.02 1 479 . 43 TYR CE1 C 117.137 0.2 1 480 . 43 TYR HE1 H 5.971 0.02 1 481 . 43 TYR CE2 C 117.137 0.2 1 482 . 43 TYR HE2 H 5.971 0.02 1 483 . 43 TYR CD2 C 132.617 0.2 1 484 . 43 TYR HD2 H 5.679 0.02 1 485 . 43 TYR C C 174.677 0.2 1 486 . 44 ALA N N 123.503 0.15 1 487 . 44 ALA H H 6.977 0.02 1 488 . 44 ALA CA C 54.335 0.2 1 489 . 44 ALA HA H 4.289 0.02 1 490 . 44 ALA HB H 1.444 0.02 1 491 . 44 ALA CB C 18.438 0.2 1 492 . 44 ALA C C 179.007 0.2 1 493 . 45 GLY N N 110.098 0.15 1 494 . 45 GLY H H 8.915 0.02 1 495 . 45 GLY CA C 45.167 0.2 1 496 . 45 GLY HA2 H 3.697 0.02 2 497 . 45 GLY HA3 H 4.042 0.02 2 498 . 45 GLY C C 174.607 0.2 1 499 . 46 TRP N N 121.658 0.15 1 500 . 46 TRP H H 7.988 0.02 1 501 . 46 TRP CA C 57.192 0.2 1 502 . 46 TRP HA H 4.333 0.02 1 503 . 46 TRP CB C 30.023 0.2 1 504 . 46 TRP HB2 H 2.930 0.02 2 505 . 46 TRP HB3 H 3.185 0.02 2 506 . 46 TRP CD1 C 126.900 0.2 1 507 . 46 TRP NE1 N 129.568 0.15 1 508 . 46 TRP HD1 H 6.774 0.02 1 509 . 46 TRP CZ2 C 114.264 0.2 1 510 . 46 TRP HE1 H 10.102 0.02 1 511 . 46 TRP CH2 C 124.494 0.2 1 512 . 46 TRP HZ2 H 7.381 0.02 1 513 . 46 TRP HH2 H 6.867 0.02 1 514 . 46 TRP C C 175.787 0.2 1 515 . 47 THR N N 119.309 0.15 1 516 . 47 THR H H 9.290 0.02 1 517 . 47 THR CA C 62.972 0.2 1 518 . 47 THR HA H 4.516 0.02 1 519 . 47 THR CB C 69.882 0.2 1 520 . 47 THR HB H 4.324 0.02 1 521 . 47 THR HG2 H 1.169 0.02 1 522 . 47 THR CG2 C 21.361 0.2 1 523 . 47 THR C C 174.017 0.2 1 524 . 48 LEU N N 131.230 0.15 1 525 . 48 LEU H H 9.150 0.02 1 526 . 48 LEU CA C 55.954 0.2 1 527 . 48 LEU HA H 4.389 0.02 1 528 . 48 LEU CB C 41.759 0.2 1 529 . 48 LEU HB2 H 1.518 0.02 2 530 . 48 LEU HB3 H 1.856 0.02 2 531 . 48 LEU CG C 27.445 0.2 1 532 . 48 LEU HG H 1.158 0.02 1 533 . 48 LEU HD1 H 0.571 0.02 2 534 . 48 LEU HD2 H 0.632 0.02 2 535 . 48 LEU CD1 C 24.531 0.2 2 536 . 48 LEU CD2 C 25.770 0.2 2 537 . 48 LEU C C 175.657 0.2 1 538 . 49 VAL N N 130.171 0.15 1 539 . 49 VAL H H 9.108 0.02 1 540 . 49 VAL CA C 64.237 0.2 1 541 . 49 VAL HA H 3.981 0.02 1 542 . 49 VAL CB C 32.996 0.2 1 543 . 49 VAL HB H 1.727 0.02 1 544 . 49 VAL HG1 H 0.863 0.02 2 545 . 49 VAL HG2 H 0.911 0.02 2 546 . 49 VAL CG1 C 22.172 0.2 2 547 . 49 VAL CG2 C 21.380 0.2 2 548 . 49 VAL C C 175.997 0.2 1 549 . 50 GLU N N 115.424 0.15 1 550 . 50 GLU H H 7.327 0.02 1 551 . 50 GLU CA C 55.252 0.2 1 552 . 50 GLU HA H 4.573 0.02 1 553 . 50 GLU CB C 33.631 0.2 1 554 . 50 GLU HB2 H 1.916 0.02 2 555 . 50 GLU HB3 H 1.991 0.02 2 556 . 50 GLU CG C 36.051 0.2 1 557 . 50 GLU HG2 H 2.076 0.02 2 558 . 50 GLU HG3 H 2.080 0.02 2 559 . 50 GLU C C 172.797 0.2 1 560 . 51 GLN N N 120.062 0.15 1 561 . 51 GLN H H 8.569 0.02 1 562 . 51 GLN CA C 54.837 0.2 1 563 . 51 GLN HA H 5.042 0.02 1 564 . 51 GLN CB C 32.021 0.2 1 565 . 51 GLN HB2 H 2.048 0.02 1 566 . 51 GLN HB3 H 2.048 0.02 1 567 . 51 GLN CG C 33.197 0.2 1 568 . 51 GLN HG2 H 2.242 0.02 2 569 . 51 GLN HG3 H 2.307 0.02 2 570 . 51 GLN NE2 N 109.844 0.15 1 571 . 51 GLN HE21 H 6.654 0.02 2 572 . 51 GLN HE22 H 7.431 0.02 2 573 . 51 GLN C C 173.797 0.2 1 574 . 52 LYS N N 122.956 0.15 1 575 . 52 LYS H H 9.181 0.02 1 576 . 52 LYS CA C 54.526 0.2 1 577 . 52 LYS HA H 4.624 0.02 1 578 . 52 LYS CB C 35.979 0.2 1 579 . 52 LYS HB2 H 1.678 0.02 2 580 . 52 LYS HB3 H 2.058 0.02 2 581 . 52 LYS CG C 24.978 0.2 1 582 . 52 LYS HG2 H 1.286 0.02 2 583 . 52 LYS HG3 H 1.423 0.02 2 584 . 52 LYS CD C 29.222 0.2 1 585 . 52 LYS HD2 H 1.520 0.02 2 586 . 52 LYS HD3 H 1.625 0.02 2 587 . 52 LYS CE C 42.089 0.2 1 588 . 52 LYS HE2 H 2.763 0.02 1 589 . 52 LYS HE3 H 2.763 0.02 1 590 . 52 LYS C C 175.817 0.2 1 591 . 53 LYS N N 122.749 0.15 1 592 . 53 LYS H H 8.602 0.02 1 593 . 53 LYS CA C 59.056 0.2 1 594 . 53 LYS HA H 4.058 0.02 1 595 . 53 LYS CB C 31.339 0.2 1 596 . 53 LYS HB2 H 1.757 0.02 1 597 . 53 LYS HB3 H 1.757 0.02 1 598 . 53 LYS CG C 24.673 0.2 1 599 . 53 LYS HG2 H 1.308 0.02 2 600 . 53 LYS HG3 H 1.415 0.02 2 601 . 53 LYS CD C 29.223 0.2 1 602 . 53 LYS HD2 H 1.649 0.02 1 603 . 53 LYS HD3 H 1.649 0.02 1 604 . 53 LYS CE C 42.037 0.2 1 605 . 53 LYS HE2 H 2.930 0.02 1 606 . 53 LYS HE3 H 2.930 0.02 1 607 . 53 LYS C C 178.147 0.2 1 608 . 54 GLY N N 114.173 0.15 1 609 . 54 GLY H H 9.003 0.02 1 610 . 54 GLY CA C 46.427 0.2 1 611 . 54 GLY HA2 H 3.865 0.02 1 612 . 54 GLY HA3 H 3.865 0.02 1 613 . 54 GLY C C 174.247 0.2 1 614 . 55 TYR N N 124.348 0.15 1 615 . 55 TYR H H 8.128 0.02 1 616 . 55 TYR CA C 57.144 0.2 1 617 . 55 TYR HA H 5.752 0.02 1 618 . 55 TYR CB C 41.767 0.2 1 619 . 