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 | position | program | type |
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475096 |
2kwq   |
16872 | cing | 1-original | 2 | AMBER | dihedral angle |
# 1473 atoms read from pdb file d20_001.amb.pdb. # 12 SER PHI: (11 GLN C)-(12 SER N)-(12 SER CA)-(12 SER C) -135.4 -55.5 &rst iat = 166, 168, 170, 177, r1 = -136.4, r2 = -135.4, r3 = -55.5, r4 = -54.5, rk2 = 2.0, rk3 = 2.0, &end # 12 SER PSI: (12 SER N)-(12 SER CA)-(12 SER C)-(13 CYS N) 84.4 164.4 &rst iat = 168, 170, 177, 179, r1 = 83.4, r2 = 84.4, r3 = 164.4, r4 = 165.4, &end # 13 CYS PHI: (12 SER C)-(13 CYS N)-(13 CYS CA)-(13 CYS C) -186.1 -106.2 &rst iat = 177, 179, 181, 188, r1 = -187.1, r2 = -186.1, r3 = -106.2, r4 = -105.2, &end # 13 CYS PSI: (13 CYS N)-(13 CYS CA)-(13 CYS C)-(14 ARG N) 114.1 194.1 &rst iat = 179, 181, 188, 190, r1 = 113.1, r2 = 114.1, r3 = 194.1, r4 = 195.1, &end # 14 ARG PHI: (13 CYS C)-(14 ARG N)-(14 ARG CA)-(14 ARG C) -160.0 -80.0 &rst iat = 188, 190, 192, 212, r1 = -161.0, r2 = -160.0, r3 = -80.0, r4 = -79.0, &end # 14 ARG PSI: (14 ARG N)-(14 ARG CA)-(14 ARG C)-(15 VAL N) 95.0 175.0 &rst iat = 190, 192, 212, 214, r1 = 94.0, r2 = 95.0, r3 = 175.0, r4 = 176.0, &end # 15 VAL PHI: (14 ARG C)-(15 VAL N)-(15 VAL CA)-(15 VAL C) -160.2 -80.2 &rst iat = 212, 214, 216, 228, r1 = -161.2, r2 = -160.2, r3 = -80.2, r4 = -79.2, &end # 15 VAL PSI: (15 VAL N)-(15 VAL CA)-(15 VAL C)-(16 VAL N) 117.1 197.1 &rst iat = 214, 216, 228, 230, r1 = 116.1, r2 = 117.1, r3 = 197.1, r4 = 198.1, &end # 16 VAL PHI: (15 VAL C)-(16 VAL N)-(16 VAL CA)-(16 VAL C) -163.8 -83.8 &rst iat = 228, 230, 232, 244, r1 = -164.8, r2 = -163.8, r3 = -83.8, r4 = -82.8, &end # 16 VAL PSI: (16 VAL N)-(16 VAL CA)-(16 VAL C)-(17 THR N) 89.4 169.4 &rst iat = 230, 232, 244, 246, r1 = 88.4, r2 = 89.4, r3 = 169.4, r4 = 170.4, &end # 17 THR PHI: (16 VAL C)-(17 THR N)-(17 THR CA)-(17 THR C) -150.4 -70.4 &rst iat = 244, 246, 248, 258, r1 = -151.4, r2 = -150.4, r3 = -70.4, r4 = -69.4, &end # 17 THR PSI: (17 THR N)-(17 THR CA)-(17 THR C)-(18 CYM N) 83.3 163.3 &rst iat = 246, 248, 258, 260, r1 = 82.3, r2 = 83.3, r3 = 163.3, r4 = 164.3, &end # 23 TYR PHI: (22 LYS C)-(23 TYR N)-(23 TYR CA)-(23 TYR C) -160.0 -80.0 &rst iat = 336, 338, 340, 357, r1 = -161.0, r2 = -160.0, r3 = -80.0, r4 = -79.0, &end # 23 TYR PSI: (23 TYR N)-(23 TYR CA)-(23 TYR C)-(24 THR N) 95.0 175.0 &rst iat = 338, 340, 357, 359, r1 = 94.0, r2 = 95.0, r3 = 175.0, r4 = 176.0, &end # 24 THR PHI: (23 TYR C)-(24 THR N)-(24 THR CA)-(24 THR C) -154.6 -74.6 &rst iat = 357, 359, 361, 371, r1 = -155.6, r2 = -154.6, r3 = -74.6, r4 = -73.6, &end # 24 THR PSI: (24 THR N)-(24 THR CA)-(24 THR C)-(25 HID N) 75.4 155.4 &rst iat = 359, 361, 371, 373, r1 = 74.4, r2 = 75.4, r3 = 155.4, r4 = 156.4, &end # 25 HIS PHI: (24 THR C)-(25 HID N)-(25 HID CA)-(25 HID C) -157.6 -77.6 &rst iat = 371, 373, 375, 388, r1 = -158.6, r2 = -157.6, r3 = -77.6, r4 = -76.6, &end # 25 HIS PSI: (25 HID N)-(25 HID CA)-(25 HID C)-(26 PHE N) 122.4 202.4 &rst iat = 373, 375, 388, 390, r1 = 121.4, r2 = 122.4, r3 = 202.4, r4 = 203.4, &end # 26 PHE PHI: (25 HID C)-(26 PHE N)-(26 PHE CA)-(26 PHE C) -109.9 -29.9 &rst iat = 388, 390, 392, 408, r1 = -110.9, r2 = -109.9, r3 = -29.9, r4 = -28.9, &end # 26 PHE PSI: (26 PHE N)-(26 PHE CA)-(26 PHE C)-(27 LYS N) -57.7 22.3 &rst iat = 390, 392, 408, 410, r1 = -58.7, r2 = -57.7, r3 = 22.3, r4 = 23.3, &end # 30 GLU PHI: (29 LYS C)-(30 GLU N)-(30 GLU CA)-(30 GLU C) -97.7 -17.7 &rst iat = 466, 468, 470, 481, r1 = -98.7, r2 = -97.7, r3 = -17.7, r4 = -16.7, &end # 30 GLU PSI: (30 GLU N)-(30 GLU CA)-(30 GLU C)-(31 THR N) -71.8 8.1 &rst iat = 468, 470, 481, 483, r1 = -72.8, r2 = -71.8, r3 = 8.1, r4 = 9.1, &end # 31 THR PHI: (30 GLU C)-(31 THR N)-(31 THR CA)-(31 THR C) -110.3 -30.3 &rst iat = 481, 483, 485, 495, r1 = -111.3, r2 = -110.3, r3 = -30.3, r4 = -29.3, &end # 31 THR PSI: (31 THR N)-(31 THR CA)-(31 THR C)-(32 CYM N) -52.4 27.6 &rst iat = 483, 485, 495, 497, r1 = -53.4, r2 = -52.4, r3 = 27.6, r4 = 28.6, &end # 33 VAL PHI: (32 CYM C)-(33 VAL N)-(33 VAL CA)-(33 VAL C) -104.8 -24.8 &rst iat = 505, 507, 509, 521, r1 = -105.8, r2 = -104.8, r3 = -24.8, r4 = -23.8, &end # 33 VAL PSI: (33 VAL N)-(33 VAL CA)-(33 VAL C)-(34 SER N) -70.2 9.8 &rst iat = 507, 509, 521, 523, r1 = -71.2, r2 = -70.2, r3 = 9.8, r4 = 10.8, &end # 34 SER PHI: (33 VAL C)-(34 SER N)-(34 SER CA)-(34 SER C) -109.0 -29.0 &rst iat = 521, 523, 525, 532, r1 = -110.0, r2 = -109.0, r3 = -29.0, r4 = -28.0, &end # 34 SER PSI: (34 SER N)-(34 SER CA)-(34 SER