data_4848 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Conformational Changes in the Isolated N-terminal Domain of 5-Enolpyruvylshikimate-3-phosphate Synthase upon Shikimate-3-phosphate Binding ; _BMRB_accession_number 4848 _BMRB_flat_file_name bmr4848.str _Entry_type original _Submission_date 2000-10-04 _Accession_date 2000-10-04 _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 Stauffer Melissa . . 2 Young John . . 3 Helms Greg . . 4 Evans Jeremy N.S. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 1206 "13C chemical shifts" 906 "15N chemical shifts" 218 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2001-11-14 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 4854 'N-terminal Domain of 5-Enolpyruvylshikimate-3-phosphate Synthase' stop_ _Original_release_date 2001-11-14 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Letter to the Editor: Sequential Assignments of the Isolated N-terminal Domain of 5-Enolpyruvylshikimate-3-phosphate Synthase ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code 21447269 _PubMed_ID 11563562 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Stauffer Melissa E. . 2 Young John K. . 3 Helms Greg L. . 4 Evans Jeremy N.S. . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 20 _Journal_issue 4 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 387 _Page_last 388 _Year 2001 _Details . loop_ _Keyword NMR 'EPSP synthase' shikimate-3-phosphate MurA stop_ save_ ################################## # Molecular system description # ################################## save_EPSP_synthase _Saveframe_category molecular_system _Mol_system_name 'N-terminal domain of 5-enolpyruvyl shikimate-3-phosphate synthase' _Abbreviation_common 'EPSP synthase' _Enzyme_commission_number 2.5.1.9 loop_ _Mol_system_component_name _Mol_label 'N-terminal domain' $EPSPS shikimate-3-phosphate $S3P stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'all free' loop_ _Biological_function 'enolpyruvyltransfer from PEP to Shikimate-3-phosphate to form enolpyruvyl shikimate-3-phosphate' stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_EPSPS _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'EPSP synthase' _Abbreviation_common EPSPS _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 240 _Mol_residue_sequence ; MESLTLQPIARVDGTINLPG SKSVSNRALLLAALAHGKTV LTNLLDSDDVRHMLNALTAL GVSYTLSADRTRCEIIGNGG PLHAEGALELFLGNAGTAMR PLAAALCLGSNDIVLTGEPR MKERPIGHLVDALRLGGAKI TYLEQENYPPLRLQGGFTGG NVDVDGSVSSQFLTALLMTA PLAPEDTVIRIKGDLVSKPY IDITLNLMKTFGVEIENQHY QQFVVKGGQSYQSPGTYLVE ; loop_ _Residue_seq_code _Residue_label 1 MET 2 GLU 3 SER 4 LEU 5 THR 6 LEU 7 GLN 8 PRO 9 ILE 10 ALA 11 ARG 12 VAL 13 ASP 14 GLY 15 THR 16 ILE 17 ASN 18 LEU 19 PRO 20 GLY 21 SER 22 LYS 23 SER 24 VAL 25 SER 26 ASN 27 ARG 28 ALA 29 LEU 30 LEU 31 LEU 32 ALA 33 ALA 34 LEU 35 ALA 36 HIS 37 GLY 38 LYS 39 THR 40 VAL 41 LEU 42 THR 43 ASN 44 LEU 45 LEU 46 ASP 47 SER 48 ASP 49 ASP 50 VAL 51 ARG 52 HIS 53 MET 54 LEU 55 ASN 56 ALA 57 LEU 58 THR 59 ALA 60 LEU 61 GLY 62 VAL 63 SER 64 TYR 65 THR 66 LEU 67 SER 68 ALA 69 ASP 70 ARG 71 THR 72 ARG 73 CYS 74 GLU 75 ILE 76 ILE 77 GLY 78 ASN 79 GLY 80 GLY 81 PRO 82 LEU 83 HIS 84 ALA 85 GLU 86 GLY 87 ALA 88 LEU 89 GLU 90 LEU 91 PHE 92 LEU 93 GLY 94 ASN 95 ALA 96 GLY 97 THR 98 ALA 99 MET 100 ARG 101 PRO 102 LEU 103 ALA 104 ALA 105 ALA 106 LEU 107 CYS 108 LEU 109 GLY 110 SER 111 ASN 112 ASP 113 ILE 114 VAL 115 LEU 116 THR 117 GLY 118 GLU 119 PRO 120 ARG 121 MET 122 LYS 123 GLU 124 ARG 125 PRO 126 ILE 127 GLY 128 HIS 129 LEU 130 VAL 131 ASP 132 ALA 133 LEU 134 ARG 135 LEU 136 GLY 137 GLY 138 ALA 139 LYS 140 ILE 141 THR 142 TYR 143 LEU 144 GLU 145 GLN 146 GLU 147 ASN 148 TYR 149 PRO 150 PRO 151 LEU 152 ARG 153 LEU 154 GLN 155 GLY 156 GLY 157 PHE 158 THR 159 GLY 160 GLY 161 ASN 162 VAL 163 ASP 164 VAL 165 ASP 166 GLY 167 SER 168 VAL 169 SER 170 SER 171 GLN 172 PHE 173 LEU 174 THR 175 ALA 176 LEU 177 LEU 178 MET 179 THR 180 ALA 181 PRO 182 LEU 183 ALA 184 PRO 185 GLU 186 ASP 187 THR 188 VAL 189 ILE 190 ARG 191 ILE 192 LYS 193 GLY 194 ASP 195 LEU 196 VAL 197 SER 198 LYS 199 PRO 200 TYR 201 ILE 202 ASP 203 ILE 204 THR 205 LEU 206 ASN 207 LEU 208 MET 209 LYS 210 THR 211 PHE 212 GLY 213 VAL 214 GLU 215 ILE 216 GLU 217 ASN 218 GLN 219 HIS 220 TYR 221 GLN 222 GLN 223 PHE 224 VAL 225 VAL 226 LYS 227 GLY 228 GLY 229 GLN 230 SER 231 TYR 232 GLN 233 SER 234 PRO 235 GLY 236 THR 237 TYR 238 LEU 239 VAL 240 GLU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-29 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 BMRB 4854 Nterm_EPSPs 100.00 240 100.00 100.00 6.32e-172 PDB 1EPS "Structure And Topological Symmetry Of The Glyphosphate 5-enol- Pyruvylshikimate-3-phosphate Synthase: A Distinctive Protein Fol" 100.00 427 99.58 100.00 8.95e-170 PDB 1G6S "Structure Of Epsp Synthase Liganded With Shikimate-3- Phosphate And Glyphosate" 100.00 427 100.00 100.00 3.43e-170 PDB 1G6T "Structure Of Epsp Synthase Liganded With Shikimate-3- Phosphate" 100.00 427 100.00 100.00 3.43e-170 PDB 1MI4 "Glyphosate Insensitive G96a Mutant Epsp Synthase Liganded With Shikimate-3-Phosphate" 100.00 427 99.58 99.58 2.03e-169 PDB 1P88 "Substrate-Induced Structural Changes To The Isolated N- Terminal Domain Of 5-Enolpyruvylshikimate-3-Phosphate Synthase" 90.00 216 100.00 100.00 1.04e-153 PDB 1P89 "Substrate-Induced Structural Changes To The Isolated N-Terminal Domain Of 5-Enolpyruvylshikimate-3-Phosphate Synthase" 90.00 216 100.00 100.00 1.04e-153 PDB 1Q36 "Epsp Synthase (Asp313ala) Liganded With Tetrahedral Reaction Intermediate" 100.00 427 100.00 100.00 3.14e-170 PDB 1X8R "Epsps Liganded With The (s)-phosphonate Analog Of The Tetrahedral Reaction Intermediate" 100.00 427 100.00 100.00 3.43e-170 PDB 1X8T "Epsps Liganded With The (r)-phosphonate Analog Of The Tetrahedral Reaction Intermediate" 100.00 427 100.00 100.00 3.43e-170 PDB 2AA9 "Epsp Synthase Liganded With Shikimate" 100.00 427 100.00 100.00 3.43e-170 PDB 2AAY "Epsp Synthase Liganded With Shikimate And Glyphosate" 100.00 427 100.00 100.00 3.43e-170 PDB 2PQ9 "E. Coli Epsps Liganded With (R)-Difluoromethyl Tetrahedral Reaction Intermediate Analog" 100.00 427 100.00 100.00 3.43e-170 PDB 2QFQ "E. Coli Epsp Synthase Pro101leu Liganded With S3p" 100.00 427 99.58 99.58 8.76e-169 PDB 2QFS "E.coli Epsp Synthase Pro101ser Liganded With S3p" 100.00 427 99.58 99.58 3.62e-169 PDB 2QFT "E.Coli Epsp Synthase Pro101ser Liganded With S3p And Glyphosate" 100.00 427 99.58 99.58 3.62e-169 PDB 2QFU "E.Coli Epsp Synthase Pro101leu Liganded With S3p And Glyphosate" 100.00 427 99.58 99.58 8.76e-169 PDB 3FJX "E. Coli Epsp Synthase (T97i) Liganded With S3p" 100.00 427 99.58 99.58 2.64e-169 PDB 3FJZ "E. Coli Epsp Synthase (T97i) Liganded With S3p And Glyphosate" 100.00 427 99.58 99.58 2.64e-169 PDB 3FK0 "E. Coli Epsp Synthase (Tips Mutation) Liganded With S3p" 100.00 427 99.17 99.17 2.82e-168 PDB 3FK1 "E. Coli Epsp Synthase (Tips Mutation) Liganded With S3p And Glyphosate" 100.00 427 99.17 99.17 2.82e-168 DBJ BAA35643 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli str. K-12 substr. W3110]" 100.00 427 100.00 100.00 3.43e-170 DBJ BAB34414 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli O157:H7 str. Sakai]" 100.00 427 100.00 100.00 3.43e-170 DBJ BAG76491 "3-phosphoshikimate 1-carboxyvinyltransferase [Escherichia coli SE11]" 100.00 427 100.00 100.00 3.43e-170 DBJ BAI24350 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli O26:H11 str. 11368]" 100.00 427 100.00 100.00 3.43e-170 DBJ BAI29802 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli O103:H2 str. 12009]" 100.00 427 100.00 100.00 3.43e-170 EMBL CAA25223 "unnamed protein product [Escherichia coli]" 100.00 427 99.58 100.00 8.95e-170 EMBL CAP75378 "3-phosphoshikimate 1-carboxyvinyltransferase [Escherichia coli LF82]" 100.00 427 98.75 98.75 3.07e-167 EMBL CAQ31436 "3-phosphoshikimate-1-carboxyvinyltransferase [Escherichia coli BL21(DE3)]" 100.00 427 99.58 99.58 1.61e-169 EMBL CAQ97812 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli IAI1]" 100.00 427 100.00 100.00 3.43e-170 EMBL CAR02268 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli S88]" 100.00 427 98.75 98.75 3.07e-167 GB AAC32745 "EPSP synthase AroA [Shigella dysenteriae]" 100.00 427 98.75 98.75 3.35e-167 GB AAC72854 "3-enolpyruvylshikimate-5-phosphate synthetase [Shigella sonnei]" 100.00 427 99.58 99.58 2.07e-169 GB AAC73994 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli str. K-12 substr. MG1655]" 100.00 427 100.00 100.00 3.43e-170 GB AAG55393 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli O157:H7 str. EDL933]" 100.00 427 100.00 100.00 3.43e-170 GB AAN42533 "5-enolpyruvylshikimate-3-phosphate synthetase [Shigella flexneri 2a str. 301]" 100.00 427 99.17 99.58 1.26e-168 PRF 1006223A synthase,enolpyruvylshikimate 100.00 427 99.58 100.00 8.95e-170 REF NP_286783 "3-phosphoshikimate 1-carboxyvinyltransferase [Escherichia coli O157:H7 str. EDL933]" 100.00 427 100.00 100.00 3.43e-170 REF NP_309018 "3-phosphoshikimate 1-carboxyvinyltransferase [Escherichia coli O157:H7 str. Sakai]" 100.00 427 100.00 100.00 3.43e-170 REF NP_415428 "5-enolpyruvylshikimate-3-phosphate synthetase [Escherichia coli str. K-12 substr. MG1655]" 100.00 427 100.00 100.00 3.43e-170 REF NP_706826 "3-phosphoshikimate 1-carboxyvinyltransferase [Shigella flexneri 2a str. 301]" 100.00 427 99.17 99.58 1.26e-168 REF NP_752973 "3-phosphoshikimate 1-carboxyvinyltransferase [Escherichia coli CFT073]" 100.00 427 98.75 98.75 2.75e-167 SP A1A9I5 "RecName: Full=3-phosphoshikimate 1-carboxyvinyltransferase; AltName: Full=5-enolpyruvylshikimate-3-phosphate synthase; Short=EP" 100.00 427 98.75 98.75 3.07e-167 SP A7ZJZ7 "RecName: Full=3-phosphoshikimate 1-carboxyvinyltransferase; AltName: Full=5-enolpyruvylshikimate-3-phosphate synthase; Short=EP" 100.00 427 100.00 100.00 3.43e-170 SP A7ZYL1 "RecName: Full=3-phosphoshikimate 1-carboxyvinyltransferase; AltName: Full=5-enolpyruvylshikimate-3-phosphate synthase; Short=EP" 100.00 427 99.58 99.58 1.61e-169 SP B1IW23 "RecName: Full=3-phosphoshikimate 1-carboxyvinyltransferase; AltName: Full=5-enolpyruvylshikimate-3-phosphate synthase; Short=EP" 100.00 427 99.58 99.58 1.61e-169 SP B1LJV6 "RecName: Full=3-phosphoshikimate 1-carboxyvinyltransferase; AltName: Full=5-enolpyruvylshikimate-3-phosphate synthase; Short=EP" 100.00 427 98.33 99.17 2.94e-167 stop_ save_ ############# # Ligands # ############# save_S3P _Saveframe_category ligand _Mol_type "non-polymer (NON-POLYMER)" _Name_common "shikimate-3-phosphate (SHIKIMATE-3-PHOSPHATE)" _Abbreviation_common S3P _BMRB_code S3P _PDB_code S3P _Molecular_mass 254.131 _Mol_charge 0 _Mol_paramagnetic . _Mol_aromatic no _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons C1 C1 C . 0 . ? C2 C2 C . 0 . ? C3 C3 C . 