data_25292 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; HIV-1 reverse transcriptase N terminal 216 residues (Fingers and Palm subdomain) ; _BMRB_accession_number 25292 _BMRB_flat_file_name bmr25292.str _Entry_type original _Submission_date 2014-10-21 _Accession_date 2014-10-21 _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 Zheng Xunhai . . 2 Mueller Geoffry A. . 3 London Robert E. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 131 "13C chemical shifts" 284 "15N chemical shifts" 131 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2015-08-25 update BMRB 'update entry citation' 2014-11-21 original author 'original release' stop_ _Original_release_date 2015-08-25 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Selective unfolding of one Ribonuclease H domain of HIV reverse transcriptase is linked to homodimer formation ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 24574528 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Zheng Xunhai . . 2 Pedersen Lars C. . 3 Gabel Scott A. . 4 Mueller Geoffrey A. . 5 Cuneo Matthew J. . 6 DeRose Eugene F. . 7 Krahn Juno M. . 8 London Robert E. . stop_ _Journal_abbreviation 'Nucleic Acids Res.' _Journal_volume 42 _Journal_issue 8 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 5361 _Page_last 5377 _Year 2014 _Details . loop_ _Keyword HIV-1 RT216 stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name RT216 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label RT216 $RT216 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_RT216 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common RT216 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 217 _Mol_residue_sequence ; MPISPIETVPVKLKPGMDGP KVKQWPLTEEKIKALVEICT EMEKEGKISKIGPENPYNTP VFAIKKKDSTKWRKLVDFRE LNKRTQDFWEVQLGIPHPAG LKKKKSVTVLDVGDAYFSVP LDEDFRKYTAFTIPSINNET PGIRYQYNVLPQGWKGSPAI FQSSMTKILEPFRKQNPDIV IYQYMDDLYVGSDLEIGQHR TKIEELRQHLLRWGLTT ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -1 MET 2 1 PRO 3 2 ILE 4 3 SER 5 4 PRO 6 5 ILE 7 6 GLU 8 7 THR 9 8 VAL 10 9 PRO 11 10 VAL 12 11 LYS 13 12 LEU 14 13 LYS 15 14 PRO 16 15 GLY 17 16 MET 18 17 ASP 19 18 GLY 20 19 PRO 21 20 LYS 22 21 VAL 23 22 LYS 24 23 GLN 25 24 TRP 26 25 PRO 27 26 LEU 28 27 THR 29 28 GLU 30 29 GLU 31 30 LYS 32 31 ILE 33 32 LYS 34 33 ALA 35 34 LEU 36 35 VAL 37 36 GLU 38 37 ILE 39 38 CYS 40 39 THR 41 40 GLU 42 41 MET 43 42 GLU 44 43 LYS 45 44 GLU 46 45 GLY 47 46 LYS 48 47 ILE 49 48 SER 50 49 LYS 51 50 ILE 52 51 GLY 53 52 PRO 54 53 GLU 55 54 ASN 56 55 PRO 57 56 TYR 58 57 ASN 59 58 THR 60 59 PRO 61 60 VAL 62 61 PHE 63 62 ALA 64 63 ILE 65 64 LYS 66 65 LYS 67 66 LYS 68 67 ASP 69 68 SER 70 69 THR 71 70 LYS 72 71 TRP 73 72 ARG 74 73 LYS 75 74 LEU 76 75 VAL 77 76 ASP 78 77 PHE 79 78 ARG 80 79 GLU 81 80 LEU 82 81 ASN 83 82 LYS 84 83 ARG 85 84 THR 86 85 GLN 87 86 ASP 88 87 PHE 89 88 TRP 90 89 GLU 91 90 VAL 92 91 GLN 93 92 LEU 94 93 GLY 95 94 ILE 96 95 PRO 97 96 HIS 98 97 PRO 99 98 ALA 100 99 GLY 101 100 LEU 102 101 LYS 103 102 LYS 104 103 LYS 105 104 LYS 106 105 SER 107 106 VAL 108 107 THR 109 108 VAL 110 109 LEU 111 110 ASP 112 111 VAL 113 112 GLY 114 113 ASP 115 114 ALA 116 115 TYR 117 116 PHE 118 117 SER 119 118 VAL 120 119 PRO 121 120 LEU 122 121 ASP 123 122 GLU 124 123 ASP 125 124 PHE 126 125 ARG 127 126 LYS 128 127 TYR 129 128 THR 130 129 ALA 131 130 PHE 132 131 THR 133 132 ILE 134 133 PRO 135 134 SER 136 135 ILE 137 136 ASN 138 137 ASN 139 138 GLU 140 139 THR 141 140 PRO 142 141 GLY 143 142 ILE 144 143 ARG 145 144 TYR 146 145 GLN 147 146 TYR 148 147 ASN 149 148 VAL 150 149 LEU 151 150 PRO 152 151 GLN 153 152 GLY 154 153 TRP 155 154 LYS 156 155 GLY 157 156 SER 158 157 PRO 159 158 ALA 160 159 ILE 161 160 PHE 162 161 GLN 163 162 SER 164 163 SER 165 164 MET 166 165 THR 167 166 LYS 168 167 ILE 169 168 LEU 170 169 GLU 171 170 PRO 172 171 PHE 173 172 ARG 174 173 LYS 175 174 GLN 176 175 ASN 177 176 PRO 178 177 ASP 179 178 ILE 180 179 VAL 181 180 ILE 182 181 TYR 183 182 GLN 184 183 TYR 185 184 MET 186 185 ASP 187 186 ASP 188 187 LEU 189 188 TYR 190 189 VAL 191 190 GLY 192 191 SER 193 192 ASP 194 193 LEU 195 194 GLU 196 195 ILE 197 196 GLY 198 197 GLN 199 198 HIS 200 199 ARG 201 200 THR 202 201 LYS 203 202 ILE 204 203 GLU 205 204 GLU 206 205 LEU 207 206 ARG 208 207 GLN 209 208 HIS 210 209 LEU 211 210 LEU 212 211 ARG 213 212 TRP 214 213 GLY 215 214 LEU 216 215 THR 217 216 THR stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-25 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 1BQM "Hiv-1 RtHBY 097" 99.54 556 99.54 100.00 9.69e-151 PDB 1BQN "Tyr 188 Leu Hiv-1 RtHBY 097" 99.54 558 99.07 99.54 9.57e-150 PDB 1C0T "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Bm+21.1326" 99.54 560 100.00 100.00 3.96e-151 PDB 1C0U "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Bm+50.0934" 99.54 560 100.00 100.00 3.96e-151 PDB 1C1B "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gca- 186" 99.54 560 100.00 100.00 3.96e-151 PDB 1C1C "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Tnk- 6123" 99.54 560 100.00 100.00 3.96e-151 PDB 1DLO "Human Immunodeficiency Virus Type 1" 99.54 556 99.54 100.00 9.69e-151 PDB 1DTQ "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Pett- 1 (pett131a94)" 99.54 560 100.00 100.00 3.96e-151 PDB 1DTT "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Pett- 2 (pett130a94)" 99.54 560 100.00 100.00 3.96e-151 PDB 1EET "Hiv-1 Reverse Transcriptase In Complex With The Inhibitor Msc204" 99.54 557 99.54 100.00 1.00e-150 PDB 1EP4 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With S- 1153" 99.54 560 100.00 100.00 3.96e-151 PDB 1FK9 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Dmp- 266(Efavirenz)" 99.54 543 100.00 100.00 1.76e-151 PDB 1FKP "Crystal Structure Of Nnrti Resistant K103n Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 99.54 543 99.54 99.54 8.43e-151 PDB 1HMV "The Structure Of Unliganded Reverse Transcriptase From The Human Immunodeficiency Virus Type 1" 99.54 560 99.54 100.00 8.46e-151 PDB 1HNI "Structure Of Hiv-1 Reverse Transcriptase In A Complex With The Nonnucleoside Inhibitor Alpha-Apa R 95845 At 2.8 Angstroms Resol" 99.54 427 100.00 100.00 3.89e-152 PDB 1HNV "Structure Of Hiv-1 Rt(Slash)tibo R 86183 Complex Reveals Similarity In The Binding Of Diverse Nonnucleoside Inhibitors" 99.54 558 99.54 100.00 8.58e-151 PDB 1HPZ "Human Immunodeficiency Virus Type 1" 99.54 560 99.07 99.54 3.83e-150 PDB 1HQE "Human Immunodeficiency Virus Type 1" 99.54 560 99.07 99.54 3.83e-150 PDB 1HQU "Human Immunodeficiency Virus Type 1" 99.54 560 99.07 99.54 3.83e-150 PDB 1HVU "Human Immunodeficiency Virus Type 1 Reverse Transcriptase Complexed With A 33-Base Nucleotide Rna Pseudoknot" 99.54 554 99.54 100.00 9.30e-151 PDB 1HYS "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With A Polypurine Tract Rna:dna" 99.54 553 99.54 100.00 9.72e-151 PDB 1IKV "K103n Mutant Hiv-1 Reverse Transcriptase In Complex With Efivarenz" 99.54 560 99.07 99.54 3.96e-150 PDB 1IKW "Wild Type Hiv-1 Reverse Transcriptase In Complex With Efavirenz" 99.54 560 99.54 100.00 7.93e-151 PDB 1IKX "K103n Mutant Hiv-1 Reverse Transcriptase In Complex With The Inhibitor Pnu142721" 99.54 560 99.07 99.54 3.96e-150 PDB 1IKY "Hiv-1 Reverse Transcriptase In Complex With The Inhibitor Msc194" 99.54 560 99.07 99.54 3.96e-150 PDB 1J5O "Crystal Structure Of Met184ile Mutant Of Hiv-1 Reverse Transcriptase In Complex With Double Stranded Dna Template- Primer" 99.54 558 99.07 100.00 3.88e-150 PDB 1JLA "Crystal Structure Of Y181c Mutant Hiv-1 Reverse Transcriptase In Complex With Tnk-651" 99.54 560 99.54 99.54 7.19e-150 PDB 1JLB "Crystal Structure Of Y181c Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 99.54 560 99.54 99.54 7.19e-150 PDB 1JLC "Crystal Structure Of Y181c Mutant Hiv-1 Reverse Transcriptase In Complex With Pett-2" 99.54 560 99.54 99.54 7.19e-150 PDB 1JLE "Crystal Structure Of Y188c Mutant Hiv-1 Reverse Transcriptase" 99.54 560 99.54 99.54 6.18e-150 PDB 1JLF "Crystal Structure Of Y188c Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 99.54 560 99.54 99.54 7.19e-150 PDB 1JLG "Crystal Structure Of Y188c Mutant Hiv-1 Reverse Transcriptase In Complex With Uc-781" 99.54 560 99.54 99.54 6.18e-150 PDB 1JLQ "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With 739w94" 99.54 560 100.00 100.00 3.96e-151 PDB 1KLM "Hiv-1 Reverse Transcriptase Complexed With Bhap U-90152" 99.54 560 100.00 100.00 3.96e-151 PDB 1LW0 "Crystal Structure Of T215y Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 99.54 560 99.54 99.54 3.79e-150 PDB 1LW2 "Crystal Structure Of T215y Mutant Hiv-1 Reverse Transcriptase In Complex With 1051u91" 99.54 560 99.54 99.54 3.79e-150 PDB 1LWC "Crystal Structure Of M184v Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 99.54 560 99.54 100.00 2.11e-150 PDB 1LWE "Crystal Structure Of M41lT215Y MUTANT HIV-1 Reverse Transcriptase (Rtmn) In Complex With Nevirapine" 99.54 560 99.07 99.54 1.35e-149 PDB 1LWF "Crystal Structure Of A Mutant Hiv-1 Reverse Transcriptase (rtmq+m184v: M41l/d67n/k70r/m184v/t215y) In Complex With Nevirapine" 99.54 560 97.69 99.54 4.14e-148 PDB 1N5Y "Hiv-1 Reverse Transcriptase Crosslinked To Post- Translocation Aztmp-Terminated Dna (Complex P)" 99.54 558 99.54 100.00 9.05e-151 PDB 1N6Q "Hiv-1 Reverse Transcriptase Crosslinked To Pre- Translocation Aztmp-Terminated Dna (Complex N)" 99.54 558 99.54 100.00 9.05e-151 PDB 1R0A "Crystal Structure Of Hiv-1 Reverse Transcriptase Covalently Tethered To Dna Template-primer Solved To 2.8 Angstroms" 99.54 558 99.54 100.00 9.05e-151 PDB 1QE1 "Crystal Structure Of 3tc-Resistant M184i Mutant Of Hiv-1 Reverse Transcriptase" 99.54 427 99.07 100.00 6.83e-151 PDB 1REV "Hiv-1 Reverse Transcriptase" 99.54 560 100.00 100.00 3.96e-151 PDB 1RT1 "Crystal Structure Of Hiv-1 Reverse Transcriptase Complexed With Mkc-442" 99.54 560 100.00 100.00 3.96e-151 PDB 1RT2 "Crystal Structure Of Hiv-1 Reverse Transcriptase Complexed With Tnk-651" 99.54 560 100.00 100.00 3.96e-151 PDB 1RT3 "Azt Drug Resistant Hiv-1 Reverse Transcriptase Complexed With 1051u91" 99.54 440 99.07 100.00 7.28e-151 PDB 1RT4 "Hiv-1 Reverse Transcriptase Complexed With Uc781" 99.54 560 100.00 100.00 3.96e-151 PDB 1RT5 "Hiv-1 Reverse Transcriptase Complexed With Uc10" 99.54 560 100.00 100.00 3.96e-151 PDB 1RT6 "Hiv-1 Reverse Transcriptase Complexed With Uc38" 99.54 560 100.00 100.00 3.96e-151 PDB 1RT7 "Hiv-1 Reverse Transcriptase Complexed With Uc84" 99.54 560 100.00 100.00 3.96e-151 PDB 1RTD "Structure Of A Catalytic Complex Of Hiv-1 Reverse Transcriptase: Implications For Nucleoside Analog Drug Resistance" 99.54 440 100.00 100.00 8.14e-152 PDB 1RTH "High Resolution Structures Of Hiv-1 Rt From Four Rt- Inhibitor Complexes" 99.54 560 100.00 100.00 3.96e-151 PDB 1RTI "High Resolution Structures Of Hiv-1 Rt From Four Rt- Inhibitor Complexes" 99.54 560 100.00 100.00 3.96e-151 PDB 1RTJ "Mechanism Of Inhibition Of Hiv-1 Reverse Transcriptase By Non-Nucleoside Inhibitors" 99.54 560 100.00 100.00 3.96e-151 PDB 1S1T "Crystal Structure Of L100i Mutant Hiv-1 Reverse Transcriptase In Complex With Uc-781" 99.54 560 99.54 100.00 9.54e-151 PDB 1S1U "Crystal Structure Of L100i Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 99.54 560 99.54 100.00 9.54e-151 PDB 1S1V "Crystal Structure Of L100i Mutant Hiv-1 Reverse Transcriptase In Complex With Tnk-651" 99.54 560 99.54 100.00 9.54e-151 PDB 1S1W "Crystal Structure Of V106a Mutant Hiv-1 Reverse Transcriptase In Complex With Uc-781" 99.54 560 99.54 99.54 1.09e-150 PDB 1S1X "Crystal Structure Of V108i Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 99.54 560 99.54 100.00 5.42e-151 PDB 1S6P "Crystal Structure Of Human Immunodeficiency Virus Type 1 Reverse Transcriptase (Rt) In Complex With Janssen-R100943" 99.54 560 99.54 100.00 8.01e-151 PDB 1S6Q "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With Janssen-R147681" 99.54 560 99.54 100.00 8.01e-151 PDB 1S9E "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With Janssen-R129385" 99.54 560 99.54 100.00 8.01e-151 PDB 1S9G "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With Janssen-R120394." 99.54 560 99.54 100.00 8.01e-151 PDB 1SUQ "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With Janssen-R185545" 99.54 560 99.54 100.00 8.01e-151 PDB 1T03 "Hiv-1 Reverse Transcriptase Crosslinked To Tenofovir Terminated Template-Primer (Complex P)" 99.54 558 99.54 100.00 9.05e-151 PDB 1T05 "Hiv-1 Reverse Transcriptase Crosslinked To Template-Primer With Tenofovir-Diphosphate Bound As The Incoming Nucleotide Substrat" 99.54 437 100.00 100.00 7.87e-152 PDB 1TKT "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gw426318" 99.54 560 100.00 100.00 3.96e-151 PDB 1TKX "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gw490745" 99.54 560 100.00 100.00 3.96e-151 PDB 1TKZ "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gw429576" 99.54 560 100.00 100.00 3.96e-151 PDB 1TL1 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gw451211" 99.54 560 100.00 100.00 3.96e-151 PDB 1TL3 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gw450557" 99.54 560 100.00 100.00 3.96e-151 PDB 1TV6 "Hiv-1 Reverse Transcriptase Complexed With Cp-94,707" 99.54 560 99.54 100.00 8.46e-151 PDB 1TVR "Hiv-1 Rt9-Cl Tibo" 99.54 558 99.54 100.00 8.58e-151 PDB 1UWB "Tyr 181 Cys Hiv-1 Rt8-Cl Tibo" 99.54 558 99.07 99.54 1.84e-149 PDB 1VRT "High Resolution Structures Of Hiv-1 Rt From Four Rt- Inhibitor Complexes" 99.54 560 100.00 100.00 3.96e-151 PDB 