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DrReposER ID	PDB	Ligand	Organism	Macromolecule	Pfam	Res.	Interface	HETATM
2OC8_A_HU5A999	2oc8	HU5 DB08873 (Boceprevir)	Hepacivirus C	HEPATITIS C VIRUS	PF02907 (Peptidase_S29)	12	GLN A 41 HIS A 57 ARG A 123 ILE A 132 LEU A 135 GLY A 137 SER A 139 PHE A 154 ARG A 155 ALA A 156 ALA A 157 VAL A 158	HU5 A 999
3KEE_A_30BA500	3kee	30B DB06290 (Simeprevir)	Hepacivirus C	GENOME POLYPROTEIN	PF02907 (Peptidase_S29)	16	GLN A 41 PHE A 43 TYR A 56 HIS A 57 GLY A 58 ASP A 81 VAL A 132 LYS A 136 GLY A 137 SER A 139 PHE A 154 ARG A 155 ALA A 156 ALA A 157 CYS A 159 ASP A 168	30B A 500
3KEE_B_30BB500	3kee	30B DB06290 (Simeprevir)	Hepacivirus C	GENOME POLYPROTEIN	no annotation	15	GLN B 41 PHE B 43 TYR B 56 HIS B 57 GLY B 58 ASP B 81 VAL B 132 LEU B 135 LYS B 136 GLY B 137 SER B 139 PHE B 154 ARG B 155 ALA B 156 ALA B 157	30B B 500
3KEE_C_30BC500	3kee	30B DB06290 (Simeprevir)	Hepacivirus C	GENOME POLYPROTEIN	no annotation	16	GLN C 41 PHE C 43 TYR C 56 HIS C 57 GLY C 58 ASP C 81 VAL C 132 LEU C 135 LYS C 136 GLY C 137 SER C 139 PHE C 154 ARG C 155 ALA C 156 ALA C 157 ASP C 168	30B C 500
3KEE_D_30BD500	3kee	30B DB06290 (Simeprevir)	Hepacivirus C	GENOME POLYPROTEIN	no annotation	16	GLN D 41 PHE D 43 TYR D 56 HIS D 57 GLY D 58 ASP D 81 VAL D 132 LEU D 135 LYS D 136 GLY D 137 SER D 139 PHE D 154 ARG D 155 ALA D 156 ALA D 157 ASP D 168	30B D 500
3SUD_A_SUEA1201	3sud	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	PF02907 (Peptidase_S29)	16	GLN A1041 PHE A1043 TYR A1056 HIS A1057 GLY A1058 ASP A1081 ARG A1123 ILE A1132 LEU A1135 LYS A1136 GLY A1137 ALA A1139 PHE A1154 ALA A1156 ALA A1157 SER A1159	SUE A1201
3SUD_B_SUEB1201	3sud	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	13	GLN B1041 PHE B1043 TYR B1056 HIS B1057 GLY B1058 ASP B1081 ILE B1132 LYS B1136 GLY B1137 ALA B1139 PHE B1154 ALA B1156 SER B1159	SUE B1201
3SUD_C_SUEC1201	3sud	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	16	GLN C1041 PHE C1043 TYR C1056 HIS C1057 GLY C1058 ASP C1081 ARG C1123 ILE C1132 LEU C1135 LYS C1136 GLY C1137 ALA C1139 PHE C1154 ARG C1155 ALA C1156 ALA C1157	SUE C1201
3SUD_D_SUED1201	3sud	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	17	GLN D1041 PHE D1043 TYR D1056 HIS D1057 GLY D1058 VAL D1078 ASP D1081 LEU D1135 LYS D1136 GLY D1137 ALA D1139 PHE D1154 ARG D1155 ALA D1156 ALA D1157 SER D1159 ASP D1168	SUE D1201
3SUE_A_SUEA1201	3sue	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	PF02907 (Peptidase_S29)	16	GLN A1041 PHE A1043 TYR A1056 HIS A1057 GLY A1058 ASP A1081 ARG A1123 ILE A1132 LEU A1135 LYS A1136 GLY A1137 SER A1139 PHE A1154 LYS A1155 ALA A1156 ALA A1157	SUE A1201
3SUE_B_SUEB1201	3sue	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	15	GLN B1041 PHE B1043 TYR B1056 HIS B1057 GLY B1058 ASP B1081 ARG B1123 LEU B1135 LYS B1136 GLY B1137 SER B1139 PHE B1154 LYS B1155 ALA B1156 ALA B1157	SUE B1201
3SUE_C_SUEC1201	3sue	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	17	GLN C1041 PHE C1043 TYR C1056 HIS C1057 GLY C1058 VAL C1078 ASP C1081 ILE C1132 LEU C1135 LYS C1136 GLY C1137 SER C1139 PHE C1154 LYS C1155 ALA C1156 ALA C1157 ASP C1168	SUE C1201