0 . ? C4 C4 C . 0 . ? C5 C5 C . 0 . ? C6 C6 C . 0 . ? C7 C7 C . 0 . ? H2 H2 H . 0 . ? H3 H3 H . 0 . ? H4 H4 H . 0 . ? H5 H5 H . 0 . ? H61 H61 H . 0 . ? H62 H62 H . 0 . ? HO2 HO2 H . 0 . ? HO3 HO3 H . 0 . ? HO4 HO4 H . 0 . ? HO7 HO7 H . 0 . ? HO8 HO8 H . 0 . ? O1 O1 O . 0 . ? O2 O2 O . 0 . ? O3 O3 O . 0 . ? O4 O4 O . 0 . ? O5 O5 O . 0 . ? O6 O6 O . 0 . ? O7 O7 O . 0 . ? O8 O8 O . 0 . ? P1 P1 P . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name DOUB C1 C2 ? ? SING C1 C6 ? ? SING C1 C7 ? ? SING C2 C3 ? ? SING C2 H2 ? ? SING C3 C4 ? ? SING C3 O1 ? ? SING C3 H3 ? ? SING C4 C5 ? ? SING C4 O2 ? ? SING C4 H4 ? ? SING C5 C6 ? ? SING C5 O3 ? ? SING C5 H5 ? ? SING C6 H61 ? ? SING C6 H62 ? ? SING C7 O4 ? ? DOUB C7 O5 ? ? SING O1 P1 ? ? SING O2 HO2 ? ? SING O3 HO3 ? ? SING O4 HO4 ? ? DOUB P1 O6 ? ? SING P1 O7 ? ? SING P1 O8 ? ? SING O7 HO7 ? ? SING O8 HO8 ? ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Gene_mnemonic $EPSPS 'E. coli' 562 Eubacteria . Eschericia coli aroA 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 $EPSPS 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Nterm+S3P _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $EPSPS 1.0 mM '[U-15N; U-13C; U70%-2H]' $S3P 1.5 mM . 'Tris buffer' 50 mM . DTT 1 mM . NaN3 3 mM . pepstatin . uM . leupeptin . uM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Inova _Field_strength 500 _Details . save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH* 7.8 0.1 n/a temperature 295 1 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 H2O H 1 'water proton' ppm 4.74 internal direct cylindrical internal parallel_to_Bo 1.00 DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 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_Nterm+S3P_cs _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $Nterm+S3P stop_ _Sample_conditions_label $Ex-cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'N-terminal domain' _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 . 1 MET HE H 2.06 0.05 . 2 . 1 MET CE C 16.58 0.5 . 3 . 3 SER H H 8.30 0.05 . 4 . 3 SER N N 118.58 0.5 . 5 . 3 SER HA H 4.28 0.05 . 6 . 3 SER CA C 61.55 0.5 . 7 . 3 SER HB2 H 4.00 0.05 . 8 . 3 SER HB3 H 4.00 0.05 . 9 . 3 SER CB C 65.23 0.5 . 10 . 3 SER C C 174.94 0.5 . 11 . 4 LEU H H 7.99 0.05 . 12 . 4 LEU N N 129.07 0.5 . 13 . 4 LEU HA H 4.38 0.05 . 14 . 4 LEU CA C 55.47 0.5 . 15 . 4 LEU HB2 H 1.60 0.05 . 16 . 4 LEU HB3 H 1.60 0.05 . 17 . 4 LEU CB C 42.01 0.5 . 18 . 4 LEU HG H 1.45 0.05 . 19 . 4 LEU CG C 24.25 0.5 . 20 . 4 LEU HD1 H 0.84 0.05 . 21 . 4 LEU HD2 H 0.89 0.05 . 22 . 4 LEU CD1 C 22.71 0.5 . 23 . 4 LEU CD2 C 22.71 0.5 . 24 . 4 LEU C C 174.91 0.5 . 25 . 5 THR H H 8.14 0.05 . 26 . 5 THR N N 115.06 0.5 . 27 . 5 THR HA H 4.29 0.05 . 28 . 5 THR CA C 61.70 0.5 . 29 . 5 THR HB H 4.17 0.05 . 30 . 5 THR CB C 69.41 0.5 . 31 . 5 THR HG2 H 1.16 0.05 . 32 . 5 THR CG2 C 21.25 0.5 . 33 . 5 THR C C 177.48 0.5 . 34 . 6 LEU H H 8.18 0.05 . 35 . 6 LEU N N 124.66 0.5 . 36 . 6 LEU HA H 4.34 0.05 . 37 . 6 LEU CA C 54.66 0.5 . 38 . 6 LEU HB2 H 1.88 0.05 . 39 . 6 LEU HB3 H 1.88 0.05 . 40 . 6 LEU CB C 41.72 0.5 . 41 . 6 LEU HG H 1.59 0.05 . 42 . 6 LEU CG C 24.33 0.5 . 43 . 6 LEU HD1 H 0.83 0.05 . 44 . 6 LEU HD2 H 0.83 0.05 . 45 . 6 LEU CD1 C 22.93 0.5 . 46 . 6 LEU CD2 C 22.93 0.5 . 47 . 6 LEU C C 176.90 0.5 . 48 . 7 GLN H H 8.30 0.05 . 49 . 7 GLN N N 122.24 0.5 . 50 . 7 GLN HA H 4.60 0.05 . 51 . 7 GLN CA C 53.20 0.5 . 52 . 7 GLN HB2 H 1.52 0.05 . 53 . 7 GLN HB3 H 1.60 0.05 . 54 . 7 GLN CB C 28.46 0.5 . 55 . 7 GLN HG2 H 2.36 0.05 . 56 . 7 GLN HG3 H 2.39 0.05 . 57 . 7 GLN CG C 33.37 0.5 . 58 . 7 GLN C C 173.93 0.5 . 59 . 8 PRO HA H 4.43 0.05 . 60 . 8 PRO CA C 62.97 0.5 . 61 . 8 PRO HB2 H 2.25 0.05 . 62 . 8 PRO HB3 H 2.25 0.05 . 63 . 8 PRO CB C 31.65 0.5 . 64 . 8 PRO HG2 H 1.97 0.05 . 65 . 8 PRO HG3 H 1.97 0.05 . 66 . 8 PRO CG C 26.99 0.5 . 67 . 8 PRO HD2 H 3.65 0.05 . 68 . 8 PRO HD3 H 3.65 0.05 . 69 . 8 PRO CD C 50.26 0.5 . 70 . 9 ILE H H 8.20 0.05 . 71 . 9 ILE N N 121.06 0.5 . 72 . 9 ILE HA H 4.10 0.05 . 73 . 9 ILE CA C 60.67 0.5 . 74 . 9 ILE HB H 1.82 0.05 . 75 . 9 ILE CB C 38.37 0.5 . 76 . 9 ILE HG12 H 1.16 0.05 . 77 . 9 ILE HG13 H 1.16 0.05 . 78 . 9 ILE HG2 H 0.87 0.05 . 79 . 9 ILE CG1 C 26.70 0.5 . 80 . 9 ILE CG2 C 17.13 0.5 . 81 . 9 ILE HD1 H 0.83 0.05 . 82 . 9 ILE CD1 C 12.39 0.5 . 83 . 9 ILE C C 175.91 0.5 . 84 . 10 ALA H H 8.34 0.05 . 85 . 10 ALA N N 128.14 0.5 . 86 . 10 ALA HA H 4.35 0.05 . 87 . 10 ALA CA C 51.85 0.5 . 88 . 10 ALA HB H 1.33 0.05 . 89 . 10 ALA CB C 18.86 0.5 . 90 . 10 ALA C C 177.27 0.5 . 91 . 11 ARG H H 8.34 0.05 . 92 . 11 ARG N N 121.03 0.5 . 93 . 11 ARG HA H 4.35 0.05 . 94 . 11 ARG CA C 55.54 0.5 . 95 . 11 ARG HB2 H 1.74 0.05 . 96 . 11 ARG HB3 H 1.74 0.05 . 97 . 11 ARG CB C 30.57 0.5 . 98 . 11 ARG HG2 H 1.59 0.05 . 99 . 11 ARG HG3 H 1.59 0.05 . 100 . 11 ARG CG C 26.79 0.5 . 101 . 11 ARG HD2 H 3.20 0.05 . 102 . 11 ARG HD3 H 3.20 0.05 . 103 . 11 ARG CD C 42.99 0.5 . 104 . 11 ARG C C 176.52 0.5 . 105 . 12 VAL H H 8.34 0.05 . 106 . 12 VAL N N 121.68 0.5 . 107 . 12 VAL HA H 4.12 0.05 . 108 . 12 VAL CA C 61.92 0.5 . 109 . 12 VAL HB H 2.07 0.05 . 110 . 12 VAL CB C 32.19 0.5 . 111 . 12 VAL HG1 H 0.84 0.05 . 112 . 12 VAL HG2 H 0.91 0.05 . 113 . 12 VAL CG1 C 20.02 0.5 . 114 . 12 VAL CG2 C 20.52 0.5 . 115 . 12 VAL C C 175.88 0.5 . 116 . 13 ASP H H 8.39 0.05 . 117 . 13 ASP N N 123.59 0.5 . 118 . 13 ASP HA H 4.59 0.05 . 119 . 13 ASP CA C 54.04 0.5 . 120 . 13 ASP HB2 H 2.69 0.05 . 121 . 13 ASP HB3 H 2.69 0.05 . 122 . 13 ASP CB C 40.88 0.5 . 123 . 13 ASP C C 176.69 0.5 . 124 . 14 GLY H H 8.36 0.05 . 125 . 14 GLY N N 109.18 0.5 . 126 . 14 GLY HA2 H 3.97 0.05 . 127 . 14 GLY HA3 H 3.97 0.05 . 128 . 14 GLY CA C 45.28 0.5 . 129 . 14 GLY C C 174.43 0.5 . 130 . 15 THR H H 8.14 0.05 . 131 . 15 THR N N 114.01 0.5 . 132 . 15 THR HA H 4.33 0.05 . 133 . 15 THR CA C 62.18 0.5 . 134 . 15 THR HB H 4.17 0.05 . 135 . 15 THR CB C 69.36 0.5 . 136 . 15 THR HG2 H 1.16 0.05 . 137 . 15 THR CG2 C 21.23 0.5 . 138 . 15 THR C C 174.49 0.5 . 139 . 16 ILE H H 8.10 0.05 . 140 . 16 ILE N N 122.41 0.5 . 141 . 16 ILE HA H 4.13 0.05 . 142 . 16 ILE CA C 60.71 0.5 . 143 . 16 ILE HB H 1.82 0.05 . 144 . 16 ILE CB C 38.33 0.5 . 145 . 16 ILE HG12 H 1.16 0.05 . 146 . 16 ILE HG13 H 1.16 0.05 . 147 . 16 ILE HG2 H 0.87 0.05 . 148 . 16 ILE CG1 C 26.70 0.5 . 149 . 16 ILE CG2 C 17.13 0.5 . 150 . 16 ILE HD1 H 0.83 0.05 . 151 . 16 ILE CD1 C 12.39 0.5 . 152 . 16 ILE C C 175.48 0.5 . 153 . 17 ASN H H 8.34 0.05 . 154 . 17 ASN N N 128.44 0.5 . 155 . 17 ASN HA H 4.75 0.05 . 156 . 17 ASN CA C 51.98 0.5 . 157 . 17 ASN HB2 H 2.65 0.05 . 158 . 17 ASN HB3 H 2.78 0.05 . 159 . 17 ASN CB C 38.73 0.5 . 160 . 17 ASN C C 174.48 0.5 . 161 . 18 LEU H H 8.27 0.05 . 162 . 18 LEU N N 124.24 0.5 . 163 . 18 LEU HA H 4.60 0.05 . 164 . 18 LEU CA C 52.81 0.5 . 165 . 18 LEU HB2 H 1.60 0.05 . 166 . 18 LEU HB3 H 1.60 0.05 . 167 . 18 LEU CB C 41.22 0.5 . 168 . 18 LEU HG H 1.53 0.05 . 169 . 18 LEU HD1 H 0.83 0.05 . 170 . 18 LEU HD2 H 0.87 0.05 . 171 . 18 LEU CD1 C 22.55 0.5 . 172 . 18 LEU CD2 C 22.55 0.5 . 173 . 18 LEU C C 175.08 0.5 . 174 . 19 PRO CA C 62.89 0.5 . 175 . 19 PRO HB2 H 2.56 0.05 . 176 . 19 PRO HB3 H 2.56 0.05 . 177 . 19 PRO CB C 30.80 0.5 . 178 . 19 PRO HG2 H 1.93 0.05 . 179 . 19 PRO HG3 H 2.00 0.05 . 180 . 19 PRO CG C 26.87 0.5 . 181 . 19 PRO HD2 H 3.75 0.05 . 182 . 19 PRO HD3 H 3.75 0.05 . 183 . 19 PRO CD C 55.75 0.5 . 184 . 20 GLY H H 8.29 0.05 . 185 . 20 GLY N N 108.94 0.5 . 186 . 20 GLY HA2 H 3.99 0.05 . 187 . 20 GLY HA3 H 4.29 0.05 . 188 . 20 GLY CA C 45.14 0.5 . 189 . 22 LYS H H 8.28 0.05 . 190 . 22 LYS N N 120.42 0.5 . 191 . 22 LYS HA H 4.13 0.05 . 192 . 22 LYS CA C 58.86 0.5 . 193 . 22 LYS HB2 H 2.05 0.05 . 194 . 22 LYS HB3 H 2.16 0.05 . 195 . 22 LYS HG2 H 1.50 0.05 . 196 . 22 LYS HG3 H 1.50 0.05 . 197 . 22 LYS CG C 24.76 0.5 . 198 . 22 LYS HD2 H 1.77 0.05 . 199 . 22 LYS HD3 H 1.75 0.05 . 200 . 22 LYS CD C 29.64 0.5 . 201 . 22 LYS HE2 H 3.08 0.05 . 202 . 22 LYS HE3 H 3.08 0.05 . 203 . 22 LYS CE C 44.13 0.5 . 204 . 24 VAL H H 7.69 0.05 . 205 . 24 VAL N N 119.89 0.5 . 206 . 24 VAL HA H 4.21 0.05 . 207 . 24 VAL CA C 62.70 0.5 . 208 . 24 VAL HB H 2.08 0.05 . 209 . 24 VAL CB C 30.91 0.5 . 210 . 24 VAL HG1 H 0.90 0.05 . 211 . 24 VAL HG2 H 0.90 0.05 . 212 . 24 VAL CG1 C 20.58 0.5 . 213 . 24 VAL CG2 C 20.58 0.5 . 214 . 27 ARG H H 7.46 0.05 . 215 . 27 ARG N N 118.00 0.5 . 216 . 27 ARG HA H 4.15 0.05 . 217 . 27 ARG CA C 59.17 0.5 . 218 . 27 ARG HB2 H 2.02 0.05 . 219 . 27 ARG HB3 H 2.02 0.05 . 220 . 27 ARG CB C 31.76 0.5 . 221 . 27 ARG HG2 H 1.47 0.05 . 222 . 27 ARG HG3 H 1.47 0.05 . 223 . 27 ARG CG C 27.56 0.5 . 224 . 27 ARG HD2 H 3.08 0.05 . 225 . 27 ARG HD3 H 3.08 0.05 . 226 . 27 ARG CD C 44.67 0.5 . 227 . 27 ARG C C 176.72 0.5 . 228 . 28 ALA H H 8.44 0.05 . 229 . 28 ALA N N 119.06 0.5 . 230 . 28 ALA HA H 4.94 0.05 . 231 . 28 ALA CA C 54.72 0.5 . 232 . 28 ALA HB H 1.27 0.05 . 233 . 28 ALA CB C 17.73 0.5 . 234 . 28 ALA C C 178.42 0.5 . 235 . 29 LEU H H 7.87 0.05 . 236 . 29 LEU N N 116.12 0.5 . 237 . 29 LEU HA H 4.27 0.05 . 238 . 29 LEU CA C 57.56 0.5 . 239 . 29 LEU HB2 H 1.82 0.05 . 240 . 29 LEU HB3 H 1.82 0.05 . 241 . 29 LEU CB C 42.09 0.5 . 242 . 29 LEU HG H 1.51 0.05 . 243 . 29 LEU CG C 26.12 0.5 . 244 . 29 LEU HD1 H 0.59 0.05 . 245 . 29 LEU HD2 H 0.63 0.05 . 246 . 29 LEU CD1 C 24.20 0.5 . 247 . 29 LEU CD2 C 24.20 0.5 . 248 . 29 LEU C C 177.46 0.5 . 249 . 30 LEU H H 7.08 0.05 . 250 . 30 LEU N N 116.70 0.5 . 251 . 30 LEU HA H 3.85 0.05 . 252 . 30 LEU CA C 57.40 0.5 . 253 . 30 LEU HB2 H 1.71 0.05 . 254 . 30 LEU HB3 H 1.71 0.05 . 255 . 30 LEU CB C 41.06 0.5 . 256 . 30 LEU HG H 1.26 0.05 . 257 . 30 LEU CG C 26.06 0.5 . 258 . 30 LEU HD1 H 0.60 0.05 . 259 . 30 LEU HD2 H 0.60 0.05 . 260 . 30 LEU CD1 C 21.77 0.5 . 261 . 30 LEU C C 177.82 0.5 . 262 . 31 LEU H H 7.86 0.05 . 263 . 31 LEU N N 116.12 0.5 . 264 . 31 LEU HA H 3.12 0.05 . 265 . 31 LEU CA C 57.56 0.5 . 266 . 31 LEU HB2 H 0.55 0.05 . 267 . 31 LEU HB3 H 0.28 0.05 . 268 . 31 LEU CB C 37.93 0.5 . 269 . 31 LEU HG H 1.10 0.05 . 270 . 31 LEU CG C 25.33 0.5 . 271 . 31 LEU HD1 H 0.24 0.05 . 272 . 31 LEU HD2 H 0.24 0.05 . 273 . 31 LEU CD1 C 24.79 0.5 . 274 . 31 LEU CD2 C 21.05 0.5 . 275 . 31 LEU C C 178.25 0.5 . 276 . 32 ALA H H 7.94 0.05 . 277 . 32 ALA N N 117.12 0.5 . 278 . 32 ALA HA H 3.84 0.05 . 279 . 32 ALA CA C 54.26 0.5 . 280 . 32 ALA HB H 1.43 0.05 . 281 . 32 ALA CB C 18.34 0.5 . 282 . 32 ALA C C 179.61 0.5 . 283 . 33 ALA H H 7.92 0.05 . 284 . 33 ALA N N 118.58 0.5 . 285 . 33 ALA HA H 3.96 0.05 . 286 . 33 ALA CA C 54.60 0.5 . 287 . 33 ALA HB H 1.52 0.05 . 288 . 33 ALA CB C 19.06 0.5 . 289 . 33 ALA C C 178.42 0.5 . 290 . 34 LEU H H 7.70 0.05 . 291 . 34 LEU N N 115.96 0.5 . 292 . 34 LEU HA H 4.33 0.05 . 293 . 34 LEU CA C 55.72 0.5 . 294 . 34 LEU HB2 H 1.75 0.05 . 295 . 34 LEU HB3 H 1.75 0.05 . 296 . 