1VRU "High Resolution Structures Of Hiv-1 Rt From Four Rt- Inhibitor Complexes" 99.54 560 100.00 100.00 3.96e-151 PDB 2B5J "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With Janssen-R165481" 99.54 560 99.54 100.00 8.01e-151 PDB 2B6A "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With Thr-50" 99.54 560 99.54 100.00 8.01e-151 PDB 2BAN "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With Janssen-R157208" 99.54 560 99.54 100.00 8.01e-151 PDB 2BE2 "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With R221239" 99.54 560 99.54 100.00 8.01e-151 PDB 2HMI "Hiv-1 Reverse TranscriptaseFRAGMENT OF FAB 28DNA COMPLEX" 99.54 558 99.54 100.00 8.58e-151 PDB 2HND "Crystal Structure Of K101e Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 98.16 534 99.53 100.00 5.71e-149 PDB 2HNY "Crystal Structure Of E138k Mutant Hiv-1 Reverse Transcriptase In Complex With Nevirapine" 98.16 534 99.53 100.00 9.11e-149 PDB 2HNZ "Crystal Structure Of E138k Mutant Hiv-1 Reverse Transcriptase In Complex With Pett-2" 98.16 534 99.53 100.00 9.11e-149 PDB 2I5J "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With Dhbnh, An Rnase H Inhibitor" 99.54 552 99.54 100.00 9.42e-151 PDB 2IAJ "Crystal Structure Of K103nY181C MUTANT HIV-1 Reverse Transcriptase (Rt) In Complex With Atp" 99.54 560 98.61 99.07 6.25e-149 PDB 2IC3 "Crystal Structure Of K103nY181C MUTANT HIV-1 Reverse Transcriptase (Rt) In Complex With Nonnucleoside Inhibitor Hby 097" 99.54 560 98.61 99.07 6.25e-149 PDB 2JLE "Novel Indazole Nnrtis Created Using Molecular Template Hybridization Based On Crystallographic Overlays" 99.54 566 100.00 100.00 4.28e-151 PDB 2OPP "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gw420867x" 98.16 542 100.00 100.00 3.83e-149 PDB 2OPQ "Crystal Structure Of L100i Mutant Hiv-1 Reverse Transcriptase In Complex With Gw420867x" 98.16 534 99.53 100.00 3.90e-149 PDB 2OPR "Crystal Structure Of K101e Mutant Hiv-1 Reverse Transcriptase In Complex With Gw420867x" 99.08 547 99.53 100.00 6.34e-150 PDB 2OPS "Crystal Structure Of Y188c Mutant Hiv-1 Reverse Transcriptase In Complex With Gw420867x" 99.08 542 99.53 99.53 3.51e-149 PDB 2RF2 "Hiv Reverse Transcriptase In Complex With Inhibitor 7e (Nnrti)" 99.54 563 100.00 100.00 2.08e-151 PDB 2RKI "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With A Triazole Derived Nnrti" 99.54 560 100.00 100.00 4.18e-151 PDB 2VG5 "Crystal Structures Of Hiv-1 Reverse Transcriptase Complexes With Thiocarbamate Non-Nucleoside Inhibitors" 99.54 557 99.54 100.00 1.19e-150 PDB 2VG6 "Crystal Structures Of Hiv-1 Reverse Transcriptase Complexes With Thiocarbamate Non-Nucleoside Inhibitors" 99.54 557 99.54 100.00 1.19e-150 PDB 2VG7 "Crystal Structures Of Hiv-1 Reverse Transcriptase Complexes With Thiocarbamate Non-Nucleoside Inhibitors" 99.54 557 99.54 100.00 1.19e-150 PDB 2WOM "Crystal Structure Of Uk-453061 Bound To Hiv-1 Reverse Transcriptase (k103n)" 99.54 560 99.54 99.54 1.54e-150 PDB 2WON "Crystal Structure Of Uk-453061 Bound To Hiv-1 Reverse Transcriptase (Wild-Type)." 99.54 560 100.00 100.00 4.18e-151 PDB 2YKM "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With A Difluoromethylbenzoxazole (Dfmb) Pyrimidine Thioether D" 99.54 428 99.54 100.00 1.44e-151 PDB 2YKN "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With A Difluoromethylbenzoxazole (Dfmb) Pyrimidine Thioether D" 99.54 428 99.54 100.00 1.44e-151 PDB 2YNF "Hiv-1 Reverse Transcriptase Y188l Mutant In Complex With Inhibitor Gsk560" 99.54 447 100.00 100.00 6.95e-152 PDB 2YNG "Hiv-1 Reverse Transcriptase In Complex With Inhibitor Gsk560" 99.54 563 100.00 100.00 2.08e-151 PDB 2YNH "Hiv-1 Reverse Transcriptase In Complex With Inhibitor Gsk500" 99.54 563 100.00 100.00 2.08e-151 PDB 2YNI "Hiv-1 Reverse Transcriptase In Complex With Inhibitor Gsk952" 99.54 563 100.00 100.00 2.08e-151 PDB 2ZD1 "Crystal Structure Of Hiv-1 Reverse Transcriptase (rt) In Complex With Tmc278 (rilpivirine), A Non-nucleoside Rt Inhibitor" 99.54 428 99.54 100.00 1.44e-151 PDB 2ZE2 "Crystal Structure Of L100i/k103n Mutant Hiv-1 Reverse Transcriptase (rt) In Complex With Tmc278 (rilpivirine), A Non-nucleoside" 99.54 428 99.54 100.00 1.44e-151 PDB 3BGR "Crystal Structure Of K103n/y181c Mutant Hiv-1 Reverse Transcriptase (rt) In Complex With Tmc278 (rilpivirine), A Non-nucleoside" 99.54 428 99.54 100.00 1.44e-151 PDB 3C6T "Crystal Structure Of Hiv Reverse Transcriptase In Complex With Inhibitor 14" 99.54 563 100.00 100.00 2.08e-151 PDB 3C6U "Crystal Structure Of Hiv Reverse Transcriptase In Complex With Inhibitor 22" 99.54 563 100.00 100.00 2.08e-151 PDB 3DI6 "Hiv-1 Rt With Pyridazinone Non-Nucleoside Inhibitor" 99.54 561 100.00 100.00 3.62e-151 PDB 3DLE "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gf128590." 99.54 560 100.00 100.00 3.96e-151 PDB 3DLG "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gw564511." 99.54 560 100.00 100.00 3.96e-151 PDB 3DLK "Crystal Structure Of An Engineered Form Of The Hiv-1 Reverse Transcriptase, Rt69a" 97.24 423 99.53 100.00 8.31e-148 PDB 3DM2 "Crystal Structure Of Hiv-1 K103n Mutant Reverse Transcriptase In Complex With Gw564511." 99.54 560 99.54 99.54 1.35e-150 PDB 3DMJ "Crystal Structure Of Hiv-1 V106a And Y181c Mutant Reverse Transcriptase In Complex With Gw564511" 99.54 560 99.07 99.07 2.09e-149 PDB 3DOK "Crystal Structure Of K103n Mutant Hiv-1 Reverse Transcriptase In Complex With Gw678248" 99.54 560 99.54 99.54 1.35e-150 PDB 3DOL "Crystal Structure Of L100i Mutant Hiv-1 Reverse Transcriptase In Complex With Gw695634." 99.54 440 100.00 100.00 8.14e-152 PDB 3DRP "Hiv Reverse Transcriptase In Complex With Inhibitor R8e" 99.54 563 100.00 100.00 2.08e-151 PDB 3DRR "Hiv Reverse Transcriptase Y181c Mutant In Complex With Inhibitor R8e" 99.54 563 99.54 99.54 3.94e-150 PDB 3DRS "Hiv Reverse Transcriptase K103n Mutant In Complex With Inhibitor R8d" 99.54 563 99.54 99.54 8.25e-151 PDB 3DYA "Hiv-1 Rt With Non-Nucleoside Inhibitor Annulated Pyrazole 1" 99.54 561 100.00 100.00 3.62e-151 PDB 3E01 "Hiv-Rt With Non-Nucleoside Inhibitor Annulated Pyrazole 2" 99.54 561 100.00 100.00 3.62e-151 PDB 3FFI "Hiv-1 Rt With Pyridone Non-Nucleoside Inhibitor" 100.00 561 100.00 100.00 3.14e-152 PDB 3HVT "Structural Basis Of Asymmetry In The Human Immunodeficiency Virus Type 1 Reverse Transcriptase Heterodimer" 99.54 556 99.54 100.00 1.14e-150 PDB 3I0R "Crystal Structure Of Hiv Reverse Transcriptase In Complex With Inhibitor 3" 99.54 563 100.00 100.00 2.08e-151 PDB 3I0S "Crystal Structure Of Hiv Reverse Transcriptase In Complex With Inhibitor 7" 99.54 563 100.00 100.00 2.08e-151 PDB 3IG1 "Hiv-1 Reverse Transcriptase With The Inhibitor Beta- Thujaplicinol Bound At The Rnase H Active Site" 99.54 428 99.54 100.00 1.44e-151 