3SUE_D_SUED1201	3sue	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	15	GLN D1041 PHE D1043 TYR D1056 HIS D1057 GLY D1058 ASP D1081 ARG D1123 LEU D1135 LYS D1136 GLY D1137 SER D1139 PHE D1154 LYS D1155 ALA D1156 SER D1159	SUE D1201
3SUF_A_SUEA1201	3suf	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	PF02907 (Peptidase_S29)	14	GLN A1041 PHE A1043 TYR A1056 HIS A1057 GLY A1058 ASP A1081 ARG A1123 LEU A1135 LYS A1136 GLY A1137 SER A1139 PHE A1154 ALA A1156 ALA A1157	SUE A1201
3SUF_B_SUEB1201	3suf	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	20	GLN B1041 PHE B1043 VAL B1055 TYR B1056 HIS B1057 GLY B1058 ASP B1081 SER C1128 ARG C1130 PRO C1131 ILE B1132 TYR C1134 LEU B1135 GLY B1137 SER B1139 PHE B1154 ARG B1155 ALA B1156 ALA B1157 VAL C1163	SUE B1201
3SUF_C_SUEC1201	3suf	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	13	GLN C1041 PHE C1043 TYR C1056 HIS C1057 GLY C1058 VAL D1078 ASP D1079 ASP C1081 GLY C1137 SER C1139 PHE C1154 ALA C1156 ALA C1157	SUE C1201
3SUF_D_SUED1201	3suf	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	no annotation	18	GLN D1041 PHE D1043 VAL D1055 TYR D1056 HIS D1057 GLY D1058 VAL D1078 ASP C1079 ASP D1081 ILE D1132 LYS D1136 GLY D1137 SER D1139 PHE D1154 ARG D1155 ALA D1156 ALA D1157 CYS D1159	SUE D1201
3SUG_A_SUEA1201	3sug	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE, NS4A PROTEIN	PF02907 (Peptidase_S29)	17	GLN A1041 PHE A1043 TYR A1056 HIS A1057 GLY A1058 VAL A1078 ASP A1081 ARG A1123 LEU A1135 LYS A1136 GLY A1137 ALA A1139 PHE A1154 ARG A1155 THR A1156 ALA A1157 ASP A1168	SUE A1201
6C2M_A_SUEA1202	6c2m	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE	PF02907 (Peptidase_S29)	21	GLN A1041 PHE A1043 VAL A1055 HIS A1056 HIS A1057 GLY A1058 VAL A1078 ASP A1081 ARG A1123 ILE A1132 LEU A1135 LYS A1136 GLY A1137 SER A1139 PHE A1154 ARG A1155 ALA A1156 ALA A1157 VAL A1158 SER A1159 ASP A1168	SUE A1202
6C2M_B_SUEB1202	6c2m	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE	None	21	GLN B1041 PHE B1043 VAL B1055 HIS B1056 HIS B1057 GLY B1058 VAL B1078 ASP B1081 ARG B1123 ILE B1132 LEU B1135 LYS B1136 GLY B1137 SER B1139 PHE B1154 ARG B1155 ALA B1156 ALA B1157 VAL B1158 SER B1159 ASP B1168	SUE B1202
6C2M_C_SUEC1203	6c2m	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE	None	21	GLN C1041 PHE C1043 VAL C1055 HIS C1056 HIS C1057 GLY C1058 VAL C1078 ASP C1081 ARG C1123 ILE C1132 LEU C1135 LYS C1136 GLY C1137 SER C1139 PHE C1154 ARG C1155 ALA C1156 ALA C1157 VAL C1158 SER C1159 ASP C1168	SUE C1203
6C2M_D_SUED1202	6c2m	SUE DB11575 (Grazoprevir)	Hepacivirus C	NS3 PROTEASE	None	21	GLN D1041 PHE D1043 VAL D1055 HIS D1056 HIS D1057 GLY D1058 VAL D1078 ASP D1081 ARG D1123 ILE D1132 LEU D1135 LYS D1136 GLY D1137 SER D1139 PHE D1154 ARG D1155 ALA D1156 ALA D1157 VAL D1158 SER D1159 ASP D1168	SUE D1202

