data_5897 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution Structure of the BHRF1 Protein From Epstein-Barr Virus, a Homolog of Human Bcl-2 ; _BMRB_accession_number 5897 _BMRB_flat_file_name bmr5897.str _Entry_type original _Submission_date 2003-08-05 _Accession_date 2003-08-06 _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 Olejniczak Edward T . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 730 "13C chemical shifts" 639 "15N chemical shifts" 143 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2003-12-05 original author . stop_ _Original_release_date 2003-12-05 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Solution Structure of the BHRF1 Protein from Epstein-Barr Virus, a Homolog of Human Bcl-2 ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code 22863537 _PubMed_ID 14499614 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Huang Qiulong . . 2 Petros Andrew M. . 3 Virgin Herbert W. . 4 Fesik Stephen W. . 5 Olejniczak Edward T. . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 332 _Journal_issue 5 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1123 _Page_last 1130 _Year 2003 _Details . loop_ _Keyword Bcl-2 BHRF1 'Epstein-Barr Virus' 'NMR spectroscopy' 'Structure determination' stop_ save_ ################################## # Molecular system description # ################################## save_Bcl-2_ebv _Saveframe_category molecular_system _Mol_system_name 'homolog Bcl-2 Epstein Barr Virus' _Abbreviation_common 'Bcl-2 ebv' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label ebv-bcl-2 $bcl-2 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not reported' loop_ _Biological_function 'human bcl-2 homolog involved in apoptosis regulation' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_bcl-2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'bcl-2 homolog' _Abbreviation_common bcl-2 _Molecular_mass . _Mol_thiol_state 'not reported' _Details ; The DDDDLEHHHHHH is a cloning artifact, and no assignment was made. ; ############################## # Polymer residue sequence # ############################## _Residue_count 172 _Mol_residue_sequence ; MAYSTREILLALCIRDSRVH GNGTLHPVLELAARETPLRL SPEDTVVLRYHVLLEEIIER NSETFTETWNRFITHTEHVD LDFNSVFLEIFHRGDPSLGR ALAWMAWCMHACRTLCCNQS TPYYVVDLSVRGMLEASEGL DGWIHQQGGWSTLIEDNIPG DDDDLEHHHHHH ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ALA 3 TYR 4 SER 5 THR 6 ARG 7 GLU 8 ILE 9 LEU 10 LEU 11 ALA 12 LEU 13 CYS 14 ILE 15 ARG 16 ASP 17 SER 18 ARG 19 VAL 20 HIS 21 GLY 22 ASN 23 GLY 24 THR 25 LEU 26 HIS 27 PRO 28 VAL 29 LEU 30 GLU 31 LEU 32 ALA 33 ALA 34 ARG 35 GLU 36 THR 37 PRO 38 LEU 39 ARG 40 LEU 41 SER 42 PRO 43 GLU 44 ASP 45 THR 46 VAL 47 VAL 48 LEU 49 ARG 50 TYR 51 HIS 52 VAL 53 LEU 54 LEU 55 GLU 56 GLU 57 ILE 58 ILE 59 GLU 60 ARG 61 ASN 62 SER 63 GLU 64 THR 65 PHE 66 THR 67 GLU 68 THR 69 TRP 70 ASN 71 ARG 72 PHE 73 ILE 74 THR 75 HIS 76 THR 77 GLU 78 HIS 79 VAL 80 ASP 81 LEU 82 ASP 83 PHE 84 ASN 85 SER 86 VAL 87 PHE 88 LEU 89 GLU 90 ILE 91 PHE 92 HIS 93 ARG 94 GLY 95 ASP 96 PRO 97 SER 98 LEU 99 GLY 100 ARG 101 ALA 102 LEU 103 ALA 104 TRP 105 MET 106 ALA 107 TRP 108 CYS 109 MET 110 HIS 111 ALA 112 CYS 113 ARG 114 THR 115 LEU 116 CYS 117 CYS 118 ASN 119 GLN 120 SER 121 THR 122 PRO 123 TYR 124 TYR 125 VAL 126 VAL 127 ASP 128 LEU 129 SER 130 VAL 131 ARG 132 GLY 133 MET 134 LEU 135 GLU 136 ALA 137 SER 138 GLU 139 GLY 140 LEU 141 ASP 142 GLY 143 TRP 144 ILE 145 HIS 146 GLN 147 GLN 148 GLY 149 GLY 150 TRP 151 SER 152 THR 153 LEU 154 ILE 155 GLU 156 ASP 157 ASN 158 ILE 159 PRO 160 GLY 161 ASP 162 ASP 163 ASP 164 ASP 165 LEU 166 GLU 167 HIS 168 HIS 169 HIS 170 HIS 171 HIS 172 HIS 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 1Q59 "Solution Structure Of The Bhrf1 Protein From Epstein-Barr Virus, A Homolog Of Human Bcl-2" 100.00 172 100.00 100.00 2.53e-122 PDB 2V6Q "Crystal Structure Of A Bhrf-1 : Bim Bh3 Complex" 93.02 173 100.00 100.00 1.79e-112 PDB 2WH6 "Crystal Structure Of Anti-Apoptotic Bhrf1 In Complex With The Bim Bh3 Domain" 93.02 173 100.00 100.00 1.79e-112 PDB 2XPX "Crystal Structure Of Bhrf1:bak Bh3 Complex" 93.02 173 100.00 100.00 1.79e-112 PDB 4OYD "Crystal Structure Of A Computationally Designed Inhibitor Of An Epstein-barr Viral Bcl-2 Protein" 91.28 158 100.00 100.00 2.27e-110 DBJ BAP94327 "apoptosis regulator BHRF1 [Human herpesvirus 4]" 93.60 191 98.76 99.38 2.10e-112 DBJ BAP94398 "apoptosis regulator BHRF1 [Human herpesvirus 4]" 93.60 191 99.38 99.38 8.57e-113 DBJ BAQ20007 "apoptosis regulator BHRF1 [Human herpesvirus 4]" 93.60 191 98.76 99.38 1.86e-112 DBJ BAQ20050 "apoptosis regulator BHRF1 [Human herpesvirus 4]" 93.60 191 97.52 98.76 6.99e-111 DBJ BAQ20091 "apoptosis regulator BHRF1 [Human herpesvirus 4]" 93.60 191 98.76 99.38 1.86e-112 EMBL CAD53396 "BHRF1 [Human herpesvirus 4]" 93.60 191 99.38 99.38 8.57e-113 GB AAA45873 "restricted early antigen complex component [Human herpesvirus 4]" 93.60 191 99.38 99.38 8.57e-113 GB AAA45875 "put. nuclear antigen precursor; putative [Human herpesvirus 4]" 93.60 191 99.38 99.38 8.57e-113 GB ABB89223 "BHRF1 [Human herpesvirus 4]" 93.60 191 99.38 99.38 8.57e-113 GB ABM92330 "BHRF1 [Human herpesvirus 4]" 93.60 191 99.38 99.38 8.57e-113 GB AEM00631 "BHRF1 [Human herpesvirus 4]" 93.60 191 98.76 99.38 2.10e-112 REF YP_001129442 "BHRF1 [Human herpesvirus 4 type 2]" 93.60 191 99.38 99.38 8.57e-113 REF YP_401646 "BHRF1 [Human herpesvirus 4]" 93.60 191 99.38 99.38 8.57e-113 SP P03182 "RecName: Full=Apoptosis regulator BHRF1; AltName: Full=Early antigen protein R; Short=EA-R; AltName: Full=Nuclear antigen [Huma" 93.60 191 99.38 99.38 8.57e-113 SP P0C6Z1 "RecName: Full=Apoptosis regulator BHRF1; AltName: Full=Early antigen protein R; Short=EA-R; AltName: Full=Nuclear antigen [Epst" 93.60 191 99.38 99.38 8.57e-113 SP P0C736 "RecName: Full=Apoptosis regulator BHRF1; AltName: Full=Early antigen protein R; Short=EA-R; AltName: Full=Nuclear antigen [Huma" 93.60 191 98.76 99.38 1.86e-112 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $bcl-2 'Epstein Barr virus' 10377 viruses . Lymphocryptovirus 'Human herpesvirus 4' 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 $bcl-2 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $bcl-2 . mM 0.5 1.0 . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _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_1 save_ ####################### # Sample conditions # ####################### save_cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.5 0.2 n/a temperature 303 3 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_1 stop_ _Sample_conditions_label $cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name ebv-bcl-2 _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 . 