55 TYR HB2 H 2.279 0.02 2 620 . 55 TYR HB3 H 2.982 0.02 2 621 . 55 TYR CD1 C 132.715 0.2 1 622 . 55 TYR HD1 H 6.580 0.02 1 623 . 55 TYR CE1 C 117.238 0.2 1 624 . 55 TYR HE1 H 6.303 0.02 1 625 . 55 TYR CE2 C 117.238 0.2 1 626 . 55 TYR HE2 H 6.303 0.02 1 627 . 55 TYR CD2 C 132.715 0.2 1 628 . 55 TYR HD2 H 6.580 0.02 1 629 . 55 TYR C C 172.507 0.2 1 630 . 56 VAL N N 125.678 0.15 1 631 . 56 VAL H H 7.953 0.02 1 632 . 56 VAL CA C 60.611 0.2 1 633 . 56 VAL HA H 4.032 0.02 1 634 . 56 VAL CB C 35.947 0.2 1 635 . 56 VAL HB H 1.243 0.02 1 636 . 56 VAL HG1 H 0.183 0.02 2 637 . 56 VAL HG2 H 0.493 0.02 2 638 . 56 VAL CG1 C 22.275 0.2 2 639 . 56 VAL CG2 C 21.845 0.2 2 640 . 56 VAL C C 170.807 0.2 1 641 . 57 LEU N N 126.561 0.15 1 642 . 57 LEU H H 7.896 0.02 1 643 . 57 LEU CA C 53.385 0.2 1 644 . 57 LEU HA H 4.919 0.02 1 645 . 57 LEU CB C 44.577 0.2 1 646 . 57 LEU HB2 H 1.306 0.02 2 647 . 57 LEU HB3 H 1.561 0.02 2 648 . 57 LEU CG C 28.718 0.2 1 649 . 57 LEU HG H 1.206 0.02 1 650 . 57 LEU HD1 H 0.738 0.02 2 651 . 57 LEU HD2 H 0.787 0.02 2 652 . 57 LEU CD1 C 24.944 0.2 2 653 . 57 LEU CD2 C 24.175 0.2 2 654 . 57 LEU C C 174.867 0.2 1 655 . 58 PHE N N 125.788 0.15 1 656 . 58 PHE H H 9.000 0.02 1 657 . 58 PHE CA C 55.677 0.2 1 658 . 58 PHE HA H 5.752 0.02 1 659 . 58 PHE CB C 44.731 0.2 1 660 . 58 PHE HB2 H 2.380 0.02 2 661 . 58 PHE HB3 H 3.176 0.02 2 662 . 58 PHE CD1 C 130.697 0.2 1 663 . 58 PHE HD1 H 7.167 0.02 1 664 . 58 PHE HE1 H 7.470 0.02 1 665 . 58 PHE HE2 H 7.470 0.02 1 666 . 58 PHE CD2 C 130.697 0.2 1 667 . 58 PHE HD2 H 7.167 0.02 1 668 . 58 PHE C C 174.677 0.2 1 669 . 59 ARG N N 120.796 0.15 1 670 . 59 ARG H H 9.527 0.02 1 671 . 59 ARG CA C 54.428 0.2 1 672 . 59 ARG HA H 6.090 0.02 1 673 . 59 ARG CB C 36.383 0.2 1 674 . 59 ARG HB2 H 1.571 0.02 2 675 . 59 ARG HB3 H 1.720 0.02 2 676 . 59 ARG CG C 28.397 0.2 1 677 . 59 ARG HG2 H 1.597 0.02 2 678 . 59 ARG HG3 H 1.600 0.02 2 679 . 59 ARG CD C 43.626 0.2 1 680 . 59 ARG HD2 H 3.073 0.02 2 681 . 59 ARG HD3 H 3.163 0.02 2 682 . 59 ARG NE N 83.632 0.15 1 683 . 59 ARG HE H 7.281 0.02 1 684 . 59 ARG C C 175.117 0.2 1 685 . 60 LYS N N 124.684 0.15 1 686 . 60 LYS H H 8.883 0.02 1 687 . 60 LYS CA C 55.651 0.2 1 688 . 60 LYS HA H 4.504 0.02 1 689 . 60 LYS CB C 36.830 0.2 1 690 . 60 LYS HB2 H 0.815 0.02 2 691 . 60 LYS HB3 H 0.904 0.02 2 692 . 60 LYS CG C 24.827 0.2 1 693 . 60 LYS HG2 H 0.710 0.02 1 694 . 60 LYS HG3 H 0.710 0.02 1 695 . 60 LYS CD C 28.899 0.2 1 696 . 60 LYS HD2 H 0.490 0.02 2 697 . 60 LYS HD3 H 0.102 0.02 2 698 . 60 LYS CE C 40.868 0.2 1 699 . 60 LYS HE2 H 1.613 0.02 2 700 . 60 LYS HE3 H 1.847 0.02 2 701 . 60 LYS C C 174.267 0.2 1 702 . 61 GLN N N 123.433 0.15 1 703 . 61 GLN H H 8.459 0.02 1 704 . 61 GLN CA C 54.665 0.2 1 705 . 61 GLN HA H 4.454 0.02 1 706 . 61 GLN CB C 28.296 0.2 1 707 . 61 GLN HB2 H 1.831 0.02 2 708 . 61 GLN HB3 H 1.990 0.02 2 709 . 61 GLN CG C 33.571 0.2 1 710 . 61 GLN HG2 H 2.213 0.02 1 711 . 61 GLN HG3 H 2.213 0.02 1 712 . 61 GLN NE2 N 110.851 0.15 1 713 . 61 GLN HE21 H 6.491 0.02 2 714 . 61 GLN HE22 H 7.420 0.02 2 715 . 61 GLN C C 175.537 0.2 1 716 . 62 MET HE H 1.884 0.02 1 717 . 62 MET CE C 16.195 0.2 1 718 . 63 ASP CA C 52.687 0.2 1 719 . 63 ASP HA H 4.790 0.02 1 720 . 63 ASP CB C 39.297 0.2 1 721 . 63 ASP HB2 H 2.480 0.02 2 722 . 63 ASP HB3 H 2.670 0.02 2 723 . 64 ASP N N 113.923 0.15 1 724 . 64 ASP H H 7.749 0.02 1 725 . 64 ASP CA C 52.197 0.2 1 726 . 64 ASP HA H 4.764 0.02 1 727 . 64 ASP CB C 43.349 0.2 1 728 . 64 ASP HB2 H 2.633 0.02 2 729 . 64 ASP HB3 H 2.713 0.02 2 730 . 64 ASP C C 173.777 0.2 1 731 . 65 ILE N N 115.211 0.15 1 732 . 65 ILE H H 9.353 0.02 1 733 . 65 ILE CA C 61.480 0.2 1 734 . 65 ILE HA H 4.316 0.02 1 735 . 65 ILE CB C 38.327 0.2 1 736 . 65 ILE HB H 2.189 0.02 1 737 . 65 ILE HG2 H 0.554 0.02 1 738 . 65 ILE CG2 C 18.926 0.2 1 739 . 65 ILE CG1 C 25.487 0.2 1 740 . 65 ILE HG12 H 0.719 0.02 2 741 . 65 ILE HG13 H 1.191 0.02 2 742 . 65 ILE HD1 H 0.531 0.02 1 743 . 65 ILE CD1 C 13.809 0.2 1 744 . 65 ILE C C 173.767 0.2 1 745 . 66 SER N N 119.140 0.15 1 746 . 66 SER H H 9.293 0.02 1 747 . 66 SER CA C 56.666 0.2 1 748 . 66 SER HA H 2.839 0.02 1 749 . 66 SER CB C 63.277 0.2 1 750 . 66 SER HB2 H 3.766 0.02 2 751 . 66 SER HB3 H 3.851 0.02 2 752 . 66 SER C C 174.067 0.2 1 753 . 67 PRO CD C 50.222 0.2 1 754 . 67 PRO CA C 65.389 0.2 1 755 . 67 PRO HA H 3.923 0.02 1 756 . 67 PRO CB C 31.877 0.2 1 757 . 67 PRO HB2 H 1.770 0.02 2 758 . 67 PRO HB3 H 2.271 0.02 2 759 . 