34 LEU CB C 42.86 0.5 . 297 . 34 LEU HG H 1.41 0.05 . 298 . 34 LEU CG C 24.66 0.5 . 299 . 34 LEU HD1 H 0.61 0.05 . 300 . 34 LEU HD2 H 0.68 0.05 . 301 . 34 LEU CD1 C 22.13 0.5 . 302 . 34 LEU CD2 C 22.13 0.5 . 303 . 34 LEU C C 178.36 0.5 . 304 . 35 ALA H H 7.70 0.05 . 305 . 35 ALA N N 120.32 0.5 . 306 . 35 ALA HA H 4.30 0.05 . 307 . 35 ALA CA C 51.85 0.5 . 308 . 35 ALA HB H 1.47 0.05 . 309 . 35 ALA CB C 19.19 0.5 . 310 . 35 ALA C C 177.50 0.5 . 311 . 36 HIS H H 8.01 0.05 . 312 . 36 HIS N N 116.01 0.5 . 313 . 36 HIS HA H 4.42 0.05 . 314 . 36 HIS CA C 56.70 0.5 . 315 . 36 HIS HB2 H 3.03 0.05 . 316 . 36 HIS HB3 H 3.14 0.05 . 317 . 36 HIS CB C 31.63 0.5 . 318 . 36 HIS C C 176.35 0.5 . 319 . 37 GLY H H 8.98 0.05 . 320 . 37 GLY N N 111.52 0.5 . 321 . 37 GLY HA2 H 4.53 0.05 . 322 . 37 GLY HA3 H 3.77 0.05 . 323 . 37 GLY CA C 43.41 0.5 . 324 . 37 GLY C C 173.43 0.5 . 325 . 38 LYS H H 8.56 0.05 . 326 . 38 LYS N N 122.53 0.5 . 327 . 38 LYS HA H 5.35 0.05 . 328 . 38 LYS CA C 54.92 0.5 . 329 . 38 LYS HB2 H 1.33 0.05 . 330 . 38 LYS HB3 H 1.33 0.05 . 331 . 38 LYS CB C 32.99 0.5 . 332 . 38 LYS HG2 H 1.04 0.05 . 333 . 38 LYS HG3 H 1.09 0.05 . 334 . 38 LYS CG C 24.20 0.5 . 335 . 38 LYS HD2 H 1.61 0.05 . 336 . 38 LYS HD3 H 1.61 0.05 . 337 . 38 LYS CD C 28.70 0.5 . 338 . 38 LYS HE2 H 2.81 0.05 . 339 . 38 LYS HE3 H 2.81 0.05 . 340 . 38 LYS CE C 41.67 0.5 . 341 . 38 LYS C C 176.71 0.5 . 342 . 39 THR H H 9.09 0.05 . 343 . 39 THR N N 124.66 0.5 . 344 . 39 THR HA H 4.85 0.05 . 345 . 39 THR CA C 61.85 0.5 . 346 . 39 THR HB H 3.89 0.05 . 347 . 39 THR CB C 69.93 0.5 . 348 . 39 THR HG2 H 1.13 0.05 . 349 . 39 THR CG2 C 22.16 0.5 . 350 . 39 THR C C 173.06 0.5 . 351 . 40 VAL H H 8.57 0.05 . 352 . 40 VAL N N 126.73 0.5 . 353 . 40 VAL HA H 4.59 0.05 . 354 . 40 VAL CA C 61.60 0.5 . 355 . 40 VAL HB H 2.12 0.05 . 356 . 40 VAL CB C 31.92 0.5 . 357 . 40 VAL HG1 H 0.77 0.05 . 358 . 40 VAL HG2 H 0.77 0.05 . 359 . 40 VAL CG1 C 20.38 0.5 . 360 . 40 VAL CG2 C 20.38 0.5 . 361 . 40 VAL C C 174.64 0.5 . 362 . 41 LEU H H 9.31 0.05 . 363 . 41 LEU N N 128.27 0.5 . 364 . 41 LEU HA H 5.54 0.05 . 365 . 41 LEU CA C 53.35 0.5 . 366 . 41 LEU HB2 H 1.37 0.05 . 367 . 41 LEU HB3 H 1.86 0.05 . 368 . 41 LEU CB C 42.89 0.5 . 369 . 41 LEU HG H 1.54 0.05 . 370 . 41 LEU CG C 28.15 0.5 . 371 . 41 LEU HD1 H 0.82 0.05 . 372 . 41 LEU HD2 H 0.98 0.05 . 373 . 41 LEU CD1 C 25.64 0.5 . 374 . 41 LEU CD2 C 26.23 0.5 . 375 . 41 LEU C C 176.08 0.5 . 376 . 42 THR H H 8.59 0.05 . 377 . 42 THR N N 112.58 0.5 . 378 . 42 THR HA H 5.09 0.05 . 379 . 42 THR CA C 59.68 0.5 . 380 . 42 THR HB H 4.17 0.05 . 381 . 42 THR CB C 70.44 0.5 . 382 . 42 THR HG2 H 1.03 0.05 . 383 . 42 THR CG2 C 21.86 0.5 . 384 . 42 THR C C 173.21 0.5 . 385 . 43 ASN H H 8.60 0.05 . 386 . 43 ASN N N 118.22 0.5 . 387 . 43 ASN HA H 4.12 0.05 . 388 . 43 ASN CA C 54.00 0.5 . 389 . 43 ASN HB2 H 2.46 0.05 . 390 . 43 ASN HB3 H 3.71 0.05 . 391 . 43 ASN CB C 38.24 0.5 . 392 . 43 ASN C C 175.54 0.5 . 393 . 44 LEU H H 8.80 0.05 . 394 . 44 LEU N N 118.21 0.5 . 395 . 44 LEU HA H 3.87 0.05 . 396 . 44 LEU CA C 55.06 0.5 . 397 . 44 LEU HB2 H 1.16 0.05 . 398 . 44 LEU HB3 H 1.16 0.05 . 399 . 44 LEU CB C 42.64 0.5 . 400 . 44 LEU HG H 1.43 0.05 . 401 . 44 LEU HD1 H 0.75 0.05 . 402 . 44 LEU HD2 H 0.79 0.05 . 403 . 44 LEU CD1 C 24.71 0.5 . 404 . 44 LEU CD2 C 25.16 0.5 . 405 . 44 LEU C C 172.90 0.5 . 406 . 45 LEU H H 7.22 0.05 . 407 . 45 LEU N N 122.97 0.5 . 408 . 45 LEU HA H 4.86 0.05 . 409 . 45 LEU CA C 54.22 0.5 . 410 . 45 LEU HB2 H 1.59 0.05 . 411 . 45 LEU HB3 H 1.59 0.05 . 412 . 45 LEU CB C 42.49 0.5 . 413 . 45 LEU HG H 1.49 0.05 . 414 . 45 LEU CG C 26.66 0.5 . 415 . 45 LEU HD1 H 0.88 0.05 . 416 . 45 LEU HD2 H 0.85 0.05 . 417 . 45 LEU CD1 C 24.84 0.5 . 418 . 45 LEU CD2 C 22.99 0.5 . 419 . 45 LEU C C 176.29 0.5 . 420 . 46 ASP H H 8.28 0.05 . 421 . 46 ASP N N 123.25 0.5 . 422 . 46 ASP HA H 4.90 0.05 . 423 . 46 ASP CA C 52.92 0.5 . 424 . 46 ASP HB2 H 2.45 0.05 . 425 . 46 ASP HB3 H 2.69 0.05 . 426 . 46 ASP CB C 39.92 0.5 . 427 . 46 ASP C C 175.19 0.5 . 428 . 47 SER H H 7.19 0.05 . 429 . 47 SER N N 116.49 0.5 . 430 . 47 SER HA H 4.35 0.05 . 431 . 47 SER CA C 55.58 0.5 . 432 . 47 SER HB2 H 3.90 0.05 . 433 . 47 SER HB3 H 3.90 0.05 . 434 . 47 SER CB C 65.74 0.5 . 435 . 47 SER C C 174.68 0.5 . 436 . 48 ASP H H 8.47 0.05 . 437 . 48 ASP N N 122.78 0.5 . 438 . 48 ASP HA H 4.76 0.05 . 439 . 48 ASP CA C 52.78 0.5 . 440 . 48 ASP HB2 H 2.65 0.05 . 441 . 48 ASP HB3 H 2.78 0.05 . 442 . 48 ASP CB C 46.30 0.5 . 443 . 49 ASP H H 7.97 0.05 . 444 . 49 ASP N N 119.81 0.5 . 445 . 49 ASP HA H 4.33 0.05 . 446 . 49 ASP CA C 57.75 0.5 . 447 . 49 ASP HB2 H 2.44 0.05 . 448 . 49 ASP HB3 H 2.62 0.05 . 449 . 49 ASP CB C 40.20 0.5 . 450 . 49 ASP C C 178.17 0.5 . 451 . 50 VAL H H 7.19 0.05 . 452 . 50 VAL N N 120.84 0.5 . 453 . 50 VAL HA H 4.18 0.05 . 454 . 50 VAL CA C 64.48 0.5 . 455 . 50 VAL HB H 2.06 0.05 . 456 . 50 VAL CB C 32.42 0.5 . 457 . 50 VAL HG1 H 0.93 0.05 . 458 . 50 VAL HG2 H 0.93 0.05 . 459 . 50 VAL CG1 C 20.65 0.5 . 460 . 50 VAL CG2 C 22.24 0.5 . 461 . 50 VAL C C 178.11 0.5 . 462 . 51 ARG H H 8.20 0.05 . 463 . 51 ARG N N 119.98 0.5 . 464 . 51 ARG HA H 3.78 0.05 . 465 . 51 ARG CA C 60.15 0.5 . 466 . 51 ARG HB2 H 1.66 0.05 . 467 . 51 ARG HB3 H 1.66 0.05 . 468 . 51 ARG CB C 29.83 0.5 . 469 . 51 ARG HG2 H 1.34 0.05 . 470 . 51 ARG HG3 H 1.34 0.05 . 471 . 51 ARG CG C 27.83 0.5 . 472 . 51 ARG HD2 H 3.15 0.05 . 473 . 51 ARG HD3 H 3.10 0.05 . 474 . 51 ARG CD C 43.36 0.5 . 475 . 51 ARG C C 179.70 0.5 . 476 . 52 HIS H H 8.06 0.05 . 477 . 52 HIS N N 115.60 0.5 . 478 . 52 HIS HA H 4.57 0.05 . 479 . 52 HIS CA C 60.36 0.5 . 480 . 52 HIS HB2 H 2.84 0.05 . 481 . 52 HIS HB3 H 2.89 0.05 . 482 . 52 HIS CB C 30.50 0.5 . 483 . 52 HIS C C 178.74 0.5 . 484 . 54 LEU H H 8.73 0.05 . 485 . 54 LEU N N 119.82 0.5 . 486 . 54 LEU HA H 3.69 0.05 . 487 . 54 LEU CA C 58.08 0.5 . 488 . 54 LEU HB2 H 1.47 0.05 . 489 . 54 LEU HB3 H 1.83 0.05 . 490 . 54 LEU CB C 40.12 0.5 . 491 . 54 LEU HG H 0.69 0.05 . 492 . 54 LEU CG C 26.56 0.5 . 493 . 54 LEU HD1 H 0.11 0.05 . 494 . 54 LEU HD2 H 0.64 0.05 . 495 . 54 LEU CD1 C 22.18 0.5 . 496 . 54 LEU CD2 C 24.79 0.5 . 497 . 54 LEU C C 180.23 0.5 . 498 . 55 ASN H H 8.38 0.05 . 499 . 55 ASN N N 118.55 0.5 . 500 . 55 ASN HA H 4.53 0.05 . 501 . 55 ASN CA C 55.68 0.5 . 502 . 55 ASN HB2 H 2.91 0.05 . 503 . 55 ASN HB3 H 3.12 0.05 . 504 . 55 ASN CB C 37.36 0.5 . 505 . 55 ASN C C 178.56 0.5 . 506 . 56 ALA H H 8.08 0.05 . 507 . 56 ALA N N 125.19 0.5 . 508 . 56 ALA HA H 4.13 0.05 . 509 . 56 ALA CA C 54.90 0.5 . 510 . 56 ALA HB H 1.47 0.05 . 511 . 56 ALA CB C 17.39 0.5 . 512 . 56 ALA C C 178.75 0.5 . 513 . 57 LEU H H 8.44 0.05 . 514 . 57 LEU N N 116.45 0.5 . 515 . 57 LEU HA H 3.95 0.05 . 516 . 57 LEU CA C 58.13 0.5 . 517 . 57 LEU HB2 H 1.27 0.05 . 518 . 57 LEU HB3 H 1.84 0.05 . 519 . 57 LEU CB C 39.25 0.5 . 520 . 57 LEU HG H 1.96 0.05 . 521 . 57 LEU CG C 25.95 0.5 . 522 . 57 LEU HD1 H 0.60 0.05 . 523 . 57 LEU HD2 H 0.60 0.05 . 524 . 57 LEU CD1 C 21.12 0.5 . 525 . 57 LEU CD2 C 24.79 0.5 . 526 . 57 LEU C C 179.59 0.5 . 527 . 58 THR H H 8.51 0.05 . 528 . 58 THR N N 116.75 0.5 . 529 . 58 THR HA H 4.22 0.05 . 530 . 58 THR CA C 66.67 0.5 . 531 . 58 THR HB H 4.43 0.05 . 532 . 58 THR CB C 68.67 0.5 . 533 . 58 THR HG2 H 1.28 0.05 . 534 . 58 THR CG2 C 21.54 0.5 . 535 . 58 THR C C 178.34 0.5 . 536 . 59 ALA H H 7.86 0.05 . 537 . 59 ALA N N 125.82 0.5 . 538 . 59 ALA HA H 4.14 0.05 . 539 . 59 ALA CA C 54.65 0.5 . 540 . 59 ALA HB H 1.59 0.05 . 541 . 59 ALA CB C 17.92 0.5 . 542 . 59 ALA C C 178.71 0.5 . 543 . 60 LEU H H 7.80 0.05 . 544 . 60 LEU N N 116.56 0.5 . 545 . 60 LEU HA H 4.21 0.05 . 546 . 60 LEU CA C 54.18 0.5 . 547 . 60 LEU HB2 H 1.79 0.05 . 548 . 60 LEU HB3 H 1.79 0.05 . 549 . 60 LEU CB C 41.55 0.5 . 550 . 60 LEU HG H 1.43 0.05 . 551 . 60 LEU CG C 27.03 0.5 . 552 . 60 LEU HD1 H 0.71 0.05 . 553 . 60 LEU HD2 H 0.89 0.05 . 554 . 60 LEU CD1 C 25.60 0.5 . 555 . 60 LEU CD2 C 22.69 0.5 . 556 . 60 LEU C C 175.54 0.5 . 557 . 61 GLY H H 7.84 0.05 . 558 . 61 GLY N N 106.17 0.5 . 559 . 61 GLY HA2 H 3.77 0.05 . 560 . 61 GLY HA3 H 4.13 0.05 . 561 . 61 GLY CA C 46.01 0.5 . 562 . 61 GLY C C 175.05 0.5 . 563 . 62 VAL H H 8.20 0.05 . 564 . 62 VAL N N 123.12 0.5 . 565 . 62 VAL HA H 4.16 0.05 . 566 . 62 VAL CA C 61.72 0.5 . 567 . 62 VAL HB H 1.95 0.05 . 568 . 62 VAL CB C 31.41 0.5 . 569 . 62 VAL HG1 H 1.03 0.05 . 570 . 62 VAL HG2 H 0.94 0.05 . 571 . 62 VAL CG1 C 20.60 0.5 . 572 . 62 VAL CG2 C 21.82 0.5 . 573 . 62 VAL C C 175.53 0.5 . 574 . 63 SER H H 9.33 0.05 . 575 . 63 SER N N 124.61 0.5 . 576 . 63 SER HA H 4.44 0.05 . 577 . 63 SER CA C 58.19 0.5 . 578 . 63 SER HB2 H 3.85 0.05 . 579 . 63 SER HB3 H 3.85 0.05 . 580 . 63 SER CB C 63.56 0.5 . 581 . 63 SER C C 172.48 0.5 . 582 . 64 TYR H H 7.45 0.05 . 583 . 64 TYR N N 118.79 0.5 . 584 . 64 TYR HA H 5.57 0.05 . 585 . 64 TYR CA C 55.87 0.5 . 586 . 64 TYR HB2 H 2.85 0.05 . 587 . 64 TYR HB3 H 2.85 0.05 . 588 . 64 TYR CB C 41.26 0.5 . 589 . 64 TYR C C 174.31 0.5 . 590 . 65 THR H H 8.90 0.05 . 591 . 65 THR N N 113.90 0.5 . 592 . 65 THR HA H 4.55 0.05 . 593 . 65 THR CA C 60.81 0.5 . 594 . 65 THR HB H 4.05 0.05 . 595 . 65 THR CB C 71.18 0.5 . 596 . 65 THR HG2 H 1.16 0.05 . 597 . 65 THR CG2 C 21.07 0.5 . 598 . 65 THR C C 173.35 0.5 . 599 . 66 LEU H H 9.15 0.05 . 600 . 66 LEU N N 129.10 0.5 . 601 . 66 LEU HA H 5.34 0.05 . 602 . 66 LEU CA C 53.16 0.5 . 603 . 66 LEU HB2 H 1.90 0.05 . 604 . 66 LEU HB3 H 1.90 0.05 . 605 . 66 LEU CB C 45.54 0.5 . 606 . 66 LEU HG H 1.56 0.05 . 607 . 66 LEU CG C 24.30 0.5 . 608 . 66 LEU HD1 H 0.86 0.05 . 609 . 66 LEU HD2 H 0.89 0.05 . 610 . 66 LEU CD1 C 23.90 0.5 . 611 . 66 LEU CD2 C 23.90 0.5 . 612 . 66 LEU C C 176.68 0.5 . 613 . 67 SER H H 8.77 0.05 . 614 . 67 SER N N 118.82 0.5 . 615 . 67 SER HA H 4.38 0.05 . 616 . 67 SER CA C 58.00 0.5 . 617 . 67 SER HB2 H 3.85 0.05 . 618 . 67 SER HB3 H 3.99 0.05 . 619 . 67 SER CB C 63.87 0.5 . 620 . 68 ALA H H 8.27 0.05 . 621 . 68 ALA N N 121.81 0.5 . 622 . 68 ALA HA H 4.70 0.05 . 623 . 68 ALA CA C 53.90 0.5 . 624 . 68 ALA HB H 1.27 0.05 . 625 . 68 ALA CB C 17.80 0.5 . 626 . 69 ASP H H 7.86 0.05 . 627 . 69 ASP N N 123.39 0.5 . 628 . 69 ASP HA H 4.47 0.05 . 629 . 69 ASP CA C 52.64 0.5 . 630 . 69 ASP HB2 H 2.65 0.05 . 631 . 69 ASP HB3 H 3.05 0.05 . 632 . 69 ASP CB C 39.74 0.5 . 633 . 70 ARG H H 7.93 0.05 . 634 . 70 ARG N N 111.86 0.5 . 635 . 70 ARG HA H 3.51 0.05 . 636 . 70 ARG CA C 58.10 0.5 . 637 . 70 ARG HB2 H 1.37 0.05 . 638 . 70 ARG HB3 H 1.37 0.05 . 639 . 70 ARG CB C 26.42 0.5 . 640 . 70 ARG HG2 H 1.90 0.05 . 641 . 70 ARG HG3 H 1.95 0.05 . 642 . 70 ARG CG C 28.04 0.5 . 643 . 70 ARG HD2 H 3.25 0.05 . 644 . 70 ARG HD3 H 3.25 0.05 . 645 . 70 ARG CD C 42.81 0.5 . 646 . 70 ARG C C 174.22 0.5 . 647 . 71 THR H H 7.87 0.05 . 648 . 71 THR N N 105.48 0.5 . 649 . 71 THR HA H 4.68 0.05 . 650 . 71 THR CA C 62.12 0.5 . 651 . 