4 SER H H 9.3280 . 1 2 . 4 SER HA H 4.6770 . 1 3 . 4 SER HB2 H 4.5790 . 2 4 . 4 SER HB3 H 3.9890 . 2 5 . 4 SER C C 179.6290 . 1 6 . 4 SER CA C 57.1490 . 1 7 . 4 SER CB C 64.7390 . 1 8 . 4 SER N N 119.2850 . 1 9 . 5 THR H H 10.0700 . 1 10 . 5 THR HA H 4.1060 . 1 11 . 5 THR HB H 3.9310 . 1 12 . 5 THR HG2 H 1.4360 . 1 13 . 5 THR C C 178.6220 . 1 14 . 5 THR CA C 68.1470 . 1 15 . 5 THR CB C 67.6820 . 1 16 . 5 THR CG2 C 23.1690 . 1 17 . 5 THR N N 120.9550 . 1 18 . 6 ARG H H 9.2080 . 1 19 . 6 ARG C C 177.3210 . 1 20 . 6 ARG CA C 59.4070 . 1 21 . 6 ARG CB C 29.7660 . 1 22 . 6 ARG CD C 42.6930 . 1 23 . 6 ARG N N 120.1840 . 1 24 . 7 GLU H H 7.4240 . 1 25 . 7 GLU HA H 4.1460 . 1 26 . 7 GLU HB2 H 2.2090 . 2 27 . 7 GLU HG2 H 2.9040 . 2 28 . 7 GLU HG3 H 2.7130 . 2 29 . 7 GLU C C 177.1290 . 1 30 . 7 GLU CA C 59.7510 . 1 31 . 7 GLU CB C 29.0170 . 1 32 . 7 GLU CG C 37.4750 . 1 33 . 7 GLU N N 115.4310 . 1 34 . 8 ILE H H 7.7120 . 1 35 . 8 ILE HA H 3.4450 . 1 36 . 8 ILE HB H 1.1400 . 1 37 . 8 ILE HG12 H 0.6770 . 1 38 . 8 ILE HG13 H 0.6500 . 2 39 . 8 ILE HG2 H -0.1710 . 1 40 . 8 ILE HD1 H 0.0480 . 1 41 . 8 ILE C C 177.9990 . 1 42 . 8 ILE CA C 63.3450 . 1 43 . 8 ILE CB C 36.2360 . 1 44 . 8 ILE CG1 C 28.1800 . 1 45 . 8 ILE CG2 C 14.8580 . 1 46 . 8 ILE CD1 C 11.2950 . 1 47 . 8 ILE N N 117.0620 . 1 48 . 9 LEU H H 8.5650 . 1 49 . 9 LEU HA H 3.8830 . 1 50 . 9 LEU HB2 H 1.5890 . 2 51 . 9 LEU HB3 H 1.1820 . 2 52 . 9 LEU HD1 H 0.6350 . 2 53 . 9 LEU C C 175.7780 . 1 54 . 9 LEU CA C 57.6130 . 1 55 . 9 LEU CB C 40.7280 . 1 56 . 9 LEU CD1 C 21.9840 . 1 57 . 9 LEU N N 120.3120 . 1 58 . 10 LEU H H 7.9760 . 1 59 . 10 LEU HA H 3.8120 . 1 60 . 10 LEU HB2 H 1.6820 . 2 61 . 10 LEU HB3 H 1.5300 . 2 62 . 10 LEU HG H 1.5240 . 1 63 . 10 LEU HD1 H 0.6880 . 2 64 . 10 LEU C C 176.4410 . 1 65 . 10 LEU CA C 58.5120 . 1 66 . 10 LEU CB C 40.8830 . 1 67 . 10 LEU CG C 26.9410 . 1 68 . 10 LEU CD1 C 24.7720 . 1 69 . 10 LEU N N 118.5140 . 1 70 . 11 ALA H H 8.3390 . 1 71 . 11 ALA HA H 3.6600 . 1 72 . 11 ALA HB H 1.1900 . 1 73 . 11 ALA C C 174.8720 . 1 74 . 11 ALA CA C 55.7930 . 1 75 . 11 ALA CB C 17.9560 . 1 76 . 11 ALA N N 119.4130 . 1 77 . 12 LEU H H 8.3900 . 1 78 . 12 LEU HA H 3.6710 . 1 79 . 12 LEU HB2 H 2.1230 . 2 80 . 12 LEU HB3 H 1.3370 . 2 81 . 12 LEU HG H 1.5730 . 1 82 . 12 LEU HD1 H 0.9650 . 2 83 . 12 LEU HD2 H 0.4710 . 2 84 . 12 LEU C C 175.7260 . 1 85 . 12 LEU CA C 58.0780 . 1 86 . 12 LEU CB C 41.8120 . 1 87 . 12 LEU CG C 26.9410 . 1 88 . 12 LEU CD1 C 24.1530 . 1 89 . 12 LEU CD2 C 25.7020 . 1 90 . 12 LEU N N 118.0710 . 1 91 . 13 CYS H H 8.2490 . 1 92 . 13 CYS HA H 4.0470 . 1 93 . 13 CYS HB2 H 2.8950 . 2 94 . 13 CYS HB3 H 2.7200 . 2 95 . 13 CYS C C 176.2750 . 1 96 . 13 CYS CA C 63.9650 . 1 97 . 13 CYS CB C 26.7860 . 1 98 . 13 CYS N N 117.1010 . 1 99 . 14 ILE H H 8.3970 . 1 100 . 14 ILE HA H 3.4490 . 1 101 . 14 ILE HB H 1.6740 . 1 102 . 14 ILE HG12 H 0.7700 . 1 103 . 14 ILE HG13 H 1.7200 . 2 104 . 14 ILE HG2 H 0.7330 . 1 105 . 14 ILE HD1 H 0.5990 . 1 106 . 14 ILE CA C 65.8240 . 1 107 . 14 ILE CB C 37.3430 . 1 108 . 14 ILE CG1 C 29.5750 . 1 109 . 14 ILE CG2 C 16.5620 . 1 110 . 14 ILE CD1 C 13.1620 . 1 111 . 14 ILE N N 122.8820 . 1 112 . 15 ARG H H 8.5130 . 1 113 . 15 ARG HA H 3.7100 . 1 114 . 15 ARG HB2 H 1.9100 . 2 115 . 15 ARG HB3 H 1.6590 . 2 116 . 15 ARG HG2 H 0.8220 . 2 117 . 15 ARG HD2 H 3.0090 . 2 118 . 15 ARG HD3 H 2.6670 . 2 119 . 15 ARG C C 176.6370 . 1 120 . 15 ARG CA C 58.8530 . 1 121 . 15 ARG CB C 27.8710 . 1 122 . 15 ARG CG C 26.3210 . 1 123 . 15 ARG CD C 42.0140 . 1 124 . 15 ARG N N 121.5970 . 1 125 . 16 ASP H H 8.7510 . 1 126 . 16 ASP HA H 4.0890 . 1 127 . 16 ASP HB2 H 3.2360 . 2 128 . 16 ASP HB3 H 2.5750 . 2 129 . 16 ASP C C 176.1150 . 1 130 . 16 ASP CA C 58.4270 . 1 131 . 16 ASP CB C 42.1220 . 1 132 . 16 ASP N N 116.9720 . 1 133 . 17 SER H H 7.6350 . 1 134 . 17 SER HA H 4.1130 . 1 135 . 17 SER HB2 H 3.8870 . 2 136 . 17 SER HB3 H 3.8010 . 2 137 . 17 SER C C 177.6280 . 1 138 . 17 SER CA C 61.3310 . 1 139 . 17 SER CB C 62.8800 . 1 140 . 17 SER N N 112.8490 . 1 141 . 18 ARG H H 7.6970 . 1 142 . 18 ARG HA H 3.9000 . 1 143 . 18 ARG HB2 H 1.9310 . 2 144 . 18 ARG HB3 H 1.7970 . 2 145 . 18 ARG HG2 H 1.6890 . 2 146 . 18 ARG HG3 H 1.5370 . 2 147 . 18 ARG C C 176.3060 . 1 148 . 18 ARG CA C 58.1050 . 1 149 . 18 ARG CB C 29.2240 . 1 150 . 18 ARG CG C 27.1750 . 1 151 . 18 ARG CD C 42.6930 . 1 152 . 18 ARG N N 120.9550 . 1 153 . 19 VAL H H 7.5180 . 1 154 . 19 VAL HA H 3.6890 . 1 155 . 19 VAL HB H 1.7880 . 1 156 . 19 VAL HG1 H 0.6870 . 2 157 . 19 VAL HG2 H 0.3780 . 2 158 . 19 VAL C C 177.3620 . 1 159 . 19 VAL CA C 64.2360 . 1 160 . 19 VAL CB C 32.1850 . 1 161 . 19 VAL CG1 C 20.7450 . 1 162 . 19 VAL CG2 C 20.2410 . 1 163 . 19 VAL N N 115.7840 . 1 164 . 20 HIS H H 8.0600 . 1 165 . 20 HIS HA H 4.6140 . 1 166 . 20 HIS HB2 H 3.1530 . 2 167 . 20 HIS HB3 H 2.7910 . 2 168 . 20 HIS HD2 H 7.5180 . 1 169 . 20 HIS HE1 H 7.5722 . 1 170 . 20 HIS C C 179.6760 . 1 171 . 20 HIS CA C 56.0950 . 1 172 . 20 HIS CB C 29.5750 . 1 173 . 20 HIS CD2 C 121.4350 . 1 174 . 20 HIS CE1 C 138.5682 . 1 175 . 20 HIS N N 115.1740 . 1 176 . 21 GLY H H 7.8390 . 1 177 . 21 GLY HA2 H 4.2390 . 2 178 . 21 GLY HA3 H 4.0390 . 2 179 . 21 GLY C C 180.4060 . 1 180 . 21 GLY CA C 44.9110 . 1 181 . 21 GLY N N 108.4940 . 1 182 . 22 ASN H H 8.4620 . 1 183 . 22 ASN HA H 4.6330 . 1 184 . 22 ASN HB2 H 2.9780 . 2 185 . 22 ASN HB3 H 2.7800 . 2 186 . 22 ASN C C 178.2110 . 1 187 . 22 ASN CA C 52.3700 . 1 188 . 22 ASN CB C 37.8850 . 1 189 . 22 ASN N N 117.8720 . 1 190 . 23 GLY H H 8.5300 . 1 191 . 23 GLY HA2 H 4.2480 . 2 192 . 23 GLY HA3 H 3.4500 . 2 193 . 23 GLY C C 180.2190 . 1 194 . 23 GLY CA C 44.5330 . 1 195 . 23 GLY N N 108.2950 . 1 196 . 24 THR H H 7.7040 . 1 197 . 24 THR HA H 4.2600 . 1 198 . 24 THR HB H 4.0030 . 1 199 . 24 THR HG2 H 1.0290 . 1 200 . 24 THR C C 181.2340 . 1 201 . 24 THR CA C 60.8660 . 1 202 . 24 THR CB C 70.3160 . 1 203 . 24 THR CG2 C 20.9000 . 1 204 . 24 THR N N 114.4030 . 1 205 . 25 LEU H H 8.5000 . 1 206 . 25 LEU HA H 4.3560 . 1 207 . 25 LEU HB2 H 1.5300 . 2 208 . 25 LEU HB3 H 1.2920 . 2 209 . 25 LEU HD1 H 0.8630 . 2 210 . 25 LEU HD2 H 0.6920 . 2 211 . 25 LEU C C 178.6040 . 1 212 . 25 LEU CA C 53.2140 . 1 213 . 25 LEU CB C 42.9430 . 1 214 . 25 LEU CD1 C 24.9270 . 1 215 . 25 LEU CD2 C 25.0820 . 1 216 . 25 LEU N N 126.2220 . 1 217 . 26 HIS H H 8.7600 . 1 218 . 26 HIS HA H 4.2690 . 1 219 . 26 HIS HB2 H 3.2540 . 2 220 . 26 HIS HB3 H 2.6450 . 2 221 . 26 HIS HD2 H 7.2720 . 1 222 . 26 HIS HE1 H 7.0352 . 1 223 . 26 HIS C C 178.9410 . 1 224 . 