NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | other_prop |
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604898 |
5kk3   |
30121 | cing | 3-converted-DOCR | DYANA/DIANA | distance | general distance | ambi | LOWER_ONLY=true |
28 LYS NZ 42 ALA C 1.80 15 GLN CG 16 LYS CD 1.80 15 GLN C 16 LYS CA 1.80 15 GLN CA 16 LYS CD 1.80 15 GLN C 16 LYS CD 1.80 16 LYS C 17 LEU CA 1.80 16 LYS CD 17 LEU CA 1.80 16 LYS C 17 LEU CD1 1.80 16 LYS C 17 LEU CB 1.80 16 LYS CD 17 LEU CD2 1.80 16 LYS C 17 LEU CD2 1.80 16 LYS C 17 LEU CG 1.80 16 LYS CG 17 LEU N 1.80 16 LYS C 17 LEU N 1.80 16 LYS C 17 LEU C 1.80 16 LYS CB 17 LEU CD2 1.80 17 LEU CG 18 VAL CA 1.80 17 LEU CD2 18 VAL CA 1.80 17 LEU CA 18 VAL C 1.80 17 LEU CB 18 VAL CA 1.80 17 LEU CD1 18 VAL CA 1.80 17 LEU CG 18 VAL CB 1.80 17 LEU CA 18 VAL N 1.80 17 LEU CD1 18 VAL CB 1.80 17 LEU CA 18 VAL CA 1.80 17 LEU CD1 18 VAL C 1.80 17 LEU CA 18 VAL CG1 1.80 17 LEU CB 18 VAL CG1 1.80 17 LEU CD1 18 VAL N 1.80 18 VAL CB 19 PHE CD1 1.80 18 VAL CG1 19 PHE N 1.80 18 VAL CA 19 PHE C 1.80 19 PHE CA 20 PHE CG 1.80 19 PHE CG 20 PHE CA 1.80 19 PHE CE1 20 PHE CB 1.80 19 PHE CA 20 PHE CA 1.80 19 PHE CG 20 PHE CG 1.80 19 PHE CD1 20 PHE CA 1.80 19 PHE C 20 PHE CA 1.80 19 PHE CA 20 PHE N 1.80 19 PHE CB 20 PHE N 1.80 19 PHE CB 20 PHE CA 1.80 20 PHE CA 21 ALA CA 1.80 20 PHE CA 21 ALA N 1.80 20 PHE C 21 ALA CA 1.80 20 PHE CA 21 ALA C 1.80 20 PHE CA 21 ALA CB 1.80 21 ALA CA 22 GLU CB 1.80 21 ALA CB 22 GLU N 1.80 21 ALA CB 22 GLU CB 1.80 21 ALA CB 22 GLU C 1.80 21 ALA C 22 GLU CD 1.80 21 ALA C 22 GLU CA 1.80 21 ALA C 22 GLU CB 1.80 21 ALA CA 22 GLU CD 1.80 22 GLU CG 23 ASP CG 1.80 22 GLU CA 23 ASP CA 1.80 22 GLU CA 23 ASP CG 1.80 22 GLU CA 23 ASP C 1.80 22 GLU CB 23 ASP CA 1.80 22 GLU CB 23 ASP C 1.80 22 GLU CG 23 ASP C 1.80 22 GLU C 23 ASP CA 1.80 22 GLU CB 23 ASP CB 1.80 22 GLU C 23 ASP CG 1.80 22 GLU CA 23 ASP N 1.80 22 GLU CB 23 ASP N 1.80 23 ASP CB 24 VAL CG2 1.80 23 ASP N 24 VAL CB 1.80 23 ASP CA 24 VAL CA 1.80 23 ASP CA 24 VAL C 1.80 23 ASP CB 24 VAL C 1.80 23 ASP CG 24 VAL CA 1.80 23 ASP C 24 VAL CG2 1.80 23 ASP CB 24 VAL CA 1.80 23 ASP N 24 VAL CG2 1.80 23 ASP C 24 VAL CA 1.80 23 ASP C 24 VAL CB 1.80 24 VAL CA 25 GLY CA 1.80 