71 THR HB H 4.13 0.05 . 652 . 71 THR CB C 70.94 0.5 . 653 . 71 THR HG2 H 1.11 0.05 . 654 . 71 THR CG2 C 20.38 0.5 . 655 . 71 THR C C 173.91 0.5 . 656 . 72 ARG H H 7.70 0.05 . 657 . 72 ARG N N 121.71 0.5 . 658 . 72 ARG HA H 5.53 0.05 . 659 . 72 ARG CA C 53.36 0.5 . 660 . 72 ARG HB2 H 1.64 0.05 . 661 . 72 ARG HB3 H 1.64 0.05 . 662 . 72 ARG CB C 32.26 0.5 . 663 . 72 ARG HG2 H 1.34 0.05 . 664 . 72 ARG HG3 H 1.34 0.05 . 665 . 72 ARG CG C 27.71 0.5 . 666 . 72 ARG HD2 H 3.11 0.05 . 667 . 72 ARG HD3 H 3.11 0.05 . 668 . 72 ARG CD C 43.36 0.5 . 669 . 72 ARG C C 174.99 0.5 . 670 . 73 CYS H H 9.23 0.05 . 671 . 73 CYS N N 126.36 0.5 . 672 . 73 CYS HA H 5.30 0.05 . 673 . 73 CYS CA C 56.37 0.5 . 674 . 73 CYS HB2 H 2.49 0.05 . 675 . 73 CYS HB3 H 2.49 0.05 . 676 . 73 CYS CB C 30.51 0.5 . 677 . 73 CYS C C 172.54 0.5 . 678 . 74 GLU H H 8.88 0.05 . 679 . 74 GLU N N 129.59 0.5 . 680 . 74 GLU HA H 5.29 0.05 . 681 . 74 GLU CA C 54.46 0.5 . 682 . 74 GLU HB2 H 1.95 0.05 . 683 . 74 GLU HB3 H 1.95 0.05 . 684 . 74 GLU CB C 30.52 0.5 . 685 . 74 GLU HG2 H 2.14 0.05 . 686 . 74 GLU HG3 H 2.14 0.05 . 687 . 74 GLU CG C 36.53 0.5 . 688 . 74 GLU C C 175.25 0.5 . 689 . 75 ILE H H 9.40 0.05 . 690 . 75 ILE N N 128.11 0.5 . 691 . 75 ILE HA H 4.87 0.05 . 692 . 75 ILE CA C 59.94 0.5 . 693 . 75 ILE HB H 1.64 0.05 . 694 . 75 ILE CB C 41.41 0.5 . 695 . 75 ILE HG12 H 1.54 0.05 . 696 . 75 ILE HG13 H 1.54 0.05 . 697 . 75 ILE HG2 H 0.88 0.05 . 698 . 75 ILE CG1 C 28.47 0.5 . 699 . 75 ILE CG2 C 16.47 0.5 . 700 . 75 ILE HD1 H 0.70 0.05 . 701 . 75 ILE CD1 C 14.40 0.5 . 702 . 75 ILE C C 173.88 0.5 . 703 . 76 ILE H H 8.31 0.05 . 704 . 76 ILE N N 126.98 0.5 . 705 . 76 ILE HA H 4.02 0.05 . 706 . 76 ILE CA C 60.11 0.5 . 707 . 76 ILE HB H 2.08 0.05 . 708 . 76 ILE CB C 35.38 0.5 . 709 . 76 ILE HG12 H 1.69 0.05 . 710 . 76 ILE HG13 H 1.69 0.05 . 711 . 76 ILE HG2 H 0.94 0.05 . 712 . 76 ILE CG1 C 26.90 0.5 . 713 . 76 ILE CG2 C 16.91 0.5 . 714 . 76 ILE HD1 H 0.79 0.05 . 715 . 76 ILE CD1 C 11.30 0.5 . 716 . 76 ILE C C 175.08 0.5 . 717 . 77 GLY H H 8.09 0.05 . 718 . 77 GLY N N 115.12 0.5 . 719 . 77 GLY HA2 H 4.45 0.05 . 720 . 77 GLY HA3 H 4.10 0.05 . 721 . 77 GLY CA C 46.65 0.5 . 722 . 77 GLY C C 176.19 0.5 . 723 . 78 ASN H H 9.48 0.05 . 724 . 78 ASN N N 120.78 0.5 . 725 . 78 ASN HA H 4.43 0.05 . 726 . 78 ASN CA C 54.32 0.5 . 727 . 78 ASN HB2 H 2.65 0.05 . 728 . 78 ASN HB3 H 2.96 0.05 . 729 . 78 ASN CB C 41.08 0.5 . 730 . 78 ASN C C 176.22 0.5 . 731 . 79 GLY H H 7.83 0.05 . 732 . 79 GLY N N 106.68 0.5 . 733 . 79 GLY HA2 H 3.23 0.05 . 734 . 79 GLY HA3 H 2.34 0.05 . 735 . 79 GLY CA C 45.09 0.5 . 736 . 79 GLY C C 173.57 0.5 . 737 . 80 GLY H H 7.78 0.05 . 738 . 80 GLY N N 107.21 0.5 . 739 . 80 GLY HA2 H 4.50 0.05 . 740 . 80 GLY HA3 H 3.79 0.05 . 741 . 80 GLY CA C 43.74 0.5 . 742 . 80 GLY C C 170.28 0.5 . 743 . 81 PRO HA H 4.44 0.05 . 744 . 81 PRO CA C 62.39 0.5 . 745 . 81 PRO HB2 H 2.25 0.05 . 746 . 81 PRO HB3 H 2.25 0.05 . 747 . 81 PRO CB C 31.89 0.5 . 748 . 81 PRO HG2 H 1.88 0.05 . 749 . 81 PRO HG3 H 2.01 0.05 . 750 . 81 PRO CG C 27.66 0.5 . 751 . 81 PRO HD3 H 3.60 0.05 . 752 . 81 PRO HD2 H 3.65 0.05 . 753 . 81 PRO CD C 49.13 0.5 . 754 . 82 LEU H H 8.12 0.05 . 755 . 82 LEU N N 122.03 0.5 . 756 . 82 LEU HA H 4.23 0.05 . 757 . 82 LEU CA C 54.46 0.5 . 758 . 82 LEU HB2 H 1.53 0.05 . 759 . 82 LEU HB3 H 1.57 0.05 . 760 . 82 LEU CB C 40.54 0.5 . 761 . 82 LEU HG H 1.22 0.05 . 762 . 82 LEU CG C 24.67 0.5 . 763 . 82 LEU HD1 H 0.60 0.05 . 764 . 82 LEU HD2 H 0.60 0.05 . 765 . 82 LEU CD1 C 21.84 0.5 . 766 . 82 LEU CD2 C 21.84 0.5 . 767 . 82 LEU C C 177.00 0.5 . 768 . 83 HIS H H 9.09 0.05 . 769 . 83 HIS N N 122.22 0.5 . 770 . 83 HIS HA H 5.15 0.05 . 771 . 83 HIS CA C 55.27 0.5 . 772 . 83 HIS HB2 H 3.03 0.05 . 773 . 83 HIS HB3 H 3.09 0.05 . 774 . 83 HIS CB C 32.04 0.5 . 775 . 83 HIS C C 172.72 0.5 . 776 . 84 ALA H H 8.04 0.05 . 777 . 84 ALA N N 125.95 0.5 . 778 . 84 ALA HA H 4.47 0.05 . 779 . 84 ALA CA C 50.27 0.5 . 780 . 84 ALA HB H 1.25 0.05 . 781 . 84 ALA CB C 21.20 0.5 . 782 . 84 ALA C C 176.19 0.5 . 783 . 85 GLU H H 8.59 0.05 . 784 . 85 GLU N N 122.26 0.5 . 785 . 85 GLU HA H 4.22 0.05 . 786 . 85 GLU CA C 56.12 0.5 . 787 . 85 GLU HB2 H 1.95 0.05 . 788 . 85 GLU HB3 H 2.04 0.05 . 789 . 85 GLU CB C 29.55 0.5 . 790 . 85 GLU HG2 H 2.29 0.05 . 791 . 85 GLU HG3 H 2.36 0.05 . 792 . 85 GLU CG C 35.96 0.5 . 793 . 85 GLU C C 176.39 0.5 . 794 . 86 GLY H H 8.13 0.05 . 795 . 86 GLY N N 110.56 0.5 . 796 . 86 GLY HA2 H 3.88 0.05 . 797 . 86 GLY HA3 H 3.88 0.05 . 798 . 86 GLY CA C 43.94 0.5 . 799 . 86 GLY C C 172.53 0.5 . 800 . 87 ALA H H 8.15 0.05 . 801 . 87 ALA N N 123.09 0.5 . 802 . 87 ALA HA H 4.95 0.05 . 803 . 87 ALA CA C 51.83 0.5 . 804 . 87 ALA HB H 1.27 0.05 . 805 . 87 ALA CB C 18.06 0.5 . 806 . 87 ALA C C 177.90 0.5 . 807 . 88 LEU H H 8.03 0.05 . 808 . 88 LEU N N 122.67 0.5 . 809 . 88 LEU HA H 4.62 0.05 . 810 . 88 LEU CA C 53.86 0.5 . 811 . 88 LEU HB2 H 1.49 0.05 . 812 . 88 LEU HB3 H 1.49 0.05 . 813 . 88 LEU CB C 45.74 0.5 . 814 . 88 LEU HG H 1.49 0.05 . 815 . 88 LEU CG C 26.66 0.5 . 816 . 88 LEU HD1 H 0.85 0.05 . 817 . 88 LEU HD2 H 0.76 0.05 . 818 . 88 LEU CD1 C 24.35 0.5 . 819 . 88 LEU CD2 C 24.35 0.5 . 820 . 88 LEU C C 174.97 0.5 . 821 . 89 GLU H H 8.55 0.05 . 822 . 89 GLU N N 125.15 0.5 . 823 . 89 GLU HA H 4.97 0.05 . 824 . 89 GLU CA C 54.84 0.5 . 825 . 89 GLU HB2 H 1.72 0.05 . 826 . 89 GLU HB3 H 1.80 0.05 . 827 . 89 GLU CB C 31.27 0.5 . 828 . 89 GLU HG2 H 1.97 0.05 . 829 . 89 GLU HG3 H 1.97 0.05 . 830 . 89 GLU CG C 36.77 0.5 . 831 . 89 GLU C C 174.68 0.5 . 832 . 90 LEU H H 9.35 0.05 . 833 . 90 LEU N N 126.94 0.5 . 834 . 90 LEU HA H 4.63 0.05 . 835 . 90 LEU CA C 52.90 0.5 . 836 . 90 LEU HB2 H 1.70 0.05 . 837 . 90 LEU HB3 H 1.70 0.05 . 838 . 90 LEU CB C 42.72 0.5 . 839 . 90 LEU HG H 1.61 0.05 . 840 . 90 LEU CG C 28.52 0.5 . 841 . 90 LEU HD1 H 0.83 0.05 . 842 . 90 LEU HD2 H 0.90 0.05 . 843 . 90 LEU CD1 C 23.82 0.5 . 844 . 90 LEU CD2 C 25.12 0.5 . 845 . 90 LEU C C 173.54 0.5 . 846 . 91 PHE H H 8.79 0.05 . 847 . 91 PHE N N 124.72 0.5 . 848 . 91 PHE HA H 4.42 0.05 . 849 . 91 PHE CA C 57.21 0.5 . 850 . 91 PHE HB2 H 2.99 0.05 . 851 . 91 PHE HB3 H 3.14 0.05 . 852 . 91 PHE CB C 39.41 0.5 . 853 . 91 PHE C C 175.83 0.5 . 854 . 92 LEU H H 8.32 0.05 . 855 . 92 LEU N N 127.51 0.5 . 856 . 92 LEU HA H 4.44 0.05 . 857 . 92 LEU CA C 52.12 0.5 . 858 . 92 LEU HB2 H 1.63 0.05 . 859 . 92 LEU HB3 H 1.63 0.05 . 860 . 92 LEU CB C 41.48 0.5 . 861 . 92 LEU HG H 1.63 0.05 . 862 . 92 LEU CG C 26.28 0.5 . 863 . 92 LEU HD1 H 0.73 0.05 . 864 . 92 LEU HD2 H 0.91 0.05 . 865 . 92 LEU CD1 C 22.68 0.5 . 866 . 92 LEU CD2 C 24.33 0.5 . 867 . 92 LEU C C 174.58 0.5 . 868 . 93 GLY H H 5.31 0.05 . 869 . 93 GLY N N 103.28 0.5 . 870 . 93 GLY HA2 H 2.73 0.05 . 871 . 93 GLY HA3 H 3.25 0.05 . 872 . 93 GLY CA C 47.76 0.5 . 873 . 94 ASN H H 8.86 0.05 . 874 . 94 ASN N N 126.90 0.5 . 875 . 94 ASN HA H 5.02 0.05 . 876 . 94 ASN CA C 51.43 0.5 . 877 . 94 ASN HB2 H 2.47 0.05 . 878 . 94 ASN HB3 H 2.83 0.05 . 879 . 94 ASN CB C 38.95 0.5 . 880 . 95 ALA H H 8.20 0.05 . 881 . 95 ALA N N 123.24 0.5 . 882 . 95 ALA HA H 4.58 0.05 . 883 . 95 ALA CA C 51.02 0.5 . 884 . 95 ALA HB H 1.25 0.05 . 885 . 95 ALA CB C 18.06 0.5 . 886 . 95 ALA C C 177.67 0.5 . 887 . 96 GLY H H 8.21 0.05 . 888 . 96 GLY N N 106.12 0.5 . 889 . 96 GLY HA2 H 3.82 0.05 . 890 . 96 GLY HA3 H 2.93 0.05 . 891 . 96 GLY CA C 45.20 0.5 . 892 . 97 THR H H 7.96 0.05 . 893 . 97 THR N N 107.94 0.5 . 894 . 97 THR HA H 4.36 0.05 . 895 . 97 THR CA C 63.35 0.5 . 896 . 97 THR HB H 4.13 0.05 . 897 . 97 THR HG2 H 1.08 0.05 . 898 . 97 THR CG2 C 21.39 0.5 . 899 . 98 ALA H H 7.32 0.05 . 900 . 98 ALA N N 120.81 0.5 . 901 . 98 ALA HA H 4.41 0.05 . 902 . 98 ALA CA C 52.92 0.5 . 903 . 98 ALA HB H 1.39 0.05 . 904 . 98 ALA CB C 19.84 0.5 . 905 . 98 ALA C C 176.91 0.5 . 906 . 99 MET H H 8.01 0.05 . 907 . 99 MET N N 115.19 0.5 . 908 . 99 MET HA H 3.76 0.05 . 909 . 99 MET CA C 58.61 0.5 . 910 . 99 MET HB2 H 2.18 0.05 . 911 . 99 MET HB3 H 2.38 0.05 . 912 . 99 MET CB C 32.93 0.5 . 913 . 99 MET HG2 H 2.47 0.05 . 914 . 99 MET HG3 H 2.47 0.05 . 915 . 99 MET CG C 31.51 0.5 . 916 . 99 MET HE H 1.61 0.05 . 917 . 99 MET CE C 17.58 0.5 . 918 . 99 MET C C 176.04 0.5 . 919 . 100 ARG H H 7.78 0.05 . 920 . 100 ARG N N 113.54 0.5 . 921 . 100 ARG HA H 4.37 0.05 . 922 . 100 ARG CA C 62.05 0.5 . 923 . 100 ARG HB2 H 1.89 0.05 . 924 . 100 ARG HB3 H 2.01 0.05 . 925 . 100 ARG CB C 27.29 0.5 . 926 . 100 ARG HG2 H 1.80 0.05 . 927 . 100 ARG HG3 H 1.80 0.05 . 928 . 100 ARG CG C 31.13 0.5 . 929 . 100 ARG HD2 H 3.24 0.05 . 930 . 100 ARG HD3 H 3.24 0.05 . 931 . 100 ARG CD C 43.44 0.5 . 932 . 100 ARG C C 174.08 0.5 . 933 . 101 PRO HA H 4.37 0.05 . 934 . 101 PRO CA C 65.74 0.5 . 935 . 101 PRO HB2 H 1.98 0.05 . 936 . 101 PRO HB3 H 1.98 0.05 . 937 . 101 PRO CB C 31.14 0.5 . 938 . 101 PRO HG2 H 1.60 0.05 . 939 . 101 PRO HG3 H 1.65 0.05 . 940 . 101 PRO CG C 27.46 0.5 . 941 . 101 PRO HD2 H 3.25 0.05 . 942 . 101 PRO HD3 H 3.25 0.05 . 943 . 101 PRO CD C 49.78 0.5 . 944 . 102 LEU H H 7.25 0.05 . 945 . 102 LEU N N 115.30 0.5 . 946 . 102 LEU HA H 3.85 0.05 . 947 . 102 LEU CA C 57.37 0.5 . 948 . 102 LEU HB2 H 1.19 0.05 . 949 . 102 LEU HB3 H 1.55 0.05 . 950 . 102 LEU CB C 41.36 0.5 . 951 . 102 LEU HG H 1.51 0.05 . 952 . 102 LEU CG C 27.03 0.5 . 953 . 102 LEU HD1 H 0.76 0.05 . 954 . 102 LEU HD2 H 0.63 0.05 . 955 . 102 LEU CD1 C 22.29 0.5 . 956 . 102 LEU CD2 C 24.82 0.5 . 957 . 102 LEU C C 176.75 0.5 . 958 . 103 ALA H H 8.27 0.05 . 959 . 103 ALA N N 119.18 0.5 . 960 . 103 ALA HA H 3.73 0.05 . 961 . 103 ALA CA C 54.24 0.5 . 962 . 103 ALA HB H 1.11 0.05 . 963 . 103 ALA CB C 16.40 0.5 . 964 . 103 ALA C C 176.88 0.5 . 965 . 104 ALA H H 6.60 0.05 . 966 . 104 ALA N N 111.59 0.5 . 967 . 104 ALA HA H 4.08 0.05 . 968 . 104 ALA CA C 53.47 0.5 . 969 . 104 ALA HB H 1.07 0.05 . 970 . 104 ALA CB C 19.67 0.5 . 971 . 104 ALA C C 177.98 0.5 . 972 . 105 ALA H H 7.83 0.05 . 973 . 105 ALA N N 119.21 0.5 . 974 . 105 ALA HA H 4.09 0.05 . 975 . 105 ALA CA C 54.92 0.5 . 976 . 105 ALA HB H 1.25 0.05 . 977 . 105 ALA CB C 17.49 0.5 . 978 . 105 ALA C C 180.59 0.5 . 979 . 106 LEU H H 8.10 0.05 . 980 . 106 LEU N N 112.95 0.5 . 981 . 106 LEU HA H 4.28 0.05 . 982 . 106 LEU CA C 54.58 0.5 . 983 . 106 LEU HB2 H 1.80 0.05 . 984 . 106 LEU HB3 H 1.80 0.05 . 985 . 106 LEU CB C 39.53 0.5 . 986 . 106 LEU HG H 1.46 0.05 . 987 . 106 LEU CG C 26.08 0.5 . 988 . 106 LEU HD1 H 0.77 0.05 . 989 . 106 LEU HD2 H 0.74 0.05 . 990 . 106 LEU CD1 C 21.50 0.5 . 991 . 106 LEU CD2 C 22.18 0.5 . 992 . 106 LEU C C 176.79 0.5 . 993 . 107 CYS H H 7.68 0.05 . 994 . 107 CYS N N 113.23 0.5 . 995 . 107 CYS HA H 4.39 0.05 . 996 . 107 CYS CA C 61.24 0.5 . 997 . 107 CYS HB2 H 2.78 0.05 . 998 . 107 CYS HB3 H 3.25 0.05 . 999 . 107 CYS CB C 26.95 0.5 . 1000 . 107 CYS C C 174.00 0.5 . 1001 . 108 LEU H H 7.36 0.05 . 1002 . 108 LEU N N 119.84 0.5 . 