67 PRO CG C 27.779 0.2 1 760 . 67 PRO HG2 H 1.932 0.02 2 761 . 67 PRO HG3 H 2.024 0.02 2 762 . 67 PRO HD2 H 3.129 0.02 2 763 . 67 PRO HD3 H 3.327 0.02 2 764 . 67 PRO C C 179.847 0.2 1 765 . 68 LEU N N 115.879 0.15 1 766 . 68 LEU H H 7.796 0.02 1 767 . 68 LEU CA C 56.869 0.2 1 768 . 68 LEU HA H 4.025 0.02 1 769 . 68 LEU CB C 41.209 0.2 1 770 . 68 LEU HB2 H 0.958 0.02 2 771 . 68 LEU HB3 H 1.287 0.02 2 772 . 68 LEU CG C 27.036 0.2 1 773 . 68 LEU HG H 1.345 0.02 1 774 . 68 LEU HD1 H 0.539 0.02 2 775 . 68 LEU HD2 H 0.737 0.02 2 776 . 68 LEU CD1 C 23.476 0.2 2 777 . 68 LEU CD2 C 23.873 0.2 2 778 . 68 LEU C C 179.887 0.2 1 779 . 69 SER N N 119.863 0.15 1 780 . 69 SER H H 7.957 0.02 1 781 . 69 SER CA C 61.103 0.2 1 782 . 69 SER HA H 3.958 0.02 1 783 . 69 SER CB C 62.797 0.2 1 784 . 69 SER C C 175.097 0.2 1 785 . 70 LYS N N 117.711 0.15 1 786 . 70 LYS H H 7.339 0.02 1 787 . 70 LYS CA C 59.183 0.2 1 788 . 70 LYS HA H 4.046 0.02 1 789 . 70 LYS CB C 32.137 0.2 1 790 . 70 LYS HB2 H 1.763 0.02 2 791 . 70 LYS HB3 H 1.909 0.02 2 792 . 70 LYS CG C 27.071 0.2 1 793 . 70 LYS HG2 H 1.222 0.02 2 794 . 70 LYS CD C 29.854 0.2 1 795 . 70 LYS HD2 H 1.415 0.02 2 796 . 70 LYS HD3 H 1.624 0.02 2 797 . 70 LYS CE C 42.836 0.2 1 798 . 70 LYS HE2 H 2.657 0.02 2 799 . 70 LYS HE3 H 2.853 0.02 2 800 . 70 LYS C C 175.897 0.2 1 801 . 71 VAL N N 113.787 0.15 1 802 . 71 VAL H H 7.156 0.02 1 803 . 71 VAL CA C 63.273 0.2 1 804 . 71 VAL HA H 4.086 0.02 1 805 . 71 VAL CB C 32.896 0.2 1 806 . 71 VAL HB H 2.111 0.02 1 807 . 71 VAL HG1 H 0.837 0.02 2 808 . 71 VAL HG2 H 0.879 0.02 2 809 . 71 VAL CG1 C 21.101 0.2 2 810 . 71 VAL CG2 C 20.937 0.2 2 811 . 71 VAL C C 177.617 0.2 1 812 . 72 ASN N N 116.159 0.15 1 813 . 72 ASN H H 7.948 0.02 1 814 . 72 ASN CA C 52.057 0.2 1 815 . 72 ASN HA H 4.761 0.02 1 816 . 72 ASN CB C 39.879 0.2 1 817 . 72 ASN HB2 H 2.549 0.02 2 818 . 72 ASN HB3 H 2.898 0.02 2 819 . 72 ASN C C 175.507 0.2 1 820 . 73 GLY N N 109.274 0.15 1 821 . 73 GLY H H 8.679 0.02 1 822 . 73 GLY CA C 46.665 0.2 1 823 . 73 GLY HA2 H 3.911 0.02 2 824 . 73 GLY HA3 H 4.136 0.02 2 825 . 73 GLY C C 172.647 0.2 1 826 . 74 TYR N N 128.742 0.15 1 827 . 74 TYR H H 9.758 0.02 1 828 . 74 TYR CA C 58.262 0.2 1 829 . 74 TYR HA H 5.291 0.02 1 830 . 74 TYR CB C 44.400 0.2 1 831 . 74 TYR HB2 H 2.502 0.02 2 832 . 74 TYR HB3 H 2.864 0.02 2 833 . 74 TYR HD1 H 6.750 0.02 1 834 . 74 TYR HE1 H 6.580 0.02 1 835 . 74 TYR HE2 H 6.580 0.02 1 836 . 74 TYR HD2 H 6.750 0.02 1 837 . 74 TYR C C 175.567 0.2 1 838 . 75 ILE N N 122.911 0.15 1 839 . 75 ILE H H 9.886 0.02 1 840 . 75 ILE CA C 60.060 0.2 1 841 . 75 ILE HA H 5.273 0.02 1 842 . 75 ILE CB C 40.496 0.2 1 843 . 75 ILE HB H 1.756 0.02 1 844 . 75 ILE HG2 H 0.855 0.02 1 845 . 75 ILE CG2 C 17.707 0.2 1 846 . 75 ILE CG1 C 29.418 0.2 1 847 . 75 ILE HG12 H 1.037 0.02 2 848 . 75 ILE HG13 H 1.791 0.02 2 849 . 75 ILE HD1 H 0.483 0.02 1 850 . 75 ILE CD1 C 13.941 0.2 1 851 . 75 ILE C C 175.157 0.2 1 852 . 76 GLY N N 113.775 0.15 1 853 . 76 GLY H H 9.061 0.02 1 854 . 76 GLY CA C 44.771 0.2 1 855 . 76 GLY HA2 H 3.830 0.02 2 856 . 76 GLY HA3 H 4.964 0.02 2 857 . 76 GLY C C 171.267 0.2 1 858 . 77 VAL N N 118.433 0.15 1 859 . 77 VAL H H 8.919 0.02 1 860 . 77 VAL CA C 58.519 0.2 1 861 . 77 VAL HA H 5.399 0.02 1 862 . 77 VAL CB C 36.061 0.2 1 863 . 77 VAL HB H 1.735 0.02 1 864 . 77 VAL HG1 H 0.761 0.02 2 865 . 77 VAL HG2 H 0.962 0.02 2 866 . 77 VAL CG1 C 20.628 0.2 2 867 . 77 VAL CG2 C 21.527 0.2 2 868 . 77 VAL C C 174.087 0.2 1 869 . 78 SER N N 120.507 0.15 1 870 . 78 SER H H 8.398 0.02 1 871 . 78 SER CA C 56.857 0.2 1 872 . 78 SER HA H 4.807 0.02 1 873 . 78 SER CB C 65.752 0.2 1 874 . 78 SER HB2 H 4.032 0.02 2 875 . 78 SER HB3 H 4.314 0.02 2 876 . 78 SER C C 175.367 0.2 1 877 . 79 ASP N N 119.844 0.15 1 878 . 79 ASP H H 8.865 0.02 1 879 . 79 ASP CA C 56.447 0.2 1 880 . 79 ASP HA H 4.321 0.02 1 881 . 79 ASP CB C 40.237 0.2 1 882 . 79 ASP HB2 H 2.659 0.02 1 883 . 79 ASP HB3 H 2.659 0.02 1 884 . 79 ASP C C 176.277 0.2 1 885 . 80 ASN N N 114.625 0.15 1 886 . 80 ASN H H 8.009 0.02 1 887 . 80 ASN CA C 52.466 0.2 1 888 . 80 ASN HA H 4.812 0.02 1 889 . 80 ASN CB C 38.189 0.2 1 890 . 80 ASN HB2 H 2.790 0.02 2 891 . 80 ASN HB3 H 2.850 0.02 2 892 . 80 ASN ND2 N 112.177 0.15 1 893 . 80 ASN HD21 H 6.862 0.02 2 894 . 80 ASN HD22 H 7.507 0.02 2 895 . 80 ASN C C 175.557 0.2 1 896 . 81 GLY N N 107.073 0.15 1 897 . 81 GLY H H 8.061 0.02 1 898 . 81 GLY CA C 46.177 0.2 1 899 . 81 GLY HA2 H 3.409 0.02 2 900 . 