24 VAL C 25 GLY CA 1.80 24 VAL CG1 25 GLY CA 1.80 24 VAL C 25 GLY N 1.80 24 VAL C 25 GLY C 1.80 24 VAL CB 25 GLY CA 1.80 25 GLY CA 26 SER CA 1.80 25 GLY CA 26 SER CB 1.80 25 GLY C 26 SER CA 1.80 25 GLY C 26 SER CB 1.80 26 SER CB 27 ASN CA 1.80 26 SER C 27 ASN CA 1.80 26 SER CB 27 ASN CB 1.80 26 SER CA 27 ASN CA 1.80 26 SER CA 27 ASN CB 1.80 26 SER CA 27 ASN C 1.80 26 SER CB 27 ASN N 1.80 26 SER CB 27 ASN C 1.80 26 SER C 27 ASN CB 1.80 27 ASN CA 28 LYS CA 1.80 27 ASN CA 28 LYS CB 1.80 27 ASN CA 28 LYS CD 1.80 27 ASN CA 28 LYS CG 1.80 27 ASN C 28 LYS CB 1.80 27 ASN C 28 LYS CD 1.80 27 ASN CB 28 LYS CB 1.80 27 ASN C 28 LYS CG 1.80 27 ASN N 28 LYS CA 1.80 27 ASN CA 28 LYS C 1.80 27 ASN CB 28 LYS CA 1.80 27 ASN CB 28 LYS C 1.80 27 ASN C 28 LYS CA 1.80 28 LYS CB 29 GLY CA 1.80 28 LYS CD 29 GLY CA 1.80 28 LYS CE 29 GLY CA 1.80 28 LYS CG 29 GLY CA 1.80 28 LYS CA 29 GLY CA 1.80 28 LYS C 29 GLY CA 1.80 28 LYS CA 29 GLY C 1.80 28 LYS CB 29 GLY C 1.80 28 LYS CD 29 GLY C 1.80 28 LYS CE 29 GLY C 1.80 28 LYS CG 29 GLY C 1.80 28 LYS CA 29 GLY N 1.80 28 LYS C 29 GLY C 1.80 29 GLY CA 30 ALA CA 1.80 29 GLY C 30 ALA CA 1.80 29 GLY CA 30 ALA CB 1.80 29 GLY C 30 ALA CB 1.80 29 GLY C 30 ALA C 1.80 29 GLY N 30 ALA CA 1.80 29 GLY CA 30 ALA N 1.80 30 ALA CA 31 ILE CA 1.80 30 ALA CB 31 ILE CB 1.80 30 ALA CA 31 ILE CB 1.80 30 ALA CA 31 ILE CD1 1.80 30 ALA C 31 ILE CD1 1.80 30 ALA CA 31 ILE CG1 1.80 30 ALA C 31 ILE CG1 1.80 30 ALA CA 31 ILE CG2 1.80 30 ALA C 31 ILE CG2 1.80 30 ALA C 31 ILE CA 1.80 30 ALA C 31 ILE CB 1.80 30 ALA CA 31 ILE C 1.80 30 ALA CA 31 ILE N 1.80 30 ALA CB 31 ILE N 1.80 30 ALA C 31 ILE N 1.80 30 ALA C 31 ILE C 1.80 30 ALA CB 31 ILE C 1.80 31 ILE CB 32 ILE CB 1.80 31 ILE C 32 ILE CB 1.80 31 ILE C 32 ILE CD1 1.80 31 ILE C 32 ILE CG1 1.80 31 ILE CG1 32 ILE C 1.80 31 ILE C 32 ILE CA 1.80 31 ILE N 32 ILE C 1.80 31 ILE CB 32 ILE N 1.80 31 ILE CA 32 ILE N 1.80 32 ILE CG2 33 GLY CA 1.80 32 ILE C 33 GLY CA 1.80 32 ILE CA 33 GLY CA 1.80 32 ILE CD1 33 GLY CA 1.80 32 ILE CB 33 GLY CA 1.80 32 ILE CG1 33 GLY CA 1.80 32 ILE CA 33 GLY N 1.80 32 ILE CA 33 GLY C 1.80 32 ILE CB 33 GLY C 1.80 32 ILE CG2 33 GLY N 1.80 33 GLY CA 34 LEU CA 1.80 33 GLY CA 34 LEU CB 1.80 33 GLY CA 34 