1003 . 108 LEU HA H 4.63 0.05 . 1004 . 108 LEU CA C 54.49 0.5 . 1005 . 108 LEU HB2 H 1.39 0.05 . 1006 . 108 LEU HB3 H 2.06 0.05 . 1007 . 108 LEU CB C 41.90 0.5 . 1008 . 108 LEU HG H 1.13 0.05 . 1009 . 108 LEU CG C 26.33 0.5 . 1010 . 108 LEU HD1 H 0.92 0.05 . 1011 . 108 LEU HD2 H 0.92 0.05 . 1012 . 108 LEU CD1 C 21.60 0.5 . 1013 . 108 LEU CD2 C 21.60 0.5 . 1014 . 108 LEU C C 178.36 0.5 . 1015 . 109 GLY H H 9.39 0.05 . 1016 . 109 GLY N N 112.39 0.5 . 1017 . 109 GLY HA2 H 3.65 0.05 . 1018 . 109 GLY HA3 H 4.09 0.05 . 1019 . 109 GLY CA C 45.26 0.5 . 1020 . 109 GLY C C 173.79 0.5 . 1021 . 110 SER H H 8.58 0.05 . 1022 . 110 SER N N 119.00 0.5 . 1023 . 110 SER HA H 4.78 0.05 . 1024 . 110 SER CA C 56.67 0.5 . 1025 . 110 SER HB2 H 3.78 0.05 . 1026 . 110 SER HB3 H 3.78 0.05 . 1027 . 110 SER CB C 63.28 0.5 . 1028 . 111 ASN H H 8.02 0.05 . 1029 . 111 ASN N N 121.35 0.5 . 1030 . 111 ASN HA H 4.78 0.05 . 1031 . 111 ASN CA C 52.76 0.5 . 1032 . 111 ASN HB2 H 2.61 0.05 . 1033 . 111 ASN HB3 H 2.69 0.05 . 1034 . 111 ASN CB C 42.65 0.5 . 1035 . 111 ASN C C 173.32 0.5 . 1036 . 112 ASP H H 8.67 0.05 . 1037 . 112 ASP N N 118.27 0.5 . 1038 . 112 ASP HA H 5.00 0.05 . 1039 . 112 ASP CA C 53.41 0.5 . 1040 . 112 ASP HB2 H 2.42 0.05 . 1041 . 112 ASP HB3 H 2.85 0.05 . 1042 . 112 ASP CB C 40.34 0.5 . 1043 . 113 ILE H H 8.44 0.05 . 1044 . 113 ILE N N 121.01 0.5 . 1045 . 113 ILE HA H 5.02 0.05 . 1046 . 113 ILE CA C 58.44 0.5 . 1047 . 113 ILE HB H 1.58 0.05 . 1048 . 113 ILE CB C 42.93 0.5 . 1049 . 113 ILE HG12 H 1.09 0.05 . 1050 . 113 ILE HG13 H 1.09 0.05 . 1051 . 113 ILE HG2 H 0.73 0.05 . 1052 . 113 ILE CG1 C 27.59 0.5 . 1053 . 113 ILE CG2 C 16.92 0.5 . 1054 . 113 ILE HD1 H 0.79 0.05 . 1055 . 113 ILE CD1 C 14.39 0.5 . 1056 . 113 ILE C C 174.81 0.5 . 1057 . 114 VAL H H 8.81 0.05 . 1058 . 114 VAL N N 127.50 0.5 . 1059 . 114 VAL HA H 5.00 0.05 . 1060 . 114 VAL CA C 60.38 0.5 . 1061 . 114 VAL HB H 1.81 0.05 . 1062 . 114 VAL CB C 33.70 0.5 . 1063 . 114 VAL HG1 H 0.96 0.05 . 1064 . 114 VAL HG2 H 0.75 0.05 . 1065 . 114 VAL CG1 C 21.46 0.5 . 1066 . 114 VAL CG2 C 20.00 0.5 . 1067 . 114 VAL C C 174.86 0.5 . 1068 . 115 LEU H H 8.86 0.05 . 1069 . 115 LEU N N 125.90 0.5 . 1070 . 115 LEU HA H 5.12 0.05 . 1071 . 115 LEU CA C 53.04 0.5 . 1072 . 115 LEU HB2 H 1.52 0.05 . 1073 . 115 LEU HB3 H 1.54 0.05 . 1074 . 115 LEU CB C 43.57 0.5 . 1075 . 115 LEU HG H 1.61 0.05 . 1076 . 115 LEU CG C 27.03 0.5 . 1077 . 115 LEU HD1 H 0.77 0.05 . 1078 . 115 LEU HD2 H 0.88 0.05 . 1079 . 115 LEU CD1 C 25.54 0.5 . 1080 . 115 LEU CD2 C 24.05 0.5 . 1081 . 115 LEU C C 175.12 0.5 . 1082 . 116 THR H H 8.51 0.05 . 1083 . 116 THR N N 117.02 0.5 . 1084 . 116 THR HA H 4.45 0.05 . 1085 . 116 THR CA C 58.04 0.5 . 1086 . 116 THR HB H 3.89 0.05 . 1087 . 116 THR CB C 70.15 0.5 . 1088 . 116 THR HG2 H 1.18 0.05 . 1089 . 116 THR CG2 C 19.29 0.5 . 1090 . 117 GLY H H 8.26 0.05 . 1091 . 117 GLY N N 106.32 0.5 . 1092 . 117 GLY HA2 H 2.97 0.05 . 1093 . 117 GLY HA3 H 3.76 0.05 . 1094 . 117 GLY CA C 45.17 0.5 . 1095 . 117 GLY C C 171.62 0.5 . 1096 . 118 GLU H H 7.89 0.05 . 1097 . 118 GLU N N 119.88 0.5 . 1098 . 118 GLU HA H 5.41 0.05 . 1099 . 118 GLU CA C 55.20 0.5 . 1100 . 118 GLU HB2 H 1.60 0.05 . 1101 . 118 GLU HB3 H 1.60 0.05 . 1102 . 118 GLU CB C 28.25 0.5 . 1103 . 118 GLU HG2 H 1.73 0.05 . 1104 . 118 GLU HG3 H 1.73 0.05 . 1105 . 118 GLU C C 174.68 0.5 . 1106 . 119 PRO HA H 4.82 0.05 . 1107 . 119 PRO HB2 H 2.25 0.05 . 1108 . 119 PRO HB3 H 2.25 0.05 . 1109 . 119 PRO CB C 31.29 0.5 . 1110 . 119 PRO HG2 H 1.88 0.05 . 1111 . 119 PRO HG3 H 2.00 0.05 . 1112 . 119 PRO CG C 27.24 0.5 . 1113 . 119 PRO HD3 H 3.68 0.05 . 1114 . 119 PRO HD2 H 3.90 0.05 . 1115 . 119 PRO CD C 50.29 0.5 . 1116 . 120 ARG H H 8.59 0.05 . 1117 . 120 ARG N N 114.13 0.5 . 1118 . 120 ARG HA H 4.00 0.05 . 1119 . 120 ARG CA C 58.66 0.5 . 1120 . 120 ARG HB2 H 1.73 0.05 . 1121 . 120 ARG HB3 H 1.73 0.05 . 1122 . 120 ARG CB C 29.53 0.5 . 1123 . 120 ARG HG2 H 1.66 0.05 . 1124 . 120 ARG HG3 H 1.66 0.05 . 1125 . 120 ARG CG C 26.85 0.5 . 1126 . 120 ARG HD2 H 3.18 0.05 . 1127 . 120 ARG HD3 H 3.18 0.05 . 1128 . 120 ARG CD C 43.23 0.5 . 1129 . 120 ARG C C 178.87 0.5 . 1130 . 121 MET H H 7.70 0.05 . 1131 . 121 MET N N 119.80 0.5 . 1132 . 121 MET HA H 4.70 0.05 . 1133 . 121 MET CA C 57.17 0.5 . 1134 . 121 MET HB2 H 1.96 0.05 . 1135 . 121 MET HB3 H 2.10 0.05 . 1136 . 121 MET CB C 32.43 0.5 . 1137 . 121 MET HG2 H 2.42 0.05 . 1138 . 121 MET HG3 H 2.42 0.05 . 1139 . 121 MET CG C 32.29 0.5 . 1140 . 121 MET HE H 1.73 0.05 . 1141 . 121 MET CE C 16.89 0.5 . 1142 . 121 MET C C 178.09 0.5 . 1143 . 122 LYS H H 7.45 0.05 . 1144 . 122 LYS N N 116.31 0.5 . 1145 . 122 LYS HA H 4.44 0.05 . 1146 . 122 LYS CA C 57.47 0.5 . 1147 . 122 LYS HB2 H 1.88 0.05 . 1148 . 122 LYS HB3 H 1.88 0.05 . 1149 . 122 LYS CB C 31.36 0.5 . 1150 . 122 LYS HG2 H 1.43 0.05 . 1151 . 122 LYS HG3 H 1.43 0.05 . 1152 . 122 LYS CG C 24.10 0.5 . 1153 . 122 LYS HD2 H 1.68 0.05 . 1154 . 122 LYS HD3 H 1.68 0.05 . 1155 . 122 LYS CD C 29.50 0.5 . 1156 . 122 LYS HE2 H 2.97 0.05 . 1157 . 122 LYS HE3 H 2.97 0.05 . 1158 . 122 LYS CE C 43.41 0.5 . 1159 . 123 GLU H H 7.14 0.05 . 1160 . 123 GLU N N 113.56 0.5 . 1161 . 123 GLU HA H 4.06 0.05 . 1162 . 123 GLU CA C 55.72 0.5 . 1163 . 123 GLU HB2 H 2.14 0.05 . 1164 . 123 GLU HB3 H 2.14 0.05 . 1165 . 123 GLU CB C 30.03 0.5 . 1166 . 123 GLU HG2 H 2.30 0.05 . 1167 . 123 GLU HG3 H 2.30 0.05 . 1168 . 123 GLU CG C 36.12 0.5 . 1169 . 123 GLU C C 176.36 0.5 . 1170 . 124 ARG H H 7.49 0.05 . 1171 . 124 ARG N N 121.31 0.5 . 1172 . 124 ARG HA H 3.89 0.05 . 1173 . 124 ARG CA C 52.41 0.5 . 1174 . 124 ARG HB2 H 1.97 0.05 . 1175 . 124 ARG HB3 H 1.97 0.05 . 1176 . 124 ARG CB C 29.74 0.5 . 1177 . 124 ARG HG2 H 1.40 0.05 . 1178 . 124 ARG HG3 H 1.40 0.05 . 1179 . 124 ARG C C 173.53 0.5 . 1180 . 125 PRO HA H 4.48 0.05 . 1181 . 125 PRO CA C 62.50 0.5 . 1182 . 125 PRO HB2 H 1.87 0.05 . 1183 . 125 PRO HB3 H 2.27 0.05 . 1184 . 125 PRO CB C 32.08 0.5 . 1185 . 125 PRO HG2 H 2.00 0.05 . 1186 . 125 PRO HG3 H 2.00 0.05 . 1187 . 125 PRO CG C 26.79 0.5 . 1188 . 125 PRO HD3 H 3.77 0.05 . 1189 . 125 PRO HD2 H 3.81 0.05 . 1190 . 125 PRO CD C 45.11 0.5 . 1191 . 126 ILE H H 8.69 0.05 . 1192 . 126 ILE N N 119.50 0.5 . 1193 . 126 ILE HA H 5.03 0.05 . 1194 . 126 ILE CA C 59.08 0.5 . 1195 . 126 ILE HB H 1.85 0.05 . 1196 . 126 ILE CB C 43.71 0.5 . 1197 . 126 ILE HG12 H 1.62 0.05 . 1198 . 126 ILE HG13 H 1.62 0.05 . 1199 . 126 ILE HG2 H 0.69 0.05 . 1200 . 126 ILE CG1 C 30.63 0.5 . 1201 . 126 ILE CG2 C 17.33 0.5 . 1202 . 126 ILE HD1 H 0.58 0.05 . 1203 . 126 ILE CD1 C 14.64 0.5 . 1204 . 126 ILE C C 175.74 0.5 . 1205 . 127 GLY H H 7.41 0.05 . 1206 . 127 GLY N N 114.37 0.5 . 1207 . 127 GLY HA2 H 3.92 0.05 . 1208 . 127 GLY HA3 H 3.92 0.05 . 1209 . 127 GLY CA C 47.16 0.5 . 1210 . 127 GLY C C 174.74 0.5 . 1211 . 128 HIS H H 8.30 0.05 . 1212 . 128 HIS N N 116.74 0.5 . 1213 . 128 HIS HA H 4.34 0.05 . 1214 . 128 HIS CA C 57.69 0.5 . 1215 . 128 HIS HB2 H 2.05 0.05 . 1216 . 128 HIS HB3 H 2.74 0.05 . 1217 . 128 HIS CB C 31.28 0.5 . 1218 . 128 HIS C C 179.33 0.5 . 1219 . 129 LEU H H 6.53 0.05 . 1220 . 129 LEU N N 116.46 0.5 . 1221 . 129 LEU CA C 56.40 0.5 . 1222 . 129 LEU HB2 H 1.38 0.05 . 1223 . 129 LEU HB3 H 1.38 0.05 . 1224 . 129 LEU CB C 41.35 0.5 . 1225 . 129 LEU HG H 1.17 0.05 . 1226 . 129 LEU CG C 26.31 0.5 . 1227 . 129 LEU HD1 H 0.84 0.05 . 1228 . 129 LEU HD2 H 0.70 0.05 . 1229 . 129 LEU CD1 C 22.18 0.5 . 1230 . 129 LEU CD2 C 24.42 0.5 . 1231 . 129 LEU C C 176.53 0.5 . 1232 . 130 VAL H H 7.35 0.05 . 1233 . 130 VAL N N 119.97 0.5 . 1234 . 130 VAL HA H 3.20 0.05 . 1235 . 130 VAL CA C 66.62 0.5 . 1236 . 130 VAL HB H 2.21 0.05 . 1237 . 130 VAL CB C 31.33 0.5 . 1238 . 130 VAL HG1 H 0.74 0.05 . 1239 . 130 VAL HG2 H 0.74 0.05 . 1240 . 130 VAL CG1 C 19.42 0.5 . 1241 . 130 VAL CG2 C 23.09 0.5 . 1242 . 130 VAL C C 177.42 0.5 . 1243 . 131 ASP H H 9.18 0.05 . 1244 . 131 ASP N N 118.04 0.5 . 1245 . 131 ASP HA H 4.24 0.05 . 1246 . 131 ASP CA C 57.04 0.5 . 1247 . 131 ASP HB2 H 2.64 0.05 . 1248 . 131 ASP HB3 H 2.64 0.05 . 1249 . 131 ASP CB C 39.73 0.5 . 1250 . 131 ASP C C 178.67 0.5 . 1251 . 132 ALA H H 6.75 0.05 . 1252 . 132 ALA N N 120.98 0.5 . 1253 . 132 ALA HA H 4.29 0.05 . 1254 . 132 ALA CA C 54.89 0.5 . 1255 . 132 ALA HB H 1.47 0.05 . 1256 . 132 ALA CB C 19.41 0.5 . 1257 . 132 ALA C C 178.87 0.5 . 1258 . 133 LEU H H 8.25 0.05 . 1259 . 133 LEU N N 116.71 0.5 . 1260 . 133 LEU HA H 4.04 0.05 . 1261 . 133 LEU CA C 57.67 0.5 . 1262 . 133 LEU HB2 H 1.84 0.05 . 1263 . 133 LEU HB3 H 1.84 0.05 . 1264 . 133 LEU CB C 40.66 0.5 . 1265 . 133 LEU HG H 1.34 0.05 . 1266 . 133 LEU CG C 25.27 0.5 . 1267 . 133 LEU HD1 H 0.46 0.05 . 1268 . 133 LEU HD2 H 0.46 0.05 . 1269 . 133 LEU CD1 C 21.57 0.5 . 1270 . 133 LEU CD2 C 21.57 0.5 . 1271 . 133 LEU C C 181.20 0.5 . 1272 . 134 ARG H H 8.93 0.05 . 1273 . 134 ARG N N 119.04 0.5 . 1274 . 134 ARG HA H 4.59 0.05 . 1275 . 134 ARG CA C 59.04 0.5 . 1276 . 134 ARG HB2 H 1.89 0.05 . 1277 . 134 ARG HB3 H 1.89 0.05 . 1278 . 134 ARG CB C 30.62 0.5 . 1279 . 134 ARG HG2 H 1.60 0.05 . 1280 . 134 ARG HG3 H 1.71 0.05 . 1281 . 134 ARG CG C 27.20 0.5 . 1282 . 134 ARG HD2 H 2.70 0.05 . 1283 . 134 ARG HD3 H 2.70 0.05 . 1284 . 134 ARG CD C 44.51 0.5 . 1285 . 134 ARG C C 181.74 0.5 . 1286 . 135 LEU H H 7.69 0.05 . 1287 . 135 LEU N N 121.28 0.5 . 1288 . 135 LEU HA H 4.34 0.05 . 1289 . 135 LEU CA C 57.63 0.5 . 1290 . 135 LEU HB2 H 1.71 0.05 . 1291 . 135 LEU HB3 H 2.42 0.05 . 1292 . 135 LEU CB C 41.18 0.5 . 1293 . 135 LEU HG H 1.23 0.05 . 1294 . 135 LEU HD1 H 2.07 0.05 . 1295 . 135 LEU CG C 26.40 0.5 . 1296 . 135 LEU HD2 H 1.03 0.05 . 1297 . 135 LEU CD1 C 21.78 0.5 . 1298 . 135 LEU CD2 C 21.78 0.5 . 1299 . 135 LEU C C 178.55 0.5 . 1300 . 136 GLY H H 7.50 0.05 . 1301 . 136 GLY N N 104.06 0.5 . 1302 . 136 GLY HA2 H 4.24 0.05 . 1303 . 136 GLY HA3 H 3.11 0.05 . 1304 . 136 GLY CA C 44.55 0.5 . 1305 . 136 GLY C C 172.62 0.5 . 1306 . 137 GLY H H 7.63 0.05 . 1307 . 137 GLY N N 105.98 0.5 . 1308 . 137 GLY HA2 H 4.60 0.05 . 1309 . 137 GLY HA3 H 3.54 0.05 . 1310 . 137 GLY CA C 44.44 0.5 . 1311 . 137 GLY C C 174.16 0.5 . 1312 . 138 ALA H H 7.89 0.05 . 1313 . 138 ALA N N 119.75 0.5 . 1314 . 138 ALA HA H 4.22 0.05 . 1315 . 138 ALA CA C 52.30 0.5 . 1316 . 138 ALA HB H 1.25 0.05 . 1317 . 138 ALA CB C 21.18 0.5 . 1318 . 138 ALA C C 176.82 0.5 . 1319 . 139 LYS H H 8.74 0.05 . 1320 . 139 LYS N N 122.57 0.5 . 1321 . 139 LYS HA H 4.60 0.05 . 1322 . 139 LYS CA C 54.73 0.5 . 1323 . 139 LYS HB2 H 1.69 0.05 . 1324 . 139 LYS HB3 H 1.69 0.05 . 1325 . 139 LYS CB C 31.88 0.5 . 1326 . 139 LYS HG2 H 1.41 0.05 . 1327 . 139 LYS HG3 H 1.45 0.05 . 1328 . 139 LYS CG C 23.92 0.5 . 1329 . 139 LYS HD2 H 1.59 0.05 . 1330 . 139 LYS HD3 H 1.59 0.05 . 1331 . 139 LYS CD C 28.32 0.5 . 1332 . 139 LYS HE2 H 2.91 0.05 . 1333 . 139 LYS HE3 H 2.91 0.05 . 1334 . 139 LYS CE C 41.86 0.5 . 