26 HIS CA C 56.9400 . 1 225 . 26 HIS CB C 31.4330 . 1 226 . 26 HIS CD2 C 118.4070 . 1 227 . 26 HIS CE1 C 137.0502 . 1 228 . 26 HIS N N 128.7910 . 1 229 . 27 PRO HA H 4.3160 . 1 230 . 27 PRO HB2 H 2.4350 . 2 231 . 27 PRO HB3 H 2.0200 . 2 232 . 27 PRO HG2 H 1.9460 . 2 233 . 27 PRO HD2 H 3.5040 . 2 234 . 27 PRO HD3 H 2.3090 . 2 235 . 27 PRO C C 175.4710 . 1 236 . 27 PRO CA C 65.0570 . 1 237 . 27 PRO CB C 32.2080 . 1 238 . 27 PRO CG C 27.0960 . 1 239 . 27 PRO CD C 50.3330 . 1 240 . 28 VAL H H 10.9500 . 1 241 . 28 VAL HA H 3.6270 . 1 242 . 28 VAL HB H 1.8020 . 1 243 . 28 VAL HG1 H 0.5920 . 2 244 . 28 VAL HG2 H 0.7100 . 2 245 . 28 VAL C C 175.1210 . 1 246 . 28 VAL CA C 66.5980 . 1 247 . 28 VAL CB C 31.1240 . 1 248 . 28 VAL CG1 C 23.2230 . 1 249 . 28 VAL CG2 C 20.7450 . 1 250 . 28 VAL N N 120.9550 . 1 251 . 29 LEU H H 7.3090 . 1 252 . 29 LEU HA H 3.8780 . 1 253 . 29 LEU HB2 H 1.9280 . 2 254 . 29 LEU HB3 H 1.1570 . 2 255 . 29 LEU HD1 H 0.6710 . 2 256 . 29 LEU HD2 H 0.5510 . 2 257 . 29 LEU C C 176.4720 . 1 258 . 29 LEU CA C 56.9940 . 1 259 . 29 LEU CB C 41.5260 . 1 260 . 29 LEU CG C 25.5370 . 1 261 . 29 LEU CD1 C 25.8330 . 1 262 . 29 LEU CD2 C 22.4720 . 1 263 . 29 LEU N N 118.0840 . 1 264 . 30 GLU H H 7.5220 . 1 265 . 30 GLU HA H 3.7140 . 1 266 . 30 GLU HB2 H 2.0010 . 2 267 . 30 GLU HB3 H 1.8120 . 2 268 . 30 GLU HG2 H 2.1610 . 2 269 . 30 GLU HG3 H 2.0180 . 2 270 . 30 GLU C C 175.2920 . 1 271 . 30 GLU CA C 59.6270 . 1 272 . 30 GLU CB C 29.4200 . 1 273 . 30 GLU CG C 35.7710 . 1 274 . 30 GLU N N 118.5650 . 1 275 . 31 LEU H H 8.2590 . 1 276 . 31 LEU HA H 3.9640 . 1 277 . 31 LEU HB2 H 1.7710 . 2 278 . 31 LEU HB3 H 1.1740 . 2 279 . 31 LEU HD1 H 0.9290 . 2 280 . 31 LEU HD2 H 0.8260 . 2 281 . 31 LEU C C 175.8090 . 1 282 . 31 LEU CA C 57.6130 . 1 283 . 31 LEU CB C 40.8830 . 1 284 . 31 LEU CD1 C 24.3080 . 1 285 . 31 LEU N N 119.6700 . 1 286 . 32 ALA H H 7.8260 . 1 287 . 32 ALA HA H 4.0470 . 1 288 . 32 ALA HB H 1.2830 . 1 289 . 32 ALA CA C 54.5150 . 1 290 . 32 ALA CB C 16.7170 . 1 291 . 32 ALA N N 121.4690 . 1 292 . 33 ALA H H 8.3190 . 1 293 . 33 ALA HA H 4.0880 . 1 294 . 33 ALA HB H 1.2360 . 1 295 . 33 ALA C C 175.2364 . 1 296 . 33 ALA CA C 54.5690 . 1 297 . 33 ALA CB C 16.7170 . 1 298 . 33 ALA N N 121.5970 . 1 299 . 34 ARG H H 7.8000 . 1 300 . 34 ARG HA H 4.0925 . 1 301 . 34 ARG HB2 H 1.9191 . 2 302 . 34 ARG HD2 H 3.1100 . 2 303 . 34 ARG C C 175.9700 . 1 304 . 34 ARG CA C 58.3260 . 1 305 . 34 ARG CB C 30.1790 . 1 306 . 34 ARG CD C 42.9150 . 1 307 . 34 ARG N N 119.1560 . 1 308 . 35 GLU H H 8.3080 . 1 309 . 35 GLU HA H 3.9950 . 1 310 . 35 GLU C C 176.7150 . 1 311 . 35 GLU CA C 57.0300 . 1 312 . 35 GLU CB C 29.7490 . 1 313 . 35 GLU CG C 35.9790 . 1 314 . 35 GLU N N 114.7880 . 1 315 . 36 THR H H 7.6120 . 1 316 . 36 THR HA H 4.5020 . 1 317 . 36 THR HB H 4.0050 . 1 318 . 36 THR HG2 H 1.1110 . 1 319 . 36 THR CA C 69.0770 . 1 320 . 36 THR CB C 66.5980 . 1 321 . 36 THR CG2 C 21.5190 . 1 322 . 36 THR N N 114.4030 . 1 323 . 37 PRO HA H 4.6885 . 1 324 . 37 PRO HB2 H 2.1154 . 2 325 . 37 PRO HB3 H 1.8270 . 2 326 . 37 PRO HG2 H 1.8414 . 2 327 . 37 PRO HG3 H 1.6139 . 2 328 . 37 PRO HD2 H 3.5246 . 2 329 . 37 PRO HD3 H 3.3482 . 2 330 . 37 PRO C C 178.9150 . 1 331 . 37 PRO CA C 60.0640 . 1 332 . 37 PRO CB C 33.1720 . 1 333 . 37 PRO CG C 22.4410 . 1 334 . 37 PRO CD C 50.3787 . 1 335 . 38 LEU H H 8.6040 . 1 336 . 38 LEU HA H 4.2270 . 1 337 . 38 LEU HB2 H 1.9950 . 2 338 . 38 LEU HB3 H 1.1940 . 2 339 . 38 LEU HD1 H 1.0720 . 2 340 . 38 LEU HD2 H 0.7890 . 2 341 . 38 LEU C C 178.1490 . 1 342 . 38 LEU CA C 54.7470 . 1 343 . 38 LEU CB C 42.5290 . 1 344 . 38 LEU CD1 C 25.0480 . 1 345 . 38 LEU CD2 C 25.9420 . 1 346 . 38 LEU N N 120.3120 . 1 347 . 39 ARG H H 9.2820 . 1 348 . 39 ARG HA H 4.3320 . 1 349 . 39 ARG HB2 H 1.8250 . 2 350 . 39 ARG C C 178.4900 . 1 351 . 39 ARG CA C 56.0410 . 1 352 . 39 ARG CB C 29.5280 . 1 353 . 39 ARG CD C 42.3590 . 1 354 . 39 ARG N N 128.6620 . 1 355 . 40 LEU H H 7.0350 . 1 356 . 40 LEU HA H 4.0830 . 1 357 . 40 LEU HB2 H 1.1850 . 2 358 . 40 LEU HB3 H 0.9160 . 2 359 . 40 LEU HG H 1.0120 . 1 360 . 40 LEU HD1 H 0.3050 . 2 361 . 40 LEU HD2 H 0.0720 . 2 362 . 40 LEU C C 179.6810 . 1 363 . 40 LEU CA C 53.5860 . 1 364 . 40 LEU CB C 43.0520 . 1 365 . 40 LEU CG C 25.5470 . 1 366 . 40 LEU CD1 C 22.7590 . 1 367 . 40 LEU CD2 C 24.6410 . 1 368 . 40 LEU N N 121.7250 . 1 369 . 41 SER H H 8.5350 . 1 370 . 41 SER HA H 4.6420 . 1 371 . 41 SER HB2 H 3.9490 . 2 372 . 41 SER HB3 H 3.6350 . 2 373 . 41 SER CA C 54.6470 . 1 374 . 41 SER CB C 63.9650 . 1 375 . 41 SER N N 119.0860 . 1 376 . 42 PRO HA H 4.1860 . 1 377 . 42 PRO HB2 H 2.1630 . 2 378 . 42 PRO HB3 H 1.7370 . 2 379 . 42 PRO HG2 H 1.9302 . 2 380 . 42 PRO HG3 H 1.6609 . 2 381 . 42 PRO HD2 H 3.6950 . 2 382 . 42 PRO HD3 H 3.8097 . 2 383 . 42 PRO C C 180.1570 . 1 384 . 42 PRO CA C 63.9650 . 1 385 . 42 PRO CB C 31.1240 . 1 386 . 42 PRO CG C 27.5607 . 1 387 . 42 PRO CD C 50.6420 . 1 388 . 43 GLU H H 7.5950 . 1 389 . 43 GLU HA H 4.1760 . 1 390 . 43 GLU HB2 H 2.1254 . 2 391 . 43 GLU HB3 H 1.5585 . 2 392 . 43 GLU C C 178.5420 . 1 393 . 43 GLU CA C 54.2350 . 1 394 . 43 GLU CB C 28.4820 . 1 395 . 43 GLU CG C 35.9230 . 1 396 . 43 GLU N N 111.3910 . 1 397 . 44 ASP H H 7.5410 . 1 398 . 44 ASP HA H 4.3820 . 1 399 . 44 ASP HB2 H 2.8410 . 2 400 . 44 ASP HB3 H 2.4740 . 2 401 . 44 ASP C C 176.9220 . 1 402 . 44 ASP CA C 54.8250 . 1 403 . 44 ASP CB C 43.5160 . 1 404 . 44 ASP N N 120.6980 . 1 405 . 45 THR H H 8.6010 . 1 406 . 45 THR HA H 3.7700 . 1 407 . 45 THR HB H 4.0990 . 1 408 . 45 THR HG2 H 1.2250 . 1 409 . 45 THR C C 178.4490 . 1 410 . 45 THR CA C 66.2880 . 1 411 . 45 THR CB C 68.6120 . 1 412 . 45 THR CG2 C 21.3640 . 1 413 . 45 THR N N 119.7980 . 1 414 . 46 VAL H H 8.8330 . 1 415 . 46 VAL HA H 3.6890 . 1 416 . 46 VAL HB H 2.1470 . 1 417 . 46 VAL HG1 H 1.0930 . 2 418 . 46 VAL HG2 H 0.8910 . 2 419 . 46 VAL C C 177.3360 . 1 420 . 46 VAL CA C 66.4430 . 1 421 . 46 VAL CB C 31.2790 . 1 422 . 46 VAL CG1 C 22.7590 . 1 423 . 46 VAL CG2 C 20.5900 . 1 424 . 46 VAL N N 121.7250 . 1 425 . 47 VAL H H 6.9940 . 1 426 . 47 VAL HA H 3.3250 . 1 427 . 47 VAL HB H 2.1430 . 1 428 . 47 VAL HG1 H 0.7940 . 2 429 . 47 VAL HG2 H 0.7090 . 2 430 . 47 VAL C C 176.7980 . 1 431 . 47 VAL CA C 66.4430 . 1 432 . 47 VAL CB C 30.9690 . 1 433 . 47 VAL CG1 C 23.6880 . 1 434 . 47 VAL CG2 C 21.2090 . 1 435 . 47 VAL N N 119.9270 . 1 436 . 48 LEU H H 7.9950 . 1 437 . 48 LEU HA H 3.8108 . 1 438 . 48 LEU HB2 H 1.8769 . 2 439 . 48 LEU HB3 H 1.1979 . 2 440 . 48 LEU HD1 H 0.6764 . 2 441 . 48 LEU C C 174.3390 . 1 442 . 48 LEU CA C 58.1710 . 1 443 . 48 LEU CB C 40.2800 . 1 444 . 48 LEU CD1 C 21.7130 . 1 445 . 48 LEU N N 118.2060 . 