LEU CD1 1.80 33 GLY CA 34 LEU CD2 1.80 33 GLY CA 34 LEU CG 1.80 33 GLY CA 34 LEU C 1.80 33 GLY C 34 LEU CA 1.80 33 GLY C 34 LEU C 1.80 33 GLY C 34 LEU CB 1.80 33 GLY C 34 LEU CD2 1.80 33 GLY C 34 LEU CG 1.80 33 GLY N 34 LEU CG 1.80 34 LEU CG 35 MET CB 1.80 34 LEU CA 35 MET CA 1.80 34 LEU C 35 MET CA 1.80 34 LEU CA 35 MET CB 1.80 34 LEU CB 35 MET CB 1.80 34 LEU C 35 MET CB 1.80 34 LEU CB 35 MET CE 1.80 34 LEU CA 35 MET CG 1.80 34 LEU C 35 MET CG 1.80 34 LEU CD1 35 MET CA 1.80 34 LEU CD2 35 MET CB 1.80 34 LEU CD1 35 MET CB 1.80 34 LEU CD2 35 MET CA 1.80 34 LEU CG 35 MET CA 1.80 34 LEU CG 35 MET CG 1.80 34 LEU CG 35 MET CE 1.80 34 LEU N 35 MET CA 1.80 34 LEU N 35 MET CG 1.80 34 LEU N 35 MET C 1.80 34 LEU CB 35 MET N 1.80 34 LEU C 35 MET C 1.80 34 LEU CA 35 MET C 1.80 34 LEU CB 35 MET CA 1.80 34 LEU CB 35 MET C 1.80 35 MET CG 36 VAL CA 1.80 35 MET CA 36 VAL CG1 1.80 35 MET CA 36 VAL CA 1.80 35 MET CB 36 VAL CA 1.80 35 MET CG 36 VAL CB 1.80 35 MET CB 36 VAL CG1 1.80 35 MET CG 36 VAL CG1 1.80 35 MET CB 36 VAL CG2 1.80 35 MET C 36 VAL CA 1.80 35 MET CA 36 VAL CG2 1.80 35 MET N 36 VAL CG2 1.80 35 MET CG 36 VAL C 1.80 35 MET C 36 VAL CG1 1.80 35 MET CG 36 VAL CG2 1.80 35 MET C 36 VAL CG2 1.80 36 VAL CB 37 GLY CA 1.80 36 VAL C 37 GLY CA 1.80 36 VAL CG2 37 GLY C 1.80 36 VAL CB 37 GLY C 1.80 36 VAL CG1 37 GLY C 1.80 36 VAL CA 37 GLY N 1.80 36 VAL CG2 37 GLY N 1.80 36 VAL C 37 GLY C 1.80 36 VAL CG1 37 GLY CA 1.80 36 VAL CA 37 GLY CA 1.80 37 GLY CA 38 GLY CA 1.80 40 VAL CG2 41 ILE CB 1.80 40 VAL CA 41 ILE CB 1.80 40 VAL CA 41 ILE CG1 1.80 40 VAL CA 41 ILE CA 1.80 40 VAL CB 41 ILE CB 1.80 40 VAL CB 41 ILE CG1 1.80 40 VAL CB 41 ILE CD1 1.80 40 VAL CG2 41 ILE CD1 1.80 40 VAL CG2 41 ILE CG1 1.80 40 VAL C 41 ILE CB 1.80 40 VAL CA 41 ILE CD1 1.80 40 VAL CA 41 ILE CG2 1.80 40 VAL CB 41 ILE CG2 1.80 40 VAL CG2 41 ILE CG2 1.80 40 VAL N 41 ILE CA 1.80 40 VAL N 41 ILE CB 1.80 40 VAL N 41 ILE CD1 1.80 40 VAL CA 41 ILE N 1.80 40 VAL C 41 ILE N 1.80 40 VAL CG2 41 ILE CA 1.80 40 VAL CG2 41 ILE N 1.80 40 VAL CB 41 ILE C 1.80 41 ILE CG1 42 ALA CA 1.80 41 ILE CA 42 ALA CA 1.80 41 ILE CB 42 ALA CA 1.80 41 ILE CD1 42 ALA CA 1.80 41 ILE CG2 42 ALA CA 1.80 41 ILE CG2 42 ALA C 1.80 41 ILE