[["2OC8_A_HU5A999","2oc8","HU5","DB08873(Boceprevir)","Hepacivirus C","HEPATITIS C VIRUS","PF02907(Peptidase_S29)",12,"GLN A  41;HIS A  57;ARG A 123;ILE A 132;LEU A 135;GLY A 137;SER A 139;PHE A 154;ARG A 155;ALA A 156;ALA A 157;VAL A 158","HU5 A 999\r"],["3KEE_A_30BA500","3kee","30B","DB06290(Simeprevir)","Hepacivirus C","GENOME POLYPROTEIN","PF02907(Peptidase_S29)",16,"GLN A  41;PHE A  43;TYR A  56;HIS A  57;GLY A  58;ASP A  81;VAL A 132;LYS A 136;GLY A 137;SER A 139;PHE A 154;ARG A 155;ALA A 156;ALA A 157;CYS A 159;ASP A 168","30B A 500\r"],["3KEE_B_30BB500","3kee","30B","DB06290(Simeprevir)","Hepacivirus C","GENOME POLYPROTEIN","no annotation",15,"GLN B  41;PHE B  43;TYR B  56;HIS B  57;GLY B  58;ASP B  81;VAL B 132;LEU B 135;LYS B 136;GLY B 137;SER B 139;PHE B 154;ARG B 155;ALA B 156;ALA B 157","30B B 500\r"],["3KEE_C_30BC500","3kee","30B","DB06290(Simeprevir)","Hepacivirus C","GENOME POLYPROTEIN","no annotation",16,"GLN C  41;PHE C  43;TYR C  56;HIS C  57;GLY C  58;ASP C  81;VAL C 132;LEU C 135;LYS C 136;GLY C 137;SER C 139;PHE C 154;ARG C 155;ALA C 156;ALA C 157;ASP C 168","30B C 500\r"],["3KEE_D_30BD500","3kee","30B","DB06290(Simeprevir)","Hepacivirus C","GENOME POLYPROTEIN","no annotation",16,"GLN D  41;PHE D  43;TYR D  56;HIS D  57;GLY D  58;ASP D  81;VAL D 132;LEU D 135;LYS D 136;GLY D 137;SER D 139;PHE D 154;ARG D 155;ALA D 156;ALA D 157;ASP D 168","30B D 500\r"],["3SUD_A_SUEA1201","3sud","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","PF02907(Peptidase_S29)",16,"GLN A1041;PHE A1043;TYR A1056;HIS A1057;GLY A1058;ASP A1081;ARG A1123;ILE A1132;LEU A1135;LYS A1136;GLY A1137;ALA A1139;PHE A1154;ALA A1156;ALA A1157;SER A1159","SUE A1201\r"],["3SUD_B_SUEB1201","3sud","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",13,"GLN B1041;PHE B1043;TYR B1056;HIS B1057;GLY B1058;ASP B1081;ILE B1132;LYS B1136;GLY B1137;ALA B1139;PHE B1154;ALA B1156;SER B1159","SUE B1201\r"],["3SUD_C_SUEC1201","3sud","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",16,"GLN C1041;PHE C1043;TYR C1056;HIS C1057;GLY C1058;ASP C1081;ARG C1123;ILE C1132;LEU C1135;LYS C1136;GLY C1137;ALA C1139;PHE C1154;ARG C1155;ALA C1156;ALA C1157","SUE C1201\r"],["3SUD_D_SUED1201","3sud","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",17,"GLN D1041;PHE D1043;TYR D1056;HIS D1057;GLY D1058;VAL D1078;ASP D1081;LEU D1135;LYS D1136;GLY D1137;ALA D1139;PHE D1154;ARG D1155;ALA D1156;ALA D1157;SER D1159;ASP D1168","SUE D1201\r"],["3SUE_A_SUEA1201","3sue","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","PF02907(Peptidase_S29)",16,"GLN A1041;PHE A1043;TYR A1056;HIS A1057;GLY A1058;ASP A1081;ARG A1123;ILE A1132;LEU A1135;LYS A1136;GLY A1137;SER A1139;PHE A1154;LYS A1155;ALA A1156;ALA A1157","SUE A1201\r"],["3SUE_B_SUEB1201","3sue","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",15,"GLN B1041;PHE B1043;TYR B1056;HIS B1057;GLY B1058;ASP B1081;ARG B1123;LEU B1135;LYS B1136;GLY B1137;SER B1139;PHE B1154;LYS B1155;ALA B1156;ALA B1157","SUE B1201\r"],["3SUE_C_SUEC1201","3sue","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",17,"GLN C1041;PHE C1043;TYR C1056;HIS C1057;GLY C1058;VAL C1078;ASP C1081;ILE C1132;LEU C1135;LYS C1136;GLY