1 446 . 49 ARG H H 7.9790 . 1 447 . 49 ARG HA H 3.9260 . 1 448 . 49 ARG HB2 H 1.7216 . 2 449 . 49 ARG HG2 H 1.8136 . 2 450 . 49 ARG HG3 H 1.5485 . 2 451 . 49 ARG HD2 H 3.0663 . 2 452 . 49 ARG HD3 H 2.9643 . 2 453 . 49 ARG C C 174.4430 . 1 454 . 49 ARG CA C 58.6310 . 1 455 . 49 ARG CB C 29.9810 . 1 456 . 49 ARG CG C 26.8270 . 1 457 . 49 ARG CD C 42.9320 . 1 458 . 49 ARG N N 116.9590 . 1 459 . 50 TYR H H 8.1380 . 1 460 . 50 TYR HA H 4.0610 . 1 461 . 50 TYR HB2 H 2.9120 . 2 462 . 50 TYR HB3 H 2.7460 . 2 463 . 50 TYR HD1 H 7.0840 . 1 464 . 50 TYR HD2 H 7.0840 . 1 465 . 50 TYR HE1 H 6.6350 . 1 466 . 50 TYR HE2 H 6.6350 . 1 467 . 50 TYR C C 176.9480 . 1 468 . 50 TYR CA C 63.5000 . 1 469 . 50 TYR CB C 38.5590 . 1 470 . 50 TYR CD1 C 132.4340 . 1 471 . 50 TYR CD2 C 132.4340 . 1 472 . 50 TYR CE1 C 117.8720 . 1 473 . 50 TYR CE2 C 117.8720 . 1 474 . 50 TYR N N 116.8440 . 1 475 . 51 HIS H H 9.0780 . 1 476 . 51 HIS HA H 3.6770 . 1 477 . 51 HIS HB2 H 3.1320 . 2 478 . 51 HIS HD2 H 7.0180 . 1 479 . 51 HIS C C 178.0510 . 1 480 . 51 HIS CA C 23.9050 . 1 481 . 51 HIS CB C 31.0310 . 1 482 . 51 HIS CD2 C 116.3230 . 1 483 . 51 HIS N N 120.8260 . 1 484 . 52 VAL H H 7.3770 . 1 485 . 52 VAL HA H 3.5980 . 1 486 . 52 VAL HB H 2.0660 . 1 487 . 52 VAL HG1 H 1.0970 . 2 488 . 52 VAL HG2 H 0.9100 . 2 489 . 52 VAL C C 175.5090 . 1 490 . 52 VAL CA C 65.7930 . 1 491 . 52 VAL CB C 31.7430 . 1 492 . 52 VAL CG1 C 22.1390 . 1 493 . 52 VAL CG2 C 20.6440 . 1 494 . 52 VAL N N 115.1740 . 1 495 . 53 LEU H H 7.0010 . 1 496 . 53 LEU HA H 4.1060 . 1 497 . 53 LEU HB2 H 1.8890 . 2 498 . 53 LEU HB3 H 1.5900 . 2 499 . 53 LEU HG H 1.7340 . 1 500 . 53 LEU HD1 H 0.8480 . 2 501 . 53 LEU HD2 H 0.8130 . 2 502 . 53 LEU C C 174.3760 . 1 503 . 53 LEU CA C 57.4580 . 1 504 . 53 LEU CB C 41.9670 . 1 505 . 53 LEU CG C 26.4760 . 1 506 . 53 LEU CD1 C 23.3780 . 1 507 . 53 LEU CD2 C 24.7720 . 1 508 . 53 LEU N N 119.0280 . 1 509 . 54 LEU H H 8.7150 . 1 510 . 54 LEU HA H 3.9730 . 1 511 . 54 LEU HB2 H 1.8140 . 2 512 . 54 LEU HD1 H 0.9570 . 2 513 . 54 LEU HD2 H 0.8250 . 2 514 . 54 LEU C C 175.2350 . 1 515 . 54 LEU CA C 57.7680 . 1 516 . 54 LEU CB C 40.7420 . 1 517 . 54 LEU CG C 27.1460 . 1 518 . 54 LEU CD1 C 24.4090 . 1 519 . 54 LEU CD2 C 27.7160 . 1 520 . 54 LEU N N 118.1280 . 1 521 . 55 GLU H H 8.4300 . 1 522 . 55 GLU HA H 4.1193 . 1 523 . 55 GLU HB3 H 1.8059 . 2 524 . 55 GLU HG2 H 1.6200 . 2 525 . 55 GLU HG3 H 1.9268 . 2 526 . 55 GLU C C 175.1260 . 1 527 . 55 GLU CA C 59.6030 . 1 528 . 55 GLU CB C 28.9020 . 1 529 . 55 GLU CG C 35.8110 . 1 530 . 55 GLU N N 118.8800 . 1 531 . 56 GLU H H 7.2000 . 1 532 . 56 GLU HA H 3.9731 . 1 533 . 56 GLU HB2 H 2.2400 . 2 534 . 56 GLU HB3 H 2.1240 . 2 535 . 56 GLU HG2 H 2.3888 . 2 536 . 56 GLU C C 175.8090 . 1 537 . 56 GLU CA C 58.9870 . 1 538 . 56 GLU CB C 28.5690 . 1 539 . 56 GLU CG C 35.7190 . 1 540 . 56 GLU N N 118.3850 . 1 541 . 57 ILE H H 7.3990 . 1 542 . 57 ILE HA H 3.4500 . 1 543 . 57 ILE HB H 1.9040 . 1 544 . 57 ILE HG2 H 0.8737 . 1 545 . 57 ILE HD1 H 0.8360 . 1 546 . 57 ILE C C 175.1730 . 1 547 . 57 ILE CA C 65.5140 . 1 548 . 57 ILE CB C 37.9400 . 1 549 . 57 ILE CG2 C 17.5610 . 1 550 . 57 ILE CD1 C 14.5480 . 1 551 . 57 ILE N N 119.4130 . 1 552 . 58 ILE H H 8.5480 . 1 553 . 58 ILE HA H 3.1260 . 1 554 . 58 ILE HB H 1.8210 . 1 555 . 58 ILE HG2 H 0.6620 . 1 556 . 58 ILE HD1 H 0.7460 . 1 557 . 58 ILE C C 177.3670 . 1 558 . 58 ILE CA C 66.2880 . 1 559 . 58 ILE CB C 37.3200 . 1 560 . 58 ILE CG2 C 17.2210 . 1 561 . 58 ILE CD1 C 14.1690 . 1 562 . 58 ILE N N 121.3400 . 1 563 . 59 GLU H H 7.9130 . 1 564 . 59 GLU HA H 3.8352 . 1 565 . 59 GLU HB2 H 2.0170 . 2 566 . 59 GLU HG2 H 2.1903 . 2 567 . 59 GLU HG3 H 2.0467 . 2 568 . 59 GLU C C 174.9910 . 1 569 . 59 GLU CA C 59.1077 . 1 570 . 59 GLU CB C 28.9390 . 1 571 . 59 GLU CG C 35.7010 . 1 572 . 59 GLU N N 117.4860 . 1 573 . 60 ARG H H 7.4500 . 1 574 . 60 ARG HA H 4.1150 . 1 575 . 60 ARG HB2 H 1.7130 . 2 576 . 60 ARG HG2 H 1.6970 . 2 577 . 60 ARG HG3 H 1.5760 . 2 578 . 60 ARG HD2 H 3.0560 . 2 579 . 60 ARG C C 177.2070 . 1 580 . 60 ARG CA C 57.4120 . 1 581 . 60 ARG CB C 30.7830 . 1 582 . 60 ARG CG C 27.0960 . 1 583 . 60 ARG CD C 43.0520 . 1 584 . 60 ARG N N 114.7630 . 1 585 . 61 ASN H H 7.4330 . 1 586 . 61 ASN HA H 4.8690 . 1 587 . 61 ASN HB2 H 1.8380 . 2 588 . 61 ASN HB3 H 1.3130 . 2 589 . 61 ASN C C 179.6550 . 1 590 . 61 ASN CA C 52.6640 . 1 591 . 61 ASN CB C 39.2950 . 1 592 . 61 ASN N N 114.5310 . 1 593 . 62 SER H H 7.3720 . 1 594 . 62 SER HA H 3.4170 . 1 595 . 62 SER HB2 H 3.8600 . 2 596 . 62 SER HB3 H 3.7940 . 2 597 . 62 SER CA C 62.8800 . 1 598 . 62 SER CB C 62.1060 . 1 599 . 62 SER N N 116.6130 . 1 600 . 63 GLU H H 8.5260 . 1 601 . 63 GLU HA H 4.1070 . 1 602 . 63 GLU HB2 H 2.1070 . 2 603 . 63 GLU HB3 H 2.0220 . 2 604 . 63 GLU HG2 H 2.0490 . 2 605 . 63 GLU HG3 H 2.1440 . 2 606 . 63 GLU C C 175.2090 . 1 607 . 63 GLU CA C 59.9120 . 1 608 . 63 GLU CB C 28.2610 . 1 609 . 63 GLU CG C 35.8340 . 1 610 . 63 GLU N N 120.8260 . 1 611 . 64 THR H H 7.8630 . 1 612 . 64 THR HA H 4.1787 . 1 613 . 64 THR HB H 4.0980 . 1 614 . 64 THR HG2 H 1.2718 . 1 615 . 64 THR C C 176.9790 . 1 616 . 64 THR CA C 65.2040 . 1 617 . 64 THR CB C 68.1470 . 1 618 . 64 THR CG2 C 21.5190 . 1 619 . 64 THR N N 116.0730 . 1 620 . 65 PHE H H 8.8650 . 1 621 . 65 PHE HA H 4.6708 . 1 622 . 65 PHE HB2 H 2.9643 . 2 623 . 65 PHE HD1 H 6.8810 . 1 624 . 65 PHE HD2 H 6.8810 . 1 625 . 65 PHE HE1 H 7.1084 . 1 626 . 65 PHE HE2 H 7.1084 . 1 627 . 65 PHE HZ H 7.1226 . 1 628 . 65 PHE C C 175.9080 . 1 629 . 65 PHE CA C 57.9320 . 1 630 . 65 PHE CB C 35.4567 . 1 631 . 65 PHE CD1 C 129.4752 . 1 632 . 65 PHE CD2 C 129.4752 . 1 633 . 65 PHE CE1 C 131.1412 . 1 634 . 65 PHE CE2 C 131.1412 . 1 635 . 65 PHE CZ C 129.1190 . 1 636 . 65 PHE N N 122.8620 . 1 637 . 66 THR H H 8.3970 . 1 638 . 66 THR HA H 4.1431 . 1 639 . 66 THR HB H 4.3520 . 1 640 . 66 THR HG2 H 1.2823 . 1 641 . 66 THR C C 175.0277 . 1 642 . 66 THR CA C 67.0090 . 1 643 . 66 THR CB C 68.6120 . 1 644 . 66 THR CG2 C 21.2090 . 1 645 . 66 THR N N 118.0000 . 1 646 . 67 GLU H H 8.1830 . 1 647 . 67 GLU HA H 4.1437 . 1 648 . 67 GLU C C 174.4738 . 1 649 . 67 GLU CA C 59.7360 . 1 650 . 67 GLU CB C 28.6670 . 1 651 . 67 GLU N N 121.9820 . 1 652 . 68 THR H H 4.5021 . 1 653 . 68 THR HB H 4.5021 . 1 654 . 68 THR C C 177.4242 . 1 655 . 68 THR CA C 66.1860 . 1 656 . 68 THR CB C 69.0770 . 1 657 . 69 TRP H H 8.3800 . 1 658 . 69 TRP HA H 4.6660 . 1 659 . 69 TRP HB2 H 3.5650 . 2 660 . 69 TRP HB3 H 3.3280 . 2 661 . 69 TRP HD1 H 7.2200 . 1 662 . 69 TRP HZ2 H 7.0730 . 1 663 . 69 TRP HH2 H 6.8830 . 1 664 . 69 TRP CA C 60.5570 . 1 665 . 69 TRP CB C 28.6450 . 1 666 . 69 TRP CD1 C 127.3680 . 