C 42 ALA C 1.80 41 ILE CB 42 ALA CB 1.80 41 ILE N 42 ALA CA 1.80 41 ILE CA 42 ALA N 1.80 41 ILE CA 42 ALA CB 1.80 41 ILE CA 42 ALA C 1.80 41 ILE CB 42 ALA C 1.80 41 ILE CG2 42 ALA N 1.80 41 ILE C 42 ALA CA 1.80 16 LYS CB 18 VAL N 1.80 16 LYS C 18 VAL N 1.80 16 LYS CA 18 VAL C 1.80 17 LEU CD1 19 PHE CA 1.80 17 LEU CD1 19 PHE CB 1.80 17 LEU CD1 19 PHE N 1.80 17 LEU CG 19 PHE CA 1.80 18 VAL CB 20 PHE CA 1.80 18 VAL CA 21 ALA CB 1.80 18 VAL C 20 PHE CA 1.80 20 PHE CA 24 VAL CG2 1.80 20 PHE CE1 24 VAL CG2 1.80 20 PHE CZ 24 VAL CG2 1.80 20 PHE CD1 24 VAL CG2 1.80 20 PHE CB 22 GLU CA 1.80 20 PHE CA 24 VAL CB 1.80 20 PHE CD1 22 GLU CA 1.80 20 PHE CA 22 GLU N 1.80 21 ALA CA 24 VAL CG2 1.80 22 GLU CA 24 VAL CG1 1.80 22 GLU CA 24 VAL CA 1.80 23 ASP N 25 GLY CA 1.80 24 VAL CA 26 SER CB 1.80 24 VAL C 27 ASN CA 1.80 24 VAL CB 26 SER CB 1.80 24 VAL CG2 27 ASN CB 1.80 24 VAL CA 26 SER CA 1.80 24 VAL CB 28 LYS N 1.80 24 VAL CB 26 SER C 1.80 24 VAL CG1 26 SER N 1.80 26 SER CB 28 LYS CB 1.80 26 SER CB 28 LYS CA 1.80 26 SER C 29 GLY CA 1.80 26 SER N 28 LYS CB 1.80 26 SER CA 29 GLY N 1.80 27 ASN CA 29 GLY CA 1.80 27 ASN CB 29 GLY CA 1.80 27 ASN CA 30 ALA CA 1.80 27 ASN CA 29 GLY N 1.80 27 ASN CA 30 ALA N 1.80 27 ASN C 29 GLY CA 1.80 28 LYS CB 30 ALA CA 1.80 28 LYS CA 30 ALA CA 1.80 28 LYS CE 30 ALA N 1.80 29 GLY C 31 ILE CG2 1.80 29 GLY CA 31 ILE CB 1.80 29 GLY C 31 ILE CG1 1.80 29 GLY C 31 ILE CB 1.80 29 GLY CA 31 ILE CG1 1.80 29 GLY CA 31 ILE CA 1.80 30 ALA CA 32 ILE CB 1.80 30 ALA N 32 ILE CG2 1.80 30 ALA N 33 GLY CA 1.80 31 ILE CG2 33 GLY CA 1.80 31 ILE N 33 GLY C 1.80 32 ILE CG2 34 LEU CA 1.80 32 ILE CG2 34 LEU CD2 1.80 32 ILE CG2 34 LEU C 1.80 32 ILE N 34 LEU CA 1.80 32 ILE CA 34 LEU N 1.80 32 ILE CD1 34 LEU N 1.80 32 ILE CG1 34 LEU N 1.80 32 ILE CG2 34 LEU N 1.80 32 ILE C 34 LEU N 1.80 32 ILE CD1 35 MET N 1.80 33 GLY CA 36 VAL CG1 1.80 33 GLY CA 35 MET CG 1.80 33 GLY CA 35 MET CB 1.80 33 GLY CA 36 VAL CB 1.80 33 GLY C 36 VAL CG1 1.80 33 GLY CA 36 VAL CG2 1.80 33 GLY CA 35 MET C 1.80 33 GLY N 35 MET CB 1.80 33 GLY CA 35 MET N 1.80 33 GLY C 36 VAL CA 1.80 33 GLY C 36 VAL CG2 1.80 33 GLY CA 36 VAL CA 1.80 34 LEU CA 36 VAL CG1 1.80 34 LEU C 36 VAL CG1 1.80 34 LEU N 36 