81 GLY HA3 H 4.483 0.02 2 901 . 81 GLY C C 173.297 0.2 1 902 . 82 VAL N N 119.825 0.15 1 903 . 82 VAL H H 7.783 0.02 1 904 . 82 VAL CA C 63.287 0.2 1 905 . 82 VAL HA H 4.089 0.02 1 906 . 82 VAL CB C 31.987 0.2 1 907 . 82 VAL HB H 1.996 0.02 1 908 . 82 VAL HG1 H 0.729 0.02 2 909 . 82 VAL HG2 H 0.786 0.02 2 910 . 82 VAL CG1 C 21.748 0.2 2 911 . 82 VAL CG2 C 22.017 0.2 2 912 . 82 VAL C C 176.897 0.2 1 913 . 83 ILE N N 132.323 0.15 1 914 . 83 ILE H H 8.756 0.02 1 915 . 83 ILE CA C 58.951 0.2 1 916 . 83 ILE HA H 4.661 0.02 1 917 . 83 ILE CB C 36.096 0.2 1 918 . 83 ILE HB H 1.471 0.02 1 919 . 83 ILE HG2 H 0.542 0.02 1 920 . 83 ILE CG2 C 16.583 0.2 1 921 . 83 ILE CG1 C 27.187 0.2 1 922 . 83 ILE HG12 H 1.117 0.02 2 923 . 83 ILE HG13 H 1.510 0.02 2 924 . 83 ILE HD1 H 0.617 0.02 1 925 . 83 ILE CD1 C 10.612 0.2 1 926 . 83 ILE C C 175.197 0.2 1 927 . 84 SER N N 122.299 0.15 1 928 . 84 SER H H 8.833 0.02 1 929 . 84 SER CA C 57.397 0.2 1 930 . 84 SER HA H 5.735 0.02 1 931 . 84 SER CB C 67.777 0.2 1 932 . 84 SER HB2 H 3.202 0.02 2 933 . 84 SER HB3 H 3.545 0.02 2 934 . 84 SER C C 172.137 0.2 1 935 . 85 THR N N 109.835 0.15 1 936 . 85 THR H H 8.462 0.02 1 937 . 85 THR CA C 59.360 0.2 1 938 . 85 THR HA H 5.344 0.02 1 939 . 85 THR CB C 70.942 0.2 1 940 . 85 THR HB H 4.531 0.02 1 941 . 85 THR HG2 H 1.430 0.02 1 942 . 85 THR CG2 C 26.331 0.2 1 943 . 85 THR C C 173.807 0.2 1 944 . 86 PHE N N 117.644 0.15 1 945 . 86 PHE H H 9.361 0.02 1 946 . 86 PHE CA C 57.997 0.2 1 947 . 86 PHE HA H 4.995 0.02 1 948 . 86 PHE CB C 44.296 0.2 1 949 . 86 PHE HB2 H 2.509 0.02 2 950 . 86 PHE HB3 H 2.859 0.02 2 951 . 86 PHE CD1 C 131.587 0.2 1 952 . 86 PHE HD1 H 7.039 0.02 1 953 . 86 PHE CD2 C 131.587 0.2 1 954 . 86 PHE HD2 H 7.039 0.02 1 955 . 86 PHE C C 175.427 0.2 1 956 . 87 HIS N N 118.532 0.15 1 957 . 87 HIS H H 8.793 0.02 1 958 . 87 HIS CA C 54.880 0.2 1 959 . 87 HIS HA H 4.937 0.02 1 960 . 87 HIS CB C 29.775 0.2 1 961 . 87 HIS HB2 H 2.967 0.02 2 962 . 87 HIS HB3 H 3.140 0.02 2 963 . 87 HIS C C 175.717 0.2 1 964 . 88 GLY N N 114.310 0.15 1 965 . 88 GLY H H 8.788 0.02 1 966 . 88 GLY CA C 43.582 0.2 1 967 . 88 GLY HA2 H 3.716 0.02 2 968 . 88 GLY HA3 H 4.299 0.02 2 969 . 88 GLY C C 170.727 0.2 1 970 . 89 ARG N N 118.191 0.15 1 971 . 89 ARG H H 7.692 0.02 1 972 . 89 ARG CA C 54.646 0.2 1 973 . 89 ARG HA H 2.576 0.02 1 974 . 89 ARG CB C 29.165 0.2 1 975 . 89 ARG HB2 H 1.209 0.02 2 976 . 89 ARG HB3 H 1.291 0.02 2 977 . 89 ARG CG C 27.490 0.2 1 978 . 89 ARG HG2 H 0.985 0.02 2 979 . 89 ARG HG3 H 1.180 0.02 2 980 . 89 ARG CD C 43.411 0.2 1 981 . 89 ARG HD2 H 2.957 0.02 2 982 . 89 ARG HD3 H 2.990 0.02 2 983 . 89 ARG C C 175.507 0.2 1 984 . 90 PRO CD C 49.797 0.2 1 985 . 90 PRO CA C 63.003 0.2 1 986 . 90 PRO HA H 3.436 0.02 1 987 . 90 PRO CB C 29.933 0.2 1 988 . 90 PRO HB2 H 0.286 0.02 2 989 . 90 PRO HB3 H 1.255 0.02 2 990 . 90 PRO CG C 27.502 0.2 1 991 . 90 PRO HG2 H 1.034 0.02 2 992 . 90 PRO HG3 H 1.560 0.02 2 993 . 90 PRO HD2 H 2.847 0.02 2 994 . 90 PRO HD3 H 3.076 0.02 2 995 . 90 PRO C C 175.277 0.2 1 996 . 91 GLU N N 123.439 0.15 1 997 . 91 GLU H H 8.081 0.02 1 998 . 91 GLU CA C 54.026 0.2 1 999 . 91 GLU HA H 4.571 0.02 1 1000 . 91 GLU CB C 30.101 0.2 1 1001 . 91 GLU HB2 H 1.708 0.02 2 1002 . 91 GLU HB3 H 2.091 0.02 2 1003 . 91 GLU CG C 35.911 0.2 1 1004 . 91 GLU HG2 H 2.058 0.02 2 1005 . 91 GLU HG3 H 2.070 0.02 2 1006 . 91 GLU C C 175.337 0.2 1 1007 . 92 PRO CD C 50.427 0.2 1 1008 . 92 PRO CA C 66.083 0.2 1 1009 . 92 PRO HA H 4.236 0.02 1 1010 . 92 PRO CB C 31.510 0.2 1 1011 . 92 PRO HB2 H 1.826 0.02 2 1012 . 92 PRO HB3 H 2.330 0.02 2 1013 . 92 PRO CG C 27.827 0.2 1 1014 . 92 PRO HG2 H 1.931 0.02 2 1015 . 92 PRO HG3 H 2.090 0.02 2 1016 . 92 PRO HD2 H 3.710 0.02 1 1017 . 92 PRO HD3 H 3.710 0.02 1 1018 . 92 PRO C C 177.377 0.2 1 1019 . 93 ALA N N 116.764 0.15 1 1020 . 93 ALA H H 8.148 0.02 1 1021 . 93 ALA CA C 52.157 0.2 1 1022 . 93 ALA HA H 4.361 0.02 1 1023 . 93 ALA HB H 1.388 0.02 1 1024 . 93 ALA CB C 18.505 0.2 1 1025 . 93 ALA C C 177.947 0.2 1 1026 . 94 SER N N 116.856 0.15 1 1027 . 94 SER H H 8.044 0.02 1 1028 . 94 SER CA C 60.242 0.2 1 1029 . 94 SER HA H 4.335 0.02 1 1030 . 94 SER CB C 63.717 0.2 1 1031 . 94 SER HB2 H 3.792 0.02 2 1032 . 94 SER HB3 H 4.010 0.02 2 1033 . 94 SER C C 173.627 0.2 1 1034 . 95 GLU N N 125.469 0.15 1 1035 . 95 GLU H H 8.806 0.02 1 1036 . 95 GLU CA C 53.237 0.2 1 1037 . 95 GLU HA H 4.806 0.02 1 1038 . 95 GLU CB C 30.555 0.2 1 1039 . 95 GLU HB2 H 1.924 0.02 2 1040 . 