1 667 . 69 TRP CZ2 C 112.2960 . 1 668 . 69 TRP CH2 C 124.4400 . 1 669 . 69 TRP N N 122.2390 . 1 670 . 70 ASN H H 8.5400 . 1 671 . 70 ASN HA H 4.2960 . 1 672 . 70 ASN HB2 H 2.8990 . 2 673 . 70 ASN HB3 H 2.7050 . 2 674 . 70 ASN C C 176.5340 . 1 675 . 70 ASN CA C 55.4450 . 1 676 . 70 ASN CB C 37.4750 . 1 677 . 70 ASN N N 115.2570 . 1 678 . 71 ARG H H 8.1070 . 1 679 . 71 ARG HA H 3.8730 . 1 680 . 71 ARG HD2 H 2.9454 . 2 681 . 71 ARG C C 177.1140 . 1 682 . 71 ARG CA C 58.1650 . 1 683 . 71 ARG CB C 30.0290 . 1 684 . 71 ARG CD C 42.6690 . 1 685 . 71 ARG N N 118.6420 . 1 686 . 72 PHE H H 7.6450 . 1 687 . 72 PHE HA H 4.2640 . 1 688 . 72 PHE HB2 H 2.9970 . 2 689 . 72 PHE HB3 H 2.8880 . 2 690 . 72 PHE HD1 H 6.9830 . 1 691 . 72 PHE HD2 H 6.9830 . 1 692 . 72 PHE HE1 H 6.8410 . 1 693 . 72 PHE HE2 H 6.8410 . 1 694 . 72 PHE C C 178.2010 . 1 695 . 72 PHE CA C 59.6270 . 1 696 . 72 PHE CB C 39.7990 . 1 697 . 72 PHE CD1 C 131.9690 . 1 698 . 72 PHE CD2 C 131.9690 . 1 699 . 72 PHE CE1 C 131.1950 . 1 700 . 72 PHE CE2 C 131.1950 . 1 701 . 72 PHE N N 117.4860 . 1 702 . 73 ILE H H 7.8930 . 1 703 . 73 ILE HA H 3.7320 . 1 704 . 73 ILE HB H 0.9180 . 1 705 . 73 ILE HG13 H 1.0123 . 2 706 . 73 ILE HG2 H 0.2730 . 1 707 . 73 ILE HD1 H 0.3610 . 1 708 . 73 ILE C C 178.1820 . 1 709 . 73 ILE CA C 59.6270 . 1 710 . 73 ILE CB C 36.8550 . 1 711 . 73 ILE CG1 C 26.9370 . 1 712 . 73 ILE CG2 C 17.4920 . 1 713 . 73 ILE CD1 C 11.9150 . 1 714 . 73 ILE N N 116.7150 . 1 715 . 74 THR H H 7.3780 . 1 716 . 74 THR HA H 4.1080 . 1 717 . 74 THR HB H 4.0230 . 1 718 . 74 THR HG2 H 0.9710 . 1 719 . 74 THR C C 176.0267 . 1 720 . 74 THR CA C 62.4160 . 1 721 . 74 THR CB C 69.3860 . 1 722 . 74 THR CG2 C 20.7450 . 1 723 . 74 THR N N 114.1460 . 1 724 . 75 HIS H H 7.9430 . 1 725 . 75 HIS HA H 4.4570 . 1 726 . 75 HIS HB2 H 3.1070 . 2 727 . 75 HIS HB3 H 3.0020 . 2 728 . 75 HIS HD2 H 6.9253 . 1 729 . 75 HIS C C 179.5930 . 1 730 . 75 HIS CA C 55.9087 . 1 731 . 75 HIS CB C 29.2640 . 1 732 . 75 HIS CD2 C 119.5454 . 1 733 . 75 HIS N N 120.3120 . 1 734 . 76 THR H H 7.6300 . 1 735 . 76 THR HA H 4.1440 . 1 736 . 76 THR HG2 H 0.9690 . 1 737 . 76 THR CA C 61.8270 . 1 738 . 76 THR CB C 69.2160 . 1 739 . 76 THR CG2 C 20.9000 . 1 740 . 76 THR N N 113.3750 . 1 741 . 77 GLU H H 8.4270 . 1 742 . 77 GLU C C 177.9880 . 1 743 . 77 GLU CA C 56.6240 . 1 744 . 77 GLU CB C 29.1570 . 1 745 . 77 GLU CG C 35.3500 . 1 746 . 77 GLU N N 121.2120 . 1 747 . 78 HIS H H 8.1310 . 1 748 . 78 HIS HA H 4.5776 . 1 749 . 78 HIS HB2 H 2.9154 . 2 750 . 78 HIS HB3 H 6.9764 . 2 751 . 78 HIS HD2 H 6.8584 . 1 752 . 78 HIS CA C 55.9370 . 1 753 . 78 HIS CB C 29.5510 . 1 754 . 78 HIS CD2 C 120.3514 . 1 755 . 78 HIS N N 117.8720 . 1 756 . 79 VAL H H 7.8390 . 1 757 . 79 VAL HA H 3.9900 . 1 758 . 79 VAL HB H 2.0330 . 1 759 . 79 VAL HG1 H 0.8180 . 2 760 . 79 VAL C C 177.5122 . 1 761 . 79 VAL CA C 62.4540 . 1 762 . 79 VAL CB C 32.1230 . 1 763 . 79 VAL CG1 C 20.7450 . 1 764 . 79 VAL N N 118.0000 . 1 765 . 80 ASP H H 8.2060 . 1 766 . 80 ASP CA C 58.5450 . 1 767 . 80 ASP CB C 39.7830 . 1 768 . 80 ASP N N 121.5970 . 1 769 . 81 LEU H H 3.8807 . 1 770 . 81 LEU HA H 3.8807 . 1 771 . 81 LEU HB2 H 1.6023 . 2 772 . 81 LEU HB3 H 1.1612 . 2 773 . 81 LEU HD1 H 0.6664 . 2 774 . 81 LEU HD2 H 0.3557 . 2 775 . 81 LEU CA C 55.0337 . 1 776 . 81 LEU CB C 41.6570 . 1 777 . 81 LEU CD1 C 25.2450 . 1 778 . 81 LEU CD2 C 22.8750 . 1 779 . 82 ASP H H 8.1510 . 1 780 . 82 ASP C C 177.9560 . 1 781 . 82 ASP CA C 56.3970 . 1 782 . 82 ASP CB C 41.1830 . 1 783 . 82 ASP N N 118.5140 . 1 784 . 83 PHE H H 4.0610 . 1 785 . 83 PHE HA H 4.0610 . 1 786 . 83 PHE HB2 H 3.0130 . 2 787 . 83 PHE HD1 H 7.4760 . 1 788 . 83 PHE HD2 H 7.4760 . 1 789 . 83 PHE HE1 H 7.5380 . 1 790 . 83 PHE HE2 H 7.5380 . 1 791 . 83 PHE CA C 61.7960 . 1 792 . 83 PHE CB C 39.4890 . 1 793 . 83 PHE CD1 C 131.3500 . 1 794 . 83 PHE CD2 C 131.3500 . 1 795 . 83 PHE CE1 C 132.5890 . 1 796 . 83 PHE CE2 C 132.5890 . 1 797 . 84 ASN H H 8.5910 . 1 798 . 84 ASN HA H 4.3540 . 1 799 . 84 ASN HB2 H 2.9280 . 2 800 . 84 ASN HB3 H 2.7360 . 2 801 . 84 ASN C C 177.1140 . 1 802 . 84 ASN CA C 56.6840 . 1 803 . 84 ASN CB C 37.9780 . 1 804 . 84 ASN N N 118.3850 . 1 805 . 85 SER H H 7.8260 . 1 806 . 85 SER HA H 4.0120 . 1 807 . 85 SER HB2 H 3.7540 . 2 808 . 85 SER C C 178.1560 . 1 809 . 85 SER CA C 61.6180 . 1 810 . 85 SER CB C 62.0440 . 1 811 . 85 SER N N 114.0180 . 1 812 . 86 VAL H H 6.8620 . 1 813 . 86 VAL HA H 3.2730 . 1 814 . 86 VAL HB H 1.7160 . 1 815 . 86 VAL HG1 H 0.3790 . 2 816 . 86 VAL HG2 H -0.0500 . 2 817 . 86 VAL C C 177.7920 . 1 818 . 86 VAL CA C 65.0490 . 1 819 . 86 VAL CB C 30.8140 . 1 820 . 86 VAL CG1 C 21.3640 . 1 821 . 86 VAL CG2 C 20.2800 . 1 822 . 86 VAL N N 121.4690 . 1 823 . 87 PHE H H 7.7900 . 1 824 . 87 PHE HA H 3.3570 . 1 825 . 87 PHE HB2 H 2.7570 . 2 826 . 87 PHE HB3 H 2.0100 . 2 827 . 87 PHE HD1 H 5.7340 . 1 828 . 87 PHE HD2 H 5.7340 . 1 829 . 87 PHE HE1 H 6.4150 . 1 830 . 87 PHE HE2 H 6.4150 . 1 831 . 87 PHE HZ H 6.2610 . 1 832 . 87 PHE C C 177.1500 . 1 833 . 87 PHE CA C 61.7260 . 1 834 . 87 PHE CB C 38.0950 . 1 835 . 87 PHE CD1 C 131.6980 . 1 836 . 87 PHE CD2 C 131.6980 . 1 837 . 87 PHE CE1 C 129.9550 . 1 838 . 87 PHE CE2 C 129.9550 . 1 839 . 87 PHE CZ C 9.2810 . 1 840 . 87 PHE N N 121.6930 . 1 841 . 88 LEU H H 8.0010 . 1 842 . 88 LEU HA H 3.6930 . 1 843 . 88 LEU HB2 H 1.7100 . 2 844 . 88 LEU HB3 H 1.3490 . 2 845 . 88 LEU HG H 1.7670 . 1 846 . 88 LEU HD1 H 0.7510 . 2 847 . 88 LEU HD2 H 0.7290 . 2 848 . 88 LEU C C 179.5620 . 1 849 . 88 LEU CA C 57.5050 . 1 850 . 88 LEU CB C 41.5030 . 1 851 . 88 LEU CG C 26.5380 . 1 852 . 88 LEU CD1 C 24.7570 . 1 853 . 88 LEU CD2 C 22.9130 . 1 854 . 88 LEU N N 117.4860 . 1 855 . 89 GLU C C 176.7360 . 1 856 . 89 GLU CA C 59.7000 . 1 857 . 89 GLU CB C 29.0550 . 1 858 . 89 GLU CG C 35.3100 . 1 859 . 90 ILE H H 7.9820 . 1 860 . 90 ILE HA H 3.6560 . 1 861 . 90 ILE HB H 1.5880 . 1 862 . 90 ILE HG12 H 0.8290 . 1 863 . 90 ILE HG13 H 1.4610 . 2 864 . 90 ILE HG2 H 0.8320 . 1 865 . 90 ILE HD1 H 0.3110 . 1 866 . 90 ILE C C 178.2580 . 1 867 . 90 ILE CA C 63.8100 . 1 868 . 90 ILE CB C 38.0480 . 1 869 . 90 ILE CG1 C 28.0250 . 1 870 . 90 ILE CG2 C 16.7050 . 1 871 . 90 ILE CD1 C 11.9850 . 1 872 . 90 ILE N N 116.2020 . 1 873 . 91 PHE H H 8.6270 . 1 874 . 91 PHE HA H 4.6900 . 1 875 . 91 PHE HB2 H 3.0153 . 2 876 . 91 PHE HB3 H 2.6860 . 2 877 . 91 PHE HD1 H 6.9890 . 1 878 . 91 PHE HD2 H 6.9890 . 1 879 . 91 PHE HE1 H 6.6163 . 1 880 . 91 PHE HE2 H 6.6163 . 1 881 . 91 PHE CA C 56.5990 . 1 882 . 91 PHE CB C 39.2800 . 1 883 . 91 PHE CD1 C 133.2090 . 1 884 . 91 PHE CD2 C 133.2090 . 1 885 . 91 PHE N N 120.9550 . 1 886 . 94 GLY C C 181.5186 . 1 887 . 