VAL CG1 1.80 34 LEU N 36 VAL CG2 1.80 34 LEU C 36 VAL CA 1.80 34 LEU C 36 VAL CB 1.80 35 MET CB 37 GLY CA 1.80 35 MET CG 37 GLY CA 1.80 36 VAL CG1 39 VAL CB 1.80 37 GLY N 39 VAL CB 1.80 37 GLY N 39 VAL CG1 1.80 37 GLY CA 39 VAL CB 1.80 39 VAL CB 41 ILE CB 1.80 40 VAL C 42 ALA C 1.80 40 VAL C 42 ALA CB 1.80 40 VAL CG2 42 ALA CA 1.80 17 LEU CD1 32 ILE CD1 1.80 17 LEU CA 34 LEU CG 1.80 17 LEU CD1 34 LEU CB 1.80 17 LEU CD1 34 LEU CG 1.80 17 LEU CG 32 ILE CA 1.80 17 LEU CD2 32 ILE CD1 1.80 17 LEU CG 34 LEU CB 1.80 17 LEU CG 34 LEU CG 1.80 17 LEU CB 34 LEU N 1.80 17 LEU CD1 32 ILE CA 1.80 18 VAL N 34 LEU CD2 1.80 18 VAL CB 32 ILE CG1 1.80 19 PHE CD1 30 ALA CA 1.80 19 PHE CE1 30 ALA CA 1.80 19 PHE CZ 30 ALA CA 1.80 19 PHE CZ 30 ALA CB 1.80 19 PHE CZ 31 ILE CA 1.80 19 PHE CZ 31 ILE CB 1.80 19 PHE CZ 32 ILE CB 1.80 19 PHE CD1 32 ILE CD1 1.80 19 PHE CE1 32 ILE CD1 1.80 19 PHE CZ 32 ILE CD1 1.80 19 PHE CD1 32 ILE CG1 1.80 19 PHE CE1 32 ILE CG1 1.80 19 PHE CZ 32 ILE CG1 1.80 19 PHE CD1 32 ILE CG2 1.80 19 PHE CE1 32 ILE CG2 1.80 19 PHE CZ 32 ILE CG2 1.80 19 PHE CB 30 ALA CA 1.80 19 PHE CD1 30 ALA CB 1.80 19 PHE CE1 30 ALA CB 1.80 19 PHE CE1 31 ILE CB 1.80 19 PHE CD1 32 ILE CA 1.80 19 PHE CE1 32 ILE CA 1.80 19 PHE CZ 32 ILE CA 1.80 19 PHE CD1 32 ILE CB 1.80 19 PHE CE1 32 ILE CB 1.80 19 PHE CB 31 ILE C 1.80 19 PHE CD1 31 ILE CB 1.80 19 PHE CE1 31 ILE CG2 1.80 19 PHE CZ 27 ASN CB 1.80 19 PHE N 32 ILE C 1.80 19 PHE CZ 30 ALA N 1.80 19 PHE CB 32 ILE N 1.80 19 PHE CD1 32 ILE N 1.80 19 PHE CG 32 ILE CB 1.80 20 PHE CZ 27 ASN CA 1.80 20 PHE CZ 27 ASN CB 1.80 20 PHE CZ 30 ALA CB 1.80 20 PHE CA 25 GLY N 1.80 20 PHE C 25 GLY N 1.80 24 VAL CG2 30 ALA N 1.80 27 ASN C 42 ALA N 1.80 28 LYS CG 41 ILE CB 1.80 28 LYS CB 41 ILE CD1 1.80 28 LYS CD 41 ILE CG2 1.80 28 LYS CG 41 ILE CG2 1.80 28 LYS CA 41 ILE CB 1.80 28 LYS CD 41 ILE CB 1.80 28 LYS CE 41 ILE CB 1.80 28 LYS CG 41 ILE CA 1.80 28 LYS CA 41 ILE CD1 1.80 28 LYS CG 41 ILE CD1 1.80 28 LYS CA 41 ILE CG2 1.80 28 LYS CB 41 ILE CG2 1.80 28 LYS CE 41 ILE CG2 1.80 28 LYS CB 41 ILE CB 1.80 28 LYS CD 41 ILE CA 1.80 28 LYS CE 41 ILE CA 1.80 28 LYS CE 41 ILE C 1.80 28 LYS CD 41 ILE CD1 1.80 28 LYS CE 41 ILE CD1 1.80 28 LYS CD 41 ILE CG1 1.80 