PDB 3IRX "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With The Non-Nucleoside Rt Inhibitor (E)-S-Methyl 5-(1-(3,7-Di" 99.54 428 99.54 100.00 1.44e-151 PDB 3IS9 "Crystal Structure Of The Hiv-1 Reverse Transcriptase (Rt) In Complex With The Alkenyldiarylmethane (Adam) Non-Nucleoside Rt Inh" 99.54 428 99.54 100.00 1.44e-151 PDB 3ISN "Crystal Structure Of Hiv-1 Rt Bound To A 6-Vinylpyrimidine Inhibitor" 99.54 560 99.54 100.00 7.93e-151 PDB 3ITH "Crystal Structure Of The Hiv-1 Reverse Transcriptase Bound To A 6-Vinylpyrimidine Inhibitor" 99.54 560 99.54 100.00 7.93e-151 PDB 3JSM "K65r Mutant Hiv-1 Reverse Transcriptase Cross-Linked To Ds-Dna And Complexed With Tenofovir-Diphosphate As The Incoming Nucleot" 99.54 437 99.54 100.00 2.26e-151 PDB 3JYT "K65r Mutant Hiv-1 Reverse Transcriptase Cross-Linked To Ds- Dna And Complexed With Datp As The Incoming Nucleotide Substrate" 99.54 437 99.54 100.00 2.26e-151 PDB 3KJV "Hiv-1 Reverse Transcriptase In Complex With Dna" 99.54 560 100.00 100.00 2.89e-151 PDB 3KK2 "Hiv-1 Reverse Transcriptase-Dna Complex With Datp Bound In The Nucleotide Binding Site" 99.54 560 100.00 100.00 2.89e-151 PDB 3KK3 "Hiv-1 Reverse Transcriptase-Dna Complex With Gs-9148 Terminated Primer" 99.54 560 100.00 100.00 2.89e-151 PDB 3KLE "Crystal Structure Of Azt-Resistant Hiv-1 Reverse Transcriptase Crosslinked To A Dsdna With A Bound Excision Product, Aztppppa" 99.54 437 99.54 100.00 2.31e-151 PDB 3KLF "Crystal Structure Of Wild-Type Hiv-1 Reverse Transcriptase Crosslinked To A Dsdna With A Bound Excision Product, Aztppppa" 99.54 444 99.54 100.00 1.41e-151 PDB 3KLG "Crystal Structure Of Azt-Resistant Hiv-1 Reverse Transcriptase Crosslinked To Pre-Translocation Aztmp-Terminated Dna (Complex N" 99.54 437 99.54 100.00 2.31e-151 PDB 3KLH "Crystal Structure Of Azt-resistant Hiv-1 Reverse Transcriptase Crosslinked To Post-translocation Aztmp-terminated Dna (complex " 99.54 437 99.54 100.00 2.31e-151 PDB 3KLI "Crystal Structure Of Unliganded Azt-Resistant Hiv-1 Reverse Transcriptase" 99.54 437 99.54 100.00 2.31e-151 PDB 3LAK "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With N1-Heterocycle Pyrimidinedione Non-Nucleoside Inhibitor" 99.54 560 100.00 100.00 4.18e-151 PDB 3LAL "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With N1-Ethyl Pyrimidinedione Non-Nucleoside Inhibitor" 99.54 560 100.00 100.00 4.18e-151 PDB 3LAM "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With N1-Propyl Pyrimidinedione Non-Nucleoside Inhibitor" 99.54 560 100.00 100.00 4.18e-151 PDB 3LAN "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With N1-Butyl Pyrimidinedione Non-Nucleoside Inhibitor" 99.54 560 100.00 100.00 4.18e-151 PDB 3LP0 "Hiv-1 Reverse Transcriptase With Inhibitor" 99.54 563 99.54 99.54 8.25e-151 PDB 3LP1 "Hiv-1 Reverse Transcriptase With Inhibitor" 99.54 563 99.54 99.54 8.25e-151 PDB 3LP2 "Hiv-1 Reverse Transcriptase With Inhibitor" 99.54 563 99.54 99.54 8.25e-151 PDB 3M8P "Hiv-1 Rt With Nnrti Tmc-125" 99.54 561 100.00 100.00 3.62e-151 PDB 3M8Q "Hiv-1 Rt With Aminopyrimidine Nnrti" 99.54 561 100.00 100.00 3.62e-151 PDB 3MEC "Hiv-1 Reverse Transcriptase In Complex With Tmc125" 99.54 560 100.00 100.00 4.18e-151 PDB 3MED "Hiv-1 K103n Reverse Transcriptase In Complex With Tmc125" 99.54 560 99.54 99.54 1.54e-150 PDB 3MEE "Hiv-1 Reverse Transcriptase In Complex With Tmc278" 99.54 560 100.00 100.00 4.18e-151 PDB 3MEG "Hiv-1 K103n Reverse Transcriptase In Complex With Tmc278" 99.54 560 99.54 99.54 1.54e-150 PDB 3NBP "Hiv-1 Reverse Transcriptase With Aminopyrimidine Inhibitor 2" 99.54 561 100.00 100.00 3.62e-151 PDB 3QIP "Structure Of Hiv-1 Reverse Transcriptase In Complex With An Rnase H Inhibitor And Nevirapine" 99.54 560 100.00 100.00 4.18e-151 PDB 3QLH "Hiv-1 Reverse Transcriptase In Complex With Manicol At The Rnase H Active Site And Tmc278 (rilpivirine) At The Nnrti Binding Po" 97.24 423 99.53 100.00 8.31e-148 PDB 3QO9 "Crystal Structure Of Hiv-1 Reverse Transcriptase (rt) In Complex With Tsao-t, A Non-nucleoside Rt Inhibitor (nnrti)" 99.54 428 99.54 100.00 1.44e-151 PDB 3T19 "Crystal Structure Of Hiv-1 Reverse Transcriptase (Wild Type) In Complex With Inhibitor M05" 99.54 563 100.00 100.00 2.08e-151 PDB 3T1A "Crystal Structure Of Hiv-1 Reverse Transcriptase (K103n Mutant) In Complex With Inhibitor M05" 99.54 563 99.54 99.54 8.25e-151 PDB 3TAM "Crystal Structure Of Hiv-1 Reverse Transcriptase (K103n Mutant) In Complex With Inhibitor M06" 99.54 563 99.54 99.54 8.25e-151 PDB 3V4I "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) With Dna And Azttp" 99.54 428 99.54 100.00 1.44e-151 PDB 3V6D "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) Cross-Linked With Azt-Terminated Dna" 99.54 428 99.54 100.00 1.44e-151 PDB 3V81 "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) With Dna And The Nonnucleoside Inhibitor Nevirapine" 99.54 428 99.54 100.00 1.44e-151 PDB 4B3O "Structures Of Hiv-1 Rt And Rna-dna Complex Reveal A Unique Rt Conformation And Substrate Interface" 99.54 560 99.07 99.54 5.54e-150 PDB 4B3P "Structures Of Hiv-1 Rt And Rna-dna Complex Reveal A Unique Rt Conformation And Substrate Interface" 99.54 560 99.07 99.54 5.19e-150 PDB 4B3Q "Structures Of Hiv-1 Rt And Rna-dna Complex Reveal A Unique Rt Conformation And Substrate Interface" 99.54 560 99.07 99.54 5.25e-150 PDB 4DG1 "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) With Polymorphism Mutation K172a And K173a" 99.54 427 99.54 100.00 1.52e-151 PDB 4G1Q "Crystal Structure Of Hiv-1 Reverse Transcriptase (rt) In Complex With Rilpivirine (tmc278, Edurant), A Non-nucleoside Rt-inhibi" 99.54 428 99.54 100.00 1.44e-151 PDB 4H4M "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With (E)- 3-(3-Chloro-5-(4-Chloro-2-(2-(2,4-Dioxo-3,4- Dihydropyrim" 99.54 428 99.54 100.00 1.44e-151 PDB 4H4O "Crystal Structure Of Hiv-1 Reverse Transcriptase (Rt) In Complex With (E)-3-(3-(2-(2-(2,4-Dioxo-3,4-Dihydropyrimidin-1(2h)-Yl)e" 99.54 428 99.54 100.00 1.44e-151 PDB 4I2P "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Rilpivirine (tmc278) Based Analogue" 99.54 428 99.54 100.00 1.44e-151 PDB 4I2Q "Crystal Structure Of K103n/y181c Mutant Of Hiv-1 Reverse Transcriptase In Complex With Rilpivirine (tmc278) Analogue" 99.54 428 99.54 100.00 1.44e-151 PDB 4I7F "Hiv-1 Reverse Transcriptase In Complex With A Phosphonate Analog Of Nevirapine" 99.54 560 100.00 100.00 4.18e-151 PDB 4ICL "Hiv-1 Reverse Transcriptase With Bound Fragment At The Incoming Dntp Binding Site" 99.54 429 99.54 100.00 1.73e-151 PDB 4ID5 "Hiv-1 Reverse Transcriptase With Bound Fragment At The Rnase H Primer Grip Site" 99.54 429 99.54 100.00 1.73e-151 PDB 4IDK "Hiv-1 Reverse Transcriptase With Bound Fragment At The 428 Site" 99.54 