94 GLY CA C 44.0500 . 1 888 . 95 ASP H H 7.9240 . 1 889 . 95 ASP HA H 4.8630 . 1 890 . 95 ASP HB2 H 2.9210 . 2 891 . 95 ASP HB3 H 2.5480 . 2 892 . 95 ASP CA C 52.6560 . 1 893 . 95 ASP CB C 40.0390 . 1 894 . 95 ASP N N 120.0940 . 1 895 . 96 PRO C C 179.4120 . 1 896 . 96 PRO CA C 62.4190 . 1 897 . 96 PRO CB C 30.7880 . 1 898 . 97 SER H H 6.2360 . 1 899 . 97 SER HA H 4.5320 . 1 900 . 97 SER HB2 H 4.0490 . 2 901 . 97 SER HB3 H 3.7920 . 2 902 . 97 SER C C 180.6230 . 1 903 . 97 SER CA C 56.0800 . 1 904 . 97 SER CB C 65.9780 . 1 905 . 97 SER N N 109.9070 . 1 906 . 98 LEU H H 9.4700 . 1 907 . 98 LEU HA H 4.3150 . 1 908 . 98 LEU HB2 H 1.9650 . 2 909 . 98 LEU HB3 H 1.7970 . 2 910 . 98 LEU HG H 1.7300 . 1 911 . 98 LEU HD1 H 1.1490 . 2 912 . 98 LEU HD2 H 1.0200 . 2 913 . 98 LEU C C 176.1460 . 1 914 . 98 LEU CA C 57.9230 . 1 915 . 98 LEU CB C 41.1930 . 1 916 . 98 LEU CG C 26.7860 . 1 917 . 98 LEU CD1 C 23.3780 . 1 918 . 98 LEU CD2 C 25.5470 . 1 919 . 98 LEU N N 123.3310 . 1 920 . 99 GLY H H 8.8140 . 1 921 . 99 GLY HA2 H 3.9040 . 2 922 . 99 GLY HA3 H 3.7250 . 2 923 . 99 GLY C C 177.1390 . 1 924 . 99 GLY CA C 46.9240 . 1 925 . 99 GLY N N 105.1540 . 1 926 . 100 ARG H H 7.5530 . 1 927 . 100 ARG C C 176.6430 . 1 928 . 100 ARG CA C 58.5120 . 1 929 . 100 ARG CB C 30.2440 . 1 930 . 100 ARG CD C 42.3830 . 1 931 . 100 ARG N N 120.1970 . 1 932 . 101 ALA H H 8.1550 . 1 933 . 101 ALA HA H 4.1510 . 1 934 . 101 ALA HB H 1.6960 . 1 935 . 101 ALA C C 174.4790 . 1 936 . 101 ALA CA C 55.4450 . 1 937 . 101 ALA CB C 18.2660 . 1 938 . 101 ALA N N 122.3680 . 1 939 . 102 LEU H H 8.9480 . 1 940 . 102 LEU HA H 4.0940 . 1 941 . 102 LEU HB2 H 2.0030 . 2 942 . 102 LEU HB3 H 1.3510 . 2 943 . 102 LEU HG H 2.1787 . 1 944 . 102 LEU HD1 H 1.0910 . 2 945 . 102 LEU HD2 H 0.9790 . 2 946 . 102 LEU C C 175.6900 . 1 947 . 102 LEU CA C 57.4510 . 1 948 . 102 LEU CB C 40.8830 . 1 949 . 102 LEU CG C 26.4030 . 1 950 . 102 LEU CD1 C 22.1620 . 1 951 . 102 LEU CD2 C 26.1670 . 1 952 . 102 LEU N N 115.0520 . 1 953 . 103 ALA H H 8.0290 . 1 954 . 103 ALA HA H 4.1450 . 1 955 . 103 ALA HB H 1.6240 . 1 956 . 103 ALA C C 175.3430 . 1 957 . 103 ALA CA C 55.8780 . 1 958 . 103 ALA CB C 17.1820 . 1 959 . 103 ALA N N 120.9550 . 1 960 . 104 TRP H H 7.8930 . 1 961 . 104 TRP HA H 4.1210 . 1 962 . 104 TRP HB2 H 3.5720 . 2 963 . 104 TRP HB3 H 3.1800 . 2 964 . 104 TRP HD1 H 6.9210 . 1 965 . 104 TRP HE1 H 10.3528 . 1 966 . 104 TRP HZ2 H 7.3241 . 1 967 . 104 TRP HZ3 H 6.5548 . 1 968 . 104 TRP HH2 H 7.0874 . 1 969 . 104 TRP C C 177.6370 . 1 970 . 104 TRP CA C 59.5390 . 1 971 . 104 TRP CB C 28.3350 . 1 972 . 104 TRP CD1 C 126.2370 . 1 973 . 104 TRP CZ2 C 115.5494 . 1 974 . 104 TRP CZ3 C 122.1254 . 1 975 . 104 TRP CH2 C 123.6044 . 1 976 . 104 TRP N N 129.1600 . 1 977 . 104 TRP NE1 N 129.1600 . 1 978 . 105 MET H H 7.8660 . 1 979 . 105 MET HA H 4.0916 . 1 980 . 105 MET HB2 H 1.6272 . 2 981 . 105 MET HB3 H 2.2552 . 2 982 . 105 MET HG2 H 2.8810 . 2 983 . 105 MET HG3 H 2.4494 . 2 984 . 105 MET HE H 2.0045 . 1 985 . 105 MET C C 176.7789 . 1 986 . 105 MET CA C 57.4230 . 1 987 . 105 MET CB C 32.7350 . 1 988 . 105 MET CG C 32.8740 . 1 989 . 105 MET CE C 16.4610 . 1 990 . 105 MET N N 116.2020 . 1 991 . 106 ALA H H 8.9380 . 1 992 . 106 ALA HA H 3.7540 . 1 993 . 106 ALA HB H 1.6400 . 1 994 . 106 ALA CA C 54.9490 . 1 995 . 106 ALA CB C 18.8860 . 1 996 . 106 ALA N N 119.7540 . 1 997 . 107 TRP H H 8.4920 . 1 998 . 107 TRP HA H 4.6690 . 1 999 . 107 TRP HB2 H 2.9550 . 2 1000 . 107 TRP HD1 H 6.3912 . 1 1001 . 107 TRP HE3 H 7.0900 . 1 1002 . 107 TRP HZ2 H 7.1798 . 1 1003 . 107 TRP HZ3 H 6.8669 . 1 1004 . 107 TRP HH2 H 7.1306 . 1 1005 . 107 TRP CA C 58.2330 . 1 1006 . 107 TRP CB C 27.4060 . 1 1007 . 107 TRP CD1 C 125.9280 . 1 1008 . 107 TRP CZ2 C 114.3094 . 1 1009 . 107 TRP CZ3 C 121.4354 . 1 1010 . 107 TRP CH2 C 123.6194 . 1 1011 . 107 TRP N N 121.3400 . 1 1012 . 108 CYS H H 7.8820 . 1 1013 . 108 CYS HA H 2.9077 . 1 1014 . 108 CYS CA C 62.4230 . 1 1015 . 108 CYS N N 116.0730 . 1 1016 . 109 MET H H 8.2450 . 1 1017 . 109 MET HA H 3.6850 . 1 1018 . 109 MET HB2 H 1.9980 . 2 1019 . 109 MET HB3 H 1.6590 . 2 1020 . 109 MET HG2 H 2.4450 . 2 1021 . 109 MET HE H 1.6816 . 1 1022 . 109 MET CA C 59.4720 . 1 1023 . 109 MET CB C 34.3840 . 1 1024 . 109 MET CG C 32.1930 . 1 1025 . 109 MET CE C 17.9640 . 1 1026 . 109 MET N N 120.0550 . 1 1027 . 110 HIS H H 8.6120 . 1 1028 . 110 HIS HA H 3.5801 . 1 1029 . 110 HIS HD2 H 6.4605 . 1 1030 . 110 HIS HE1 H 7.3692 . 1 1031 . 110 HIS CA C 60.1927 . 1 1032 . 110 HIS CB C 29.5020 . 1 1033 . 110 HIS CE1 C 138.1502 . 1 1034 . 110 HIS N N 119.6700 . 1 1035 . 111 ALA H H 7.9060 . 1 1036 . 111 ALA HA H 4.0990 . 1 1037 . 111 ALA HB H 1.2470 . 1 1038 . 111 ALA C C 175.5643 . 1 1039 . 111 ALA CA C 54.1940 . 1 1040 . 111 ALA CB C 16.3370 . 1 1041 . 111 ALA N N 120.3120 . 1 1042 . 112 CYS H H 8.1620 . 1 1043 . 112 CYS HA H 3.4780 . 1 1044 . 112 CYS HB2 H 2.7310 . 2 1045 . 112 CYS HB3 H 2.3970 . 2 1046 . 112 CYS C C 178.8320 . 1 1047 . 112 CYS CA C 63.8100 . 1 1048 . 112 CYS CB C 26.1670 . 1 1049 . 112 CYS N N 115.8290 . 1 1050 . 113 ARG H H 7.8390 . 1 1051 . 113 ARG HA H 3.7070 . 1 1052 . 113 ARG HB2 H 2.0010 . 2 1053 . 113 ARG HB3 H 1.4330 . 2 1054 . 113 ARG HG2 H 1.4130 . 2 1055 . 113 ARG HG3 H 1.2860 . 2 1056 . 113 ARG HD2 H 2.6458 . 2 1057 . 113 ARG C C 176.0420 . 1 1058 . 113 ARG CA C 59.3600 . 1 1059 . 113 ARG CB C 30.8530 . 1 1060 . 113 ARG CG C 24.3930 . 1 1061 . 113 ARG CD C 44.2830 . 1 1062 . 113 ARG N N 120.4990 . 1 1063 . 114 THR H H 7.4890 . 1 1064 . 114 THR HA H 3.4110 . 1 1065 . 114 THR HB H 3.5790 . 1 1066 . 114 THR HG2 H 0.7640 . 1 1067 . 114 THR C C 179.6600 . 1 1068 . 114 THR CA C 65.6690 . 1 1069 . 114 THR CB C 68.1240 . 1 1070 . 114 THR CG2 C 20.2410 . 1 1071 . 114 THR N N 114.2750 . 1 1072 . 115 LEU H H 7.7210 . 1 1073 . 115 LEU HA H 3.9140 . 1 1074 . 115 LEU HB2 H 1.7490 . 2 1075 . 115 LEU HB3 H 1.1670 . 2 1076 . 115 LEU HD1 H 0.8330 . 2 1077 . 115 LEU HD2 H 0.6700 . 2 1078 . 115 LEU C C 175.6640 . 1 1079 . 115 LEU CA C 56.9940 . 1 1080 . 115 LEU CB C 43.6170 . 1 1081 . 115 LEU CG C 22.7330 . 1 1082 . 115 LEU CD1 C 23.2230 . 1 1083 . 115 LEU CD2 C 26.0120 . 1 1084 . 115 LEU N N 119.3360 . 1 1085 . 116 CYS H H 8.1980 . 1 1086 . 116 CYS HA H 4.0000 . 1 1087 . 116 CYS HB2 H 2.8690 . 2 1088 . 116 CYS C C 178.0710 . 1 1089 . 116 CYS CA C 62.1440 . 1 1090 . 116 CYS CB C 27.2660 . 1 1091 . 116 CYS N N 112.2710 . 1 1092 . 117 CYS H H 7.7750 . 1 1093 . 117 CYS HA H 4.4330 . 1 1094 . 117 CYS HB2 H 2.9030 . 2 1095 . 117 CYS HB3 H 2.5530 . 2 1096 . 117 CYS C C 180.7160 . 1 1097 . 117 CYS CA C 59.8750 . 1 1098 . 117 CYS CB C 26.7550 . 1 1099 . 