95 GLU HB3 H 1.992 0.02 2 1041 . 95 GLU CG C 35.818 0.2 1 1042 . 95 GLU HG2 H 2.247 0.02 2 1043 . 95 GLU HG3 H 2.304 0.02 2 1044 . 95 GLU C C 174.007 0.2 1 1045 . 96 PRO CD C 50.923 0.2 1 1046 . 96 PRO CA C 62.100 0.2 1 1047 . 96 PRO HA H 3.804 0.02 1 1048 . 96 PRO CB C 32.367 0.2 1 1049 . 96 PRO HB2 H 1.345 0.02 2 1050 . 96 PRO HB3 H 1.340 0.02 2 1051 . 96 PRO CG C 26.687 0.2 1 1052 . 96 PRO HG2 H 1.743 0.02 2 1053 . 96 PRO HG3 H 1.736 0.02 2 1054 . 96 PRO HD2 H 3.693 0.02 1 1055 . 96 PRO HD3 H 3.693 0.02 1 1056 . 96 PRO C C 176.937 0.2 1 1057 . 97 ILE N N 123.411 0.15 1 1058 . 97 ILE H H 8.732 0.02 1 1059 . 97 ILE CA C 63.147 0.2 1 1060 . 97 ILE HA H 3.632 0.02 1 1061 . 97 ILE CB C 36.566 0.2 1 1062 . 97 ILE HB H 1.850 0.02 1 1063 . 97 ILE HG2 H 0.575 0.02 1 1064 . 97 ILE CG2 C 17.312 0.2 1 1065 . 97 ILE CG1 C 27.407 0.2 1 1066 . 97 ILE HG12 H 0.738 0.02 2 1067 . 97 ILE HG13 H 0.988 0.02 2 1068 . 97 ILE HD1 H 0.072 0.02 1 1069 . 97 ILE CD1 C 11.655 0.2 1 1070 . 97 ILE C C 176.727 0.2 1 1071 . 98 GLN N N 115.134 0.15 1 1072 . 98 GLN H H 6.894 0.02 1 1073 . 98 GLN CA C 54.238 0.2 1 1074 . 98 GLN HA H 4.294 0.02 1 1075 . 98 GLN CB C 32.507 0.2 1 1076 . 98 GLN HB2 H 1.613 0.02 2 1077 . 98 GLN HB3 H 1.967 0.02 2 1078 . 98 GLN CG C 33.314 0.2 1 1079 . 98 GLN HG2 H 1.625 0.02 2 1080 . 98 GLN HG3 H 1.726 0.02 2 1081 . 98 GLN NE2 N 111.787 0.15 1 1082 . 98 GLN HE21 H 6.653 0.02 2 1083 . 98 GLN HE22 H 6.778 0.02 2 1084 . 98 GLN C C 172.977 0.2 1 1085 . 99 SER N N 120.289 0.15 1 1086 . 99 SER H H 8.383 0.02 1 1087 . 99 SER CA C 57.547 0.2 1 1088 . 99 SER HA H 5.068 0.02 1 1089 . 99 SER CB C 64.694 0.2 1 1090 . 99 SER HB2 H 3.390 0.02 2 1091 . 99 SER HB3 H 3.568 0.02 2 1092 . 99 SER C C 173.687 0.2 1 1093 . 100 PHE N N 122.176 0.15 1 1094 . 100 PHE H H 8.985 0.02 1 1095 . 100 PHE CA C 59.822 0.2 1 1096 . 100 PHE HA H 4.408 0.02 1 1097 . 100 PHE CB C 39.687 0.2 1 1098 . 100 PHE HB2 H 2.109 0.02 2 1099 . 100 PHE HB3 H 2.957 0.02 2 1100 . 100 PHE CD1 C 131.062 0.2 1 1101 . 100 PHE HD1 H 7.170 0.02 1 1102 . 100 PHE CE1 C 131.847 0.2 1 1103 . 100 PHE HE1 H 7.447 0.02 1 1104 . 100 PHE CE2 C 131.847 0.2 1 1105 . 100 PHE HE2 H 7.447 0.02 1 1106 . 100 PHE CD2 C 131.062 0.2 1 1107 . 100 PHE HD2 H 7.170 0.02 1 1108 . 100 PHE C C 174.187 0.2 1 1109 . 101 PHE N N 112.863 0.15 1 1110 . 101 PHE H H 6.440 0.02 1 1111 . 101 PHE CA C 54.991 0.2 1 1112 . 101 PHE HA H 4.841 0.02 1 1113 . 101 PHE CB C 39.757 0.2 1 1114 . 101 PHE HB2 H 3.234 0.02 2 1115 . 101 PHE HB3 H 3.449 0.02 2 1116 . 101 PHE CD1 C 132.912 0.2 1 1117 . 101 PHE HD1 H 7.064 0.02 1 1118 . 101 PHE CE1 C 130.987 0.2 1 1119 . 101 PHE HE1 H 7.170 0.02 1 1120 . 101 PHE CE2 C 130.987 0.2 1 1121 . 101 PHE HE2 H 7.170 0.02 1 1122 . 101 PHE CD2 C 132.912 0.2 1 1123 . 101 PHE HD2 H 7.064 0.02 1 1124 . 101 PHE C C 172.747 0.2 1 1125 . 102 GLN N N 121.161 0.15 1 1126 . 102 GLN H H 8.935 0.02 1 1127 . 102 GLN CA C 54.957 0.2 1 1128 . 102 GLN HA H 4.933 0.02 1 1129 . 102 GLN CB C 31.006 0.2 1 1130 . 102 GLN HB2 H 1.878 0.02 2 1131 . 102 GLN HB3 H 2.100 0.02 2 1132 . 102 GLN CG C 34.011 0.2 1 1133 . 102 GLN HG2 H 2.270 0.02 2 1134 . 102 GLN HG3 H 2.346 0.02 2 1135 . 102 GLN NE2 N 111.908 0.15 1 1136 . 102 GLN HE21 H 6.818 0.02 2 1137 . 102 GLN HE22 H 7.611 0.02 2 1138 . 102 GLN C C 175.797 0.2 1 1139 . 103 ILE N N 120.209 0.15 1 1140 . 103 ILE H H 8.970 0.02 1 1141 . 103 ILE CA C 59.304 0.2 1 1142 . 103 ILE HA H 4.797 0.02 1 1143 . 103 ILE CB C 42.172 0.2 1 1144 . 103 ILE HB H 1.719 0.02 1 1145 . 103 ILE HG2 H 1.011 0.02 1 1146 . 103 ILE CG2 C 19.407 0.2 1 1147 . 103 ILE CG1 C 25.816 0.2 1 1148 . 103 ILE HG12 H 1.117 0.02 2 1149 . 103 ILE HG13 H 1.245 0.02 2 1150 . 103 ILE HD1 H 0.731 0.02 1 1151 . 103 ILE CD1 C 15.976 0.2 1 1152 . 103 ILE C C 174.107 0.2 1 1153 . 104 ASP N N 119.781 0.15 1 1154 . 104 ASP H H 7.789 0.02 1 1155 . 104 ASP CA C 52.169 0.2 1 1156 . 104 ASP HA H 4.786 0.02 1 1157 . 104 ASP CB C 40.477 0.2 1 1158 . 104 ASP HB2 H 2.566 0.02 2 1159 . 104 ASP HB3 H 2.824 0.02 2 1160 . 104 ASP C C 176.717 0.2 1 1161 . 105 LEU N N 125.747 0.15 1 1162 . 105 LEU H H 8.452 0.02 1 1163 . 105 LEU CA C 57.892 0.2 1 1164 . 105 LEU HA H 3.714 0.02 1 1165 . 105 LEU CB C 42.537 0.2 1 1166 . 105 LEU HB2 H 1.510 0.02 2 1167 . 105 LEU HB3 H 1.635 0.02 2 1168 . 105 LEU CG C 27.612 0.2 1 1169 . 105 LEU HG H 1.626 0.02 1 1170 . 105 LEU HD1 H 0.804 0.02 2 1171 . 105 LEU HD2 H 0.877 0.02 2 1172 . 105 LEU CD1 C 24.617 0.2 2 1173 . 