429 99.54 100.00 1.73e-151 PDB 4IFV "Detecting Allosteric Sites Of Hiv-1 Reverse Transcriptase By X-ray Crystallographic Fragment Screening" 99.54 429 99.54 100.00 1.73e-151 PDB 4IFY "Hiv-1 Reverse Transcriptase With Bound Fragment At The Knuckles Site" 99.54 429 99.54 100.00 1.73e-151 PDB 4IG0 "Hiv-1 Reverse Transcriptase With Bound Fragment At The 507 Site" 99.54 429 99.54 100.00 1.73e-151 PDB 4IG3 "Hiv-1 Reverse Transcriptase With Bound Fragment Near Knuckles Site" 99.54 429 99.54 100.00 1.73e-151 PDB 4KFB "Hiv-1 Reverse Transcriptase With Bound Fragment At Nnrti Adjacent Site" 99.54 429 99.54 100.00 1.73e-151 PDB 4KKO "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With 4- ((4-methoxy-6-(2-morpholinoethoxy)-1,3,5-triazin-2-yl)amino" 99.54 428 99.54 100.00 1.44e-151 PDB 4KO0 "Crystal Structure Of Hiv-1 Reverse Transcriptase (rt) In Complex With An Anilinylpyrimidine Derivative (jlj-135)" 99.54 428 99.54 100.00 1.44e-151 PDB 4KSE "Crystal Structure Of A Hiv P51 (219-230) Deletion Mutant" 99.54 418 100.00 100.00 1.78e-152 PDB 4KV8 "Crystal Structure Of Hiv Rt In Complex With Bilr0355bs" 100.00 564 100.00 100.00 4.29e-152 PDB 4LSL "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With (e)- 3-(3-(4-chloro-2-(2-(2,4-dioxo-3,4-dihydropyrimidin-1(2h)" 99.54 428 99.54 100.00 1.44e-151 PDB 4LSN "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With (e)- 3-(3-bromo-5-(4-chloro-2-(2-(2,4-dioxo-3,4-dihydropyrimid" 99.54 428 99.54 100.00 1.44e-151 PDB 4MFB "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With 8-(2- (2-(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)ethoxy)pheno" 99.54 428 99.54 100.00 1.44e-151 PDB 4NCG "Discovery Of Doravirine, An Orally Bioavailable Non-nucleoside Reverse Transcriptase Inhibitor Potent Against A Wide Range Of R" 99.54 563 100.00 100.00 2.08e-151 PDB 4O44 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With 4- ((4-(mesitylamino)-6-(3-morpholinopropoxy)-1,3,5-triazin-2-" 99.54 428 99.54 100.00 1.44e-151 PDB 4O4G "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With 4- ((4-(mesitylamino)-1,3,5-triazin-2-yl)amino)benzonitrile (j" 99.54 428 99.54 100.00 1.44e-151 PDB 4PQU "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Rna/dna And Datp" 99.54 428 99.54 100.00 1.44e-151 PDB 4PUO "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Rna/dna And Nevirapine" 99.54 428 99.54 100.00 1.44e-151 PDB 4PWD "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Bulge-rna/dna And Nevirapine" 99.54 428 99.54 100.00 1.44e-151 PDB 4Q0B "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With Gap- Rna/dna And Nevirapine" 99.54 428 99.54 100.00 1.44e-151 PDB 4R5P "Crystal Structure Of Hiv-1 Reverse Transcriptase (rt) With Dna And A Nucleoside Triphosphate Mimic Alpha-carboxy Nucleoside Pho" 99.54 428 99.54 100.00 1.44e-151 PDB 4RW4 "Crystal Structure Of Hiv-1 Reverse Transcriptase (k103n,y181c) Variant In Complex With (e)-3-(3-chloro-5-(4-chloro-2-(2-(2,4-di" 99.54 428 99.54 100.00 1.44e-151 PDB 4RW6 "Crystal Structure Of Hiv-1 Reverse Transcriptase (y181c) Variant In Complex With (e)-3-(3-chloro-5-(4-chloro-2-(2-(2,4-dioxo-3," 99.54 428 99.54 100.00 1.44e-151 PDB 4RW7 "Crystal Structure Of Hiv-1 Reverse Transcriptase (k103n, Y181c) Variant In Complex With (e)-3-(3-chloro-5-(2-(2-(2,4-dioxo-3,4-" 99.54 428 99.54 100.00 1.44e-151 PDB 4RW8 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With (e)- 3-(3-chloro-5-(2-(2-(2,4-dioxo-3,4-dihydropyrimidin-1(2h)" 99.54 428 99.54 100.00 1.44e-151 PDB 4RW9 "Crystal Structure Of Hiv-1 Reverse Transcriptase (y181c) Variant In Complex With (e)-3-(3-chloro-5-(2-(2-(2,4-dioxo-3,4-dihydro" 99.54 428 99.54 100.00 1.44e-151 PDB 4WE1 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With 5-(2- (2-(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)ethoxy)pheno" 99.54 428 99.54 100.00 1.44e-151 PDB 4ZHR "Structure Of Hiv-1 Rt Q151m Mutant" 100.00 562 97.24 98.62 2.70e-148 PDB 5C24 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With 7- ((4-((4-cyanophenyl)amino)-1,3,5-triazin-2-yl)amino)-6,8- D" 96.77 412 99.52 100.00 1.97e-147 PDB 5C25 "Crystal Structure Of Hiv-1 Reverse Transcriptase In Complex With 6- ((4-((4-cyanophenyl)amino)-1,3,5-triazin-2-yl)amino)-5,7-di" 99.54 428 99.54 100.00 1.44e-151 PDB 5C42 "Crystal Structure Of Hiv-1 Reverse Transcriptase (k101p) Variant In Complex With 8-(2-(2-(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-" 99.54 428 99.54 100.00 1.44e-151 PDB 5D3G "Structure Of Hiv-1 Reverse Transcriptase Bound To A Novel 38-mer Hairpin Template-primer Dna Aptamer" 99.54 555 99.54 100.00 8.70e-151 DBJ BAA00993 "pol polyprotein [Human immunodeficiency virus 1]" 100.00 1003 98.62 99.08 2.63e-145 DBJ BAA12989 "Pol [Human immunodeficiency virus 1]" 100.00 1015 98.16 98.62 1.23e-144 DBJ BAA12997 "Pol [Human immunodeficiency virus 1]" 100.00 1015 99.54 99.54 8.20e-147 DBJ BAA24269 "reverse transcriptase [Human immunodeficiency virus 1]" 95.85 263 99.52 100.00 1.66e-147 DBJ BAA24270 "reverse transcriptase [Human immunodeficiency virus 1]" 95.85 263 100.00 100.00 4.84e-148 EMBL CAA05982 "reverse transcriptase [Human immunodeficiency virus 1]" 99.54 259 97.22 98.61 2.16e-150 EMBL CAA05984 "reverse transcriptase [Human immunodeficiency virus 1]" 99.54 259 98.15 99.07 9.19e-152 EMBL CAA06947 "pol polyprotein precursor [Human immunodeficiency virus 1]" 100.00 1006 97.24 99.08 1.15e-143 EMBL CAA12651 "reverse transcriptase [Human immunodeficiency virus 1]" 82.49 206 97.21 97.77 1.04e-123 EMBL CAA12656 "reverse transcriptase [Human immunodeficiency virus 1]" 93.55 216 97.04 98.52 2.34e-141 GB AAA44198 "pol polyprotein, partial [Human immunodeficiency virus 1]" 100.00 1015 99.08 99.54 3.17e-146 GB AAA44619 "reverse transcriptase, partial [Human immunodeficiency virus 1]" 72.35 191 97.45 98.09 6.96e-106 GB AAA44653 "pol polyprotein, partial [Human immunodeficiency virus 1]" 100.00 1015 97.70 98.16 9.11e-144 GB AAA44988 "pol polyprotein (NH2-terminus uncertain), partial [Human immunodeficiency virus 1]" 100.00 1003 97.70 98.62 1.53e-144 GB AAA45006 "reverse transcriptase, partial [Human immunodeficiency virus 1]" 70.97 217 97.40 99.35 2.90e-104 PIR GNVWLV "HIV-1 retropepsin (EC 3.4.23.16) - human immunodeficiency virus type 1 (isolate LAV-1a)" 100.00 1003 99.54 99.54 6.64e-147 PRF 1102247C "protein pol" 100.00 1015 99.08 99.54 3.17e-146 PRF 1103299E "pol gene" 100.00 1012 99.54 99.54 1.03e-146 PRF 1817237A "reverse transcriptase" 70.97 162 98.70 99.35 2.13e-106 REF NP_057849 "Gag-Pol [Human immunodeficiency virus 1]" 100.00 1435 99.54 99.54 3.86e-144 REF NP_705927 "reverse transcriptase [Human immunodeficiency virus 1]" 99.54 560 100.00 100.00 4.18e-151 REF NP_789739 "reverse