C)-(35 GLU N) -70.0 10.0 &rst iat = 523, 525, 532, 534, r1 = -71.0, r2 = -70.0, r3 = 10.0, r4 = 11.0, &end # 35 GLU PHI: (34 SER C)-(35 GLU N)-(35 GLU CA)-(35 GLU C) -125.4 -45.5 &rst iat = 532, 534, 536, 547, r1 = -126.4, r2 = -125.4, r3 = -45.5, r4 = -44.5, &end # 35 GLU PSI: (35 GLU N)-(35 GLU CA)-(35 GLU C)-(36 ASN N) -45.5 34.5 &rst iat = 534, 536, 547, 549, r1 = -46.5, r2 = -45.5, r3 = 34.5, r4 = 35.5, &end # 36 ASN PHI: (35 GLU C)-(36 ASN N)-(36 ASN CA)-(36 ASN C) 15.9 95.9 &rst iat = 547, 549, 551, 561, r1 = 14.9, r2 = 15.9, r3 = 95.9, r4 = 96.9, &end # 36 ASN PSI: (36 ASN N)-(36 ASN CA)-(36 ASN C)-(37 HIZ N) 2.4 82.4 &rst iat = 549, 551, 561, 563, r1 = 1.4, r2 = 2.4, r3 = 82.4, r4 = 83.4, &end # 40 HIS PHI: (39 PHE C)-(40 HID N)-(40 HID CA)-(40 HID C) -146.4 -66.4 &rst iat = 611, 613, 615, 628, r1 = -147.4, r2 = -146.4, r3 = -66.4, r4 = -65.4, &end # 40 HIS PSI: (40 HID N)-(40 HID CA)-(40 HID C)-(41 TRP N) 83.1 163.1 &rst iat = 613, 615, 628, 630, r1 = 82.1, r2 = 83.1, r3 = 163.1, r4 = 164.1, &end # 41 TRP PHI: (40 HID C)-(41 TRP N)-(41 TRP CA)-(41 TRP C) -140.3 -60.3 &rst iat = 628, 630, 632, 652, r1 = -141.3, r2 = -140.3, r3 = -60.3, r4 = -59.3, &end # 41 TRP PSI: (41 TRP N)-(41 TRP CA)-(41 TRP C)-(42 HID N) 93.0 173.0 &rst iat = 630, 632, 652, 654, r1 = 92.0, r2 = 93.0, r3 = 173.0, r4 = 174.0, &end # 43 ASN PHI: (42 HID C)-(43 ASN N)-(43 ASN CA)-(43 ASN C) -160.0 -80.0 &rst iat = 669, 671, 673, 683, r1 = -161.0, r2 = -160.0, r3 = -80.0, r4 = -79.0, &end # 43 ASN PSI: (43 ASN N)-(43 ASN CA)-(43 ASN C)-(44 GLY N) 95.0 175.0 &rst iat = 671, 673, 683, 685, r1 = 94.0, r2 = 95.0, r3 = 175.0, r4 = 176.0, &end # 42 HIS PHI: (41 TRP C)-(42 HID N)-(42 HID CA)-(42 HID C) -172.8 -92.8 &rst iat = 652, 654, 656, 669, r1 = -173.8, r2 = -172.8, r3 = -92.8, r4 = -91.8, &end # 42 HIS PSI: (42 HID N)-(42 HID CA)-(42 HID C)-(43 ASN N) 112.1 192.1 &rst iat = 654, 656, 669, 671, r1 = 111.1, r2 = 112.1, r3 = 192.1, r4 = 193.1, &end # 47 ARG PHI: (46 LYS C)-(47 ARG N)-(47 ARG CA)-(47 ARG C) -163.0 -83.0 &rst iat = 728, 730, 732, 752, r1 = -164.0, r2 = -163.0, r3 = -83.0, r4 = -82.0, &end # 47 ARG PSI: (47 ARG N)-(47 ARG CA)-(47 ARG C)-(48 PHE N) 108.2 188.1 &rst iat = 730, 732, 752, 754, r1 = 107.2, r2 = 108.2, r3 = 188.1, r4 = 