C1137;SER C1139;PHE C1154;LYS C1155;ALA C1156;ALA C1157;ASP C1168","SUE C1201\r"],["3SUE_D_SUED1201","3sue","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",15,"GLN D1041;PHE D1043;TYR D1056;HIS D1057;GLY D1058;ASP D1081;ARG D1123;LEU D1135;LYS D1136;GLY D1137;SER D1139;PHE D1154;LYS D1155;ALA D1156;SER D1159","SUE D1201\r"],["3SUF_A_SUEA1201","3suf","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","PF02907(Peptidase_S29)",14,"GLN A1041;PHE A1043;TYR A1056;HIS A1057;GLY A1058;ASP A1081;ARG A1123;LEU A1135;LYS A1136;GLY A1137;SER A1139;PHE A1154;ALA A1156;ALA A1157","SUE A1201\r"],["3SUF_B_SUEB1201","3suf","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",20,"GLN B1041;PHE B1043;VAL B1055;TYR B1056;HIS B1057;GLY B1058;ASP B1081;SER C1128;ARG C1130;PRO C1131;ILE B1132;TYR C1134;LEU B1135;GLY B1137;SER B1139;PHE B1154;ARG B1155;ALA B1156;ALA B1157;VAL C1163","SUE B1201\r"],["3SUF_C_SUEC1201","3suf","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",13,"GLN C1041;PHE C1043;TYR C1056;HIS C1057;GLY C1058;VAL D1078;ASP D1079;ASP C1081;GLY C1137;SER C1139;PHE C1154;ALA C1156;ALA C1157","SUE C1201\r"],["3SUF_D_SUED1201","3suf","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","no annotation",18,"GLN D1041;PHE D1043;VAL D1055;TYR D1056;HIS D1057;GLY D1058;VAL D1078;ASP C1079;ASP D1081;ILE D1132;LYS D1136;GLY D1137;SER D1139;PHE D1154;ARG D1155;ALA D1156;ALA D1157;CYS D1159","SUE D1201\r"],["3SUG_A_SUEA1201","3sug","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE, NS4A PROTEIN","PF02907(Peptidase_S29)",17,"GLN A1041;PHE A1043;TYR A1056;HIS A1057;GLY A1058;VAL A1078;ASP A1081;ARG A1123;LEU A1135;LYS A1136;GLY A1137;ALA A1139;PHE A1154;ARG A1155;THR A1156;ALA A1157;ASP A1168","SUE A1201\r"],["6C2M_A_SUEA1202","6c2m","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE","PF02907(Peptidase_S29)",21,"GLN A1041;PHE A1043;VAL A1055;HIS A1056;HIS A1057;GLY A1058;VAL A1078;ASP A1081;ARG A1123;ILE A1132;LEU A1135;LYS A1136;GLY A1137;SER A1139;PHE A1154;ARG A1155;ALA A1156;ALA A1157;VAL A1158;SER A1159;ASP A1168","SUE A1202\r"],["6C2M_B_SUEB1202","6c2m","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE","None",21,"GLN B1041;PHE B1043;VAL B1055;HIS B1056;HIS B1057;GLY B1058;VAL B1078;ASP B1081;ARG B1123;ILE B1132;LEU B1135;LYS B1136;GLY B1137;SER B1139;PHE B1154;ARG B1155;ALA B1156;ALA B1157;VAL B1158;SER B1159;ASP B1168","SUE B1202\r"],["6C2M_C_SUEC1203","6c2m","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE","None",21,"GLN C1041;PHE C1043;VAL C1055;HIS C1056;HIS C1057;GLY C1058;VAL C1078;ASP C1081;ARG C1123;ILE C1132;LEU C1135;LYS C1136;GLY C1137;SER C1139;PHE C1154;ARG C1155;ALA C1156;ALA C1157;VAL C1158;SER C1159;ASP C1168","SUE C1203\r"],["6C2M_D_SUED1202","6c2m","SUE","DB11575(Grazoprevir)","Hepacivirus C","NS3 PROTEASE","None",21,"GLN D1041;PHE D1043;VAL D1055;HIS D1056;HIS D1057;GLY D1058;VAL D1078;ASP D1081;ARG D1123;ILE D1132;LEU D1135;LYS D1136;GLY D1137;SER D1139;PHE D1154;ARG D1155;ALA D1156;ALA D1157;VAL D1158;SER D1159;ASP D1168","SUE D1202\r"]]