transcriptase p51 subunit [Human immunodeficiency virus 1]" 99.54 440 100.00 100.00 8.14e-152 REF NP_789740 "Pol [Human immunodeficiency virus 1]" 100.00 995 99.54 99.54 7.36e-147 REF YP_001856242 "reverse transcriptase [Human immunodeficiency virus 1]" 99.54 560 100.00 100.00 4.18e-151 SP P03366 "RecName: Full=Gag-Pol polyprotein; AltName: Full=Pr160Gag-Pol; Contains: RecName: Full=Matrix protein p17; Short=MA; Contains: " 100.00 1447 99.08 99.54 1.51e-143 SP P03367 "RecName: Full=Gag-Pol polyprotein; AltName: Full=Pr160Gag-Pol; Contains: RecName: Full=Matrix protein p17; Short=MA; Contains: " 100.00 1447 99.54 99.54 3.57e-144 SP P03369 "RecName: Full=Gag-Pol polyprotein; AltName: Full=Pr160Gag-Pol; Contains: RecName: Full=Matrix protein p17; Short=MA; Contains: " 100.00 1437 98.62 99.08 6.88e-143 SP P04585 "RecName: Full=Gag-Pol polyprotein; AltName: Full=Pr160Gag-Pol; Contains: RecName: Full=Matrix protein p17; Short=MA; Contains: " 100.00 1435 99.54 99.54 3.86e-144 SP P04587 "RecName: Full=Gag-Pol polyprotein; AltName: Full=Pr160Gag-Pol; Contains: RecName: Full=Matrix protein p17; Short=MA; Contains: " 100.00 1447 97.70 98.16 2.36e-141 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $RT216 HIV 11676 Viruses . Lentivirus . 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 $RT216 'recombinant technology' . Escherichia coli . PET30 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 _Isotopic_labeling $RT216 .6 mM '[U-13C; U-15N; U-2H] ILE methyl protonated' TRIS 50 mM d-11 EDTA 1 mM d-16 DSS 0.2 mM 'natural abundance' 'sodium azide' 2 % 'natural abundance' H2O 90 % 'natural abundance' D2O 8 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRDraw _Saveframe_category software _Name NMRDraw _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_VNMRJ _Saveframe_category software _Name VNMRJ _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CA)CB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CB' _Sample_label $sample_1 save_ save_3D_HN(COCA)CB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(COCA)CB' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_CCCCOSY_CA_NNH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CCCCOSY_CA_NNH' _Sample_label $sample_1 save_ save_3D_HCCCCOSY_CA_NNH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCCCOSY_CA_NNH' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 1 . mM pH 6.8 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details DSS 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 DSS C 13 'methyl protons' ppm 0 internal indirect . . . 0.25145 DSS H 1 'methyl protons' ppm 0 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0 internal indirect . . . 0.10133 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_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCA' '3D HN(CA)CB' '3D HN(COCA)CB' '3D HN(CO)CA' '3D CCCCOSY_CA_NNH' '3D HCCCCOSY_CA_NNH' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name RT216 _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 2 PRO CA C 62.8230 . 1 2 1 2 PRO CB C 31.1890 . 1 3 2 3 ILE H H 8.0310 . 1 4 2 3 ILE CA C 61.1360 . 1 5 2 3 ILE CB C 37.8950 . 1 6 2 3 ILE N N 121.0560 . 1 7 3 4 SER H H 7.9370 . 1 8 3 4 SER CA C 55.4950 . 1 9 3 4 SER CB C 63.6580 . 1 10 3 4 SER N N 119.1710 . 1 11 4 5 PRO CA C 62.3980 . 1 12 4 5 PRO CB C 29.9550 . 1 13 5 6 ILE H H 7.8150 . 1 14 5 6 ILE CA C 65.1260 . 1 15 5 6 ILE CB C 39.1120 . 1 16 5 6 ILE N N 122.2920 . 1 17 6 7 GLU H H 7.9980 . 1 18 6 7 GLU CA C 56.1880 . 1 19 6 7 GLU CB C 29.6560 . 1 20 6 7 GLU N N 123.0680 . 1 21 7 8 THR H H 8.1870 . 1 22 7 8 THR CA C 61.5440 . 1 23 7 8 THR CB C 69.3060 . 1 24 7 8 THR N N 117.3280 . 1 25 8 9 VAL H H 8.1170 . 1 26 8 9 VAL CA C 59.5730 . 1 27 8 9 VAL CB C 31.7070 . 1 28 8 9 VAL N N 125.0200 . 1 29 15 16 GLY CA C 45.0000 . 1 30 16 17 MET H H 7.6850 . 1 31 16 17 MET CA C 54.6600 . 1 32 16 17 MET CB C 33.1010 . 1 33 16 17 MET N N 118.7220 . 1 34 17 18 ASP H H 8.2810 . 1 35 17 18 ASP CA C 50.8030 . 1 36 17 18 ASP CB C 42.5410 . 1 37 17 18 ASP N N 120.8460 . 1 38 18 19 GLY H H 8.1820 . 1 39 18 19 GLY CA C 44.5390 . 1 40 18 19 GLY N N 104.8180 . 1 41 26 27 LEU CA C 52.2790 . 1 42 26 27 LEU CB C 46.1180 . 1 43 27 28 THR H H 7.0480 . 1 44 27 28 THR CA C 60.3960 . 1 45 27 28 THR CB C 69.9990 . 1 46 27 28 THR N N 109.2940 . 1 47 28 29 GLU H H 8.9890 . 1 48 28 29 GLU CA C 60.1950 . 1 49 28 29 GLU CB C 28.6440 . 1 50 28 29 GLU N N 122.1480 . 1 51 29 30 GLU H H 8.7510 . 1 52 29 30 GLU CA C 58.6060 . 1 53 29 30 GLU CB C 28.1240 . 1 54 29 30 GLU N N 118.5460 . 1 55 30 31 LYS H H 7.0670 . 1 56 30 31 LYS CA C 59.0470 . 1 57 30 31 LYS CB C 32.9550 . 1 58 30 31 LYS N N 120.2230 . 1 59 31 32 ILE H H 7.9980 . 1 60 31 32 ILE CA C 66.0890 . 1 61 31 32 ILE CB C 37.6080 . 1 62 31 32 ILE N N 120.8760 . 1 63 32 33 LYS H H 8.1800 . 1 64 32 33 LYS CA C 59.5120 . 1 65 32 33 LYS CB C 31.2400 . 1 66 32 33 LYS N N 118.1450 . 1 67 33 34 ALA H H 7.0450 . 1 68 33 34 ALA CA C 54.2430 . 1 69 33 34 ALA CB C 15.9850 . 1 70 33 34 ALA N N 120.8390 . 1 71 34 35 LEU H H 7.9760 . 1 72 34 35 LEU CA C 57.3910 . 1 73 34 35 LEU CB C 41.4710 . 1 74 34 35 LEU N N 118.5680 . 1 75 35 36 VAL H H 8.8960 . 1 76 35 36 VAL CA C 66.5510 . 1 77 35 36 VAL CB C 30.9180 . 1 78 35 36 VAL N N 122.5340 . 1 79 36 37 GLU H H 7.6670 . 1 80 36 37 GLU CA C 59.7110 . 1 81 36 37 GLU CB C 28.6260 . 1 82 36 37 GLU N N 122.6050 . 1 83 37 38 ILE H H 8.0980 . 1 84 37 38 ILE CA C 58.5340 . 1 85 37 38 ILE CB C 36.6020 . 1 86 37 38 ILE N N 121.1420 . 1 87 38 39 CYS H H 8.9830 . 1 88 38 39 CYS CA C 57.0820 . 1 89 38 39 CYS CB C 41.2170 . 1 90 38 39 CYS N N 118.3780 . 1 91 39 40 THR H H 7.7780 . 1 92 39 40 THR CA C 60.9050 . 1 93 39 40 THR CB C 72.5970 . 1 94 39 40 THR N N 123.2000 . 1 95 40 41 GLU H H 7.1630 . 1 96 40 41 GLU CA C 59.0700 . 1 97 40 41 GLU CB C 28.4910 . 1 98 40 41 GLU N N 122.4120 . 1 99 41 42 MET H H 8.0930 . 1 100 41 42 MET CA C 59.4770 . 1 101 41 42 MET CB C 33.5630 . 1 102 41 42 MET N N 117.8830 . 1 103 42 43 GLU H H 8.6870 . 1 104 42 43 GLU CA C 58.3540 . 1 105 42 43 GLU CB C 28.6480 . 1 106 42 43 GLU N N 122.8660 . 1 107 43 44 LYS H H 7.8660 . 1 108 43 44 LYS CA C 59.2250 . 1 109 43 44 LYS CB C 31.0920 . 1 110 43 44 LYS N N 123.8530 . 1 111 44 45 GLU H H 7.4510 . 1 112 44 45 GLU CA C 56.1900 . 1 113 44 45 GLU CB C 30.0960 . 1 114 44 45 GLU N N 115.5620 . 1 115 45 46 GLY H H 7.9010 . 1 116 45 46 GLY CA C 44.9990 . 1 117 45 46 GLY N N 107.8770 . 1 118 46 47 LYS H H 8.2810 . 1 119 46 47 LYS CA C 58.1840 . 1 120 46 47 LYS CB C 33.0140 . 1 121 46 47 LYS N N 120.1790 . 1 122 47 48 ILE H H 6.8140 . 1 123 47 48 ILE CA C 58.0940 . 1 124 47 48 ILE CB C 40.6090 . 1 125 47 48 ILE N N 107.0310 . 1 126 48 49 SER H H 8.5840 . 1 127 48 49 SER CA C 57.4310 . 