117 CYS N N 114.4030 . 1 1100 . 118 ASN H H 7.0380 . 1 1101 . 118 ASN HA H 4.7380 . 1 1102 . 118 ASN HB2 H 2.9780 . 2 1103 . 118 ASN HB3 H 2.6870 . 2 1104 . 118 ASN C C 178.9930 . 1 1105 . 118 ASN CA C 52.1220 . 1 1106 . 118 ASN CB C 38.5590 . 1 1107 . 118 ASN N N 117.4480 . 1 1108 . 119 GLN H H 4.2440 . 1 1109 . 119 GLN HA H 4.2440 . 1 1110 . 119 GLN C C 178.1437 . 1 1111 . 119 GLN CA C 56.6000 . 1 1112 . 119 GLN CG C 33.3110 . 1 1113 . 120 SER H H 8.3800 . 1 1114 . 120 SER HA H 4.4070 . 1 1115 . 120 SER HB2 H 3.8790 . 2 1116 . 120 SER CA C 58.3880 . 1 1117 . 120 SER CB C 63.3450 . 1 1118 . 120 SER N N 112.8610 . 1 1119 . 121 THR H H 7.7280 . 1 1120 . 121 THR HA H 4.2820 . 1 1121 . 121 THR HB H 3.9350 . 1 1122 . 121 THR HG2 H 1.1810 . 1 1123 . 121 THR C C 182.0880 . 1 1124 . 121 THR CA C 61.0210 . 1 1125 . 121 THR CB C 69.3170 . 1 1126 . 121 THR CG2 C 22.5880 . 1 1127 . 121 THR N N 121.9820 . 1 1128 . 122 PRO HA H 4.4270 . 1 1129 . 122 PRO HB2 H 2.4700 . 2 1130 . 122 PRO HB3 H 1.5540 . 2 1131 . 122 PRO HG2 H 2.0210 . 2 1132 . 122 PRO HD2 H 4.1400 . 2 1133 . 122 PRO HD3 H 3.4070 . 2 1134 . 122 PRO C C 177.0830 . 1 1135 . 122 PRO CA C 62.8800 . 1 1136 . 122 PRO CB C 32.6730 . 1 1137 . 122 PRO CG C 27.5610 . 1 1138 . 122 PRO CD C 51.2080 . 1 1139 . 123 TYR H H 9.0460 . 1 1140 . 123 TYR HA H 3.9210 . 1 1141 . 123 TYR HB2 H 3.1380 . 2 1142 . 123 TYR HD1 H 7.0410 . 1 1143 . 123 TYR HD2 H 7.0410 . 1 1144 . 123 TYR HE1 H 6.6490 . 1 1145 . 123 TYR HE2 H 6.6490 . 1 1146 . 123 TYR C C 176.4980 . 1 1147 . 123 TYR CA C 62.1060 . 1 1148 . 123 TYR CB C 37.8540 . 1 1149 . 123 TYR CD1 C 133.2090 . 1 1150 . 123 TYR CD2 C 133.2090 . 1 1151 . 123 TYR CE1 C 118.3370 . 1 1152 . 123 TYR CE2 C 118.3370 . 1 1153 . 123 TYR N N 126.0160 . 1 1154 . 124 TYR H H 8.5080 . 1 1155 . 124 TYR HA H 4.4520 . 1 1156 . 124 TYR HB2 H 3.2870 . 2 1157 . 124 TYR HB3 H 3.0610 . 2 1158 . 124 TYR HD1 H 7.1470 . 1 1159 . 124 TYR HD2 H 7.1470 . 1 1160 . 124 TYR HE1 H 6.7820 . 1 1161 . 124 TYR HE2 H 6.7820 . 1 1162 . 124 TYR C C 177.5640 . 1 1163 . 124 TYR CA C 59.9370 . 1 1164 . 124 TYR CB C 36.6690 . 1 1165 . 124 TYR CD1 C 133.6730 . 1 1166 . 124 TYR CD2 C 133.6730 . 1 1167 . 124 TYR CE1 C 118.6470 . 1 1168 . 124 TYR CE2 C 118.6470 . 1 1169 . 124 TYR N N 113.3370 . 1 1170 . 125 VAL H H 6.5570 . 1 1171 . 125 VAL HA H 3.3700 . 1 1172 . 125 VAL HB H 1.8080 . 1 1173 . 125 VAL HG1 H 0.7400 . 2 1174 . 125 VAL HG2 H 0.4840 . 2 1175 . 125 VAL C C 175.6130 . 1 1176 . 125 VAL CA C 65.3590 . 1 1177 . 125 VAL CB C 31.1240 . 1 1178 . 125 VAL CG1 C 20.4350 . 1 1179 . 125 VAL CG2 C 21.9920 . 1 1180 . 125 VAL N N 120.2550 . 1 1181 . 126 VAL H H 7.2310 . 1 1182 . 126 VAL HA H 3.1800 . 1 1183 . 126 VAL HB H 1.6440 . 1 1184 . 126 VAL HG1 H 0.5900 . 2 1185 . 126 VAL HG2 H 0.0010 . 2 1186 . 126 VAL C C 177.6570 . 1 1187 . 126 VAL CA C 67.2180 . 1 1188 . 126 VAL CB C 30.9690 . 1 1189 . 126 VAL CG1 C 21.9840 . 1 1190 . 126 VAL CG2 C 20.9460 . 1 1191 . 126 VAL N N 122.1690 . 1 1192 . 127 ASP H H 8.2460 . 1 1193 . 127 ASP HA H 4.0880 . 1 1194 . 127 ASP HB2 H 2.6550 . 2 1195 . 127 ASP HB3 H 2.3140 . 2 1196 . 127 ASP C C 177.1500 . 1 1197 . 127 ASP CA C 57.5130 . 1 1198 . 127 ASP CB C 42.1220 . 1 1199 . 127 ASP N N 117.4540 . 1 1200 . 128 LEU H H 8.0120 . 1 1201 . 128 LEU HA H 3.9380 . 1 1202 . 128 LEU HB2 H 1.8370 . 2 1203 . 128 LEU HB3 H 1.6100 . 2 1204 . 128 LEU HD1 H 0.9260 . 2 1205 . 128 LEU HD2 H 0.9671 . 2 1206 . 128 LEU C C 173.4590 . 1 1207 . 128 LEU CA C 57.7680 . 1 1208 . 128 LEU CB C 42.0140 . 1 1209 . 128 LEU CD1 C 23.8430 . 1 1210 . 128 LEU CD2 C 25.0590 . 1 1211 . 128 LEU N N 115.8160 . 1 1212 . 129 SER H H 7.9800 . 1 1213 . 129 SER HA H 4.4270 . 1 1214 . 129 SER HB2 H 3.9370 . 2 1215 . 129 SER HB3 H 3.5830 . 2 1216 . 129 SER C C 179.8160 . 1 1217 . 129 SER CA C 62.5700 . 1 1218 . 129 SER CB C 63.0350 . 1 1219 . 129 SER N N 116.0730 . 1 1220 . 130 VAL H H 8.5090 . 1 1221 . 130 VAL HA H 3.1940 . 1 1222 . 130 VAL HB H 1.7750 . 1 1223 . 130 VAL HG1 H 0.5980 . 2 1224 . 130 VAL HG2 H 0.4960 . 2 1225 . 130 VAL C C 176.9890 . 1 1226 . 130 VAL CA C 67.2180 . 1 1227 . 130 VAL CB C 30.6590 . 1 1228 . 130 VAL CG1 C 22.9870 . 1 1229 . 130 VAL CG2 C 19.8150 . 1 1230 . 130 VAL N N 122.3680 . 1 1231 . 131 ARG H H 7.8520 . 1 1232 . 131 ARG HA H 3.7350 . 1 1233 . 131 ARG HD2 H 3.1380 . 2 1234 . 131 ARG HD3 H 2.9320 . 2 1235 . 131 ARG C C 175.0070 . 1 1236 . 131 ARG CA C 60.0920 . 1 1237 . 131 ARG CB C 29.1100 . 1 1238 . 131 ARG CD C 43.0520 . 1 1239 . 131 ARG N N 116.3300 . 1 1240 . 132 GLY H H 7.9940 . 1 1241 . 132 GLY HA2 H 3.9100 . 2 1242 . 132 GLY HA3 H 3.6730 . 2 1243 . 132 GLY C C 177.8440 . 1 1244 . 132 GLY CA C 46.4210 . 1 1245 . 132 GLY N N 106.0530 . 1 1246 . 133 MET H H 8.0750 . 1 1247 . 133 MET HA H 3.7232 . 1 1248 . 133 MET HB3 H 1.9956 . 2 1249 . 133 MET HE H 1.4830 . 1 1250 . 133 MET CA C 59.7310 . 1 1251 . 133 MET CB C 32.2990 . 1 1252 . 133 MET CE C 15.9500 . 1 1253 . 133 MET N N 122.0400 . 1 1254 . 134 LEU C C 176.0320 . 1 1255 . 134 LEU CA C 57.9600 . 1 1256 . 134 LEU CB C 39.9200 . 1 1257 . 135 GLU H H 8.0210 . 1 1258 . 135 GLU C C 174.3840 . 1 1259 . 135 GLU CA C 58.8240 . 1 1260 . 135 GLU CB C 28.6000 . 1 1261 . 135 GLU CG C 35.7000 . 1 1262 . 135 GLU N N 117.8720 . 1 1263 . 136 ALA H H 8.0860 . 1 1264 . 136 ALA HA H 3.8930 . 1 1265 . 136 ALA HB H 1.2566 . 1 1266 . 136 ALA C C 174.6960 . 1 1267 . 136 ALA CA C 53.8800 . 1 1268 . 136 ALA CB C 17.6470 . 1 1269 . 136 ALA N N 120.1840 . 1 1270 . 137 SER H H 7.6190 . 1 1271 . 137 SER HA H 4.1430 . 1 1272 . 137 SER C C 180.6990 . 1 1273 . 137 SER CA C 61.7960 . 1 1274 . 137 SER CB C 63.0910 . 1 1275 . 137 SER N N 111.5770 . 1 1276 . 138 GLU H H 7.1780 . 1 1277 . 138 GLU HA H 4.1200 . 1 1278 . 138 GLU HB2 H 2.0930 . 2 1279 . 138 GLU HB3 H 1.9950 . 2 1280 . 138 GLU HG2 H 2.5930 . 2 1281 . 138 GLU HG3 H 2.3530 . 2 1282 . 138 GLU C C 175.5660 . 1 1283 . 138 GLU CA C 58.2330 . 1 1284 . 138 GLU CB C 28.3350 . 1 1285 . 138 GLU CG C 36.2360 . 1 1286 . 138 GLU N N 119.6700 . 1 1287 . 139 GLY H H 7.5020 . 1 1288 . 139 GLY HA2 H 3.9220 . 2 1289 . 139 GLY HA3 H 3.3920 . 2 1290 . 139 GLY C C 179.6450 . 1 1291 . 139 GLY CA C 45.5610 . 1 1292 . 139 GLY N N 103.8690 . 1 1293 . 140 LEU H H 7.6550 . 1 1294 . 140 LEU HA H 4.2730 . 1 1295 . 140 LEU HB2 H 2.0130 . 2 1296 . 140 LEU HB3 H 1.8160 . 2 1297 . 140 LEU HD1 H 1.0120 . 2 1298 . 140 LEU HD2 H 0.4810 . 2 1299 . 140 LEU C C 177.4630 . 1 1300 . 140 LEU CA C 55.1350 . 1 1301 . 140 LEU CB C 42.8970 . 1 1302 . 140 LEU CG C 26.9940 . 1 1303 . 140 LEU CD1 C 25.5470 . 1 1304 . 140 LEU CD2 C 23.7810 . 1 1305 . 140 LEU N N 120.1070 . 1 1306 . 141 ASP H H 7.3690 . 