1335 . 139 LYS C C 175.76 0.5 . 1336 . 140 ILE H H 9.05 0.05 . 1337 . 140 ILE N N 127.34 0.5 . 1338 . 140 ILE HA H 4.93 0.05 . 1339 . 140 ILE CA C 60.09 0.5 . 1340 . 140 ILE HB H 1.27 0.05 . 1341 . 140 ILE CB C 42.03 0.5 . 1342 . 140 ILE HG12 H 1.43 0.05 . 1343 . 140 ILE HG13 H 1.43 0.05 . 1344 . 140 ILE HG2 H 0.43 0.05 . 1345 . 140 ILE CG1 C 27.06 0.5 . 1346 . 140 ILE CG2 C 17.85 0.5 . 1347 . 140 ILE HD1 H 0.85 0.05 . 1348 . 140 ILE CD1 C 16.15 0.5 . 1349 . 140 ILE C C 174.66 0.5 . 1350 . 141 THR H H 8.78 0.05 . 1351 . 141 THR N N 122.89 0.5 . 1352 . 141 THR HA H 4.44 0.05 . 1353 . 141 THR CA C 60.37 0.5 . 1354 . 141 THR HB H 3.86 0.05 . 1355 . 141 THR CB C 71.38 0.5 . 1356 . 141 THR HG2 H 1.16 0.05 . 1357 . 141 THR CG2 C 20.78 0.5 . 1358 . 141 THR C C 173.69 0.5 . 1359 . 142 TYR H H 8.94 0.05 . 1360 . 142 TYR N N 125.68 0.5 . 1361 . 142 TYR HA H 4.49 0.05 . 1362 . 142 TYR CA C 58.47 0.5 . 1363 . 142 TYR HB2 H 2.73 0.05 . 1364 . 142 TYR HB3 H 3.20 0.05 . 1365 . 142 TYR CB C 36.66 0.5 . 1366 . 142 TYR C C 175.92 0.5 . 1367 . 143 LEU H H 7.58 0.05 . 1368 . 143 LEU N N 123.53 0.5 . 1369 . 143 LEU HA H 4.27 0.05 . 1370 . 143 LEU CA C 55.87 0.5 . 1371 . 143 LEU HB2 H 1.65 0.05 . 1372 . 143 LEU HB3 H 1.65 0.05 . 1373 . 143 LEU CB C 42.69 0.5 . 1374 . 143 LEU HG H 1.43 0.05 . 1375 . 143 LEU CG C 26.42 0.5 . 1376 . 143 LEU HD1 H 0.88 0.05 . 1377 . 143 LEU HD2 H 0.78 0.05 . 1378 . 143 LEU CD1 C 22.93 0.5 . 1379 . 143 LEU CD2 C 21.92 0.5 . 1380 . 143 LEU C C 177.42 0.5 . 1381 . 144 GLU H H 9.52 0.05 . 1382 . 144 GLU N N 121.52 0.5 . 1383 . 144 GLU HA H 4.45 0.05 . 1384 . 144 GLU CA C 56.15 0.5 . 1385 . 144 GLU HB2 H 2.01 0.05 . 1386 . 144 GLU HB3 H 2.01 0.05 . 1387 . 144 GLU CB C 30.51 0.5 . 1388 . 144 GLU HG2 H 2.29 0.05 . 1389 . 144 GLU HG3 H 2.29 0.05 . 1390 . 144 GLU CG C 36.22 0.5 . 1391 . 144 GLU C C 175.08 0.5 . 1392 . 145 GLN H H 8.21 0.05 . 1393 . 145 GLN N N 121.33 0.5 . 1394 . 145 GLN HA H 4.39 0.05 . 1395 . 145 GLN CA C 55.00 0.5 . 1396 . 145 GLN HB2 H 2.01 0.05 . 1397 . 145 GLN HB3 H 2.01 0.05 . 1398 . 145 GLN CB C 29.41 0.5 . 1399 . 145 GLN HG2 H 2.37 0.05 . 1400 . 145 GLN HG3 H 2.37 0.05 . 1401 . 145 GLN CG C 33.33 0.5 . 1402 . 145 GLN C C 175.87 0.5 . 1403 . 146 GLU H H 8.58 0.05 . 1404 . 146 GLU N N 125.45 0.5 . 1405 . 146 GLU HA H 5.32 0.05 . 1406 . 146 GLU CA C 57.43 0.5 . 1407 . 146 GLU HB2 H 2.10 0.05 . 1408 . 146 GLU HB3 H 2.10 0.05 . 1409 . 146 GLU CB C 28.88 0.5 . 1410 . 146 GLU HG2 H 2.30 0.05 . 1411 . 146 GLU HG3 H 2.36 0.05 . 1412 . 146 GLU CG C 35.60 0.5 . 1413 . 146 GLU C C 176.42 0.5 . 1414 . 147 ASN H H 4.00 0.05 . 1415 . 147 ASN N N 110.45 0.5 . 1416 . 147 ASN HA H 3.94 0.05 . 1417 . 147 ASN CA C 56.34 0.5 . 1418 . 147 ASN HB2 H 2.69 0.05 . 1419 . 147 ASN HB3 H 3.06 0.05 . 1420 . 147 ASN CB C 37.12 0.5 . 1421 . 147 ASN C C 172.55 0.5 . 1422 . 148 TYR H H 7.49 0.05 . 1423 . 148 TYR N N 119.43 0.5 . 1424 . 148 TYR HA H 4.31 0.05 . 1425 . 148 TYR CA C 56.84 0.5 . 1426 . 148 TYR HB2 H 2.73 0.05 . 1427 . 148 TYR HB3 H 2.73 0.05 . 1428 . 148 TYR CB C 40.09 0.5 . 1429 . 148 TYR C C 171.88 0.5 . 1430 . 150 PRO HA H 5.59 0.05 . 1431 . 150 PRO CA C 65.67 0.5 . 1432 . 150 PRO HB2 H 2.65 0.05 . 1433 . 150 PRO HB3 H 2.65 0.05 . 1434 . 150 PRO CB C 35.43 0.5 . 1435 . 150 PRO HG2 H 1.88 0.05 . 1436 . 150 PRO HG3 H 2.00 0.05 . 1437 . 150 PRO CG C 25.17 0.5 . 1438 . 150 PRO HD2 H 3.59 0.05 . 1439 . 150 PRO HD3 H 3.59 0.05 . 1440 . 150 PRO CD C 50.70 0.5 . 1441 . 151 LEU H H 8.18 0.05 . 1442 . 151 LEU N N 117.67 0.5 . 1443 . 151 LEU HA H 5.24 0.05 . 1444 . 151 LEU CA C 52.63 0.5 . 1445 . 151 LEU HB2 H 1.49 0.05 . 1446 . 151 LEU HB3 H 1.49 0.05 . 1447 . 151 LEU CB C 45.77 0.5 . 1448 . 151 LEU HG H 0.64 0.05 . 1449 . 151 LEU CG C 25.41 0.5 . 1450 . 151 LEU HD1 H 0.85 0.05 . 1451 . 151 LEU HD2 H 0.76 0.05 . 1452 . 151 LEU CD1 C 24.42 0.5 . 1453 . 151 LEU CD2 C 24.42 0.5 . 1454 . 151 LEU C C 174.46 0.5 . 1455 . 152 ARG H H 9.10 0.05 . 1456 . 152 ARG N N 121.06 0.5 . 1457 . 152 ARG HA H 4.50 0.05 . 1458 . 152 ARG CA C 54.59 0.5 . 1459 . 152 ARG HB2 H 1.53 0.05 . 1460 . 152 ARG HB3 H 1.53 0.05 . 1461 . 152 ARG CB C 32.35 0.5 . 1462 . 152 ARG HG2 H 1.14 0.05 . 1463 . 152 ARG HG3 H 1.14 0.05 . 1464 . 152 ARG CG C 26.34 0.5 . 1465 . 152 ARG HD2 H 2.93 0.05 . 1466 . 152 ARG HD3 H 2.93 0.05 . 1467 . 152 ARG CD C 43.82 0.5 . 1468 . 152 ARG C C 174.77 0.5 . 1469 . 153 LEU N N 130.96 0.5 . 1470 . 153 LEU HA H 4.59 0.05 . 1471 . 153 LEU CA C 53.82 0.5 . 1472 . 153 LEU HB2 H 1.84 0.05 . 1473 . 153 LEU HB3 H 1.84 0.05 . 1474 . 153 LEU CB C 41.32 0.5 . 1475 . 153 LEU HG H 1.18 0.05 . 1476 . 153 LEU CG C 26.56 0.5 . 1477 . 153 LEU HD1 H 0.82 0.05 . 1478 . 153 LEU HD2 H 0.90 0.05 . 1479 . 153 LEU CD1 C 22.55 0.5 . 1480 . 153 LEU CD2 C 24.59 0.5 . 1481 . 153 LEU C C 176.51 0.5 . 1482 . 154 GLN H H 8.38 0.05 . 1483 . 154 GLN N N 118.55 0.5 . 1484 . 154 GLN HA H 4.56 0.05 . 1485 . 154 GLN CA C 54.00 0.5 . 1486 . 154 GLN HB2 H 1.73 0.05 . 1487 . 154 GLN HB3 H 1.78 0.05 . 1488 . 154 GLN CB C 31.47 0.5 . 1489 . 154 GLN HG2 H 2.28 0.05 . 1490 . 154 GLN HG3 H 2.28 0.05 . 1491 . 154 GLN CG C 36.36 0.5 . 1492 . 154 GLN C C 176.70 0.5 . 1493 . 155 GLY H H 7.99 0.05 . 1494 . 155 GLY N N 106.93 0.5 . 1495 . 155 GLY HA2 H 3.67 0.05 . 1496 . 155 GLY HA3 H 4.57 0.05 . 1497 . 155 GLY CA C 45.19 0.5 . 1498 . 155 GLY C C 174.57 0.5 . 1499 . 156 GLY H H 8.08 0.05 . 1500 . 156 GLY N N 104.54 0.5 . 1501 . 156 GLY HA2 H 4.50 0.05 . 1502 . 156 GLY HA3 H 3.68 0.05 . 1503 . 156 GLY CA C 45.07 0.5 . 1504 . 156 GLY C C 174.90 0.5 . 1505 . 157 PHE H H 8.68 0.05 . 1506 . 157 PHE N N 119.51 0.5 . 1507 . 157 PHE HA H 4.04 0.05 . 1508 . 157 PHE CA C 60.02 0.5 . 1509 . 157 PHE HB2 H 2.51 0.05 . 1510 . 157 PHE HB3 H 2.88 0.05 . 1511 . 157 PHE CB C 38.68 0.5 . 1512 . 157 PHE C C 174.99 0.5 . 1513 . 158 THR H H 8.68 0.05 . 1514 . 158 THR N N 122.91 0.5 . 1515 . 158 THR HA H 4.38 0.05 . 1516 . 158 THR CA C 62.50 0.5 . 1517 . 158 THR HB H 4.13 0.05 . 1518 . 158 THR CB C 70.26 0.5 . 1519 . 158 THR HG2 H 1.05 0.05 . 1520 . 158 THR CG2 C 20.90 0.5 . 1521 . 158 THR C C 171.75 0.5 . 1522 . 159 GLY H H 6.34 0.05 . 1523 . 159 GLY N N 106.68 0.5 . 1524 . 159 GLY HA2 H 4.17 0.05 . 1525 . 159 GLY HA3 H 3.24 0.05 . 1526 . 159 GLY CA C 43.59 0.5 . 1527 . 159 GLY C C 172.89 0.5 . 1528 . 160 GLY H H 8.28 0.05 . 1529 . 160 GLY N N 107.80 0.5 . 1530 . 160 GLY HA2 H 3.61 0.05 . 1531 . 160 GLY HA3 H 4.35 0.05 . 1532 . 160 GLY CA C 43.76 0.5 . 1533 . 160 GLY C C 172.88 0.5 . 1534 . 161 ASN H H 8.48 0.05 . 1535 . 161 ASN N N 120.68 0.5 . 1536 . 161 ASN HA H 5.22 0.05 . 1537 . 161 ASN CA C 52.90 0.5 . 1538 . 161 ASN HB2 H 2.60 0.05 . 1539 . 161 ASN HB3 H 2.70 0.05 . 1540 . 161 ASN CB C 38.39 0.5 . 1541 . 161 ASN C C 174.39 0.5 . 1542 . 162 VAL H H 8.88 0.05 . 1543 . 162 VAL N N 122.92 0.5 . 1544 . 162 VAL HA H 4.19 0.05 . 1545 . 162 VAL CA C 60.68 0.5 . 1546 . 162 VAL HB H 1.93 0.05 . 1547 . 162 VAL CB C 35.07 0.5 . 1548 . 162 VAL HG1 H 0.88 0.05 . 1549 . 162 VAL HG2 H 0.73 0.05 . 1550 . 162 VAL CG1 C 19.98 0.5 . 1551 . 162 VAL CG2 C 21.75 0.5 . 1552 . 162 VAL C C 173.26 0.5 . 1553 . 163 ASP H H 6.55 0.05 . 1554 . 163 ASP N N 124.93 0.5 . 1555 . 163 ASP HA H 5.79 0.05 . 1556 . 163 ASP CA C 52.54 0.5 . 1557 . 163 ASP HB2 H 2.33 0.05 . 1558 . 163 ASP HB3 H 2.35 0.05 . 1559 . 163 ASP CB C 42.92 0.5 . 1560 . 163 ASP C C 175.51 0.5 . 1561 . 164 VAL H H 8.77 0.05 . 1562 . 164 VAL N N 118.25 0.5 . 1563 . 164 VAL HA H 4.61 0.05 . 1564 . 164 VAL CA C 58.91 0.5 . 1565 . 164 VAL HB H 1.67 0.05 . 1566 . 164 VAL CB C 35.22 0.5 . 1567 . 164 VAL HG1 H 0.78 0.05 . 1568 . 164 VAL HG2 H 0.70 0.05 . 1569 . 164 VAL CG1 C 20.89 0.5 . 1570 . 164 VAL CG2 C 20.39 0.5 . 1571 . 164 VAL C C 172.90 0.5 . 1572 . 165 ASP H H 8.88 0.05 . 1573 . 165 ASP N N 128.35 0.5 . 1574 . 165 ASP HA H 4.66 0.05 . 1575 . 165 ASP CA C 54.30 0.5 . 1576 . 165 ASP HB2 H 1.99 0.05 . 1577 . 165 ASP HB3 H 2.28 0.05 . 1578 . 165 ASP CB C 40.81 0.5 . 1579 . 165 ASP C C 177.37 0.5 . 1580 . 166 GLY H H 9.32 0.05 . 1581 . 166 GLY N N 116.98 0.5 . 1582 . 166 GLY HA2 H 3.48 0.05 . 1583 . 166 GLY HA3 H 4.54 0.05 . 1584 . 166 GLY CA C 45.53 0.5 . 1585 . 167 SER H H 8.86 0.05 . 1586 . 167 SER N N 114.21 0.5 . 1587 . 167 SER HA H 4.44 0.05 . 1588 . 167 SER CA C 60.47 0.5 . 1589 . 167 SER HB2 H 3.85 0.05 . 1590 . 167 SER HB3 H 3.85 0.05 . 1591 . 167 SER CB C 64.10 0.5 . 1592 . 168 VAL H H 8.51 0.05 . 1593 . 168 VAL N N 122.58 0.5 . 1594 . 168 VAL HA H 4.19 0.05 . 1595 . 168 VAL CA C 61.65 0.5 . 1596 . 168 VAL HB H 2.07 0.05 . 1597 . 168 VAL CB C 34.46 0.5 . 1598 . 168 VAL HG1 H 0.94 0.05 . 1599 . 168 VAL HG2 H 1.03 0.05 . 1600 . 168 VAL CG1 C 20.55 0.5 . 1601 . 168 VAL CG2 C 21.69 0.5 . 1602 . 168 VAL C C 173.94 0.5 . 1603 . 169 SER H H 8.19 0.05 . 1604 . 169 SER N N 112.97 0.5 . 1605 . 169 SER HA H 4.47 0.05 . 1606 . 169 SER CA C 56.84 0.5 . 1607 . 169 SER HB2 H 3.64 0.05 . 1608 . 169 SER HB3 H 3.85 0.05 . 1609 . 169 SER CB C 64.49 0.5 . 1610 . 170 SER HA H 4.48 0.05 . 1611 . 170 SER HB2 H 4.00 0.05 . 1612 . 170 SER HB3 H 4.00 0.05 . 1613 . 171 GLN HB2 H 1.13 0.05 . 1614 . 171 GLN HB3 H 1.13 0.05 . 1615 . 171 GLN HG2 H 2.67 0.05 . 1616 . 171 GLN HG3 H 2.67 0.05 . 1617 . 173 LEU H H 7.87 0.05 . 1618 . 173 LEU N N 121.03 0.5 . 1619 . 173 LEU HA H 3.83 0.05 . 1620 . 173 LEU CA C 57.78 0.5 . 1621 . 173 LEU HB2 H 1.71 0.05 . 1622 . 173 LEU HB3 H 1.71 0.05 . 1623 . 173 LEU CB C 40.14 0.5 . 1624 . 173 LEU HG H 1.39 0.05 . 1625 . 173 LEU CG C 26.60 0.5 . 1626 . 173 LEU HD1 H 0.61 0.05 . 1627 . 173 LEU HD2 H 0.61 0.05 . 1628 . 173 LEU CD1 C 22.53 0.5 . 1629 . 173 LEU CD2 C 22.53 0.5 . 1630 . 174 THR H H 8.49 0.05 . 1631 . 174 THR N N 112.63 0.5 . 1632 . 174 THR HA H 3.67 0.05 . 1633 . 174 THR CA C 67.03 0.5 . 1634 . 174 THR HB H 3.68 0.05 . 1635 . 174 THR CB C 68.56 0.5 . 1636 . 174 THR HG2 H 1.20 0.05 . 1637 . 174 THR CG2 C 22.94 0.5 . 1638 . 174 THR C C 175.28 0.5 . 1639 . 175 ALA H H 7.11 0.05 . 1640 . 175 ALA N N 121.32 0.5 . 1641 . 175 ALA HA H 4.78 0.05 . 1642 . 175 ALA CA C 54.80 0.5 . 1643 . 175 ALA HB H 1.47 0.05 . 1644 . 175 ALA CB C 17.87 0.5 . 1645 . 175 ALA C C 179.30 0.5 . 1646 . 176 LEU H H 7.40 0.05 . 1647 . 176 LEU N N 117.84 0.5 . 1648 . 176 LEU HA H 3.57 0.05 . 1649 . 176 LEU CA C 57.47 0.5 . 1650 . 176 LEU HB2 H 1.53 0.05 . 1651 . 176 LEU HB3 H 1.53 0.05 . 1652 . 176 LEU CB C 42.46 0.5 . 1653 . 176 LEU HG H 1.52 0.05 . 1654 . 176 LEU CG C 26.28 0.5 . 1655 . 176 LEU HD1 H 0.62 0.05 . 1656 . 176 LEU HD2 H 0.63 0.05 . 1657 . 176 LEU CD1 C 21.86 0.5 . 1658 . 176 LEU CD2 C 21.86 0.5 . 1659 . 176 LEU C C 178.17 0.5 . 1660 . 177 LEU H H 8.60 0.05 . 1661 . 177 LEU N N 118.23 0.5 . 1662 . 177 LEU HA H 3.67 0.05 . 1663 . 177 LEU CA C 57.76 0.5 . 1664 . 177 LEU HB2 H 0.94 0.05 . 1665 . 177 LEU HB3 H 1.76 0.05 . 1666 . 177 LEU CB C 41.27 0.5 . 1667 . 