1 128 48 49 SER CB C 66.5600 . 1 129 48 49 SER N N 115.5600 . 1 130 49 50 LYS H H 9.1330 . 1 131 49 50 LYS CA C 57.0420 . 1 132 49 50 LYS CB C 32.0910 . 1 133 49 50 LYS N N 125.7440 . 1 134 50 51 ILE H H 7.3550 . 1 135 50 51 ILE CA C 59.2380 . 1 136 50 51 ILE CB C 40.5140 . 1 137 50 51 ILE N N 117.0940 . 1 138 51 52 GLY H H 8.3940 . 1 139 51 52 GLY CA C 43.8160 . 1 140 51 52 GLY N N 109.3990 . 1 141 59 60 PRO CA C 62.2940 . 1 142 59 60 PRO CB C 32.2380 . 1 143 60 61 VAL H H 9.4210 . 1 144 60 61 VAL CA C 58.5580 . 1 145 60 61 VAL CB C 34.8810 . 1 146 60 61 VAL N N 118.1460 . 1 147 61 62 PHE H H 8.8360 . 1 148 61 62 PHE CA C 56.1990 . 1 149 61 62 PHE CB C 40.5930 . 1 150 61 62 PHE N N 118.8370 . 1 151 62 63 ALA H H 7.3460 . 1 152 62 63 ALA CB C 21.1540 . 1 153 62 63 ALA N N 121.1420 . 1 154 63 64 ILE H H 8.9510 . 1 155 63 64 ILE CA C 59.0080 . 1 156 63 64 ILE CB C 41.5350 . 1 157 63 64 ILE N N 119.4950 . 1 158 64 65 LYS H H 8.3270 . 1 159 64 65 LYS CA C 55.2280 . 1 160 64 65 LYS CB C 31.7610 . 1 161 64 65 LYS N N 126.5100 . 1 162 65 66 LYS H H 8.4260 . 1 163 65 66 LYS CA C 55.8950 . 1 164 65 66 LYS CB C 31.9900 . 1 165 65 66 LYS N N 126.0030 . 1 166 66 67 LYS H H 7.9730 . 1 167 66 67 LYS CA C 61.6790 . 1 168 66 67 LYS CB C 31.9870 . 1 169 66 67 LYS N N 121.8120 . 1 170 69 70 THR CA C 61.4050 . 1 171 69 70 THR CB C 68.6130 . 1 172 70 71 LYS H H 7.9450 . 1 173 70 71 LYS CA C 54.9730 . 1 174 70 71 LYS CB C 33.0570 . 1 175 70 71 LYS N N 122.6060 . 1 176 71 72 TRP H H 8.5260 . 1 177 71 72 TRP CA C 57.0050 . 1 178 71 72 TRP CB C 31.0630 . 1 179 71 72 TRP N N 122.9970 . 1 180 72 73 ARG H H 9.2630 . 1 181 72 73 ARG CA C 53.7000 . 1 182 72 73 ARG CB C 32.4800 . 1 183 72 73 ARG N N 119.9830 . 1 184 73 74 LYS H H 8.7450 . 1 185 73 74 LYS CA C 55.4750 . 1 186 73 74 LYS CB C 33.6920 . 1 187 73 74 LYS N N 124.9780 . 1 188 74 75 LEU H H 8.5210 . 1 189 74 75 LEU CA C 53.6460 . 1 190 74 75 LEU CB C 44.1020 . 1 191 74 75 LEU N N 131.0440 . 1 192 75 76 VAL H H 8.4190 . 1 193 75 76 VAL CA C 60.4760 . 1 194 75 76 VAL CB C 31.6560 . 1 195 75 76 VAL N N 124.2830 . 1 196 76 77 ASP H H 8.1150 . 1 197 76 77 ASP CA C 51.7620 . 1 198 76 77 ASP CB C 40.0510 . 1 199 76 77 ASP N N 125.1960 . 1 200 77 78 PHE H H 8.0640 . 1 201 77 78 PHE CA C 59.0190 . 1 202 77 78 PHE CB C 37.5980 . 1 203 77 78 PHE N N 123.9920 . 1 204 78 79 ARG H H 7.7470 . 1 205 78 79 ARG CA C 61.4200 . 1 206 78 79 ARG CB C 29.6930 . 1 207 78 79 ARG N N 120.6750 . 1 208 79 80 GLU H H 9.3500 . 1 209 79 80 GLU CA C 59.3010 . 1 210 79 80 GLU CB C 27.6400 . 1 211 79 80 GLU N N 119.9690 . 1 212 80 81 LEU H H 9.2140 . 1 213 80 81 LEU CA C 57.9080 . 1 214 80 81 LEU CB C 40.5140 . 1 215 80 81 LEU N N 122.4560 . 1 216 81 82 ASN H H 9.7090 . 1 217 81 82 ASN CA C 56.2630 . 1 218 81 82 ASN CB C 36.4980 . 1 219 81 82 ASN N N 121.8500 . 1 220 82 83 LYS H H 7.6020 . 1 221 82 83 LYS CA C 58.9130 . 1 222 82 83 LYS CB C 32.0330 . 1 223 82 83 LYS N N 120.3650 . 1 224 88 89 TRP CA C 62.7520 . 1 225 88 89 TRP CB C 31.4180 . 1 226 89 90 GLU CA C 62.6890 . 1 227 89 90 GLU CB C 31.2620 . 1 228 90 91 VAL H H 8.1150 . 1 229 90 91 VAL CA C 61.9150 . 1 230 90 91 VAL CB C 31.9830 . 1 231 90 91 VAL N N 121.6590 . 1 232 91 92 GLN H H 8.2710 . 1 233 91 92 GLN CA C 55.7900 . 1 234 91 92 GLN CB C 32.1110 . 1 235 91 92 GLN N N 126.0760 . 1 236 92 93 LEU H H 8.0980 . 1 237 92 93 LEU CA C 60.6320 . 1 238 92 93 LEU CB C 37.9470 . 1 239 92 93 LEU N N 122.6300 . 1 240 93 94 GLY H H 8.2260 . 1 241 93 94 GLY CA C 44.1320 . 1 242 93 94 GLY N N 113.9530 . 1 243 102 103 LYS CA C 55.7210 . 1 244 102 103 LYS CB C 31.6410 . 1 245 103 104 LYS H H 7.4460 . 1 246 103 104 LYS CA C 53.5300 . 1 247 103 104 LYS CB C 30.9380 . 1 248 103 104 LYS N N 121.1010 . 1 249 104 105 LYS H H 8.3980 . 1 250 104 105 LYS CA C 58.9520 . 1 251 104 105 LYS CB C 32.5450 . 1 252 104 105 LYS N N 122.7060 . 1 253 105 106 SER H H 8.3440 . 1 254 105 106 SER CA C 57.2220 . 1 255 105 106 SER CB C 64.0100 . 1 256 105 106 SER N N 114.3710 . 1 257 106 107 VAL H H 8.1450 . 1 258 106 107 VAL CA C 60.7500 . 1 259 106 107 VAL CB C 34.5930 . 1 260 106 107 VAL N N 123.5430 . 1 261 107 108 THR H H 9.2600 . 1 262 107 108 THR CA C 61.4810 . 1 263 107 108 THR CB C 71.5860 . 1 264 107 108 THR N N 126.0830 . 1 265 108 109 VAL H H 8.5640 . 1 266 108 109 VAL CA C 60.5340 . 1 267 108 109 VAL CB C 31.9550 . 1 268 108 109 VAL N N 126.5770 . 1 269 109 110 LEU H H 9.3170 . 1 270 109 110 LEU CA C 53.1880 . 1 271 109 110 LEU CB C 42.8210 . 1 272 109 110 LEU N N 130.1580 . 1 273 110 111 ASP H H 8.5110 . 1 274 110 111 ASP CA C 53.6040 . 1 275 110 111 ASP CB C 40.9730 . 1 276 110 111 ASP N N 123.8980 . 1 277 111 112 VAL H H 8.7140 . 1 278 111 112 VAL CA C 59.6940 . 1 279 111 112 VAL N N 120.2740 . 1 280 119 120 PRO CA C 61.8690 . 1 281 119 120 PRO CB C 31.4780 . 1 282 120 121 LEU H H 7.9340 . 1 283 120 121 LEU CA C 51.9320 . 1 284 120 121 LEU CB C 44.3920 . 1 285 120 121 LEU N N 123.3490 . 1 286 121 122 ASP H H 9.3960 . 1 287 121 122 ASP CA C 55.5630 . 1 288 121 122 ASP CB C 42.5820 . 1 289 121 122 ASP N N 129.0550 . 1 290 122 123 GLU H H 9.1860 . 1 291 122 123 GLU CA C 60.3980 . 1 292 122 123 GLU CB C 29.0080 . 1 293 122 123 GLU N N 128.5140 . 1 294 123 124 ASP H H 8.4100 . 1 295 123 124 ASP CA C 56.3580 . 1 296 123 124 ASP CB C 40.9600 . 1 297 123 124 ASP N N 118.3350 . 1 298 124 125 PHE H H 7.9670 . 1 299 124 125 PHE CA C 57.4940 . 1 300 124 125 PHE CB C 40.9920 . 1 301 124 125 PHE N N 120.1800 . 1 302 125 126 ARG H H 7.1190 . 1 303 125 126 ARG CA C 59.9840 . 1 304 125 126 ARG CB C 29.9060 . 1 305 125 126 ARG N N 115.7190 . 1 306 126 127 LYS H H 8.2210 . 1 307 126 127 LYS CA C 57.1620 . 1 308 126 127 LYS CB C 29.6530 . 1 309 126 127 LYS N N 116.1960 . 1 310 127 128 TYR H H 6.9530 . 1 311 127 128 TYR CB C 36.4760 . 1 312 127 128 TYR N N 116.7460 . 1 313 128 129 THR H H 8.0370 . 1 314 128 129 THR CA C 61.1670 . 1 315 128 129 THR CB C 68.9880 . 1 316 128 129 THR N N 109.2430 . 1 317 129 130 ALA H H 6.3180 . 1 318 129 130 ALA CA C 51.9190 . 1 319 129 130 ALA CB C 20.4040 . 1 320 129 130 ALA N N 119.6240 . 1 321 130 131 PHE H H 8.8470 . 1 322 130 131 PHE CA C 56.0220 . 1 323 130 131 PHE CB C 41.2080 . 1 324 130 131 PHE N N 117.3610 . 1 325 131 132 THR H H 10.3520 . 1 326 131 132 THR CA C 61.1610 . 1 327 131 132 THR CB C 71.9820 . 1 328 131 132 THR N N 118.8960 . 1 329 132 133 ILE H H 9.1160 . 1 330 132 133 ILE CA C 56.9090 . 1 331 132 133 ILE CB C 36.6260 . 1 332 132 133 ILE N N 124.6190 . 1 333 133 134 PRO CA C 62.0740 . 1 334 133 134 PRO CB C 31.5280 . 1 335 134 135 SER H H 8.0930 . 1 336 134 135 SER CA C 56.2730 . 1 337 134 135 SER CB C 64.5370 . 1 338 134 135 SER N N 111.7410 . 1 339 135 136 ILE H H 8.4600 . 1 340 135 136 ILE CA C 62.5740 . 