28 LYS CB 41 ILE N 1.80 28 LYS CB 42 ALA C 1.80 28 LYS CG 41 ILE C 1.80 28 LYS NZ 42 ALA C 1.80 29 GLY CA 41 ILE CA 1.80 29 GLY CA 41 ILE CB 1.80 29 GLY CA 41 ILE CD1 1.80 29 GLY C 41 ILE CD1 1.80 29 GLY CA 41 ILE CG1 1.80 29 GLY C 41 ILE CG1 1.80 29 GLY CA 41 ILE CG2 1.80 29 GLY C 41 ILE CG2 1.80 29 GLY C 41 ILE CA 1.80 29 GLY C 41 ILE CB 1.80 29 GLY CA 42 ALA CB 1.80 29 GLY CA 41 ILE N 1.80 29 GLY CA 42 ALA CA 1.80 30 ALA N 40 VAL CG1 1.80 31 ILE CB 36 VAL CB 1.80 31 ILE CD1 36 VAL CG2 1.80 31 ILE CG2 36 VAL CG2 1.80 31 ILE CD1 36 VAL CB 1.80 31 ILE CD1 36 VAL CG1 1.80 31 ILE CA 36 VAL CG1 1.80 31 ILE CB 36 VAL CG1 1.80 31 ILE CG1 36 VAL CG1 1.80 31 ILE CA 36 VAL CG2 1.80 31 ILE CB 39 VAL CG1 1.80 31 ILE N 40 VAL CG1 1.80 31 ILE CG2 36 VAL CB 1.80 15 GLN CA 135 MET CE 1.80 15 GLN CB 135 MET CE 1.80 15 GLN CG 135 MET CE 1.80 15 GLN CG 135 MET CB 1.80 15 GLN C 135 MET CB 1.80 15 GLN C 135 MET CG 1.80 15 GLN CD 136 VAL CB 1.80 15 GLN CD 135 MET CE 1.80 15 GLN C 135 MET CE 1.80 15 GLN CD 135 MET N 1.80 16 LYS CD 135 MET CE 1.80 16 LYS C 135 MET CE 1.80 17 LEU CD2 135 MET CG 1.80 17 LEU CG 135 MET CB 1.80 17 LEU CB 135 MET CB 1.80 17 LEU CB 135 MET CE 1.80 17 LEU CD2 135 MET CE 1.80 17 LEU CG 135 MET CE 1.80 17 LEU CB 135 MET CG 1.80 17 LEU CD1 135 MET CE 1.80 17 LEU CD1 135 MET CB 1.80 17 LEU CD1 135 MET CG 1.80 17 LEU CD2 135 MET CB 1.80 17 LEU CA 135 MET CE 1.80 17 LEU C 135 MET CE 1.80 17 LEU N 135 MET CE 1.80 17 LEU CB 135 MET CA 1.80 115 GLN CA 35 MET CE 1.80 115 GLN CB 35 MET CE 1.80 115 GLN CG 35 MET CE 1.80 115 GLN CG 35 MET CB 1.80 115 GLN C 35 MET CB 1.80 115 GLN C 35 MET CG 1.80 115 GLN CD 36 VAL CB 1.80 115 GLN CD 35 MET CE 1.80 115 GLN C 35 MET CE 1.80 115 GLN CD 35 MET N 1.80 116 LYS CD 35 MET CE 1.80 116 LYS C 35 MET CE 1.80 117 LEU CD2 35 MET CG 1.80 117 LEU CG 35 MET CB 1.80 117 LEU CB 35 MET CB 1.80 117 LEU CB 35 MET CE 1.80 117 LEU CD2 35 MET CE 1.80 117 LEU CG 35 MET CE 1.80 117 LEU CB 35 MET CG 1.80 117 LEU CD1 35 MET CE 1.80 117 LEU CD1 35 MET CB 1.80 117 LEU CD1 35 MET CG 1.80 117 LEU CD2 35 MET CB 1.80 117 LEU CA 35 MET CE 1.80 117 LEU C 35 MET CE 1.80 117 LEU N 35 MET CE 1.80
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