105 LEU CD2 C 25.261 0.2 2 1174 . 105 LEU C C 178.477 0.2 1 1175 . 106 GLU N N 114.266 0.15 1 1176 . 106 GLU H H 8.140 0.02 1 1177 . 106 GLU CA C 57.820 0.2 1 1178 . 106 GLU HA H 3.958 0.02 1 1179 . 106 GLU CB C 29.207 0.2 1 1180 . 106 GLU HB2 H 2.039 0.02 1 1181 . 106 GLU HB3 H 2.039 0.02 1 1182 . 106 GLU CG C 36.628 0.2 1 1183 . 106 GLU HG2 H 2.197 0.02 2 1184 . 106 GLU HG3 H 2.318 0.02 2 1185 . 106 GLU C C 177.657 0.2 1 1186 . 107 ARG N N 116.039 0.15 1 1187 . 107 ARG H H 7.530 0.02 1 1188 . 107 ARG CA C 56.387 0.2 1 1189 . 107 ARG HA H 4.194 0.02 1 1190 . 107 ARG CB C 31.337 0.2 1 1191 . 107 ARG HB2 H 1.860 0.02 2 1192 . 107 ARG HB3 H 2.131 0.02 2 1193 . 107 ARG CG C 27.975 0.2 1 1194 . 107 ARG HG2 H 1.666 0.02 2 1195 . 107 ARG HG3 H 1.752 0.02 2 1196 . 107 ARG CD C 43.790 0.2 1 1197 . 107 ARG HD2 H 3.291 0.02 1 1198 . 107 ARG HD3 H 3.291 0.02 1 1199 . 107 ARG NE N 84.494 0.15 1 1200 . 107 ARG HE H 7.481 0.02 1 1201 . 107 ARG C C 176.307 0.2 1 1202 . 108 LEU N N 119.229 0.15 1 1203 . 108 LEU H H 7.016 0.02 1 1204 . 108 LEU CA C 55.068 0.2 1 1205 . 108 LEU HA H 3.825 0.02 1 1206 . 108 LEU CB C 43.091 0.2 1 1207 . 108 LEU HB2 H 1.278 0.02 2 1208 . 108 LEU HB3 H 1.465 0.02 2 1209 . 108 LEU CG C 27.558 0.2 1 1210 . 108 LEU HG H 1.159 0.02 1 1211 . 108 LEU HD1 H 0.196 0.02 2 1212 . 108 LEU HD2 H 0.453 0.02 2 1213 . 108 LEU CD1 C 24.282 0.2 2 1214 . 108 LEU CD2 C 26.370 0.2 2 1215 . 108 LEU C C 176.877 0.2 1 1216 . 109 GLU N N 122.627 0.15 1 1217 . 109 GLU H H 8.486 0.02 1 1218 . 109 GLU CA C 57.184 0.2 1 1219 . 109 GLU HA H 4.168 0.02 1 1220 . 109 GLU CB C 30.163 0.2 1 1221 . 109 GLU HB2 H 1.776 0.02 2 1222 . 109 GLU HB3 H 2.198 0.02 2 1223 . 109 GLU CG C 36.690 0.2 1 1224 . 109 GLU HG2 H 2.476 0.02 2 1225 . 109 GLU HG3 H 2.521 0.02 2 1226 . 109 GLU C C 178.497 0.2 1 1227 . 110 SER N N 118.983 0.15 1 1228 . 110 SER H H 8.865 0.02 1 1229 . 110 SER CA C 57.150 0.2 1 1230 . 110 SER HA H 4.700 0.02 1 1231 . 110 SER CB C 62.668 0.2 1 1232 . 110 SER HB2 H 3.891 0.02 2 1233 . 111 HIS CA C 59.439 0.2 1 1234 . 111 HIS HA H 4.291 0.02 1 1235 . 111 HIS CB C 29.117 0.2 1 1236 . 111 HIS HB2 H 3.098 0.02 2 1237 . 111 HIS HB3 H 3.223 0.02 2 1238 . 111 HIS C C 177.357 0.2 1 1239 . 112 MET N N 120.217 0.15 1 1240 . 112 MET H H 6.948 0.02 1 1241 . 112 MET CA C 56.497 0.2 1 1242 . 112 MET HA H 4.306 0.02 1 1243 . 112 MET CB C 31.787 0.2 1 1244 . 112 MET HB2 H 2.360 0.02 2 1245 . 112 MET HB3 H 2.412 0.02 2 1246 . 112 MET CG C 31.727 0.2 1 1247 . 112 MET HG2 H 1.930 0.02 1 1248 . 112 MET HG3 H 1.930 0.02 1 1249 . 112 MET HE H 2.004 0.02 1 1250 . 112 MET CE C 16.758 0.2 1 1251 . 112 MET C C 177.937 0.2 1 1252 . 113 GLN N N 119.441 0.15 1 1253 . 113 GLN H H 8.234 0.02 1 1254 . 113 GLN CA C 60.031 0.2 1 1255 . 113 GLN HA H 3.602 0.02 1 1256 . 113 GLN CB C 28.614 0.2 1 1257 . 113 GLN HB2 H 2.002 0.02 2 1258 . 113 GLN HB3 H 2.069 0.02 2 1259 . 113 GLN CG C 34.413 0.2 1 1260 . 113 GLN HG2 H 2.063 0.02 2 1261 . 113 GLN HG3 H 2.224 0.02 2 1262 . 113 GLN NE2 N 111.803 0.15 1 1263 . 113 GLN HE21 H 6.767 0.02 2 1264 . 113 GLN HE22 H 7.152 0.02 2 1265 . 113 GLN C C 177.427 0.2 1 1266 . 114 LYS N N 115.810 0.15 1 1267 . 114 LYS H H 7.679 0.02 1 1268 . 114 LYS CA C 59.325 0.2 1 1269 . 114 LYS HA H 3.867 0.02 1 1270 . 114 LYS CB C 32.037 0.2 1 1271 . 114 LYS HB2 H 1.794 0.02 2 1272 . 114 LYS HB3 H 1.845 0.02 2 1273 . 114 LYS CG C 25.198 0.2 1 1274 . 114 LYS HG2 H 1.407 0.02 2 1275 . 114 LYS HG3 H 1.567 0.02 2 1276 . 114 LYS CD C 29.107 0.2 1 1277 . 114 LYS HD2 H 1.600 0.02 1 1278 . 114 LYS HD3 H 1.600 0.02 1 1279 . 114 LYS CE C 42.102 0.2 1 1280 . 114 LYS HE2 H 2.886 0.02 2 1281 . 114 LYS HE3 H 2.890 0.02 2 1282 . 114 LYS C C 179.287 0.2 1 1283 . 115 ASN N N 117.500 0.15 1 1284 . 115 ASN H H 7.747 0.02 1 1285 . 115 ASN CA C 55.723 0.2 1 1286 . 115 ASN HA H 4.408 0.02 1 1287 . 115 ASN CB C 37.849 0.2 1 1288 . 115 ASN HB2 H 2.697 0.02 2 1289 . 115 ASN HB3 H 2.861 0.02 2 1290 . 115 ASN ND2 N 111.123 0.15 1 1291 . 115 ASN HD21 H 6.910 0.02 2 1292 . 115 ASN C C 177.147 0.2 1 1293 . 116 LEU N N 120.505 0.15 1 1294 . 116 LEU H H 8.244 0.02 1 1295 . 116 LEU CA C 57.873 0.2 1 1296 . 116 LEU HA H 4.067 0.02 1 1297 . 116 LEU CB C 42.197 0.2 1 1298 . 116 LEU HB2 H 1.487 0.02 2 1299 . 116 LEU HB3 H 1.624 0.02 2 1300 . 116 LEU CG C 27.061 0.2 1 1301 . 116 LEU HG H 1.470 0.02 1 1302 . 116 LEU HD1 H 0.707 0.02 2 1303 . 116 LEU HD2 H 0.781 0.02 2 1304 . 116 LEU CD1 C 25.701 0.2 2 1305 . 