1 341 135 136 ILE CB C 37.2450 . 1 342 135 136 ILE N N 123.4790 . 1 343 137 138 ASN CA C 54.4850 . 1 344 137 138 ASN CB C 37.8230 . 1 345 138 139 GLU H H 8.1010 . 1 346 138 139 GLU CA C 57.4290 . 1 347 138 139 GLU CB C 29.4980 . 1 348 138 139 GLU N N 118.4710 . 1 349 139 140 THR H H 7.6640 . 1 350 139 140 THR CA C 59.0510 . 1 351 139 140 THR CB C 69.3500 . 1 352 139 140 THR N N 113.4900 . 1 353 140 141 PRO CA C 63.0830 . 1 354 140 141 PRO CB C 31.4760 . 1 355 141 142 GLY H H 8.1170 . 1 356 141 142 GLY CA C 43.9920 . 1 357 141 142 GLY N N 109.0670 . 1 358 142 143 ILE H H 8.4180 . 1 359 142 143 ILE CA C 60.7860 . 1 360 142 143 ILE CB C 38.9190 . 1 361 142 143 ILE N N 122.7080 . 1 362 143 144 ARG H H 7.7890 . 1 363 143 144 ARG CA C 53.9010 . 1 364 143 144 ARG CB C 30.7630 . 1 365 143 144 ARG N N 125.7080 . 1 366 144 145 TYR H H 7.8840 . 1 367 144 145 TYR CA C 55.8080 . 1 368 144 145 TYR CB C 44.8740 . 1 369 144 145 TYR N N 119.7390 . 1 370 145 146 GLN H H 8.3610 . 1 371 145 146 GLN CA C 53.0780 . 1 372 145 146 GLN CB C 29.5540 . 1 373 145 146 GLN N N 111.9150 . 1 374 146 147 TYR H H 8.6070 . 1 375 146 147 TYR CA C 60.4320 . 1 376 146 147 TYR CB C 39.4780 . 1 377 146 147 TYR N N 119.4890 . 1 378 147 148 ASN H H 8.4520 . 1 379 147 148 ASN CA C 52.2870 . 1 380 147 148 ASN CB C 40.0350 . 1 381 147 148 ASN N N 112.0700 . 1 382 148 149 VAL H H 7.5160 . 1 383 148 149 VAL CA C 58.1190 . 1 384 148 149 VAL CB C 35.3610 . 1 385 148 149 VAL N N 114.6140 . 1 386 149 150 LEU H H 7.6390 . 1 387 149 150 LEU CA C 52.7170 . 1 388 149 150 LEU CB C 39.1410 . 1 389 149 150 LEU N N 117.2060 . 1 390 151 152 GLN CA C 57.4480 . 1 391 151 152 GLN CB C 28.8750 . 1 392 152 153 GLY H H 8.0060 . 1 393 152 153 GLY CA C 45.6030 . 1 394 152 153 GLY N N 108.3670 . 1 395 153 154 TRP H H 7.4060 . 1 396 153 154 TRP CA C 56.0460 . 1 397 153 154 TRP CB C 30.9350 . 1 398 153 154 TRP N N 121.0870 . 1 399 155 156 GLY H H 3.7830 . 1 400 155 156 GLY CA C 45.0850 . 1 401 155 156 GLY N N 99.6190 . 1 402 157 158 PRO CA C 65.5990 . 1 403 157 158 PRO CB C 30.0330 . 1 404 158 159 ALA H H 6.7440 . 1 405 158 159 ALA CA C 54.4550 . 1 406 158 159 ALA CB C 17.0260 . 1 407 158 159 ALA N N 119.9520 . 1 408 159 160 ILE H H 8.0730 . 1 409 159 160 ILE CA C 64.4230 . 1 410 159 160 ILE CB C 36.5340 . 1 411 159 160 ILE N N 120.2230 . 1 412 160 161 PHE H H 9.0110 . 1 413 160 161 PHE CA C 62.5530 . 1 414 160 161 PHE CB C 38.8620 . 1 415 160 161 PHE N N 125.7040 . 1 416 161 162 GLN H H 8.0760 . 1 417 161 162 GLN CA C 59.2560 . 1 418 161 162 GLN CB C 27.8600 . 1 419 161 162 GLN N N 118.7220 . 1 420 162 163 SER H H 8.1350 . 1 421 162 163 SER CA C 61.6260 . 1 422 162 163 SER CB C 62.5370 . 1 423 162 163 SER N N 115.9960 . 1 424 163 164 SER CA C 65.1260 . 1 425 170 171 PRO CA C 65.3290 . 1 426 170 171 PRO CB C 30.1040 . 1 427 171 172 PHE H H 6.7340 . 1 428 171 172 PHE CA C 60.9100 . 1 429 171 172 PHE CB C 38.4760 . 1 430 171 172 PHE N N 118.4880 . 1 431 172 173 ARG H H 8.5840 . 1 432 172 173 ARG CA C 59.1730 . 1 433 172 173 ARG CB C 29.3220 . 1 434 172 173 ARG N N 120.7170 . 1 435 173 174 LYS H H 7.9620 . 1 436 173 174 LYS CA C 58.3970 . 1 437 173 174 LYS CB C 31.4570 . 1 438 173 174 LYS N N 118.3100 . 1 439 174 175 GLN H H 6.9630 . 1 440 174 175 GLN CA C 55.9660 . 1 441 174 175 GLN CB C 29.0280 . 1 442 174 175 GLN N N 115.0160 . 1 443 175 176 ASN H H 7.1600 . 1 444 175 176 ASN CA C 51.2590 . 1 445 175 176 ASN CB C 39.5930 . 1 446 175 176 ASN N N 116.9180 . 1 447 185 186 ASP CA C 54.6770 . 1 448 185 186 ASP CB C 40.0620 . 1 449 186 187 ASP H H 8.0290 . 1 450 186 187 ASP CA C 53.6370 . 1 451 186 187 ASP CB C 44.0350 . 1 452 186 187 ASP N N 119.0530 . 1 453 187 188 LEU H H 9.0420 . 1 454 187 188 LEU CA C 53.3920 . 1 455 187 188 LEU CB C 44.0350 . 1 456 187 188 LEU N N 123.3100 . 1 457 188 189 TYR H H 9.3570 . 1 458 188 189 TYR CA C 57.4610 . 1 459 188 189 TYR CB C 39.5700 . 1 460 188 189 TYR N N 126.4390 . 1 461 189 190 VAL H H 8.9700 . 1 462 189 190 VAL CA C 60.5620 . 1 463 189 190 VAL CB C 32.5580 . 1 464 189 190 VAL N N 123.1580 . 1 465 190 191 GLY H H 9.7310 . 1 466 190 191 GLY CA C 43.8000 . 1 467 190 191 GLY N N 114.6410 . 1 468 191 192 SER H H 9.6930 . 1 469 191 192 SER CA C 58.5570 . 1 470 191 192 SER CB C 67.1510 . 1 471 191 192 SER N N 120.7180 . 1 472 192 193 ASP H H 9.1650 . 1 473 192 193 ASP CA C 53.4170 . 1 474 192 193 ASP CB C 40.5070 . 1 475 192 193 ASP N N 121.0370 . 1 476 193 194 LEU H H 8.0570 . 1 477 193 194 LEU CA C 54.0620 . 1 478 193 194 LEU CB C 42.5540 . 1 479 193 194 LEU N N 121.5760 . 1 480 194 195 GLU H H 8.3200 . 1 481 194 195 GLU CA C 56.4930 . 1 482 194 195 GLU CB C 28.6380 . 1 483 194 195 GLU N N 120.8860 . 1 484 195 196 ILE H H 8.5260 . 1 485 195 196 ILE CA C 63.2100 . 1 486 195 196 ILE CB C 37.1240 . 1 487 195 196 ILE N N 123.5910 . 1 488 196 197 GLY H H 8.6550 . 1 489 196 197 GLY CA C 46.9440 . 1 490 196 197 GLY N N 110.8490 . 1 491 197 198 GLN H H 7.4760 . 1 492 197 198 GLN CA C 58.0680 . 1 493 197 198 GLN CB C 28.5290 . 1 494 197 198 GLN N N 122.9270 . 1 495 198 199 HIS H H 8.9970 . 1 496 198 199 HIS CA C 60.5650 . 1 497 198 199 HIS CB C 30.3060 . 1 498 198 199 HIS N N 123.4510 . 1 499 199 200 ARG H H 8.6370 . 1 500 199 200 ARG CA C 59.8470 . 1 501 199 200 ARG CB C 28.9150 . 1 502 199 200 ARG N N 117.7040 . 1 503 200 201 THR H H 7.7330 . 1 504 200 201 THR CA C 66.3460 . 1 505 200 201 THR CB C 68.0580 . 1 506 200 201 THR N N 117.4380 . 1 507 201 202 LYS H H 7.7480 . 1 508 201 202 LYS CA C 56.9290 . 1 509 201 202 LYS CB C 29.3860 . 1 510 201 202 LYS N N 123.6620 . 1 511 202 203 ILE H H 8.0830 . 1 512 202 203 ILE CA C 61.7970 . 1 513 202 203 ILE CB C 33.5810 . 1 514 202 203 ILE N N 120.4340 . 1 515 203 204 GLU H H 7.8120 . 1 516 203 204 GLU CA C 58.6600 . 1 517 203 204 GLU CB C 27.5330 . 1 518 203 204 GLU N N 121.0740 . 1 519 204 205 GLU H H 8.1220 . 1 520 204 205 GLU CA C 59.3130 . 1 521 204 205 GLU CB C 28.6370 . 1 522 204 205 GLU N N 121.0870 . 1 523 205 206 LEU H H 8.3300 . 1 524 205 206 LEU CA C 57.3740 . 1 525 205 206 LEU CB C 39.0290 . 1 526 205 206 LEU N N 124.4380 . 1 527 206 207 ARG H H 8.8230 . 1 528 206 207 ARG CA C 60.3340 . 1 529 206 207 ARG CB C 29.0990 . 1 530 206 207 ARG N N 120.8230 . 1 531 207 208 GLN H H 8.3170 . 1 532 207 208 GLN CA C 58.3830 . 1 533 207 208 GLN CB C 27.1740 . 1 534 207 208 GLN N N 119.4550 . 1 535 208 209 HIS H H 8.1930 . 1 536 208 209 HIS CA C 60.2270 . 1 537 208 209 HIS CB C 30.5770 . 1 538 208 209 HIS N N 122.9830 . 1 539 209 210 LEU H H 8.4260 . 1 540 209 210 LEU CA C 58.0660 . 1 541 209 210 LEU CB C 39.5340 . 1 542 209 210 LEU N N 117.5510 . 1 543 210 211 LEU H H 8.0480 . 1 544 210 211 LEU CA C 57.5860 . 1 545 210 211 LEU CB C 41.0350 . 1 546 210 211 LEU N N 121.7810 . 1 stop_ save_