189.1, &end # 49 PHE PHI: (48 PHE C)-(49 PHE N)-(49 PHE CA)-(49 PHE C) -177.0 -97.0 &rst iat = 772, 774, 776, 792, r1 = -178.0, r2 = -177.0, r3 = -97.0, r4 = -96.0, &end # 49 PHE PSI: (49 PHE N)-(49 PHE CA)-(49 PHE C)-(50 LYS N) 118.5 198.5 &rst iat = 774, 776, 792, 794, r1 = 117.5, r2 = 118.5, r3 = 198.5, r4 = 199.5, &end # 50 LYS PHI: (49 PHE C)-(50 LYS N)-(50 LYS CA)-(50 LYS C) -153.6 -73.6 &rst iat = 792, 794, 796, 814, r1 = -154.6, r2 = -153.6, r3 = -73.6, r4 = -72.6, &end # 50 LYS PSI: (50 LYS N)-(50 LYS CA)-(50 LYS C)-(51 CYZ N) 76.7 156.7 &rst iat = 794, 796, 814, 816, r1 = 75.7, r2 = 76.7, r3 = 156.7, r4 = 157.7, &end # 56 ARG PHI: (55 ASN C)-(56 ARG N)-(56 ARG CA)-(56 ARG C) -162.7 -82.7 &rst iat = 870, 872, 874, 894, r1 = -163.7, r2 = -162.7, r3 = -82.7, r4 = -81.7, &end # 56 ARG PSI: (56 ARG N)-(56 ARG CA)-(56 ARG C)-(57 THR N) 109.8 189.8 &rst iat = 872, 874, 894, 896, r1 = 108.8, r2 = 109.8, r3 = 189.8, r4 = 190.8, &end # 57 THR PHI: (56 ARG C)-(57 THR N)-(57 THR CA)-(57 THR C) -172.9 -92.8 &rst iat = 894, 896, 898, 908, r1 = -173.9, r2 = -172.9, r3 = -92.8, r4 = -91.8, &end # 57 THR PSI: (57 THR N)-(57 THR CA)-(57 THR C)-(58 ILE N) 107.7 187.7 &rst iat = 896, 898, 908, 910, r1 = 106.7, r2 = 107.7, r3 = 187.7, r4 = 188.7, &end # 58 ILE PHI: (57 THR C)-(58 ILE N)-(58 ILE CA)-(58 ILE C) -159.2 -79.2 &rst iat = 908, 910, 912, 927, r1 = -160.2, r2 = -159.2, r3 = -79.2, r4 = -78.2, &end # 58 ILE PSI: (58 ILE N)-(58 ILE CA)-(58 ILE C)-(59 SER N) 112.4 192.4 &rst iat = 910, 912, 927, 929, r1 = 111.4, r2 = 112.4, r3 = 192.4, r4 = 193.4, &end # 77 GLU PHI: (76 TRP C)-(77 GLU N)-(77 GLU CA)-(77 GLU C) -146.0 -66.0 &rst iat = 1224, 1226, 1228, 1239, r1 = -147.0, r2 = -146.0, r3 = -66.0, r4 = -65.0, &end # 77 GLU PSI: (77 GLU N)-(77 GLU CA)-(77 GLU C)-(78 ARG N) 89.0 169.0 &rst iat = 1226, 1228, 1239, 1241, r1 = 88.0, r2 = 89.0, r3 = 169.0, r4 = 170.0, &end # 78 ARG PHI: (77 GLU C)-(78 ARG N)-(78 ARG CA)-(78 ARG C) -128.0 -48.0 &rst iat = 1239, 1241, 1243, 1263, r1 = -129.0, r2 = -128.0, r3 = -48.0, r4 = -47.0, &end # 78 ARG PSI: (78 ARG N)-(78 ARG CA)-(78 ARG C)-(79 VAL N) 76.0 156.0 &rst iat = 1241, 1243, 1263, 1265, r1 = 75.0, r2 = 76.0, r3 = 156.0, r4 = 157.0, &end
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