177 LEU HG H 1.34 0.05 . 1668 . 177 LEU CG C 25.91 0.5 . 1669 . 177 LEU HD1 H 0.23 0.05 . 1670 . 177 LEU HD2 H 0.23 0.05 . 1671 . 177 LEU CD1 C 22.28 0.5 . 1672 . 177 LEU CD2 C 24.67 0.5 . 1673 . 177 LEU C C 175.85 0.5 . 1674 . 178 MET H H 7.02 0.05 . 1675 . 178 MET N N 108.07 0.5 . 1676 . 178 MET HA H 4.15 0.05 . 1677 . 178 MET CA C 57.64 0.5 . 1678 . 178 MET HB2 H 2.12 0.05 . 1679 . 178 MET HB3 H 2.12 0.05 . 1680 . 178 MET CB C 33.81 0.5 . 1681 . 178 MET HG2 H 2.78 0.05 . 1682 . 178 MET HG3 H 2.78 0.05 . 1683 . 178 MET CG C 31.82 0.5 . 1684 . 178 MET HE H 1.80 0.05 . 1685 . 178 MET CE C 15.65 0.5 . 1686 . 178 MET C C 178.92 0.5 . 1687 . 179 THR H H 6.92 0.05 . 1688 . 179 THR N N 114.57 0.5 . 1689 . 179 THR HA H 3.81 0.05 . 1690 . 179 THR CA C 66.28 0.5 . 1691 . 179 THR HB H 3.64 0.05 . 1692 . 179 THR CB C 69.34 0.5 . 1693 . 179 THR HG2 H 0.59 0.05 . 1694 . 179 THR CG2 C 19.63 0.5 . 1695 . 179 THR C C 174.10 0.5 . 1696 . 180 ALA H H 7.82 0.05 . 1697 . 180 ALA N N 119.99 0.5 . 1698 . 180 ALA HA H 3.98 0.05 . 1699 . 180 ALA CA C 56.63 0.5 . 1700 . 180 ALA HB H 1.36 0.05 . 1701 . 180 ALA CB C 15.85 0.5 . 1702 . 180 ALA C C 175.07 0.5 . 1703 . 181 PRO HA H 4.38 0.05 . 1704 . 181 PRO CA C 65.49 0.5 . 1705 . 181 PRO HB2 H 1.95 0.05 . 1706 . 181 PRO HB3 H 1.95 0.05 . 1707 . 181 PRO CB C 29.89 0.5 . 1708 . 181 PRO HG2 H 1.53 0.05 . 1709 . 181 PRO HG3 H 1.53 0.05 . 1710 . 181 PRO CG C 28.40 0.5 . 1711 . 181 PRO HD2 H 3.21 0.05 . 1712 . 181 PRO HD3 H 3.21 0.05 . 1713 . 181 PRO CD C 50.43 0.5 . 1714 . 182 LEU H H 7.06 0.05 . 1715 . 182 LEU N N 110.06 0.5 . 1716 . 182 LEU HA H 4.30 0.05 . 1717 . 182 LEU CA C 54.09 0.5 . 1718 . 182 LEU HB2 H 1.76 0.05 . 1719 . 182 LEU HB3 H 1.76 0.05 . 1720 . 182 LEU CB C 42.24 0.5 . 1721 . 182 LEU HG H 0.75 0.05 . 1722 . 182 LEU CG C 25.78 0.5 . 1723 . 182 LEU HD1 H 0.79 0.05 . 1724 . 182 LEU HD2 H 0.79 0.05 . 1725 . 182 LEU CD1 C 23.74 0.5 . 1726 . 182 LEU CD2 C 23.74 0.5 . 1727 . 182 LEU C C 178.47 0.5 . 1728 . 183 ALA H H 8.01 0.05 . 1729 . 183 ALA N N 125.05 0.5 . 1730 . 183 ALA HA H 4.27 0.05 . 1731 . 183 ALA CA C 50.37 0.5 . 1732 . 183 ALA HB H 1.53 0.05 . 1733 . 183 ALA CB C 17.37 0.5 . 1734 . 183 ALA C C 174.77 0.5 . 1735 . 184 PRO HA H 4.32 0.05 . 1736 . 184 PRO CA C 64.42 0.5 . 1737 . 184 PRO HB2 H 2.05 0.05 . 1738 . 184 PRO HB3 H 2.05 0.05 . 1739 . 184 PRO CB C 31.82 0.5 . 1740 . 184 PRO HG2 H 2.22 0.05 . 1741 . 184 PRO HG3 H 2.22 0.05 . 1742 . 184 PRO CG C 27.26 0.5 . 1743 . 184 PRO HD2 H 3.98 0.05 . 1744 . 184 PRO HD3 H 3.98 0.05 . 1745 . 184 PRO CD C 49.41 0.5 . 1746 . 185 GLU H H 7.77 0.05 . 1747 . 185 GLU N N 116.14 0.5 . 1748 . 185 GLU HA H 4.58 0.05 . 1749 . 185 GLU CA C 53.44 0.5 . 1750 . 185 GLU HB2 H 2.08 0.05 . 1751 . 185 GLU HB3 H 2.13 0.05 . 1752 . 185 GLU CB C 30.48 0.5 . 1753 . 185 GLU HG2 H 2.27 0.05 . 1754 . 185 GLU HG3 H 2.30 0.05 . 1755 . 185 GLU CG C 36.22 0.5 . 1756 . 185 GLU C C 174.70 0.5 . 1757 . 186 ASP H H 8.30 0.05 . 1758 . 186 ASP N N 119.69 0.5 . 1759 . 186 ASP HA H 4.55 0.05 . 1760 . 186 ASP CA C 54.60 0.5 . 1761 . 186 ASP HB2 H 2.45 0.05 . 1762 . 186 ASP HB3 H 2.52 0.05 . 1763 . 186 ASP CB C 40.22 0.5 . 1764 . 186 ASP C C 176.98 0.5 . 1765 . 187 THR H H 8.93 0.05 . 1766 . 187 THR N N 120.99 0.5 . 1767 . 187 THR HA H 5.20 0.05 . 1768 . 187 THR CA C 62.39 0.5 . 1769 . 187 THR HB H 3.69 0.05 . 1770 . 187 THR CB C 69.99 0.5 . 1771 . 187 THR HG2 H 1.12 0.05 . 1772 . 187 THR CG2 C 21.70 0.5 . 1773 . 187 THR C C 173.21 0.5 . 1774 . 188 VAL H H 8.43 0.05 . 1775 . 188 VAL N N 126.79 0.5 . 1776 . 188 VAL HA H 4.77 0.05 . 1777 . 188 VAL CA C 61.42 0.5 . 1778 . 188 VAL HB H 2.07 0.05 . 1779 . 188 VAL CB C 32.39 0.5 . 1780 . 188 VAL HG1 H 0.84 0.05 . 1781 . 188 VAL HG2 H 0.91 0.05 . 1782 . 188 VAL CG1 C 20.63 0.5 . 1783 . 188 VAL CG2 C 20.63 0.5 . 1784 . 188 VAL C C 175.32 0.5 . 1785 . 189 ILE H H 9.33 0.05 . 1786 . 189 ILE N N 127.89 0.5 . 1787 . 189 ILE HA H 5.01 0.05 . 1788 . 189 ILE CA C 59.46 0.5 . 1789 . 189 ILE HB H 1.83 0.05 . 1790 . 189 ILE CB C 39.40 0.5 . 1791 . 189 ILE HG12 H 1.63 0.05 . 1792 . 189 ILE HG13 H 1.63 0.05 . 1793 . 189 ILE HG2 H 0.66 0.05 . 1794 . 189 ILE CG1 C 27.77 0.5 . 1795 . 189 ILE CG2 C 18.04 0.5 . 1796 . 189 ILE HD1 H 0.79 0.05 . 1797 . 189 ILE CD1 C 13.69 0.5 . 1798 . 189 ILE C C 175.22 0.5 . 1799 . 190 ARG H H 9.05 0.05 . 1800 . 190 ARG N N 128.03 0.5 . 1801 . 190 ARG HA H 4.97 0.05 . 1802 . 190 ARG CA C 55.19 0.5 . 1803 . 190 ARG HB2 H 1.95 0.05 . 1804 . 190 ARG HB3 H 1.95 0.05 . 1805 . 190 ARG CB C 31.18 0.5 . 1806 . 190 ARG HG2 H 1.68 0.05 . 1807 . 190 ARG HG3 H 1.52 0.05 . 1808 . 190 ARG CG C 27.87 0.5 . 1809 . 190 ARG HD2 H 3.19 0.05 . 1810 . 190 ARG HD3 H 3.19 0.05 . 1811 . 190 ARG CD C 43.17 0.5 . 1812 . 190 ARG C C 175.03 0.5 . 1813 . 191 ILE H H 8.20 0.05 . 1814 . 191 ILE N N 123.57 0.5 . 1815 . 191 ILE HA H 4.65 0.05 . 1816 . 191 ILE CA C 58.08 0.5 . 1817 . 191 ILE HB H 2.33 0.05 . 1818 . 191 ILE CB C 35.79 0.5 . 1819 . 191 ILE HG12 H 1.59 0.05 . 1820 . 191 ILE HG13 H 1.59 0.05 . 1821 . 191 ILE HG2 H 0.96 0.05 . 1822 . 191 ILE CG1 C 27.40 0.5 . 1823 . 191 ILE CG2 C 18.05 0.5 . 1824 . 191 ILE HD1 H 0.80 0.05 . 1825 . 191 ILE CD1 C 11.05 0.5 . 1826 . 191 ILE C C 177.03 0.5 . 1827 . 192 LYS H H 8.63 0.05 . 1828 . 192 LYS N N 128.24 0.5 . 1829 . 192 LYS HA H 4.41 0.05 . 1830 . 192 LYS CA C 56.19 0.5 . 1831 . 192 LYS HB2 H 1.75 0.05 . 1832 . 192 LYS HB3 H 1.75 0.05 . 1833 . 192 LYS CB C 32.15 0.5 . 1834 . 192 LYS HG2 H 1.32 0.05 . 1835 . 192 LYS HG3 H 1.32 0.05 . 1836 . 192 LYS CG C 24.15 0.5 . 1837 . 192 LYS HD2 H 1.59 0.05 . 1838 . 192 LYS HD3 H 1.59 0.05 . 1839 . 192 LYS CD C 28.58 0.5 . 1840 . 192 LYS HE2 H 2.85 0.05 . 1841 . 192 LYS HE3 H 2.85 0.05 . 1842 . 192 LYS CE C 41.55 0.5 . 1843 . 192 LYS C C 176.47 0.5 . 1844 . 193 GLY H H 8.42 0.05 . 1845 . 193 GLY N N 112.29 0.5 . 1846 . 193 GLY HA2 H 3.99 0.05 . 1847 . 193 GLY HA3 H 3.77 0.05 . 1848 . 193 GLY CA C 44.45 0.5 . 1849 . 193 GLY C C 172.29 0.5 . 1850 . 194 ASP H H 8.27 0.05 . 1851 . 194 ASP N N 121.64 0.5 . 1852 . 194 ASP HA H 4.55 0.05 . 1853 . 194 ASP CA C 53.79 0.5 . 1854 . 194 ASP HB2 H 2.46 0.05 . 1855 . 194 ASP HB3 H 2.52 0.05 . 1856 . 194 ASP CB C 41.26 0.5 . 1857 . 194 ASP C C 176.01 0.5 . 1858 . 195 LEU H H 8.15 0.05 . 1859 . 195 LEU N N 123.16 0.5 . 1860 . 195 LEU HA H 4.40 0.05 . 1861 . 195 LEU CA C 53.96 0.5 . 1862 . 195 LEU HB2 H 1.56 0.05 . 1863 . 195 LEU HB3 H 1.77 0.05 . 1864 . 195 LEU CB C 43.20 0.5 . 1865 . 195 LEU HG H 1.74 0.05 . 1866 . 195 LEU CG C 26.44 0.5 . 1867 . 195 LEU HD1 H 1.11 0.05 . 1868 . 195 LEU HD2 H 1.18 0.05 . 1869 . 195 LEU CD1 C 23.56 0.5 . 1870 . 195 LEU CD2 C 23.56 0.5 . 1871 . 195 LEU C C 176.48 0.5 . 1872 . 196 VAL H H 7.92 0.05 . 1873 . 196 VAL N N 122.15 0.5 . 1874 . 196 VAL HA H 4.22 0.05 . 1875 . 196 VAL CA C 60.90 0.5 . 1876 . 196 VAL HB H 1.93 0.05 . 1877 . 196 VAL CB C 32.15 0.5 . 1878 . 196 VAL HG1 H 0.92 0.05 . 1879 . 196 VAL HG2 H 1.02 0.05 . 1880 . 196 VAL CG1 C 20.55 0.5 . 1881 . 196 VAL CG2 C 21.69 0.5 . 1882 . 196 VAL C C 174.71 0.5 . 1883 . 197 SER H H 8.19 0.05 . 1884 . 197 SER N N 112.97 0.5 . 1885 . 197 SER HA H 4.82 0.05 . 1886 . 197 SER CA C 56.84 0.5 . 1887 . 197 SER HB2 H 3.80 0.05 . 1888 . 197 SER HB3 H 3.80 0.05 . 1889 . 197 SER CB C 64.49 0.5 . 1890 . 198 LYS H H 8.02 0.05 . 1891 . 198 LYS N N 121.28 0.5 . 1892 . 198 LYS CA C 52.76 0.5 . 1893 . 198 LYS HG2 H 1.51 0.05 . 1894 . 198 LYS HG3 H 1.51 0.05 . 1895 . 198 LYS HD2 H 1.74 0.05 . 1896 . 198 LYS HD3 H 1.74 0.05 . 1897 . 198 LYS HE2 H 3.55 0.05 . 1898 . 198 LYS HE3 H 3.55 0.05 . 1899 . 199 PRO HA H 4.36 0.05 . 1900 . 199 PRO CA C 65.78 0.5 . 1901 . 199 PRO HB2 H 1.57 0.05 . 1902 . 199 PRO HB3 H 1.94 0.05 . 1903 . 199 PRO CB C 30.97 0.5 . 1904 . 199 PRO HG2 H 1.70 0.05 . 1905 . 199 PRO HG3 H 1.74 0.05 . 1906 . 199 PRO CG C 28.09 0.5 . 1907 . 199 PRO HD2 H 3.19 0.05 . 1908 . 199 PRO HD3 H 3.19 0.05 . 1909 . 199 PRO CD C 45.35 0.5 . 1910 . 200 TYR H H 7.87 0.05 . 1911 . 200 TYR N N 114.27 0.5 . 1912 . 200 TYR HA H 4.60 0.05 . 1913 . 200 TYR CA C 61.48 0.5 . 1914 . 200 TYR HB2 H 2.91 0.05 . 1915 . 200 TYR HB3 H 3.02 0.05 . 1916 . 200 TYR CB C 37.06 0.5 . 1917 . 200 TYR C C 179.06 0.5 . 1918 . 201 ILE H H 7.97 0.05 . 1919 . 201 ILE N N 123.46 0.5 . 1920 . 201 ILE HA H 3.80 0.05 . 1921 . 201 ILE CA C 62.61 0.5 . 1922 . 201 ILE HB H 2.65 0.05 . 1923 . 201 ILE CB C 34.54 0.5 . 1924 . 201 ILE HG12 H 1.40 0.05 . 1925 . 201 ILE HG13 H 1.40 0.05 . 1926 . 201 ILE HG2 H 0.94 0.05 . 1927 . 201 ILE CG1 C 26.10 0.5 . 1928 . 201 ILE CG2 C 18.01 0.5 . 1929 . 201 ILE HD1 H 0.90 0.05 . 1930 . 201 ILE CD1 C 12.11 0.5 . 1931 . 201 ILE C C 174.18 0.5 . 1932 . 202 ASP H H 7.92 0.05 . 1933 . 202 ASP N N 120.93 0.5 . 1934 . 202 ASP HA H 4.62 0.05 . 1935 . 202 ASP CA C 57.83 0.5 . 1936 . 202 ASP HB2 H 2.67 0.05 . 1937 . 202 ASP HB3 H 2.87 0.05 . 1938 . 202 ASP CB C 39.13 0.5 . 1939 . 202 ASP C C 178.74 0.5 . 1940 . 203 ILE H H 7.51 0.05 . 1941 . 203 ILE N N 118.18 0.5 . 1942 . 203 ILE HA H 3.79 0.05 . 1943 . 203 ILE CA C 64.81 0.5 . 1944 . 203 ILE HB H 1.88 0.05 . 1945 . 203 ILE CB C 37.56 0.5 . 1946 . 203 ILE HG12 H 1.13 0.05 . 1947 . 203 ILE HG13 H 1.13 0.05 . 1948 . 203 ILE HG2 H 0.86 0.05 . 1949 . 203 ILE CG1 C 28.09 0.5 . 1950 . 203 ILE CG2 C 16.77 0.5 . 1951 . 203 ILE HD1 H 0.67 0.05 . 1952 . 203 ILE CD1 C 12.86 0.5 . 1953 . 203 ILE C C 178.81 0.5 . 1954 . 204 THR H H 7.47 0.05 . 1955 . 204 THR N N 118.75 0.5 . 1956 . 204 THR HA H 4.32 0.05 . 1957 . 204 THR CA C 68.24 0.5 . 1958 . 204 THR HB H 4.17 0.05 . 1959 . 204 THR CB C 69.61 0.5 . 1960 . 204 THR HG2 H 1.17 0.05 . 1961 . 204 THR CG2 C 22.30 0.5 . 1962 . 204 THR C C 175.29 0.5 . 1963 . 205 LEU H H 8.73 0.05 . 1964 . 205 LEU N N 120.70 0.5 . 1965 . 205 LEU HA H 4.21 0.05 . 1966 . 205 LEU CA C 57.92 0.5 . 1967 . 205 LEU HB2 H 1.56 0.05 . 1968 . 205 LEU HB3 H 1.99 0.05 . 1969 . 205 LEU CB C 40.41 0.5 . 1970 . 205 LEU HG H 1.85 0.05 . 1971 . 205 LEU CG C 27.03 0.5 . 1972 . 205 LEU HD1 H 0.98 0.05 . 1973 . 205 LEU HD2 H 0.88 0.05 . 1974 . 205 LEU CD1 C 22.18 0.5 . 1975 . 205 LEU CD2 C 25.29 0.5 . 1976 . 205 LEU C C 180.54 0.5 . 1977 . 206 ASN H H 8.59 0.05 . 1978 . 206 ASN N N 119.28 0.5 . 1979 . 206 ASN HA H 4.55 0.05 . 1980 . 206 ASN CA C 56.00 0.5 . 1981 . 206 ASN HB2 H 2.94 0.05 . 1982 . 206 ASN HB3 H 3.13 0.05 . 1983 . 206 ASN CB C 37.79 0.5 . 1984 . 206 ASN C C 177.98 0.5 . 1985 . 207 LEU H H 8.07 0.05 . 1986 . 207 LEU N N 124.75 0.5 . 1987 . 207 LEU HA H 4.20 0.05 . 1988 . 207 LEU CA C 57.93 0.5 . 1989 . 207 LEU HB2 H 1.73 0.05 . 1990 . 207 LEU HB3 H 1.85 0.05 . 1991 . 207 LEU CB C 40.71 0.5 . 1992 . 207 LEU HG H 1.55 0.05 . 1993 . 207 LEU CG C 25.45 0.5 . 1994 . 207 LEU HD1 H 0.65 0.05 . 1995 . 207 LEU HD2 H 0.65 0.05 . 1996 . 207 LEU CD1 C 23.98 0.5 . 1997 . 207 LEU CD2 C 24.04 0.5 . 1998 . 207 LEU C C 178.97 0.5 . 