1 1307 . 141 ASP HA H 4.2710 . 1 1308 . 141 ASP HB2 H 2.7990 . 2 1309 . 141 ASP HB3 H 2.5970 . 2 1310 . 141 ASP C C 176.2230 . 1 1311 . 141 ASP CA C 58.6980 . 1 1312 . 141 ASP CB C 39.7990 . 1 1313 . 141 ASP N N 116.6960 . 1 1314 . 142 GLY H H 8.7050 . 1 1315 . 142 GLY HA2 H 3.8930 . 2 1316 . 142 GLY HA3 H 3.7550 . 2 1317 . 142 GLY C C 178.3920 . 1 1318 . 142 GLY CA C 47.0640 . 1 1319 . 142 GLY N N 108.0570 . 1 1320 . 143 TRP H H 8.6560 . 1 1321 . 143 TRP HA H 4.1030 . 1 1322 . 143 TRP HB2 H 3.4240 . 2 1323 . 143 TRP HB3 H 3.1800 . 2 1324 . 143 TRP HD1 H 7.2430 . 1 1325 . 143 TRP HE1 H 10.1897 . 1 1326 . 143 TRP HE3 H 7.0830 . 1 1327 . 143 TRP HZ2 H 7.1840 . 1 1328 . 143 TRP HZ3 H 6.5180 . 1 1329 . 143 TRP HH2 H 6.7730 . 1 1330 . 143 TRP C C 175.9650 . 1 1331 . 143 TRP CA C 62.4000 . 1 1332 . 143 TRP CB C 27.8710 . 1 1333 . 143 TRP CD1 C 126.8800 . 1 1334 . 143 TRP CE3 C 40.1390 . 1 1335 . 143 TRP CZ2 C 113.8450 . 1 1336 . 143 TRP CZ3 C 120.9470 . 1 1337 . 143 TRP CH2 C 123.3720 . 1 1338 . 143 TRP N N 130.7270 . 1 1339 . 143 TRP NE1 N 130.7270 . 1 1340 . 144 ILE H H 8.3500 . 1 1341 . 144 ILE HA H 2.9410 . 1 1342 . 144 ILE HB H 1.7550 . 1 1343 . 144 ILE HG12 H 0.7130 . 1 1344 . 144 ILE HG13 H 1.2080 . 2 1345 . 144 ILE HG2 H -0.1630 . 1 1346 . 144 ILE HD1 H -0.4954 . 1 1347 . 144 ILE C C 174.8930 . 1 1348 . 144 ILE CA C 61.1760 . 1 1349 . 144 ILE CB C 34.4230 . 1 1350 . 144 ILE CG1 C 26.6310 . 1 1351 . 144 ILE CG2 C 15.9430 . 1 1352 . 144 ILE CD1 C 8.5070 . 1 1353 . 144 ILE N N 117.8520 . 1 1354 . 145 HIS H H 8.3970 . 1 1355 . 145 HIS HA H 3.9920 . 1 1356 . 145 HIS HB2 H 3.1300 . 2 1357 . 145 HIS HD2 H 6.8660 . 1 1358 . 145 HIS C C 174.7740 . 1 1359 . 145 HIS CA C 59.8050 . 1 1360 . 145 HIS CB C 29.7290 . 1 1361 . 145 HIS CD2 C 119.2660 . 1 1362 . 145 HIS N N 119.7980 . 1 1363 . 146 GLN H H 7.5290 . 1 1364 . 146 GLN HA H 3.7880 . 1 1365 . 146 GLN HB2 H 2.0230 . 2 1366 . 146 GLN HB3 H 1.9830 . 2 1367 . 146 GLN HG2 H 2.4220 . 2 1368 . 146 GLN HG3 H 2.2630 . 2 1369 . 146 GLN C C 177.5950 . 1 1370 . 146 GLN CA C 57.7680 . 1 1371 . 146 GLN CB C 27.5610 . 1 1372 . 146 GLN CG C 33.4630 . 1 1373 . 146 GLN N N 119.0280 . 1 1374 . 147 GLN H H 7.0840 . 1 1375 . 147 GLN HA H 3.8600 . 1 1376 . 147 GLN HB3 H 0.5590 . 2 1377 . 147 GLN HG2 H 1.1740 . 2 1378 . 147 GLN HG3 H 0.5820 . 2 1379 . 147 GLN C C 179.2000 . 1 1380 . 147 GLN CA C 53.6860 . 1 1381 . 147 GLN CB C 30.7750 . 1 1382 . 147 GLN CG C 30.7980 . 1 1383 . 147 GLN N N 114.1460 . 1 1384 . 148 GLY H H 7.2150 . 1 1385 . 148 GLY HA2 H 4.2520 . 2 1386 . 148 GLY HA3 H 3.4470 . 2 1387 . 148 GLY C C 179.2050 . 1 1388 . 148 GLY CA C 44.1360 . 1 1389 . 148 GLY N N 103.4840 . 1 1390 . 149 GLY H H 7.7280 . 1 1391 . 149 GLY HA2 H 4.4200 . 2 1392 . 149 GLY HA3 H 3.4040 . 2 1393 . 149 GLY CA C 43.5160 . 1 1394 . 149 GLY N N 107.8510 . 1 1395 . 150 TRP H H 8.0580 . 1 1396 . 150 TRP HA H 4.2340 . 1 1397 . 150 TRP HB2 H 3.1770 . 2 1398 . 150 TRP HB3 H 3.0060 . 2 1399 . 150 TRP HD1 H 7.2119 . 1 1400 . 150 TRP HE1 H 10.0122 . 1 1401 . 150 TRP HE3 H 7.7655 . 1 1402 . 150 TRP HZ2 H 7.5700 . 1 1403 . 150 TRP HZ3 H 6.7360 . 1 1404 . 150 TRP HH2 H 6.9500 . 1 1405 . 150 TRP CA C 60.0920 . 1 1406 . 150 TRP CB C 30.1790 . 1 1407 . 150 TRP CD1 C 117.8720 . 1 1408 . 150 TRP CE3 C 121.1201 . 1 1409 . 150 TRP CZ2 C 114.7250 . 1 1410 . 150 TRP CZ3 C 120.9550 . 1 1411 . 150 TRP CH2 C 124.1460 . 1 1412 . 150 TRP N N 128.6910 . 1 1413 . 150 TRP NE1 N 128.6910 . 1 1414 . 151 SER H H 4.3024 . 1 1415 . 151 SER HA H 4.3024 . 1 1416 . 151 SER HB2 H 4.0043 . 2 1417 . 151 SER HB3 H 3.9381 . 2 1418 . 151 SER CA C 61.9347 . 1 1419 . 151 SER CB C 61.9462 . 1 1420 . 152 THR H H 7.3980 . 1 1421 . 152 THR HA H 4.1280 . 1 1422 . 152 THR HB H 3.9490 . 1 1423 . 152 THR HG2 H 1.1120 . 1 1424 . 152 THR C C 178.4802 . 1 1425 . 152 THR CA C 63.9650 . 1 1426 . 152 THR CB C 68.6120 . 1 1427 . 152 THR CG2 C 21.4500 . 1 1428 . 152 THR N N 115.0450 . 1 1429 . 153 LEU H H 7.2690 . 1 1430 . 153 LEU HA H 3.9832 . 1 1431 . 153 LEU HB2 H 2.6147 . 2 1432 . 153 LEU HB3 H 2.4982 . 2 1433 . 153 LEU HG H 1.5600 . 1 1434 . 153 LEU HD1 H 0.7330 . 2 1435 . 153 LEU HD2 H 0.4830 . 2 1436 . 153 LEU C C 177.1550 . 1 1437 . 153 LEU CA C 57.1490 . 1 1438 . 153 LEU CB C 42.1220 . 1 1439 . 153 LEU CG C 26.4120 . 1 1440 . 153 LEU CD1 C 23.5330 . 1 1441 . 153 LEU CD2 C 25.3070 . 1 1442 . 153 LEU N N 120.0550 . 1 1443 . 154 ILE H H 6.9320 . 1 1444 . 154 ILE HA H 4.2340 . 1 1445 . 154 ILE HB H 1.7010 . 1 1446 . 154 ILE HG12 H 0.8730 . 1 1447 . 154 ILE HG13 H 1.1700 . 2 1448 . 154 ILE HG2 H 0.7670 . 1 1449 . 154 ILE HD1 H 0.1900 . 1 1450 . 154 ILE C C 179.0390 . 1 1451 . 154 ILE CA C 59.0080 . 1 1452 . 154 ILE CB C 38.3890 . 1 1453 . 154 ILE CG1 C 28.0250 . 1 1454 . 154 ILE CG2 C 17.1820 . 1 1455 . 154 ILE CD1 C 12.9990 . 1 1456 . 154 ILE N N 112.1870 . 1 1457 . 155 GLU H H 7.5010 . 1 1458 . 155 GLU HA H 4.1720 . 1 1459 . 155 GLU HB2 H 1.9450 . 2 1460 . 155 GLU HG2 H 2.4150 . 2 1461 . 155 GLU HG3 H 2.2830 . 2 1462 . 155 GLU C C 178.0040 . 1 1463 . 155 GLU CA C 56.0770 . 1 1464 . 155 GLU CB C 29.1860 . 1 1465 . 155 GLU CG C 35.6570 . 1 1466 . 155 GLU N N 121.3400 . 1 1467 . 156 ASP H H 8.0810 . 1 1468 . 156 ASP HA H 4.5190 . 1 1469 . 156 ASP HB2 H 2.6147 . 2 1470 . 156 ASP HB3 H 2.4982 . 2 1471 . 156 ASP C C 178.8420 . 1 1472 . 156 ASP CA C 53.8960 . 1 1473 . 156 ASP CB C 40.2880 . 1 1474 . 156 ASP N N 119.3490 . 1 1475 . 157 ASN H H 8.0550 . 1 1476 . 157 ASN HA H 4.0350 . 1 1477 . 157 ASN HB2 H 1.5420 . 2 1478 . 157 ASN HB3 H 1.4140 . 2 1479 . 157 ASN C C 176.5290 . 1 1480 . 157 ASN CA C 55.7230 . 1 1481 . 157 ASN CB C 1.9620 . 1 1482 . 157 ASN N N 121.4110 . 1 1483 . 158 ILE H H 4.3410 . 1 1484 . 158 ILE HA H 4.3410 . 1 1485 . 158 ILE HB H 1.7980 . 1 1486 . 158 ILE HG12 H 1.0610 . 1 1487 . 158 ILE HG13 H 1.4280 . 2 1488 . 158 ILE HG2 H 0.8280 . 1 1489 . 158 ILE HD1 H 0.7740 . 1 1490 . 158 ILE CA C 58.2330 . 1 1491 . 158 ILE CB C 37.9400 . 1 1492 . 158 ILE CG1 C 26.6310 . 1 1493 . 158 ILE CG2 C 16.6860 . 1 1494 . 158 ILE CD1 C 12.0700 . 1 1495 . 159 PRO HA H 4.3190 . 1 1496 . 159 PRO HB2 H 2.1950 . 2 1497 . 159 PRO HB3 H 1.8740 . 2 1498 . 159 PRO HG2 H 1.9760 . 2 1499 . 159 PRO HG3 H 1.8870 . 2 1500 . 159 PRO HD2 H 3.7730 . 2 1501 . 159 PRO HD3 H 3.5760 . 2 1502 . 159 PRO C C 177.2430 . 1 1503 . 159 PRO CA C 63.0350 . 1 1504 . 159 PRO CB C 31.7430 . 1 1505 . 159 PRO CG C 26.9410 . 1 1506 . 159 PRO CD C 50.7970 . 1 1507 . 160 GLY H H 8.3920 . 1 1508 . 160 GLY HA2 H 4.0000 . 2 1509 . 160 GLY HA3 H 3.7730 . 2 1510 . 160 GLY C C 180.7890 . 1 1511 . 160 GLY CA C 44.5620 . 1 1512 . 160 GLY N N 108.8790 . 1 stop_ save_