116 LEU CD2 C 23.681 0.2 2 1306 . 116 LEU C C 178.477 0.2 1 1307 . 117 LEU N N 117.457 0.15 1 1308 . 117 LEU H H 7.857 0.02 1 1309 . 117 LEU CA C 57.594 0.2 1 1310 . 117 LEU HA H 3.990 0.02 1 1311 . 117 LEU CB C 41.826 0.2 1 1312 . 117 LEU HB2 H 1.426 0.02 2 1313 . 117 LEU HB3 H 1.750 0.02 2 1314 . 117 LEU CG C 27.426 0.2 1 1315 . 117 LEU HG H 1.655 0.02 1 1316 . 117 LEU HD1 H 0.756 0.02 2 1317 . 117 LEU HD2 H 0.781 0.02 2 1318 . 117 LEU CD1 C 22.976 0.2 2 1319 . 117 LEU CD2 C 25.181 0.2 2 1320 . 117 LEU C C 179.137 0.2 1 1321 . 118 LYS N N 115.922 0.15 1 1322 . 118 LYS H H 7.327 0.02 1 1323 . 118 LYS CA C 56.947 0.2 1 1324 . 118 LYS HA H 4.239 0.02 1 1325 . 118 LYS CB C 33.045 0.2 1 1326 . 118 LYS HB2 H 1.871 0.02 2 1327 . 118 LYS HB3 H 1.912 0.02 2 1328 . 118 LYS CG C 24.777 0.2 1 1329 . 118 LYS HG2 H 1.563 0.02 1 1330 . 118 LYS HG3 H 1.563 0.02 1 1331 . 118 LYS CD C 29.241 0.2 1 1332 . 118 LYS HD2 H 1.649 0.02 1 1333 . 118 LYS HD3 H 1.649 0.02 1 1334 . 118 LYS CE C 42.017 0.2 1 1335 . 118 LYS HE2 H 2.950 0.02 1 1336 . 118 LYS HE3 H 2.950 0.02 1 1337 . 118 LYS C C 176.817 0.2 1 1338 . 119 GLY N N 110.156 0.15 1 1339 . 119 GLY H H 7.693 0.02 1 1340 . 119 GLY CA C 43.797 0.2 1 1341 . 119 GLY HA2 H 4.032 0.02 2 1342 . 119 GLY HA3 H 4.130 0.02 2 1343 . 119 GLY C C 172.597 0.2 1 1344 . 120 ILE CA C 58.296 0.2 1 1345 . 120 ILE HA H 4.677 0.02 1 1346 . 120 ILE CB C 40.997 0.2 1 1347 . 120 ILE HB H 1.789 0.02 1 1348 . 120 ILE HG2 H 1.014 0.02 1 1349 . 120 ILE CG2 C 17.025 0.2 1 1350 . 120 ILE CG1 C 27.723 0.2 1 1351 . 120 ILE HG12 H 1.648 0.02 2 1352 . 120 ILE HG13 H 0.964 0.02 2 1353 . 120 ILE HD1 H 0.786 0.02 1 1354 . 120 ILE CD1 C 14.117 0.2 1 1355 . 121 PRO CD C 51.047 0.2 1 1356 . 121 PRO CA C 62.336 0.2 1 1357 . 121 PRO HA H 4.133 0.02 1 1358 . 121 PRO CB C 32.387 0.2 1 1359 . 121 PRO HB2 H 1.530 0.02 1 1360 . 121 PRO HB3 H 1.530 0.02 1 1361 . 121 PRO CG C 26.847 0.2 1 1362 . 121 PRO HG2 H 1.901 0.02 2 1363 . 121 PRO HG3 H 2.010 0.02 2 1364 . 121 PRO HD2 H 3.896 0.02 1 1365 . 121 PRO HD3 H 3.896 0.02 1 1366 . 121 PRO C C 175.487 0.2 1 1367 . 122 PHE N N 114.832 0.15 1 1368 . 122 PHE H H 7.281 0.02 1 1369 . 122 PHE CA C 57.228 0.2 1 1370 . 122 PHE HA H 4.885 0.02 1 1371 . 122 PHE CB C 41.687 0.2 1 1372 . 122 PHE HB2 H 2.897 0.02 1 1373 . 122 PHE HB3 H 2.897 0.02 1 1374 . 122 PHE C C 173.947 0.2 1 1375 . 123 ARG N N 116.233 0.15 1 1376 . 123 ARG H H 8.950 0.02 1 1377 . 123 ARG CA C 53.199 0.2 1 1378 . 123 ARG CB C 31.647 0.2 1 1379 . 123 ARG C C 175.687 0.2 1 1380 . 124 THR N N 107.319 0.15 1 1381 . 124 THR H H 7.616 0.02 1 1382 . 124 THR CA C 58.539 0.2 1 1383 . 124 THR HA H 4.692 0.02 1 1384 . 124 THR CB C 73.809 0.2 1 1385 . 124 THR HB H 4.598 0.02 1 1386 . 124 THR HG2 H 1.170 0.02 1 1387 . 124 THR CG2 C 22.022 0.2 1 1388 . 124 THR C C 174.717 0.2 1 1389 . 125 LYS N N 123.762 0.15 1 1390 . 125 LYS H H 9.822 0.02 1 1391 . 125 LYS CA C 60.431 0.2 1 1392 . 125 LYS HA H 3.984 0.02 1 1393 . 125 LYS CB C 32.690 0.2 1 1394 . 125 LYS HB2 H 1.901 0.02 2 1395 . 125 LYS HB3 H 2.151 0.02 2 1396 . 125 LYS CG C 24.797 0.2 1 1397 . 125 LYS HG2 H 1.262 0.02 2 1398 . 125 LYS HG3 H 1.272 0.02 2 1399 . 125 LYS CD C 30.197 0.2 1 1400 . 125 LYS HD2 H 1.596 0.02 1 1401 . 125 LYS HD3 H 1.596 0.02 1 1402 . 125 LYS CE C 42.159 0.2 1 1403 . 125 LYS HE2 H 2.860 0.02 2 1404 . 125 LYS HE3 H 2.859 0.02 2 1405 . 125 LYS C C 176.747 0.2 1 1406 . 126 ALA N N 120.388 0.15 1 1407 . 126 ALA H H 8.306 0.02 1 1408 . 126 ALA CA C 55.105 0.2 1 1409 . 126 ALA HA H 4.224 0.02 1 1410 . 126 ALA HB H 1.396 0.02 1 1411 . 126 ALA CB C 18.281 0.2 1 1412 . 126 ALA C C 180.287 0.2 1 1413 . 127 GLU N N 117.742 0.15 1 1414 . 127 GLU H H 7.925 0.02 1 1415 . 127 GLU CA C 59.218 0.2 1 1416 . 127 GLU HA H 4.101 0.02 1 1417 . 127 GLU CB C 31.527 0.2 1 1418 . 127 GLU HB2 H 2.210 0.02 2 1419 . 127 GLU HB3 H 2.228 0.02 2 1420 . 127 GLU CG C 36.947 0.2 1 1421 . 127 GLU HG2 H 2.345 0.02 2 1422 . 127 GLU HG3 H 2.469 0.02 2 1423 . 127 GLU C C 178.617 0.2 1 1424 . 128 PHE N N 118.954 0.15 1 1425 . 128 PHE H H 8.083 0.02 1 1426 . 128 PHE CA C 61.099 0.2 1 1427 . 128 PHE HA H 3.474 0.02 1 1428 . 128 PHE CB C 39.417 0.2 1 1429 . 128 PHE HB2 H 2.888 0.02 2 1430 . 128 PHE HB3 H 3.056 0.02 2 1431 . 128 PHE CD1 C 130.560 0.2 1 1432 . 128 PHE HD1 H 5.964 0.02 1 1433 . 128 PHE CE1 C 130.542 0.2 1 1434 . 128 PHE HE1 H 6.630 0.02 1 1435 . 128 PHE CE2 C 130.542 0.2 1 1436 . 128 PHE HE2 H 6.630 0.02 1 1437 . 128 PHE CD2 C 130.560 0.2 1 1438 . 