1999 . 208 MET H H 8.52 0.05 . 2000 . 208 MET N N 117.92 0.5 . 2001 . 208 MET HA H 3.76 0.05 . 2002 . 208 MET CA C 60.53 0.5 . 2003 . 208 MET HB2 H 2.10 0.05 . 2004 . 208 MET HB3 H 2.10 0.05 . 2005 . 208 MET CB C 33.28 0.5 . 2006 . 208 MET HG2 H 2.47 0.05 . 2007 . 208 MET HG3 H 2.71 0.05 . 2008 . 208 MET CG C 30.53 0.5 . 2009 . 208 MET HE H 1.98 0.05 . 2010 . 208 MET CE C 16.09 0.5 . 2011 . 208 MET C C 178.31 0.5 . 2012 . 209 LYS H H 8.08 0.05 . 2013 . 209 LYS N N 119.79 0.5 . 2014 . 209 LYS HA H 4.20 0.05 . 2015 . 209 LYS CA C 59.39 0.5 . 2016 . 209 LYS HB2 H 2.06 0.05 . 2017 . 209 LYS HB3 H 2.15 0.05 . 2018 . 209 LYS CB C 31.73 0.5 . 2019 . 209 LYS HG2 H 1.53 0.05 . 2020 . 209 LYS HG3 H 1.53 0.05 . 2021 . 209 LYS CG C 24.52 0.5 . 2022 . 209 LYS HD2 H 1.77 0.05 . 2023 . 209 LYS HD3 H 1.77 0.05 . 2024 . 209 LYS CD C 29.02 0.5 . 2025 . 209 LYS HE2 H 3.03 0.05 . 2026 . 209 LYS HE3 H 3.03 0.05 . 2027 . 209 LYS CE C 41.86 0.5 . 2028 . 209 LYS C C 181.79 0.5 . 2029 . 210 THR H H 8.40 0.05 . 2030 . 210 THR N N 122.29 0.5 . 2031 . 210 THR HA H 3.97 0.05 . 2032 . 210 THR CA C 66.97 0.5 . 2033 . 210 THR HB H 4.73 0.05 . 2034 . 210 THR CB C 67.91 0.5 . 2035 . 210 THR HG2 H 1.12 0.05 . 2036 . 210 THR CG2 C 21.37 0.5 . 2037 . 210 THR C C 175.68 0.5 . 2038 . 211 PHE H H 7.75 0.05 . 2039 . 211 PHE N N 119.10 0.5 . 2040 . 211 PHE HA H 4.44 0.05 . 2041 . 211 PHE CA C 58.74 0.5 . 2042 . 211 PHE HB2 H 2.88 0.05 . 2043 . 211 PHE HB3 H 3.63 0.05 . 2044 . 211 PHE CB C 38.60 0.5 . 2045 . 211 PHE C C 174.80 0.5 . 2046 . 212 GLY H H 7.97 0.05 . 2047 . 212 GLY N N 106.21 0.5 . 2048 . 212 GLY HA2 H 4.34 0.05 . 2049 . 212 GLY HA3 H 3.88 0.05 . 2050 . 212 GLY CA C 46.54 0.5 . 2051 . 212 GLY C C 174.72 0.5 . 2052 . 213 VAL H H 8.52 0.05 . 2053 . 213 VAL N N 122.95 0.5 . 2054 . 213 VAL HA H 4.35 0.05 . 2055 . 213 VAL CA C 61.83 0.5 . 2056 . 213 VAL HB H 1.65 0.05 . 2057 . 213 VAL CB C 34.63 0.5 . 2058 . 213 VAL HG1 H 0.32 0.05 . 2059 . 213 VAL HG2 H 0.57 0.05 . 2060 . 213 VAL CG1 C 21.83 0.5 . 2061 . 213 VAL CG2 C 20.68 0.5 . 2062 . 213 VAL C C 173.94 0.5 . 2063 . 214 GLU H H 8.74 0.05 . 2064 . 214 GLU N N 126.18 0.5 . 2065 . 214 GLU HA H 4.57 0.05 . 2066 . 214 GLU CA C 54.53 0.5 . 2067 . 214 GLU HB2 H 2.06 0.05 . 2068 . 214 GLU HB3 H 2.06 0.05 . 2069 . 214 GLU CB C 32.27 0.5 . 2070 . 214 GLU HG2 H 2.13 0.05 . 2071 . 214 GLU HG3 H 2.28 0.05 . 2072 . 214 GLU CG C 36.47 0.5 . 2073 . 214 GLU C C 175.22 0.5 . 2074 . 215 ILE H H 8.30 0.05 . 2075 . 215 ILE N N 119.60 0.5 . 2076 . 215 ILE HA H 4.58 0.05 . 2077 . 215 ILE CA C 58.45 0.5 . 2078 . 215 ILE HB H 2.00 0.05 . 2079 . 215 ILE CB C 40.11 0.5 . 2080 . 215 ILE HG12 H 1.23 0.05 . 2081 . 215 ILE HG13 H 1.23 0.05 . 2082 . 215 ILE HG2 H 0.87 0.05 . 2083 . 215 ILE CG1 C 26.10 0.5 . 2084 . 215 ILE CG2 C 18.70 0.5 . 2085 . 215 ILE HD1 H 0.79 0.05 . 2086 . 215 ILE CD1 C 14.46 0.5 . 2087 . 215 ILE C C 174.19 0.5 . 2088 . 216 GLU H H 7.94 0.05 . 2089 . 216 GLU N N 123.75 0.5 . 2090 . 216 GLU HA H 4.52 0.05 . 2091 . 216 GLU CA C 55.32 0.5 . 2092 . 216 GLU HB2 H 1.90 0.05 . 2093 . 216 GLU HB3 H 1.90 0.05 . 2094 . 216 GLU CB C 30.34 0.5 . 2095 . 216 GLU HG2 H 2.24 0.05 . 2096 . 216 GLU HG3 H 2.24 0.05 . 2097 . 216 GLU CG C 35.72 0.5 . 2098 . 216 GLU C C 174.18 0.5 . 2099 . 217 ASN H H 8.79 0.05 . 2100 . 217 ASN N N 125.69 0.5 . 2101 . 217 ASN HA H 4.29 0.05 . 2102 . 217 ASN CA C 50.90 0.5 . 2103 . 217 ASN HB2 H 2.28 0.05 . 2104 . 217 ASN HB3 H 2.85 0.05 . 2105 . 217 ASN CB C 38.30 0.5 . 2106 . 217 ASN C C 174.20 0.5 . 2107 . 218 GLN H H 8.33 0.05 . 2108 . 218 GLN N N 124.99 0.5 . 2109 . 218 GLN HA H 4.27 0.05 . 2110 . 218 GLN CA C 53.69 0.5 . 2111 . 218 GLN HB2 H 2.02 0.05 . 2112 . 218 GLN HB3 H 2.16 0.05 . 2113 . 218 GLN CB C 25.71 0.5 . 2114 . 218 GLN HG2 H 1.02 0.05 . 2115 . 218 GLN HG3 H 2.16 0.05 . 2116 . 218 GLN CG C 32.18 0.5 . 2117 . 218 GLN C C 175.22 0.5 . 2118 . 219 HIS H H 7.93 0.05 . 2119 . 219 HIS N N 120.82 0.5 . 2120 . 219 HIS HA H 4.09 0.05 . 2121 . 219 HIS CA C 57.64 0.5 . 2122 . 219 HIS HB2 H 3.08 0.05 . 2123 . 219 HIS HB3 H 3.29 0.05 . 2124 . 219 HIS CB C 28.36 0.5 . 2125 . 219 HIS C C 173.85 0.5 . 2126 . 220 TYR H H 8.47 0.05 . 2127 . 220 TYR N N 111.27 0.5 . 2128 . 220 TYR HA H 3.52 0.05 . 2129 . 220 TYR CA C 60.12 0.5 . 2130 . 220 TYR HB2 H 3.35 0.05 . 2131 . 220 TYR HB3 H 3.35 0.05 . 2132 . 220 TYR CB C 34.53 0.5 . 2133 . 220 TYR C C 173.66 0.5 . 2134 . 221 GLN H H 8.12 0.05 . 2135 . 221 GLN N N 115.90 0.5 . 2136 . 221 GLN HA H 4.56 0.05 . 2137 . 221 GLN CA C 55.88 0.5 . 2138 . 221 GLN HB2 H 2.02 0.05 . 2139 . 221 GLN HB3 H 2.18 0.05 . 2140 . 221 GLN CB C 30.83 0.5 . 2141 . 221 GLN HG2 H 2.49 0.05 . 2142 . 221 GLN HG3 H 2.58 0.05 . 2143 . 221 GLN CG C 34.14 0.5 . 2144 . 221 GLN C C 176.14 0.5 . 2145 . 222 GLN H H 7.11 0.05 . 2146 . 222 GLN N N 116.96 0.5 . 2147 . 222 GLN HA H 5.34 0.05 . 2148 . 222 GLN CA C 54.52 0.5 . 2149 . 222 GLN HB2 H 2.02 0.05 . 2150 . 222 GLN HB3 H 2.02 0.05 . 2151 . 222 GLN CB C 31.82 0.5 . 2152 . 222 GLN HG2 H 2.06 0.05 . 2153 . 222 GLN HG3 H 2.06 0.05 . 2154 . 222 GLN CG C 34.85 0.5 . 2155 . 222 GLN C C 172.55 0.5 . 2156 . 223 PHE H H 9.37 0.05 . 2157 . 223 PHE N N 122.24 0.5 . 2158 . 223 PHE HA H 3.86 0.05 . 2159 . 223 PHE CA C 55.43 0.5 . 2160 . 223 PHE HB2 H 2.50 0.05 . 2161 . 223 PHE HB3 H 2.74 0.05 . 2162 . 223 PHE CB C 40.98 0.5 . 2163 . 223 PHE C C 174.29 0.5 . 2164 . 224 VAL H H 8.98 0.05 . 2165 . 224 VAL N N 123.81 0.5 . 2166 . 224 VAL HA H 4.42 0.05 . 2167 . 224 VAL CA C 62.51 0.5 . 2168 . 224 VAL HB H 2.07 0.05 . 2169 . 224 VAL CB C 32.65 0.5 . 2170 . 224 VAL HG1 H 0.84 0.05 . 2171 . 224 VAL HG2 H 0.91 0.05 . 2172 . 224 VAL CG1 C 20.37 0.5 . 2173 . 224 VAL CG2 C 20.37 0.5 . 2174 . 224 VAL C C 175.01 0.5 . 2175 . 225 VAL H H 9.29 0.05 . 2176 . 225 VAL N N 130.36 0.5 . 2177 . 225 VAL HA H 4.13 0.05 . 2178 . 225 VAL CA C 60.70 0.5 . 2179 . 225 VAL HB H 2.25 0.05 . 2180 . 225 VAL CB C 33.34 0.5 . 2181 . 225 VAL HG1 H 0.70 0.05 . 2182 . 225 VAL HG2 H 0.71 0.05 . 2183 . 225 VAL CG1 C 20.79 0.5 . 2184 . 225 VAL CG2 C 19.46 0.5 . 2185 . 225 VAL C C 174.19 0.5 . 2186 . 226 LYS H H 8.06 0.05 . 2187 . 226 LYS N N 126.60 0.5 . 2188 . 226 LYS HA H 4.45 0.05 . 2189 . 226 LYS CA C 54.46 0.5 . 2190 . 226 LYS HB2 H 1.84 0.05 . 2191 . 226 LYS HB3 H 1.84 0.05 . 2192 . 226 LYS CB C 30.86 0.5 . 2193 . 226 LYS HG2 H 1.54 0.05 . 2194 . 226 LYS HG3 H 1.54 0.05 . 2195 . 226 LYS CG C 23.54 0.5 . 2196 . 226 LYS HD2 H 1.64 0.05 . 2197 . 226 LYS HD3 H 1.64 0.05 . 2198 . 226 LYS CD C 27.56 0.5 . 2199 . 226 LYS HE2 H 2.97 0.05 . 2200 . 226 LYS HE3 H 2.97 0.05 . 2201 . 226 LYS CE C 41.61 0.5 . 2202 . 226 LYS C C 177.12 0.5 . 2203 . 227 GLY H H 9.06 0.05 . 2204 . 227 GLY N N 110.83 0.5 . 2205 . 227 GLY HA2 H 4.37 0.05 . 2206 . 227 GLY HA3 H 3.25 0.05 . 2207 . 227 GLY CA C 43.88 0.5 . 2208 . 227 GLY C C 175.82 0.5 . 2209 . 228 GLY H H 8.74 0.05 . 2210 . 228 GLY N N 105.15 0.5 . 2211 . 228 GLY HA2 H 3.85 0.05 . 2212 . 228 GLY HA3 H 3.73 0.05 . 2213 . 228 GLY CA C 46.02 0.5 . 2214 . 228 GLY C C 175.96 0.5 . 2215 . 229 GLN H H 8.61 0.05 . 2216 . 229 GLN N N 117.80 0.5 . 2217 . 229 GLN HA H 4.43 0.05 . 2218 . 229 GLN CA C 55.60 0.5 . 2219 . 229 GLN HB2 H 1.92 0.05 . 2220 . 229 GLN HB3 H 1.92 0.05 . 2221 . 229 GLN CB C 30.73 0.5 . 2222 . 229 GLN HG2 H 2.49 0.05 . 2223 . 229 GLN HG3 H 2.49 0.05 . 2224 . 229 GLN CG C 34.98 0.5 . 2225 . 229 GLN C C 173.80 0.5 . 2226 . 230 SER H H 7.78 0.05 . 2227 . 230 SER N N 110.94 0.5 . 2228 . 230 SER HA H 4.46 0.05 . 2229 . 230 SER CA C 56.92 0.5 . 2230 . 230 SER HB2 H 2.64 0.05 . 2231 . 230 SER HB3 H 3.85 0.05 . 2232 . 230 SER CB C 65.76 0.5 . 2233 . 230 SER C C 173.09 0.5 . 2234 . 231 TYR H H 8.81 0.05 . 2235 . 231 TYR N N 121.06 0.5 . 2236 . 231 TYR HA H 6.64 0.05 . 2237 . 231 TYR CA C 58.40 0.5 . 2238 . 231 TYR HB2 H 2.44 0.05 . 2239 . 231 TYR HB3 H 3.21 0.05 . 2240 . 231 TYR CB C 38.81 0.5 . 2241 . 231 TYR C C 176.15 0.5 . 2242 . 232 GLN H H 9.29 0.05 . 2243 . 232 GLN N N 121.28 0.5 . 2244 . 232 GLN HA H 4.89 0.05 . 2245 . 232 GLN CA C 53.46 0.5 . 2246 . 232 GLN HB2 H 1.78 0.05 . 2247 . 232 GLN HB3 H 1.78 0.05 . 2248 . 232 GLN CB C 30.88 0.5 . 2249 . 232 GLN HG2 H 2.39 0.05 . 2250 . 232 GLN HG3 H 2.39 0.05 . 2251 . 232 GLN CG C 32.31 0.5 . 2252 . 232 GLN C C 175.15 0.5 . 2253 . 233 SER H H 8.49 0.05 . 2254 . 233 SER N N 118.23 0.5 . 2255 . 233 SER HA H 4.19 0.05 . 2256 . 233 SER CA C 55.51 0.5 . 2257 . 233 SER HB2 H 3.70 0.05 . 2258 . 233 SER HB3 H 3.74 0.05 . 2259 . 233 SER CB C 63.27 0.5 . 2260 . 233 SER C C 175.20 0.5 . 2261 . 234 PRO HA H 4.73 0.05 . 2262 . 234 PRO CA C 70.67 0.5 . 2263 . 234 PRO HB2 H 1.90 0.05 . 2264 . 234 PRO HB3 H 2.24 0.05 . 2265 . 234 PRO CB C 31.33 0.5 . 2266 . 234 PRO HG2 H 2.06 0.05 . 2267 . 234 PRO HG3 H 2.06 0.05 . 2268 . 234 PRO CG C 25.31 0.5 . 2269 . 234 PRO HD2 H 3.69 0.05 . 2270 . 234 PRO HD3 H 3.69 0.05 . 2271 . 234 PRO CD C 50.53 0.5 . 2272 . 235 GLY H H 8.79 0.05 . 2273 . 235 GLY N N 113.63 0.5 . 2274 . 235 GLY HA2 H 4.44 0.05 . 2275 . 235 GLY HA3 H 3.47 0.05 . 2276 . 235 GLY CA C 46.23 0.5 . 2277 . 235 GLY C C 173.67 0.5 . 2278 . 236 THR H H 7.97 0.05 . 2279 . 236 THR N N 120.08 0.5 . 2280 . 236 THR HA H 5.21 0.05 . 2281 . 236 THR CA C 60.69 0.5 . 2282 . 236 THR HB H 3.96 0.05 . 2283 . 236 THR CB C 70.02 0.5 . 2284 . 236 THR HG2 H 1.06 0.05 . 2285 . 236 THR CG2 C 19.99 0.5 . 2286 . 236 THR C C 172.93 0.5 . 2287 . 237 TYR H H 9.14 0.05 . 2288 . 237 TYR N N 126.87 0.5 . 2289 . 237 TYR HA H 4.27 0.05 . 2290 . 237 TYR CA C 57.98 0.5 . 2291 . 237 TYR HB2 H 2.31 0.05 . 2292 . 237 TYR HB3 H 2.67 0.05 . 2293 . 237 TYR CB C 40.97 0.5 . 2294 . 237 TYR C C 174.50 0.5 . 2295 . 238 LEU H H 7.50 0.05 . 2296 . 238 LEU N N 131.44 0.5 . 2297 . 238 LEU HA H 4.35 0.05 . 2298 . 238 LEU CA C 53.73 0.5 . 2299 . 238 LEU HB2 H 1.40 0.05 . 2300 . 238 LEU HB3 H 1.40 0.05 . 2301 . 238 LEU CB C 41.22 0.5 . 2302 . 238 LEU HG H 1.58 0.05 . 2303 . 238 LEU CG C 27.03 0.5 . 2304 . 238 LEU HD1 H 0.72 0.05 . 2305 . 238 LEU HD2 H 0.90 0.05 . 2306 . 238 LEU CD1 C 24.79 0.5 . 2307 . 238 LEU CD2 C 24.42 0.5 . 2308 . 238 LEU C C 174.62 0.5 . 2309 . 239 VAL H H 8.36 0.05 . 2310 . 239 VAL N N 127.63 0.5 . 2311 . 239 VAL HA H 3.65 0.05 . 2312 . 239 VAL CA C 63.73 0.5 . 2313 . 239 VAL HB H 2.21 0.05 . 2314 . 239 VAL CB C 30.79 0.5 . 2315 . 239 VAL HG1 H 1.00 0.05 . 2316 . 239 VAL HG2 H 1.00 0.05 . 2317 . 239 VAL CG1 C 21.75 0.5 . 2318 . 239 VAL CG2 C 21.75 0.5 . 2319 . 239 VAL C C 174.58 0.5 . 2320 . 240 GLU H H 7.50 0.05 . 2321 . 240 GLU N N 130.86 0.5 . 2322 . 240 GLU HA H 4.31 0.05 . 2323 . 240 GLU CA C 57.66 0.5 . 2324 . 240 GLU HB2 H 1.78 0.05 . 2325 . 240 GLU HB3 H 2.04 0.05 . 2326 . 240 GLU CB C 30.93 0.5 . 2327 . 240 GLU HG2 H 2.39 0.05 . 2328 . 240 GLU HG3 H 2.39 0.05 . 2329 . 240 GLU CG C 33.00 0.5 . 2330 . 240 GLU C C 180.94 0.5 . stop_ save_