128 PHE HD2 H 5.964 0.02 1 1439 . 128 PHE C C 175.457 0.2 1 1440 . 129 GLU N N 116.527 0.15 1 1441 . 129 GLU H H 8.624 0.02 1 1442 . 129 GLU CA C 59.492 0.2 1 1443 . 129 GLU HA H 3.426 0.02 1 1444 . 129 GLU CB C 29.517 0.2 1 1445 . 129 GLU HB2 H 1.896 0.02 2 1446 . 129 GLU HB3 H 2.045 0.02 2 1447 . 129 GLU CG C 37.490 0.2 1 1448 . 129 GLU HG2 H 2.170 0.02 2 1449 . 129 GLU HG3 H 2.616 0.02 2 1450 . 129 GLU C C 178.817 0.2 1 1451 . 130 ASP N N 118.336 0.15 1 1452 . 130 ASP H H 8.032 0.02 1 1453 . 130 ASP CA C 57.425 0.2 1 1454 . 130 ASP HA H 4.314 0.02 1 1455 . 130 ASP CB C 41.384 0.2 1 1456 . 130 ASP HB2 H 2.635 0.02 2 1457 . 130 ASP HB3 H 2.784 0.02 2 1458 . 130 ASP C C 179.267 0.2 1 1459 . 131 VAL N N 119.695 0.15 1 1460 . 131 VAL H H 7.732 0.02 1 1461 . 131 VAL CA C 66.473 0.2 1 1462 . 131 VAL HA H 3.742 0.02 1 1463 . 131 VAL CB C 31.638 0.2 1 1464 . 131 VAL HB H 1.836 0.02 1 1465 . 131 VAL HG1 H 0.806 0.02 2 1466 . 131 VAL HG2 H 1.063 0.02 2 1467 . 131 VAL CG1 C 22.753 0.2 2 1468 . 131 VAL CG2 C 22.545 0.2 2 1469 . 131 VAL C C 178.327 0.2 1 1470 . 132 ILE N N 120.238 0.15 1 1471 . 132 ILE H H 7.876 0.02 1 1472 . 132 ILE CA C 62.716 0.2 1 1473 . 132 ILE HA H 3.423 0.02 1 1474 . 132 ILE CB C 35.088 0.2 1 1475 . 132 ILE HB H 1.438 0.02 1 1476 . 132 ILE HG2 H 0.613 0.02 1 1477 . 132 ILE CG2 C 17.199 0.2 1 1478 . 132 ILE CG1 C 26.264 0.2 1 1479 . 132 ILE HG12 H 0.078 0.02 2 1480 . 132 ILE HG13 H 0.523 0.02 2 1481 . 132 ILE HD1 H -0.238 0.02 1 1482 . 132 ILE CD1 C 8.171 0.2 1 1483 . 132 ILE C C 178.047 0.2 1 1484 . 133 GLU N N 117.922 0.15 1 1485 . 133 GLU H H 8.289 0.02 1 1486 . 133 GLU CA C 59.181 0.2 1 1487 . 133 GLU HA H 3.808 0.02 1 1488 . 133 GLU CB C 29.003 0.2 1 1489 . 133 GLU HB2 H 1.935 0.02 2 1490 . 133 GLU HB3 H 2.045 0.02 2 1491 . 133 GLU CG C 36.073 0.2 1 1492 . 133 GLU HG2 H 2.200 0.02 2 1493 . 133 GLU HG3 H 2.232 0.02 2 1494 . 133 GLU C C 179.597 0.2 1 1495 . 134 HIS N N 117.236 0.15 1 1496 . 134 HIS H H 7.747 0.02 1 1497 . 134 HIS CA C 59.123 0.2 1 1498 . 134 HIS HA H 4.367 0.02 1 1499 . 134 HIS CB C 29.299 0.2 1 1500 . 134 HIS HB2 H 3.306 0.02 2 1501 . 134 HIS HB3 H 3.359 0.02 2 1502 . 134 HIS CD2 C 120.738 0.2 1 1503 . 134 HIS HD2 H 7.096 0.02 1 1504 . 134 HIS C C 178.357 0.2 1 1505 . 135 MET N N 117.618 0.15 1 1506 . 135 MET H H 8.618 0.02 1 1507 . 135 MET CA C 56.536 0.2 1 1508 . 135 MET HA H 4.664 0.02 1 1509 . 135 MET CB C 32.040 0.2 1 1510 . 135 MET CG C 33.148 0.2 1 1511 . 135 MET HG2 H 2.577 0.02 2 1512 . 135 MET HG3 H 2.918 0.02 2 1513 . 135 MET HE H 1.915 0.02 1 1514 . 135 MET CE C 19.126 0.2 1 1515 . 135 MET C C 178.157 0.2 1 1516 . 136 LYS N N 119.228 0.15 1 1517 . 136 LYS H H 8.113 0.02 1 1518 . 136 LYS CA C 59.152 0.2 1 1519 . 136 LYS HA H 3.339 0.02 1 1520 . 136 LYS CB C 32.237 0.2 1 1521 . 136 LYS HB2 H 1.598 0.02 1 1522 . 136 LYS HB3 H 1.598 0.02 1 1523 . 136 LYS CG C 25.617 0.2 1 1524 . 136 LYS HG2 H 0.781 0.02 2 1525 . 136 LYS HG3 H 1.052 0.02 2 1526 . 136 LYS CD C 29.367 0.2 1 1527 . 136 LYS HD2 H 1.282 0.02 1 1528 . 136 LYS HD3 H 1.282 0.02 1 1529 . 136 LYS CE C 41.844 0.2 1 1530 . 136 LYS HE2 H 2.544 0.02 2 1531 . 136 LYS HE3 H 2.616 0.02 2 1532 . 136 LYS C C 179.137 0.2 1 1533 . 137 THR N N 111.792 0.15 1 1534 . 137 THR H H 7.337 0.02 1 1535 . 137 THR CA C 64.528 0.2 1 1536 . 137 THR HA H 3.907 0.02 1 1537 . 137 THR CB C 69.059 0.2 1 1538 . 137 THR HB H 3.766 0.02 1 1539 . 137 THR HG2 H 0.995 0.02 1 1540 . 137 THR CG2 C 21.091 0.2 1 1541 . 137 THR C C 174.827 0.2 1 1542 . 138 TYR N N 119.086 0.15 1 1543 . 138 TYR H H 7.514 0.02 1 1544 . 138 TYR CA C 57.656 0.2 1 1545 . 138 TYR HA H 4.576 0.02 1 1546 . 138 TYR CB C 37.987 0.2 1 1547 . 138 TYR HB2 H 2.767 0.02 2 1548 . 138 TYR HB3 H 3.361 0.02 2 1549 . 138 TYR CD1 C 133.242 0.2 1 1550 . 138 TYR HD1 H 7.011 0.02 1 1551 . 138 TYR CE1 C 118.590 0.2 1 1552 . 138 TYR HE1 H 6.623 0.02 1 1553 . 138 TYR CE2 C 118.590 0.2 1 1554 . 138 TYR HE2 H 6.623 0.02 1 1555 . 138 TYR CD2 C 133.242 0.2 1 1556 . 138 TYR HD2 H 7.011 0.02 1 1557 . 138 TYR C C 174.897 0.2 1 1558 . 139 SER N N 115.674 0.15 1 1559 . 139 SER H H 7.549 0.02 1 1560 . 139 SER CA C 58.282 0.2 1 1561 . 139 SER HA H 4.748 0.02 1 1562 . 139 SER CB C 65.127 0.2 1 1563 . 139 SER HB2 H 3.720 0.02 2 1564 . 139 SER HB3 H 3.859 0.02 2 1565 . 139 SER C C 173.807 0.2 1 1566 . 140 GLY N N 117.465 0.15 1 1567 . 140 GLY H H 8.153 0.02 1 1568 . 140 GLY CA C 46.320 0.2 1 1569 . 140 GLY C C 178.967 0.2 1 stop_ save_